#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b5m s SER 2 N 0.00 1.89 -0.35 7.83 1.04 -1.26 -5.09 113.70 117.76 2b5m s SER 2 Ca 0.00 -0.32 0.03 0.00 0.48 0.00 0.00 55.95 56.14 2b5m s SER 2 Cb 0.00 -0.81 0.16 0.00 0.10 0.00 0.00 66.02 65.46 2b5m s SER 2 CO 0.00 0.06 0.39 -0.31 0.98 0.00 0.00 173.24 174.36 2b5m s TYR 3 N 0.53 -0.56 0.28 5.02 2.02 -1.26 -4.30 117.35 119.08 2b5m s TYR 3 Ca -0.13 -0.44 0.12 0.00 -0.37 0.00 0.00 57.07 56.25 2b5m s TYR 3 Cb -0.15 -0.31 -0.05 0.00 -0.40 0.00 0.00 41.96 41.05 2b5m s TYR 3 CO 0.04 -0.98 -0.20 -0.80 -1.57 0.00 0.00 175.55 172.03 2b5m s ASN 4 N 1.80 3.59 -0.06 2.29 0.01 -0.25 -1.41 114.94 120.91 2b5m s ASN 4 Ca 0.14 -1.03 0.02 0.00 -0.71 0.00 0.00 52.86 51.28 2b5m s ASN 4 Cb -0.14 -0.30 0.02 0.00 0.41 0.00 0.00 41.25 41.24 2b5m s ASN 4 CO -0.13 0.04 -0.10 -0.47 -1.51 0.00 0.00 177.10 174.93 2b5m s TYR 5 N -2.51 1.23 -0.01 2.20 5.04 0.03 -0.86 117.35 122.47 2b5m s TYR 5 Ca 0.30 -0.43 0.06 0.00 -2.44 0.00 0.00 57.07 54.55 2b5m s TYR 5 Cb -0.05 -0.94 -0.01 0.00 0.35 0.00 0.00 41.96 41.31 2b5m s TYR 5 CO 0.15 -0.25 -0.18 0.14 -1.34 0.00 0.00 175.55 174.07 2b5m s VAL 6 N 0.74 1.46 0.04 3.14 -7.23 0.43 -1.10 120.40 117.88 2b5m s VAL 6 Ca -0.14 -0.80 -0.02 0.00 -1.81 0.00 0.00 61.98 59.22 2b5m s VAL 6 Cb -0.15 -1.21 -0.03 0.00 0.56 0.00 0.00 36.38 35.55 2b5m s VAL 6 CO 0.03 0.41 0.00 0.68 -0.31 0.00 0.00 175.10 175.91 2b5m s VAL 7 N -0.44 0.16 0.20 1.32 -7.23 -0.77 0.13 120.40 113.77 2b5m s VAL 7 Ca 0.07 -1.33 -0.30 0.00 -1.81 0.00 0.00 61.98 58.61 2b5m s VAL 7 Cb -0.07 -0.95 -0.08 0.00 0.56 0.00 0.00 36.38 35.84 2b5m s VAL 7 CO -0.01 -0.73 1.00 -0.89 -0.31 0.00 0.00 175.10 174.16 2b5m s THR 8 N -2.79 4.06 -0.13 5.32 2.01 -1.26 -0.63 115.64 122.21 2b5m s THR 8 Ca -0.04 1.89 0.12 0.00 0.31 0.00 0.00 61.69 63.98 2b5m s THR 8 Cb -0.00 -4.21 -0.17 0.00 0.01 0.00 0.00 72.50 68.13 2b5m s THR 8 CO -0.06 0.38 0.06 0.00 -0.69 0.00 0.00 174.62 174.31 2b5m n ALA 9 N 2.00 1.68 -3.67 7.40 0.00 0.70 -4.87 120.51 123.75 2b5m n ALA 9 Ca 0.00 -0.91 -0.09 0.00 0.00 0.00 0.00 53.44 52.45 2b5m n ALA 9 Cb 0.47 -0.06 -0.10 0.00 0.00 0.00 0.00 19.45 19.76 2b5m n ALA 9 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 2b5m s GLN 10 N -2.36 0.36 0.85 0.00 2.00 -0.86 -4.92 119.66 114.73 2b5m s GLN 10 Ca -0.07 0.97 -0.11 0.00 -2.00 0.00 0.00 55.36 54.15 2b5m s GLN 10 Cb 0.04 0.22 0.10 0.00 0.80 0.00 0.00 33.01 34.18 2b5m s GLN 10 CO 0.57 -0.22 1.09 0.15 -0.50 0.00 0.00 175.29 176.39 2b5m s LYS 11 N 2.21 1.62 0.43 1.67 1.02 -1.26 -1.10 119.74 124.33 2b5m s LYS 11 Ca -0.04 1.05 -0.26 0.00 0.02 0.00 0.00 55.97 56.73 2b5m s LYS 11 Cb -0.11 -1.83 -0.09 0.00 -0.52 0.00 0.00 37.83 35.28 2b5m s LYS 11 CO -0.13 -2.05 1.44 -2.14 -0.92 0.00 0.00 175.35 171.54 2b5m s PRO 12 N -4.88 3.79 -0.00 -1.68 0.02 -1.26 -4.30 135.00 126.69 2b5m s PRO 12 Ca 0.63 2.44 0.05 0.00 0.02 0.00 0.00 61.00 64.14 2b5m s PRO 12 Cb -0.18 -2.73 -0.06 0.00 0.02 0.00 0.00 34.50 31.55 2b5m s PRO 12 CO 0.57 -0.74 0.21 0.25 -0.33 0.00 0.00 177.00 176.95 2b5m n THR 13 N -0.03 0.00 -2.33 0.99 -2.24 -0.97 -4.88 114.28 104.82 2b5m n THR 13 Ca 0.04 -0.34 -0.36 0.00 -2.27 0.00 0.00 64.05 61.12 2b5m n THR 13 Cb 0.41 0.91 -0.01 0.00 -2.10 0.00 0.00 70.33 69.54 2b5m n THR 13 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2b5m s ALA 14 N -1.61 2.91 -0.25 6.98 0.00 -0.62 -4.75 121.76 124.42 2b5m s ALA 14 Ca 0.01 0.84 -0.08 0.00 0.00 0.00 0.00 51.96 52.74 2b5m s ALA 14 Cb 0.04 -3.35 -0.04 0.00 0.00 0.00 0.00 23.12 19.77 2b5m s ALA 14 CO 0.21 -0.59 0.10 0.08 0.00 0.00 0.00 175.76 175.57 2b5m s VAL 15 N -1.66 4.61 -0.16 0.00 1.01 -0.62 -4.57 120.40 119.01 2b5m s VAL 15 Ca 0.65 -0.07 0.06 0.00 0.00 0.00 0.00 61.98 62.62 2b5m s VAL 15 Cb -0.25 -3.16 -0.14 0.00 0.00 0.00 0.00 36.38 32.83 2b5m s VAL 15 CO 0.30 0.33 -0.06 0.59 0.00 0.00 0.00 175.10 176.26 2b5m n ASN 16 N 4.80 2.15 -4.10 3.32 3.02 -0.79 -4.12 115.26 119.54 2b5m n ASN 16 Ca -0.16 -0.05 -0.09 0.00 -0.03 0.00 0.00 54.58 54.25 2b5m n ASN 16 Cb 0.52 0.25 -0.10 0.00 -0.61 0.00 0.00 39.78 39.84 2b5m n ASN 16 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 2b5m s GLY 17 N -5.23 0.78 -0.30 7.41 0.00 -1.19 -4.87 107.32 103.92 2b5m s GLY 17 Ca -0.16 -1.31 -0.15 0.00 0.00 0.00 0.00 44.72 43.09 2b5m s GLY 17 CO 0.48 -1.27 1.06 0.00 0.00 0.00 0.00 173.10 173.37 2b5m s VAL 19 N 2.45 1.73 0.04 0.00 0.11 -0.44 -4.78 120.40 119.50 2b5m s VAL 19 Ca -0.01 -2.05 0.07 0.00 -2.93 0.00 0.00 61.98 57.06 2b5m s VAL 19 Cb -0.06 -2.80 -0.02 0.00 -1.53 0.00 0.00 36.38 31.97 2b5m s VAL 19 CO -0.16 -0.08 -0.20 0.28 -3.33 0.00 0.00 175.10 171.61 2b5m s THR 20 N -2.92 1.60 -1.07 5.04 -1.32 -1.26 -1.82 115.64 113.89 2b5m s THR 20 Ca 0.34 -1.16 0.00 0.00 -1.21 0.00 0.00 61.69 59.66 2b5m s THR 20 Cb 0.08 -1.40 0.00 0.00 -1.51 0.00 0.00 72.50 69.67 2b5m s THR 20 CO 0.16 0.19 0.00 0.61 -2.21 0.00 0.00 174.62 173.37 2b5m n GLY 21 N 1.88 -0.77 2.86 6.08 0.00 -1.13 -4.85 105.19 109.26 2b5m n GLY 21 Ca -0.17 -0.33 -0.29 0.00 0.00 0.00 0.00 46.02 45.23 2b5m n GLY 21 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2b5m s HIS 22 N -4.00 2.94 -0.07 1.61 3.76 -1.26 0.05 115.29 118.33 2b5m s HIS 22 Ca 0.00 -3.03 0.08 0.00 -0.15 0.00 0.00 55.06 51.96 2b5m s HIS 22 Cb 0.00 -2.49 -0.24 0.00 1.11 0.00 0.00 32.58 30.96 2b5m s HIS 22 CO 0.00 -0.69 0.57 0.34 -0.85 0.00 0.00 174.74 174.11 2b5m n PHE 23 N 2.83 1.04 0.05 1.40 7.35 -1.26 -1.24 117.46 127.63 2b5m n PHE 23 Ca 0.12 0.33 -0.03 0.00 -0.76 0.00 0.00 57.45 57.10 2b5m n PHE 23 Cb 0.34 -1.18 -0.01 0.00 0.35 0.00 0.00 39.48 38.98 2b5m n PHE 23 CO 0.00 0.00 0.00 1.15 -0.76 0.00 0.00 176.76 177.15 2b5m h THR 24 N 0.02 0.00 -3.42 -2.13 2.02 -1.89 -3.39 112.91 104.12 2b5m h THR 24 Ca -0.33 -0.59 -0.20 0.00 0.77 0.00 0.00 66.41 66.06 2b5m h THR 24 Cb 2.02 0.00 -0.27 0.00 -1.74 0.00 0.00 68.15 68.16 2b5m h THR 24 CO 0.08 0.00 -0.58 -0.44 0.37 0.00 0.00 175.52 174.95 2b5m s SER 25 N -4.60 -0.13 0.39 4.18 0.01 -1.26 -4.98 113.70 107.32 2b5m s SER 25 Ca -0.03 0.25 0.29 0.00 1.31 0.00 0.00 55.95 57.78 2b5m s SER 25 Cb 0.00 0.25 1.32 0.00 0.21 0.00 0.00 66.02 67.80 2b5m s SER 25 CO 0.09 -0.05 1.37 0.00 0.41 0.00 0.00 173.24 175.06 2b5m n ALA 26 N 3.12 1.22 -2.92 1.44 0.00 -1.26 -1.41 120.51 120.70 2b5m n ALA 26 Ca -0.14 0.76 -0.28 0.00 0.00 0.00 0.00 53.44 53.79 2b5m n ALA 26 Cb 0.58 -0.94 -0.04 0.00 0.00 0.00 0.00 19.45 19.06 2b5m n ALA 26 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2b5m n GLU 27 N -4.43 3.35 -3.64 0.00 -0.00 -1.26 -4.82 120.64 109.84 2b5m n GLU 27 Ca 0.36 -4.86 -0.07 0.00 -0.00 0.00 0.00 57.16 52.59 2b5m n GLU 27 Cb 1.39 -2.25 -0.07 0.00 -0.00 0.00 0.00 31.44 30.52 2b5m n GLU 27 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.13 177.47 2b5m s ASP 28 N -3.39 -0.83 -0.28 -1.84 2.15 -0.50 -5.15 116.67 106.84 2b5m s ASP 28 Ca 0.49 1.35 -0.09 0.00 0.43 0.00 0.00 52.55 54.73 2b5m s ASP 28 Cb 0.28 1.34 -0.02 0.00 -0.30 0.00 0.00 42.92 44.22 2b5m s ASP 28 CO -0.14 -0.22 0.13 -0.22 -0.17 0.00 0.00 175.17 174.55 2b5m s LEU 29 N 1.40 3.86 0.38 -1.34 2.96 -1.26 -4.23 118.68 120.44 2b5m s LEU 29 Ca -0.08 -0.34 0.08 0.00 -0.22 0.00 0.00 54.13 53.57 2b5m s LEU 29 Cb -0.05 -1.99 -0.03 0.00 0.50 0.00 0.00 46.19 44.62 2b5m s LEU 29 CO -0.16 -0.12 0.32 0.20 -1.32 0.00 0.00 176.35 175.27 2b5m s ASN 30 N 1.64 5.08 -0.05 3.68 0.01 0.11 0.55 114.94 125.95 2b5m s ASN 30 Ca 0.06 -0.67 0.01 0.00 -0.71 0.00 0.00 52.86 51.55 2b5m s ASN 30 Cb -0.16 -0.73 0.02 0.00 0.41 0.00 0.00 41.25 40.79 2b5m s ASN 30 CO 0.06 -0.51 -0.05 -0.22 -1.51 0.00 0.00 177.10 174.87 2b5m s LEU 31 N -4.05 1.34 -0.23 0.60 2.96 -0.93 -2.82 118.68 115.55 2b5m s LEU 31 Ca 0.44 -0.15 -0.02 0.00 -0.22 0.00 0.00 54.13 54.17 2b5m s LEU 31 Cb -0.04 -0.51 0.01 0.00 0.50 0.00 0.00 46.19 46.15 2b5m s LEU 31 CO 0.27 -0.05 -0.06 -0.76 -1.32 0.00 0.00 176.35 174.43 2b5m s LEU 32 N 0.94 2.98 -0.08 -0.68 1.02 -0.76 -0.16 118.68 121.94 2b5m s LEU 32 Ca -0.11 -0.65 0.03 0.00 0.02 0.00 0.00 54.13 53.43 2b5m s LEU 32 Cb -0.14 -1.68 -0.02 0.00 0.02 0.00 0.00 46.19 44.36 2b5m s LEU 32 CO 0.00 -0.07 -0.17 -0.63 0.02 0.00 0.00 176.35 175.50 2b5m s ILE 33 N 1.39 2.77 -0.17 -0.59 1.01 -0.12 -1.33 121.20 124.16 2b5m s ILE 33 Ca 0.03 -0.80 -0.03 0.00 0.00 0.00 0.00 60.65 59.85 2b5m s ILE 33 Cb -0.15 -2.09 -0.02 0.00 0.01 0.00 0.00 42.46 40.21 2b5m s ILE 33 CO -0.05 0.56 -0.06 0.00 0.00 0.00 0.00 174.94 175.40 2b5m s ALA 34 N -0.22 2.84 0.00 9.38 0.00 -0.47 -0.30 121.76 133.00 2b5m s ALA 34 Ca -0.00 -0.95 0.00 0.00 0.00 0.00 0.00 51.96 51.01 2b5m s ALA 34 Cb -0.13 -1.52 0.00 0.00 0.00 0.00 0.00 23.12 21.47 2b5m s ALA 34 CO 0.03 0.01 0.00 1.63 0.00 0.00 0.00 175.76 177.44 2b5m n LYS 35 N 3.94 0.00 0.00 0.00 4.01 0.15 -1.88 118.16 124.38 2b5m n LYS 35 Ca -0.18 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.62 2b5m n LYS 35 Cb 0.52 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 35.04 2b5m n LYS 35 CO 0.00 0.00 0.00 -1.71 -1.11 0.00 0.00 177.40 174.58 2b5m n ASN 36 N 0.00 0.00 -1.90 4.39 5.15 -1.26 -4.29 115.26 117.34 2b5m n ASN 36 Ca 0.00 0.00 0.01 0.00 -0.60 0.00 0.00 54.58 53.99 2b5m n ASN 36 Cb 0.00 -0.31 0.35 0.00 -0.53 0.00 0.00 39.78 39.29 2b5m n ASN 36 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 2b5m n THR 37 N -2.28 2.74 -4.79 -0.44 -2.24 -1.26 -1.49 114.28 104.51 2b5m n THR 37 Ca 0.00 -1.43 -0.28 0.00 -2.27 0.00 0.00 64.05 60.07 2b5m n THR 37 Cb 0.00 -0.33 -0.17 0.00 -2.10 0.00 0.00 70.33 67.73 2b5m n THR 37 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2b5m s ARG 38 N -2.78 2.30 -0.25 -0.78 1.81 -1.26 -1.27 118.95 116.73 2b5m s ARG 38 Ca 0.53 -0.61 -0.06 0.00 -1.72 0.00 0.00 55.73 53.86 2b5m s ARG 38 Cb 0.41 -1.83 -0.02 0.00 -0.45 0.00 0.00 34.95 33.06 2b5m s ARG 38 CO 0.14 0.06 0.03 -1.17 -0.68 0.00 0.00 175.30 173.69 2b5m s LEU 39 N 0.61 3.31 -0.15 2.53 2.96 -0.70 0.31 118.68 127.55 2b5m s LEU 39 Ca -0.15 -0.34 -0.00 0.00 -0.22 0.00 0.00 54.13 53.42 2b5m s LEU 39 Cb -0.16 -1.85 -0.01 0.00 0.50 0.00 0.00 46.19 44.66 2b5m s LEU 39 CO 0.05 -0.05 -0.14 -1.61 -1.32 0.00 0.00 176.35 173.28 2b5m s GLU 40 N 1.55 3.31 -0.18 1.98 2.02 0.59 -2.23 118.70 125.73 2b5m s GLU 40 Ca 0.06 -0.71 -0.03 0.00 0.02 0.00 0.00 54.97 54.30 2b5m s GLU 40 Cb -0.15 -2.64 -0.02 0.00 0.10 0.00 0.00 34.13 31.42 2b5m s GLU 40 CO 0.01 0.10 -0.05 0.42 0.02 0.00 0.00 175.26 175.77 2b5m s ILE 41 N 0.62 3.55 0.21 -1.63 1.01 -0.38 -0.94 121.20 123.63 2b5m s ILE 41 Ca -0.08 -0.46 0.11 0.00 0.00 0.00 0.00 60.65 60.22 2b5m s ILE 41 Cb -0.16 -2.58 -0.04 0.00 0.01 0.00 0.00 42.46 39.69 2b5m s ILE 41 CO 0.03 0.46 -0.22 -0.31 0.00 0.00 0.00 174.94 174.90 2b5m s TYR 42 N 0.91 2.18 -0.24 3.97 1.51 0.78 -2.02 117.35 124.44 2b5m s TYR 42 Ca -0.01 -0.38 -0.04 0.00 -1.01 0.00 0.00 57.07 55.63 2b5m s TYR 42 Cb -0.15 -1.05 -0.00 0.00 -0.11 0.00 0.00 41.96 40.66 2b5m s TYR 42 CO 0.01 0.51 -0.02 0.08 -1.11 0.00 0.00 175.55 175.02 2b5m s VAL 43 N -1.97 3.42 0.25 0.71 1.01 0.05 -2.20 120.40 121.66 2b5m s VAL 43 Ca 0.22 -0.60 -0.30 0.00 0.00 0.00 0.00 61.98 61.30 2b5m s VAL 43 Cb -0.07 -2.62 -0.09 0.00 0.00 0.00 0.00 36.38 33.60 2b5m s VAL 43 CO 0.10 0.33 1.30 -0.69 0.00 0.00 0.00 175.10 176.14 2b5m s VAL 44 N 1.46 3.06 0.23 2.92 1.01 0.19 -1.86 120.40 127.41 2b5m s VAL 44 Ca 0.04 0.94 -0.02 0.00 0.00 0.00 0.00 61.98 62.94 2b5m s VAL 44 Cb -0.15 -3.60 -0.03 0.00 0.00 0.00 0.00 36.38 32.60 2b5m s VAL 44 CO -0.02 0.17 0.22 0.42 0.00 0.00 0.00 175.10 175.89 2b5m s THR 45 N -0.35 0.00 0.03 3.92 -4.23 -0.94 -4.67 115.64 109.40 2b5m s THR 45 Ca 0.54 -1.89 -0.06 0.00 -1.18 0.00 0.00 61.69 59.10 2b5m s THR 45 Cb -0.37 -2.46 -0.01 0.00 1.34 0.00 0.00 72.50 70.99 2b5m s THR 45 CO 0.43 0.00 0.72 0.00 -0.54 0.00 0.00 174.62 175.23 2b5m n ALA 46 N -0.35 -0.13 -0.11 3.99 0.00 -1.26 -1.36 120.51 121.30 2b5m n ALA 46 Ca 0.02 0.17 -0.05 0.00 0.00 0.00 0.00 53.44 53.58 2b5m n ALA 46 Cb 0.65 0.18 0.01 0.00 0.00 0.00 0.00 19.45 20.28 2b5m n ALA 46 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2b5m h GLU 47 N 0.00 -0.01 0.00 0.00 4.57 -2.01 -3.49 114.58 113.63 2b5m h GLU 47 Ca 0.03 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.21 2b5m h GLU 47 Cb 0.08 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.67 2b5m h GLU 47 CO -0.19 -0.01 0.00 0.41 -1.18 0.00 0.00 179.01 178.04 2b5m n GLY 48 N -1.30 -0.44 3.33 1.92 0.00 -0.46 -5.11 105.19 103.13 2b5m n GLY 48 Ca 0.02 0.28 -0.35 0.00 0.00 0.00 0.00 46.02 45.97 2b5m n GLY 48 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2b5m s LEU 49 N 0.00 2.95 -0.33 0.99 1.02 -1.26 -2.23 118.68 119.82 2b5m s LEU 49 Ca 0.00 -0.36 -0.12 0.00 0.02 0.00 0.00 54.13 53.67 2b5m s LEU 49 Cb 0.00 -1.75 -0.01 0.00 0.02 0.00 0.00 46.19 44.45 2b5m s LEU 49 CO 0.00 -0.01 0.21 -0.13 0.02 0.00 0.00 176.35 176.44 2b5m s ARG 50 N 1.39 3.38 0.66 1.70 1.81 -0.78 -4.90 118.95 122.21 2b5m s ARG 50 Ca 0.05 -0.71 -0.15 0.00 -1.72 0.00 0.00 55.73 53.19 2b5m s ARG 50 Cb -0.14 -3.72 0.00 0.00 -0.45 0.00 0.00 34.95 30.64 2b5m s ARG 50 CO -0.02 -0.46 1.13 -2.14 -0.68 0.00 0.00 175.30 173.13 2b5m s PRO 51 N 1.67 2.72 0.05 3.54 0.02 -1.26 -0.77 135.00 140.97 2b5m s PRO 51 Ca 0.05 1.49 0.00 0.00 0.02 0.00 0.00 61.00 62.57 2b5m s PRO 51 Cb -0.17 -1.93 0.00 0.00 0.02 0.00 0.00 34.50 32.41 2b5m s PRO 51 CO 0.09 -1.33 0.00 1.33 -0.33 0.00 0.00 177.00 176.76 2b5m n VAL 52 N -2.36 0.03 -3.73 3.83 0.24 -0.85 -4.82 118.33 110.67 2b5m n VAL 52 Ca 0.11 0.01 -0.13 0.00 -2.04 0.00 0.00 64.34 62.29 2b5m n VAL 52 Cb 0.51 -0.63 -0.10 0.00 -1.47 0.00 0.00 33.84 32.16 2b5m n VAL 52 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 2b5m s LYS 53 N -2.00 0.48 -0.30 7.34 2.47 -1.23 -5.04 119.74 121.47 2b5m s LYS 53 Ca 0.00 0.56 0.01 0.00 -1.56 0.00 0.00 55.97 54.98 2b5m s LYS 53 Cb 0.00 0.23 0.09 0.00 -1.46 0.00 0.00 37.83 36.69 2b5m s LYS 53 CO 0.00 -0.06 0.04 -2.00 0.16 0.00 0.00 175.35 173.49 2b5m s GLU 54 N 0.20 1.21 0.19 4.03 -6.30 -1.26 -1.25 118.70 115.51 2b5m s GLU 54 Ca -0.00 -1.33 0.02 0.00 -2.50 0.00 0.00 54.97 51.16 2b5m s GLU 54 Cb -0.03 -2.57 -0.04 0.00 0.00 0.00 0.00 34.13 31.49 2b5m s GLU 54 CO 0.01 -0.87 0.34 0.14 0.02 0.00 0.00 175.26 174.90 2b5m s VAL 55 N 1.31 5.26 -0.11 3.70 -7.23 -0.95 -5.00 120.40 117.38 2b5m s VAL 55 Ca 0.06 -0.61 -0.02 0.00 -1.81 0.00 0.00 61.98 59.60 2b5m s VAL 55 Cb -0.18 -3.76 -0.03 0.00 0.56 0.00 0.00 36.38 32.97 2b5m s VAL 55 CO -0.14 -0.18 -0.03 -0.83 -0.31 0.00 0.00 175.10 173.61 2b5m s GLY 56 N -3.35 1.76 0.08 2.32 0.00 -1.26 -1.72 107.32 105.14 2b5m s GLY 56 Ca 0.36 -0.83 -0.00 0.00 0.00 0.00 0.00 44.72 44.25 2b5m s GLY 56 CO 0.29 -0.36 0.24 1.06 0.00 0.00 0.00 173.10 174.34 2b5m s MET 57 N -0.28 3.46 -1.28 2.90 -1.94 -0.40 -4.66 119.30 117.10 2b5m s MET 57 Ca 0.05 -0.43 -0.07 0.00 -1.71 0.00 0.00 55.69 53.53 2b5m s MET 57 Cb -0.13 -3.01 0.16 0.00 2.01 0.00 0.00 34.83 33.87 2b5m s MET 57 CO 0.02 0.58 2.10 0.66 -0.01 0.00 0.00 175.02 178.37 2b5m n TYR 58 N 0.12 2.72 0.00 -0.03 4.01 -1.26 -4.79 117.16 117.93 2b5m n TYR 58 Ca -0.05 -2.78 0.00 0.00 -0.16 0.00 0.00 57.90 54.90 2b5m n TYR 58 Cb 0.52 -1.84 0.00 0.00 -0.31 0.00 0.00 39.34 37.71 2b5m n TYR 58 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2b5m n GLY 59 N 2.13 2.35 3.71 2.72 0.00 -1.26 -4.64 105.19 110.19 2b5m n GLY 59 Ca 0.50 -0.84 -0.41 0.00 0.00 0.00 0.00 46.02 45.27 2b5m n GLY 59 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2b5m s LYS 60 N -2.00 4.49 0.11 1.61 1.02 -1.26 -4.18 119.74 119.53 2b5m s LYS 60 Ca 0.00 1.15 -0.30 0.00 0.02 0.00 0.00 55.97 56.84 2b5m s LYS 60 Cb 0.00 -3.46 -0.06 0.00 -0.52 0.00 0.00 37.83 33.79 2b5m s LYS 60 CO 0.00 -0.01 1.06 0.42 -0.92 0.00 0.00 175.35 175.90 2b5m s ILE 61 N 0.98 4.24 0.00 2.17 1.01 -0.56 -0.84 121.20 128.21 2b5m s ILE 61 Ca 0.44 1.79 0.00 0.00 0.00 0.00 0.00 60.65 62.88 2b5m s ILE 61 Cb -0.19 -4.14 0.00 0.00 0.01 0.00 0.00 42.46 38.13 2b5m s ILE 61 CO 0.22 0.24 0.00 0.00 0.00 0.00 0.00 174.94 175.41 2b5m n ALA 62 N 3.02 1.55 -3.55 9.38 0.00 0.41 -4.79 120.51 126.52 2b5m n ALA 62 Ca 0.04 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.34 2b5m n ALA 62 Cb 0.48 0.09 -0.15 0.00 0.00 0.00 0.00 19.45 19.87 2b5m n ALA 62 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2b5m s VAL 63 N -1.55 -0.04 -0.28 0.00 1.01 -0.95 -4.91 120.40 113.68 2b5m s VAL 63 Ca 0.00 0.15 -0.01 0.00 0.00 0.00 0.00 61.98 62.12 2b5m s VAL 63 Cb 0.00 -0.14 0.13 0.00 0.00 0.00 0.00 36.38 36.36 2b5m s VAL 63 CO 0.00 0.06 0.28 -0.32 0.00 0.00 0.00 175.10 175.12 2b5m s MET 64 N 0.85 0.30 0.11 2.72 0.00 -1.26 -1.77 119.30 120.26 2b5m s MET 64 Ca -0.07 -0.08 0.06 0.00 0.00 0.00 0.00 55.69 55.60 2b5m s MET 64 Cb -0.09 -0.75 -0.04 0.00 0.00 0.00 0.00 34.83 33.95 2b5m s MET 64 CO -0.03 -0.96 -0.14 -1.21 0.00 0.00 0.00 175.02 172.68 2b5m s GLU 65 N 2.35 0.98 0.20 4.11 0.41 -0.97 -4.72 118.70 121.07 2b5m s GLU 65 Ca 0.09 -1.19 0.09 0.00 -0.41 0.00 0.00 54.97 53.55 2b5m s GLU 65 Cb -0.14 -0.88 -0.04 0.00 -1.78 0.00 0.00 34.13 31.29 2b5m s GLU 65 CO -0.29 0.17 -0.06 -0.51 -0.49 0.00 0.00 175.26 174.07 2b5m s LEU 66 N -2.34 3.06 -0.17 1.80 1.43 -1.26 -0.50 118.68 120.70 2b5m s LEU 66 Ca 0.07 -0.57 -0.31 0.00 -1.03 0.00 0.00 54.13 52.29 2b5m s LEU 66 Cb -0.06 -1.70 0.14 0.00 0.03 0.00 0.00 46.19 44.60 2b5m s LEU 66 CO 0.03 0.08 1.10 0.72 0.23 0.00 0.00 176.35 178.50 2b5m s PHE 67 N -1.85 -0.25 -0.24 0.29 -0.12 -0.53 -4.95 117.98 110.34 2b5m s PHE 67 Ca 0.27 0.33 -0.04 0.00 -0.05 0.00 0.00 56.93 57.44 2b5m s PHE 67 Cb -0.08 0.49 0.08 0.00 -0.63 0.00 0.00 43.02 42.88 2b5m s PHE 67 CO 0.17 -0.28 0.10 -0.98 -0.05 0.00 0.00 175.22 174.17 2b5m s ARG 68 N -1.72 0.27 0.81 1.99 1.70 -1.26 0.13 118.95 120.88 2b5m s ARG 68 Ca 0.04 -0.42 -0.12 0.00 -0.47 0.00 0.00 55.73 54.76 2b5m s ARG 68 Cb -0.01 -1.62 0.08 0.00 -0.57 0.00 0.00 34.95 32.83 2b5m s ARG 68 CO -0.03 -0.84 1.14 -2.14 -1.08 0.00 0.00 175.30 172.35 2b5m s PRO 69 N 2.02 1.78 0.45 3.89 0.02 -1.26 -4.89 135.00 137.01 2b5m s PRO 69 Ca 0.05 1.49 -0.23 0.00 0.02 0.00 0.00 61.00 62.33 2b5m s PRO 69 Cb -0.16 -1.82 -0.11 0.00 0.02 0.00 0.00 34.50 32.43 2b5m s PRO 69 CO -0.22 -2.05 0.81 0.36 -0.33 0.00 0.00 177.00 175.57 2b5m n LYS 70 N -3.51 0.96 -1.09 5.54 0.00 -1.26 -2.03 118.16 116.77 2b5m n LYS 70 Ca 0.11 0.35 -0.03 0.00 -0.00 0.00 0.00 58.31 58.74 2b5m n LYS 70 Cb 0.52 -1.83 -0.01 0.00 -0.00 0.00 0.00 35.03 33.70 2b5m n LYS 70 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2b5m n GLY 71 N 1.45 0.57 3.49 2.58 0.00 -1.26 -4.98 105.19 107.04 2b5m n GLY 71 Ca 0.11 -0.26 -0.34 0.00 0.00 0.00 0.00 46.02 45.53 2b5m n GLY 71 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2b5m s GLU 72 N -1.48 3.68 -0.02 1.61 0.41 -0.86 -5.01 118.70 117.02 2b5m s GLU 72 Ca 0.00 -0.50 -0.24 0.00 -0.41 0.00 0.00 54.97 53.82 2b5m s GLU 72 Cb 0.00 -3.03 -0.17 0.00 -1.78 0.00 0.00 34.13 29.15 2b5m s GLU 72 CO 0.00 0.13 1.11 1.03 -0.49 0.00 0.00 175.26 177.04 2b5m h SER 73 N 7.08 -0.20 -0.44 -0.19 0.87 -1.94 -3.46 113.55 115.28 2b5m h SER 73 Ca -0.34 -0.32 0.00 0.00 -1.23 0.00 0.00 61.79 59.90 2b5m h SER 73 Cb 1.18 0.05 0.00 0.00 -0.44 0.00 0.00 62.40 63.19 2b5m h SER 73 CO 0.63 0.26 0.00 2.29 -0.53 0.00 0.00 176.83 179.48 2b5m n LYS 74 N -4.99 2.37 -3.89 2.24 2.85 -1.26 -4.64 118.16 110.85 2b5m n LYS 74 Ca -0.09 0.00 -0.33 0.00 -1.05 0.00 0.00 58.31 56.85 2b5m n LYS 74 Cb 0.26 0.00 -0.05 0.00 -0.65 0.00 0.00 35.03 34.59 2b5m n LYS 74 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 2b5m s ASP 75 N 1.00 6.38 0.27 -5.58 -0.00 -0.37 -4.68 116.67 113.68 2b5m s ASP 75 Ca 0.00 0.35 -0.02 0.00 -0.00 0.00 0.00 52.55 52.88 2b5m s ASP 75 Cb 0.00 -2.00 -0.05 0.00 -0.00 0.00 0.00 42.92 40.87 2b5m s ASP 75 CO 0.00 0.23 0.50 -0.76 -0.00 0.00 0.00 175.17 175.14 2b5m s LEU 76 N -2.10 4.11 -0.20 1.23 1.43 0.35 -4.50 118.68 119.00 2b5m s LEU 76 Ca 0.30 0.56 -0.09 0.00 -1.03 0.00 0.00 54.13 53.86 2b5m s LEU 76 Cb -0.13 -3.37 -0.05 0.00 0.03 0.00 0.00 46.19 42.68 2b5m s LEU 76 CO 0.21 -0.16 0.11 -0.22 0.23 0.00 0.00 176.35 176.52 2b5m s LEU 77 N -3.60 4.04 -0.09 1.79 2.96 0.06 -1.45 118.68 122.40 2b5m s LEU 77 Ca 0.41 0.15 -0.02 0.00 -0.22 0.00 0.00 54.13 54.46 2b5m s LEU 77 Cb -0.11 -2.05 -0.03 0.00 0.50 0.00 0.00 46.19 44.51 2b5m s LEU 77 CO 0.31 0.15 -0.01 0.12 -1.32 0.00 0.00 176.35 175.60 2b5m s PHE 78 N 0.51 3.11 -0.06 5.38 5.36 0.35 0.76 117.98 133.38 2b5m s PHE 78 Ca 0.06 0.12 -0.04 0.00 -0.96 0.00 0.00 56.93 56.11 2b5m s PHE 78 Cb -0.12 -1.79 0.02 0.00 -0.34 0.00 0.00 43.02 40.79 2b5m s PHE 78 CO -0.00 0.39 0.14 0.42 -1.46 0.00 0.00 175.22 174.72 2b5m s ILE 79 N -0.74 -0.02 -0.04 3.12 1.01 -0.26 -2.29 121.20 121.99 2b5m s ILE 79 Ca 0.11 0.06 0.06 0.00 0.00 0.00 0.00 60.65 60.88 2b5m s ILE 79 Cb -0.11 -0.22 -0.02 0.00 0.01 0.00 0.00 42.46 42.12 2b5m s ILE 79 CO 0.02 0.02 -0.21 -0.22 0.00 0.00 0.00 174.94 174.56 2b5m s LEU 80 N 0.44 2.35 0.37 2.97 2.96 -0.73 -1.10 118.68 125.94 2b5m s LEU 80 Ca -0.03 -0.36 -0.13 0.00 -0.22 0.00 0.00 54.13 53.38 2b5m s LEU 80 Cb -0.04 -1.44 -0.08 0.00 0.50 0.00 0.00 46.19 45.12 2b5m s LEU 80 CO -0.02 0.31 0.76 -0.89 -1.32 0.00 0.00 176.35 175.19 2b5m s THR 81 N -0.53 4.71 0.54 3.68 2.01 0.22 -0.45 115.64 125.83 2b5m s THR 81 Ca 0.07 0.84 0.28 0.00 0.31 0.00 0.00 61.69 63.19 2b5m s THR 81 Cb -0.11 -3.66 0.43 0.00 0.01 0.00 0.00 72.50 69.16 2b5m s THR 81 CO 0.01 -0.35 1.94 0.00 -0.69 0.00 0.00 174.62 175.53 2b5m h ALA 82 N 1.78 2.57 -0.44 7.40 0.00 -1.30 0.35 119.26 129.63 2b5m h ALA 82 Ca -0.48 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2b5m h ALA 82 Cb 1.18 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2b5m h ALA 82 CO 0.64 -0.84 0.00 1.17 0.00 0.00 0.00 179.25 180.23 2b5m n LYS 83 N -4.21 3.89 -1.42 0.00 3.00 -1.26 -4.94 118.16 113.21 2b5m n LYS 83 Ca 0.13 -2.38 -0.07 0.00 -0.00 0.00 0.00 58.31 56.00 2b5m n LYS 83 Cb 0.75 -2.05 -0.02 0.00 0.00 0.00 0.00 35.03 33.71 2b5m n LYS 83 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 2b5m n TYR 84 N 0.51 -0.08 -2.58 5.64 4.02 0.12 -4.81 117.16 119.99 2b5m n TYR 84 Ca 0.21 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.68 2b5m n TYR 84 Cb 0.95 -1.58 -0.03 0.00 -0.02 0.00 0.00 39.34 38.66 2b5m n TYR 84 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 176.86 175.05 2b5m s ASN 85 N -2.87 6.29 0.29 7.72 0.01 -1.25 -0.82 114.94 124.31 2b5m s ASN 85 Ca 0.00 -0.22 -0.17 0.00 -0.71 0.00 0.00 52.86 51.76 2b5m s ASN 85 Cb 0.00 -2.55 -0.09 0.00 0.41 0.00 0.00 41.25 39.02 2b5m s ASN 85 CO 0.00 -1.66 0.74 0.00 -1.51 0.00 0.00 177.10 174.67 2b5m s ALA 86 N 5.32 3.35 -0.10 0.60 0.00 0.06 -0.61 121.76 130.39 2b5m s ALA 86 Ca 0.38 0.10 -0.30 0.00 0.00 0.00 0.00 51.96 52.14 2b5m s ALA 86 Cb -0.08 -2.80 0.11 0.00 0.00 0.00 0.00 23.12 20.35 2b5m s ALA 86 CO 0.19 0.32 0.88 0.00 0.00 0.00 0.00 175.76 177.16 2b5m s ILE 88 N -1.47 3.71 0.17 0.00 1.01 -1.00 -1.10 121.20 122.52 2b5m s ILE 88 Ca -0.03 -0.44 0.10 0.00 0.00 0.00 0.00 60.65 60.27 2b5m s ILE 88 Cb -0.00 -2.57 -0.04 0.00 0.01 0.00 0.00 42.46 39.85 2b5m s ILE 88 CO 0.02 0.54 -0.21 -0.76 0.00 0.00 0.00 174.94 174.53 2b5m s LEU 89 N -0.13 2.43 -0.03 2.97 1.43 0.23 -1.37 118.68 124.21 2b5m s LEU 89 Ca 0.02 -0.85 0.04 0.00 -1.03 0.00 0.00 54.13 52.30 2b5m s LEU 89 Cb -0.13 -1.00 -0.00 0.00 0.03 0.00 0.00 46.19 45.09 2b5m s LEU 89 CO 0.03 0.05 -0.14 -0.70 0.23 0.00 0.00 176.35 175.81 2b5m s GLU 90 N -2.67 1.44 -0.28 1.70 2.12 -0.60 -0.76 118.70 119.66 2b5m s GLU 90 Ca 0.17 -0.50 -0.22 0.00 0.36 0.00 0.00 54.97 54.78 2b5m s GLU 90 Cb -0.07 -1.29 -0.01 0.00 0.26 0.00 0.00 34.13 33.02 2b5m s GLU 90 CO 0.08 0.21 0.71 -0.47 -0.54 0.00 0.00 175.26 175.25 2b5m s TYR 91 N 0.04 3.25 -0.16 5.30 5.04 -1.26 -0.90 117.35 128.66 2b5m s TYR 91 Ca -0.02 0.82 -0.01 0.00 -2.44 0.00 0.00 57.07 55.42 2b5m s TYR 91 Cb -0.10 -3.02 0.04 0.00 0.35 0.00 0.00 41.96 39.23 2b5m s TYR 91 CO 0.01 -0.44 -0.04 0.21 -1.34 0.00 0.00 175.55 173.95 2b5m s LYS 92 N 2.72 1.32 -0.12 4.97 2.20 0.79 -4.92 119.74 126.71 2b5m s LYS 92 Ca 0.29 -0.45 -0.04 0.00 -0.36 0.00 0.00 55.97 55.41 2b5m s LYS 92 Cb -0.15 -1.92 0.06 0.00 -1.51 0.00 0.00 37.83 34.31 2b5m s LYS 92 CO 0.10 -0.43 0.17 -1.14 -0.36 0.00 0.00 175.35 173.69 2b5m s GLN 93 N 1.68 0.07 0.03 4.03 0.74 -1.26 -0.21 119.66 124.74 2b5m s GLN 93 Ca 0.01 0.45 0.00 0.00 0.05 0.00 0.00 55.36 55.87 2b5m s GLN 93 Cb -0.15 -0.57 0.00 0.00 1.10 0.00 0.00 33.01 33.39 2b5m s GLN 93 CO -0.08 -0.40 0.00 0.43 -0.55 0.00 0.00 175.29 174.69 2b5m n SER 94 N 5.32 0.14 -2.20 6.67 7.64 -1.23 -5.03 113.62 124.92 2b5m n SER 94 Ca -0.05 0.04 0.00 0.00 1.01 0.00 0.00 58.87 59.87 2b5m n SER 94 Cb 0.50 -0.02 0.00 0.00 -1.01 0.00 0.00 64.21 63.67 2b5m n SER 94 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2b5m n GLY 95 N 2.68 0.54 0.31 0.23 0.00 -1.26 -4.88 105.19 102.81 2b5m n GLY 95 Ca 0.00 -1.67 0.08 0.00 0.00 0.00 0.00 46.02 44.43 2b5m n GLY 95 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2b5m h GLU 96 N 0.00 0.31 -6.32 1.61 4.22 -2.03 -3.44 114.58 108.93 2b5m h GLU 96 Ca 0.00 -0.02 -0.46 0.00 0.08 0.00 0.00 59.36 58.96 2b5m h GLU 96 Cb 0.00 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.17 2b5m h GLU 96 CO 0.00 0.21 -0.30 -1.54 -2.18 0.00 0.00 179.01 175.20 2b5m s SER 97 N -6.69 5.31 0.02 1.04 1.04 -1.26 -5.14 113.70 108.03 2b5m s SER 97 Ca -0.07 -0.63 0.03 0.00 0.48 0.00 0.00 55.95 55.77 2b5m s SER 97 Cb 0.18 -0.50 -0.02 0.00 0.10 0.00 0.00 66.02 65.78 2b5m s SER 97 CO 0.72 -0.77 -0.11 -0.63 0.98 0.00 0.00 173.24 173.43 2b5m s ILE 98 N -2.45 0.81 -0.13 -1.02 1.09 -1.26 -3.56 121.20 114.68 2b5m s ILE 98 Ca 0.52 -0.79 -0.09 0.00 -1.10 0.00 0.00 60.65 59.19 2b5m s ILE 98 Cb -0.06 -0.75 0.05 0.00 -1.06 0.00 0.00 42.46 40.63 2b5m s ILE 98 CO 0.31 -0.02 0.33 -1.81 -0.10 0.00 0.00 174.94 173.65 2b5m s ASP 99 N -0.91 -0.38 -0.62 3.58 1.01 0.71 -5.00 116.67 115.06 2b5m s ASP 99 Ca -0.00 0.70 -0.19 0.00 0.71 0.00 0.00 52.55 53.77 2b5m s ASP 99 Cb -0.07 0.62 0.11 0.00 1.01 0.00 0.00 42.92 44.60 2b5m s ASP 99 CO 0.01 -0.16 0.72 -0.63 0.21 0.00 0.00 175.17 175.32 2b5m s ILE 100 N 0.98 4.85 0.31 0.77 -1.09 -1.26 -0.15 121.20 125.62 2b5m s ILE 100 Ca -0.07 -1.09 -0.10 0.00 -2.23 0.00 0.00 60.65 57.16 2b5m s ILE 100 Cb -0.07 -4.50 -0.07 0.00 -1.58 0.00 0.00 42.46 36.24 2b5m s ILE 100 CO -0.07 -1.14 0.65 -0.51 -1.23 0.00 0.00 174.94 172.64 2b5m s ILE 101 N 2.56 4.86 -0.73 2.92 1.10 -0.08 -4.86 121.20 126.97 2b5m s ILE 101 Ca 0.13 0.51 -0.06 0.00 -0.51 0.00 0.00 60.65 60.72 2b5m s ILE 101 Cb -0.23 -3.68 0.19 0.00 0.15 0.00 0.00 42.46 38.89 2b5m s ILE 101 CO 0.05 -0.29 0.60 -0.89 -2.11 0.00 0.00 174.94 172.30 2b5m s THR 102 N -2.08 4.35 0.19 4.00 2.01 -1.26 -1.56 115.64 121.29 2b5m s THR 102 Ca 0.49 -3.01 -0.12 0.00 0.31 0.00 0.00 61.69 59.36 2b5m s THR 102 Cb -0.11 -3.76 0.11 0.00 0.01 0.00 0.00 72.50 68.76 2b5m s THR 102 CO 0.26 -0.96 1.84 0.03 -0.69 0.00 0.00 174.62 175.10 2b5m h ARG 103 N 7.02 0.87 -3.88 4.92 2.47 -1.57 -3.44 114.38 120.76 2b5m h ARG 103 Ca 0.05 -0.07 -0.10 0.00 -1.26 0.00 0.00 59.98 58.60 2b5m h ARG 103 Cb 0.95 -0.19 -0.13 0.00 -1.65 0.00 0.00 29.97 28.95 2b5m h ARG 103 CO 0.75 0.60 -0.35 0.00 0.56 0.00 0.00 179.97 181.53 2b5m s ALA 104 N -6.05 -0.03 -0.18 0.04 0.00 -1.20 -4.88 121.76 109.46 2b5m s ALA 104 Ca -0.13 -0.82 -0.30 0.00 0.00 0.00 0.00 51.96 50.71 2b5m s ALA 104 Cb 0.14 0.74 0.13 0.00 0.00 0.00 0.00 23.12 24.12 2b5m s ALA 104 CO 0.77 -0.59 1.02 -3.38 0.00 0.00 0.00 175.76 173.58 2b5m s HIS 105 N -3.94 -0.36 -0.29 0.00 -3.43 -0.40 -2.38 115.29 104.50 2b5m s HIS 105 Ca 0.13 0.64 -0.36 0.00 -0.80 0.00 0.00 55.06 54.67 2b5m s HIS 105 Cb 0.04 0.44 0.17 0.00 -1.43 0.00 0.00 32.58 31.80 2b5m s HIS 105 CO -0.04 -0.31 1.38 0.20 -2.00 0.00 0.00 174.74 173.97 2b5m s GLY 106 N -0.97 -0.13 -0.33 -1.38 0.00 -0.72 -4.21 107.32 99.57 2b5m s GLY 106 Ca -0.01 2.13 -0.13 0.00 0.00 0.00 0.00 44.72 46.71 2b5m s GLY 106 CO 0.00 0.75 0.28 0.21 0.00 0.00 0.00 173.10 174.34 2b5m s ASN 107 N -1.79 6.10 0.00 1.64 3.84 -1.26 -0.76 114.94 122.72 2b5m s ASN 107 Ca 0.11 -0.29 0.23 0.00 0.21 0.00 0.00 52.86 53.13 2b5m s ASN 107 Cb -0.01 -2.16 0.49 0.00 -0.55 0.00 0.00 41.25 39.02 2b5m s ASN 107 CO -0.04 -0.25 1.43 1.33 -2.79 0.00 0.00 177.10 176.78 2b5m n VAL 108 N 5.14 0.27 -1.38 -5.21 0.24 0.00 -4.91 118.33 112.49 2b5m n VAL 108 Ca -0.11 -0.56 -0.52 0.00 -2.04 0.00 0.00 64.34 61.11 2b5m n VAL 108 Cb 0.50 0.95 -0.06 0.00 -1.47 0.00 0.00 33.84 33.76 2b5m n VAL 108 CO 0.00 0.00 0.00 1.67 -2.14 0.00 0.00 176.83 176.36 2b5m n GLN 109 N 1.10 0.00 -4.54 7.34 7.27 -1.25 -4.98 117.38 122.32 2b5m n GLN 109 Ca 0.17 0.00 -0.33 0.00 0.07 0.00 0.00 57.00 56.91 2b5m n GLN 109 Cb 0.53 -1.25 -0.14 0.00 2.41 0.00 0.00 30.24 31.79 2b5m n GLN 109 CO 0.00 0.00 0.00 -0.51 0.07 0.00 0.00 177.06 176.62 2b5m s ASP 110 N -0.33 4.04 0.30 1.69 1.01 -1.26 -5.02 116.67 117.10 2b5m s ASP 110 Ca 0.77 -0.35 -0.00 0.00 0.71 0.00 0.00 52.55 53.67 2b5m s ASP 110 Cb -1.08 -1.63 0.69 0.00 1.01 0.00 0.00 42.92 41.90 2b5m s ASP 110 CO 0.53 0.12 1.58 -0.09 0.21 0.00 0.00 175.17 177.52 2b5m h ARG 111 N 7.07 0.02 0.00 8.23 9.65 -2.01 -3.41 114.38 133.92 2b5m h ARG 111 Ca -0.30 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.58 2b5m h ARG 111 Cb 1.20 -0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.77 2b5m h ARG 111 CO 0.57 0.01 0.00 0.44 2.80 0.00 0.00 179.97 183.80 2b5m n ILE 112 N -5.49 0.00 -1.10 1.20 -5.35 -1.26 -5.05 119.36 102.31 2b5m n ILE 112 Ca 0.21 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.69 2b5m n ILE 112 Cb 0.70 -1.28 0.00 0.00 -1.74 0.00 0.00 39.64 37.32 2b5m n ILE 112 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2b5m n GLY 113 N 5.00 -4.35 3.76 3.28 0.00 -1.26 -5.01 105.19 106.61 2b5m n GLY 113 Ca 0.00 -0.59 -0.38 0.00 0.00 0.00 0.00 46.02 45.06 2b5m n GLY 113 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2b5m s ARG 114 N -2.31 4.18 -0.20 1.61 1.70 -1.26 -4.98 118.95 117.68 2b5m s ARG 114 Ca 0.00 0.35 -0.38 0.00 -0.47 0.00 0.00 55.73 55.23 2b5m s ARG 114 Cb 0.00 -3.37 -0.14 0.00 -0.57 0.00 0.00 34.95 30.87 2b5m s ARG 114 CO 0.00 0.35 1.77 -2.30 -1.08 0.00 0.00 175.30 174.04 2b5m n PRO 115 N 3.06 1.48 -2.95 3.89 -0.02 -1.26 -1.71 135.00 137.50 2b5m n PRO 115 Ca -0.10 0.54 -0.34 0.00 -2.02 0.00 0.00 63.50 61.58 2b5m n PRO 115 Cb 0.52 -2.28 -0.07 0.00 -0.02 0.00 0.00 33.50 31.66 2b5m n PRO 115 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2b5m s SER 116 N 3.57 6.98 0.28 2.55 1.04 -1.24 -4.75 113.70 122.14 2b5m s SER 116 Ca 0.96 1.56 -0.30 0.00 0.48 0.00 0.00 55.95 58.65 2b5m s SER 116 Cb -0.95 -2.48 -0.11 0.00 0.10 0.00 0.00 66.02 62.59 2b5m s SER 116 CO 0.60 -0.21 1.53 -0.70 0.98 0.00 0.00 173.24 175.45 2b5m s GLU 117 N -2.75 4.17 0.00 4.02 2.12 -1.26 -1.52 118.70 123.48 2b5m s GLU 117 Ca 0.55 2.48 0.00 0.00 0.36 0.00 0.00 54.97 58.36 2b5m s GLU 117 Cb -0.12 -3.05 0.00 0.00 0.26 0.00 0.00 34.13 31.22 2b5m s GLU 117 CO 0.17 -0.55 0.00 0.25 -0.54 0.00 0.00 175.26 174.60 2b5m n THR 118 N 2.09 0.00 -4.89 -1.70 -2.24 -1.26 -4.87 114.28 101.41 2b5m n THR 118 Ca 0.07 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.85 2b5m n THR 118 Cb 0.39 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.62 2b5m n THR 118 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2b5m n GLY 119 N -2.00 0.26 3.73 3.38 0.00 -0.57 -4.83 105.19 105.16 2b5m n GLY 119 Ca 0.00 -0.92 -0.42 0.00 0.00 0.00 0.00 46.02 44.68 2b5m n GLY 119 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2b5m s ILE 120 N 0.00 2.82 -0.06 -0.61 1.01 -1.26 -4.81 121.20 118.28 2b5m s ILE 120 Ca 0.00 0.64 0.03 0.00 0.00 0.00 0.00 60.65 61.32 2b5m s ILE 120 Cb 0.00 -3.41 0.01 0.00 0.01 0.00 0.00 42.46 39.07 2b5m s ILE 120 CO 0.00 0.08 -0.14 -0.63 0.00 0.00 0.00 174.94 174.25 2b5m s ILE 121 N 0.48 1.28 -0.19 2.92 1.01 -0.64 -5.00 121.20 121.05 2b5m s ILE 121 Ca 0.63 -0.58 -0.01 0.00 0.00 0.00 0.00 60.65 60.69 2b5m s ILE 121 Cb -0.41 -1.14 0.05 0.00 0.01 0.00 0.00 42.46 40.97 2b5m s ILE 121 CO 0.37 0.38 -0.03 -0.83 0.00 0.00 0.00 174.94 174.83 2b5m s GLY 122 N 0.48 1.00 0.12 6.18 0.00 -1.26 -0.42 107.32 113.43 2b5m s GLY 122 Ca -0.12 -0.96 0.07 0.00 0.00 0.00 0.00 44.72 43.71 2b5m s GLY 122 CO 0.04 1.04 -0.16 -0.26 0.00 0.00 0.00 173.10 173.75 2b5m s ILE 123 N 1.61 1.49 -0.10 0.90 -4.36 0.76 -4.93 121.20 116.58 2b5m s ILE 123 Ca -0.02 -1.70 0.02 0.00 -0.26 0.00 0.00 60.65 58.70 2b5m s ILE 123 Cb -0.17 -1.57 0.01 0.00 1.25 0.00 0.00 42.46 41.99 2b5m s ILE 123 CO -0.07 -0.31 -0.16 -0.63 0.24 0.00 0.00 174.94 174.01 2b5m s ILE 124 N -1.86 1.48 0.39 8.37 1.01 -1.26 0.17 121.20 129.51 2b5m s ILE 124 Ca 0.09 -0.65 -0.27 0.00 0.00 0.00 0.00 60.65 59.82 2b5m s ILE 124 Cb -0.06 -1.35 -0.10 0.00 0.01 0.00 0.00 42.46 40.96 2b5m s ILE 124 CO 0.04 0.44 1.37 -0.67 0.00 0.00 0.00 174.94 176.12 2b5m n ASP 125 N 4.04 3.11 0.31 3.58 2.03 -1.11 -4.86 116.55 123.64 2b5m n ASP 125 Ca -0.20 1.17 0.19 0.00 0.52 0.00 0.00 54.79 56.47 2b5m n ASP 125 Cb 0.52 -1.55 0.95 0.00 -0.72 0.00 0.00 41.12 40.32 2b5m n ASP 125 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 2b5m h PRO 126 N 2.49 0.00 -0.70 -0.67 0.11 -1.92 0.46 132.00 131.76 2b5m h PRO 126 Ca -0.49 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.45 2b5m h PRO 126 Cb 1.27 0.00 -0.10 0.00 0.11 0.00 0.00 31.00 32.28 2b5m h PRO 126 CO 0.62 0.02 0.21 0.39 -0.21 0.00 0.00 178.00 179.03 2b5m n GLU 127 N -3.17 3.92 -4.25 1.05 1.02 -1.26 -4.95 120.64 112.99 2b5m n GLU 127 Ca -0.01 -3.11 -0.32 0.00 -0.02 0.00 0.00 57.16 53.69 2b5m n GLU 127 Cb 0.18 -2.22 -0.06 0.00 -0.02 0.00 0.00 31.44 29.32 2b5m n GLU 127 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2b5m h ARG 129 N -1.60 0.00 -3.48 0.00 9.65 -1.93 -3.43 114.38 113.58 2b5m h ARG 129 Ca -0.63 0.00 -0.05 0.00 -1.10 0.00 0.00 59.98 58.20 2b5m h ARG 129 Cb 1.39 0.00 -0.07 0.00 -1.39 0.00 0.00 29.97 29.90 2b5m h ARG 129 CO 0.73 0.52 -0.01 0.00 2.80 0.00 0.00 179.97 184.02 2b5m s MET 130 N -2.74 1.71 -0.14 0.20 0.23 -1.26 -2.75 119.30 114.54 2b5m s MET 130 Ca -0.02 -1.26 -0.03 0.00 -1.03 0.00 0.00 55.69 53.34 2b5m s MET 130 Cb 0.08 0.52 -0.03 0.00 -1.53 0.00 0.00 34.83 33.87 2b5m s MET 130 CO 0.81 -0.74 -0.03 0.42 -2.03 0.00 0.00 175.02 173.45 2b5m s ILE 131 N -3.73 3.96 -0.33 3.16 1.01 0.58 -2.74 121.20 123.11 2b5m s ILE 131 Ca 0.20 -0.34 -0.09 0.00 0.00 0.00 0.00 60.65 60.41 2b5m s ILE 131 Cb -0.02 -2.72 0.01 0.00 0.01 0.00 0.00 42.46 39.74 2b5m s ILE 131 CO 0.10 0.51 0.15 -0.83 0.00 0.00 0.00 174.94 174.87 2b5m s GLY 132 N 0.17 1.87 -0.19 6.18 0.00 0.46 -0.87 107.32 114.94 2b5m s GLY 132 Ca -0.01 -1.53 -0.04 0.00 0.00 0.00 0.00 44.72 43.14 2b5m s GLY 132 CO 0.03 0.74 -0.04 1.08 0.00 0.00 0.00 173.10 174.91 2b5m s LEU 133 N 1.56 3.07 -0.38 0.66 1.02 -0.70 -0.17 118.68 123.74 2b5m s LEU 133 Ca 0.03 -0.26 -0.09 0.00 0.02 0.00 0.00 54.13 53.83 2b5m s LEU 133 Cb -0.18 -1.76 0.05 0.00 0.02 0.00 0.00 46.19 44.32 2b5m s LEU 133 CO 0.05 0.08 0.20 -0.60 0.02 0.00 0.00 176.35 176.10 2b5m s ARG 134 N 0.91 2.67 -0.07 1.70 3.00 0.43 -1.29 118.95 126.30 2b5m s ARG 134 Ca -0.00 -1.26 0.07 0.00 -1.00 0.00 0.00 55.73 53.53 2b5m s ARG 134 Cb -0.15 -3.67 -0.10 0.00 0.00 0.00 0.00 34.95 31.04 2b5m s ARG 134 CO 0.01 -0.79 0.03 1.28 0.00 0.00 0.00 175.30 175.83 2b5m n LEU 135 N 4.91 0.00 -4.10 -0.88 4.77 -1.26 -1.63 117.00 118.81 2b5m n LEU 135 Ca -0.11 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 55.72 2b5m n LEU 135 Cb 0.44 0.18 -0.12 0.00 -2.33 0.00 0.00 43.42 41.60 2b5m n LEU 135 CO 0.36 0.18 -0.42 -0.31 -1.33 0.00 0.00 177.39 175.87 2b5m s TYR 136 N -2.20 0.88 -0.01 -1.77 1.51 -1.26 -3.59 117.35 110.90 2b5m s TYR 136 Ca -0.04 -0.47 -0.33 0.00 -1.01 0.00 0.00 57.07 55.23 2b5m s TYR 136 Cb 0.02 -0.51 -0.11 0.00 -0.11 0.00 0.00 41.96 41.25 2b5m s TYR 136 CO 0.32 -0.03 1.88 -0.25 -1.11 0.00 0.00 175.55 176.36 2b5m n ASP 137 N 1.46 3.70 0.00 2.29 8.00 -0.69 -2.14 116.55 129.16 2b5m n ASP 137 Ca -0.22 0.96 0.00 0.00 0.71 0.00 0.00 54.79 56.25 2b5m n ASP 137 Cb 0.55 -1.44 0.00 0.00 -0.02 0.00 0.00 41.12 40.20 2b5m n ASP 137 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2b5m n GLY 138 N 4.34 0.55 3.27 0.44 0.00 -1.26 -4.74 105.19 107.80 2b5m n GLY 138 Ca 0.21 -0.82 -0.11 0.00 0.00 0.00 0.00 46.02 45.30 2b5m n GLY 138 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2b5m s LEU 139 N 0.00 0.09 -0.30 0.99 1.43 -0.91 -3.06 118.68 116.91 2b5m s LEU 139 Ca 0.00 0.86 0.02 0.00 -1.03 0.00 0.00 54.13 53.98 2b5m s LEU 139 Cb 0.00 1.34 0.08 0.00 0.03 0.00 0.00 46.19 47.64 2b5m s LEU 139 CO 0.00 -0.18 0.01 0.12 0.23 0.00 0.00 176.35 176.53 2b5m s PHE 140 N 1.04 3.02 0.13 0.29 5.36 -0.50 -4.21 117.98 123.12 2b5m s PHE 140 Ca -0.07 -2.40 -0.30 0.00 -0.96 0.00 0.00 56.93 53.20 2b5m s PHE 140 Cb -0.07 -2.26 -0.07 0.00 -0.34 0.00 0.00 43.02 40.29 2b5m s PHE 140 CO -0.09 -0.89 1.11 0.21 -1.46 0.00 0.00 175.22 174.11 2b5m s LYS 141 N 1.17 4.55 -0.09 10.12 2.20 -0.41 -2.52 119.74 134.76 2b5m s LYS 141 Ca 0.04 1.71 0.04 0.00 -0.36 0.00 0.00 55.97 57.40 2b5m s LYS 141 Cb -0.19 -3.31 -0.01 0.00 -1.51 0.00 0.00 37.83 32.82 2b5m s LYS 141 CO -0.10 -0.02 -0.23 0.08 -0.36 0.00 0.00 175.35 174.72 2b5m s VAL 142 N 0.18 2.15 -0.31 4.02 1.01 0.73 -1.71 120.40 126.46 2b5m s VAL 142 Ca 0.52 -1.01 -0.04 0.00 0.00 0.00 0.00 61.98 61.45 2b5m s VAL 142 Cb -0.29 -1.81 0.04 0.00 0.00 0.00 0.00 36.38 34.33 2b5m s VAL 142 CO 0.33 0.56 0.05 -0.63 0.00 0.00 0.00 175.10 175.41 2b5m s ILE 143 N 0.15 3.40 0.12 2.22 1.01 -0.05 -1.07 121.20 126.98 2b5m s ILE 143 Ca -0.13 -1.21 -0.30 0.00 0.00 0.00 0.00 60.65 59.01 2b5m s ILE 143 Cb -0.16 -2.92 -0.07 0.00 0.01 0.00 0.00 42.46 39.32 2b5m s ILE 143 CO 0.07 -0.11 1.25 -2.84 0.00 0.00 0.00 174.94 173.30 2b5m s PRO 144 N 1.34 4.43 -0.06 2.79 0.02 -1.26 -0.31 135.00 141.95 2b5m s PRO 144 Ca -0.03 1.89 0.17 0.00 0.02 0.00 0.00 61.00 63.05 2b5m s PRO 144 Cb -0.19 -3.28 0.60 0.00 0.02 0.00 0.00 34.50 31.64 2b5m s PRO 144 CO 0.01 -0.24 1.49 1.28 -0.33 0.00 0.00 177.00 179.21 2b5m n LEU 145 N 3.37 3.83 -4.16 -5.54 4.32 -1.11 -4.89 117.00 112.82 2b5m n LEU 145 Ca 0.08 -1.93 -0.35 0.00 -0.02 0.00 0.00 56.01 53.79 2b5m n LEU 145 Cb 0.45 -0.49 0.08 0.00 -1.62 0.00 0.00 43.42 41.84 2b5m n LEU 145 CO 0.56 0.77 -1.04 -0.90 -1.22 0.00 0.00 177.39 175.57 2b5m n ASP 146 N 1.12 -3.71 -0.32 -1.43 5.68 -1.26 -4.85 116.55 111.78 2b5m n ASP 146 Ca 0.22 0.13 0.30 0.00 -0.50 0.00 0.00 54.79 54.93 2b5m n ASP 146 Cb 0.68 -0.86 0.55 0.00 -1.14 0.00 0.00 41.12 40.35 2b5m n ASP 146 CO 0.00 0.00 0.00 0.03 -1.33 0.00 0.00 177.20 175.90 2b5m h ARG 147 N -1.34 0.08 0.00 0.11 2.47 -2.00 -3.41 114.38 110.29 2b5m h ARG 147 Ca -0.45 -0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.27 2b5m h ARG 147 Cb 1.33 -0.02 0.00 0.00 -1.65 0.00 0.00 29.97 29.63 2b5m h ARG 147 CO 0.28 0.05 0.00 -0.25 0.56 0.00 0.00 179.97 180.62 2b5m n ASP 148 N -5.21 0.00 -3.55 7.04 8.00 -1.26 -4.69 116.55 116.87 2b5m n ASP 148 Ca 0.36 0.00 -0.22 0.00 0.71 0.00 0.00 54.79 55.64 2b5m n ASP 148 Cb 1.20 0.00 0.08 0.00 -0.02 0.00 0.00 41.12 42.38 2b5m n ASP 148 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2b5m n ASN 149 N 0.00 -4.80 0.03 -2.24 5.15 -1.26 -4.86 115.26 107.28 2b5m n ASN 149 Ca 0.00 -0.58 0.05 0.00 -0.60 0.00 0.00 54.58 53.46 2b5m n ASN 149 Cb 0.00 -5.03 0.25 0.00 -0.53 0.00 0.00 39.78 34.46 2b5m n ASN 149 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 2b5m n LYS 150 N -4.70 0.04 -0.15 1.20 5.02 -1.26 -1.49 118.16 116.81 2b5m n LYS 150 Ca -0.10 0.41 0.12 0.00 -2.02 0.00 0.00 58.31 56.72 2b5m n LYS 150 Cb 0.60 -1.59 0.23 0.00 -0.02 0.00 0.00 35.03 34.25 2b5m n LYS 150 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2b5m n GLU 151 N -1.67 2.36 -4.27 1.97 1.02 -1.26 -1.27 120.64 117.52 2b5m n GLU 151 Ca 0.01 -2.05 -0.35 0.00 -0.02 0.00 0.00 57.16 54.75 2b5m n GLU 151 Cb 0.10 -1.49 -0.05 0.00 -0.02 0.00 0.00 31.44 29.98 2b5m n GLU 151 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2b5m n LEU 152 N 1.28 -1.49 -4.67 -4.62 4.77 -0.56 -4.17 117.00 107.55 2b5m n LEU 152 Ca 0.18 -1.10 -0.43 0.00 -0.03 0.00 0.00 56.01 54.63 2b5m n LEU 152 Cb 0.56 -1.93 -0.03 0.00 -2.33 0.00 0.00 43.42 39.69 2b5m n LEU 152 CO 0.15 0.30 1.53 0.29 -1.33 0.00 0.00 177.39 178.33 2b5m n LYS 153 N -4.34 2.72 -3.74 3.23 5.02 -1.26 -4.93 118.16 114.85 2b5m n LYS 153 Ca -0.04 0.99 -0.24 0.00 -2.02 0.00 0.00 58.31 57.00 2b5m n LYS 153 Cb 0.55 -2.91 -0.01 0.00 -0.02 0.00 0.00 35.03 32.64 2b5m n LYS 153 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2b5m s ALA 154 N 3.64 4.35 0.05 7.82 0.00 -1.26 -4.39 121.76 131.97 2b5m s ALA 154 Ca 0.87 -1.52 -0.02 0.00 0.00 0.00 0.00 51.96 51.29 2b5m s ALA 154 Cb -0.50 -0.85 -0.03 0.00 0.00 0.00 0.00 23.12 21.74 2b5m s ALA 154 CO 0.42 -0.44 -0.00 -0.59 0.00 0.00 0.00 175.76 175.15 2b5m s PHE 155 N -2.70 0.42 -0.05 0.00 -0.12 -0.23 -4.95 117.98 110.35 2b5m s PHE 155 Ca 0.40 -0.88 -0.02 0.00 -0.05 0.00 0.00 56.93 56.38 2b5m s PHE 155 Cb -0.02 -0.31 -0.04 0.00 -0.63 0.00 0.00 43.02 42.02 2b5m s PHE 155 CO 0.24 -0.36 0.06 -0.80 -0.05 0.00 0.00 175.22 174.31 2b5m s ASN 156 N -2.59 5.59 -0.05 1.98 0.02 -1.26 -0.19 114.94 118.44 2b5m s ASN 156 Ca 0.02 0.18 0.05 0.00 -1.02 0.00 0.00 52.86 52.09 2b5m s ASN 156 Cb 0.04 -1.62 -0.02 0.00 0.02 0.00 0.00 41.25 39.67 2b5m s ASN 156 CO -0.08 0.33 -0.20 -0.63 0.02 0.00 0.00 177.10 176.53 2b5m s ILE 157 N -1.06 2.52 0.34 0.60 1.01 -1.05 -4.97 121.20 118.59 2b5m s ILE 157 Ca 0.18 -0.92 -0.27 0.00 0.00 0.00 0.00 60.65 59.65 2b5m s ILE 157 Cb -0.12 -1.94 -0.09 0.00 0.01 0.00 0.00 42.46 40.32 2b5m s ILE 157 CO 0.08 0.58 1.07 -0.60 0.00 0.00 0.00 174.94 176.07 2b5m s ARG 158 N -0.52 4.39 -0.23 2.79 3.52 -1.26 -1.41 118.95 126.24 2b5m s ARG 158 Ca 0.07 1.63 0.02 0.00 -0.13 0.00 0.00 55.73 57.32 2b5m s ARG 158 Cb -0.11 -2.84 0.04 0.00 -1.56 0.00 0.00 34.95 30.48 2b5m s ARG 158 CO 0.01 0.03 -0.15 -1.17 -0.81 0.00 0.00 175.30 173.22 2b5m s LEU 159 N -2.08 2.89 0.48 -0.88 0.20 -1.17 -4.86 118.68 113.27 2b5m s LEU 159 Ca 0.51 -1.08 0.16 0.00 0.69 0.00 0.00 54.13 54.42 2b5m s LEU 159 Cb -0.26 -1.52 1.15 0.00 -0.43 0.00 0.00 46.19 45.13 2b5m s LEU 159 CO 0.33 -0.11 2.07 -0.08 -0.29 0.00 0.00 176.35 178.27 2b5m h GLU 160 N 7.84 0.00 -6.15 1.98 4.57 -1.95 -3.38 114.58 117.49 2b5m h GLU 160 Ca -0.30 0.00 -0.58 0.00 -1.18 0.00 0.00 59.36 57.30 2b5m h GLU 160 Cb 1.08 0.00 -0.10 0.00 -0.16 0.00 0.00 28.75 29.58 2b5m h GLU 160 CO 0.54 0.10 1.23 -1.21 -1.18 0.00 0.00 179.01 178.49 2b5m s GLU 161 N -4.78 3.39 0.43 1.92 8.01 -1.26 -4.92 118.70 121.48 2b5m s GLU 161 Ca -0.04 -0.73 0.22 0.00 0.01 0.00 0.00 54.97 54.43 2b5m s GLU 161 Cb 0.16 -4.75 1.20 0.00 -4.31 0.00 0.00 34.13 26.43 2b5m s GLU 161 CO 0.68 -2.15 1.78 1.37 0.01 0.00 0.00 175.26 176.95 2b5m h LEU 162 N 12.74 0.34 -7.03 1.80 -0.00 -1.86 -3.39 115.31 117.92 2b5m h LEU 162 Ca -0.04 0.06 -0.61 0.00 -0.00 0.00 0.00 57.88 57.30 2b5m h LEU 162 Cb 1.03 0.01 -0.40 0.00 -0.00 0.00 0.00 40.66 41.30 2b5m h LEU 162 CO 1.34 0.06 -0.74 -2.28 -0.00 0.00 0.00 178.44 176.82 2b5m s HIS 163 N -5.37 1.95 0.11 0.17 5.04 -1.25 -4.05 115.29 111.88 2b5m s HIS 163 Ca -0.08 -2.30 -0.23 0.00 -1.54 0.00 0.00 55.06 50.91 2b5m s HIS 163 Cb 0.25 -1.86 -0.07 0.00 0.04 0.00 0.00 32.58 30.94 2b5m s HIS 163 CO 0.80 -0.81 0.70 0.08 -2.34 0.00 0.00 174.74 173.17 2b5m s VAL 164 N 0.61 4.58 -0.21 0.89 1.01 -1.26 0.26 120.40 126.27 2b5m s VAL 164 Ca 0.16 1.52 -0.15 0.00 0.00 0.00 0.00 61.98 63.51 2b5m s VAL 164 Cb -0.23 -4.05 -0.19 0.00 0.00 0.00 0.00 36.38 31.91 2b5m s VAL 164 CO -0.04 0.50 0.09 -0.38 0.00 0.00 0.00 175.10 175.26 2b5m n ILE 165 N 1.92 1.59 -3.48 2.22 -0.00 0.15 -4.86 119.36 116.90 2b5m n ILE 165 Ca -0.07 -0.29 -0.14 0.00 -0.00 0.00 0.00 62.75 62.25 2b5m n ILE 165 Cb 0.50 -1.88 -0.04 0.00 -0.00 0.00 0.00 39.64 38.21 2b5m n ILE 165 CO 0.00 0.00 0.00 -0.62 -0.00 0.00 0.00 176.55 175.93 2b5m s ASP 166 N -7.01 -0.58 -0.15 4.38 2.15 -1.22 -4.95 116.67 109.29 2b5m s ASP 166 Ca -0.30 0.25 -0.13 0.00 0.43 0.00 0.00 52.55 52.80 2b5m s ASP 166 Cb 0.08 0.56 0.04 0.00 -0.30 0.00 0.00 42.92 43.31 2b5m s ASP 166 CO 0.61 -0.82 0.40 -0.69 -0.17 0.00 0.00 175.17 174.50 2b5m s VAL 167 N -2.75 -0.00 -0.01 1.11 1.01 -1.26 -2.46 120.40 116.03 2b5m s VAL 167 Ca -0.04 0.01 -0.06 0.00 0.00 0.00 0.00 61.98 61.89 2b5m s VAL 167 Cb -0.01 -0.57 0.00 0.00 0.00 0.00 0.00 36.38 35.81 2b5m s VAL 167 CO -0.04 0.00 0.13 -0.54 0.00 0.00 0.00 175.10 174.65 2b5m s LYS 168 N 0.36 0.39 0.36 2.72 1.02 -1.08 -4.87 119.74 118.63 2b5m s LYS 168 Ca -0.01 -0.25 -0.27 0.00 0.02 0.00 0.00 55.97 55.45 2b5m s LYS 168 Cb -0.04 0.17 -0.09 0.00 -0.52 0.00 0.00 37.83 37.35 2b5m s LYS 168 CO -0.01 -0.09 1.24 -0.06 -0.92 0.00 0.00 175.35 175.51 2b5m s PHE 169 N -1.01 3.08 0.48 3.18 0.40 -1.26 -1.96 117.98 120.89 2b5m s PHE 169 Ca -0.11 1.49 -0.07 0.00 -0.60 0.00 0.00 56.93 57.64 2b5m s PHE 169 Cb -0.06 -3.55 -0.04 0.00 0.51 0.00 0.00 43.02 39.88 2b5m s PHE 169 CO 0.01 -1.58 0.81 -0.51 0.70 0.00 0.00 175.22 174.65 2b5m s LEU 170 N -2.04 3.63 0.22 -0.37 1.43 -0.19 -4.72 118.68 116.64 2b5m s LEU 170 Ca 0.52 1.04 -0.03 0.00 -1.03 0.00 0.00 54.13 54.63 2b5m s LEU 170 Cb -0.36 -3.99 -0.05 0.00 0.03 0.00 0.00 46.19 41.83 2b5m s LEU 170 CO 0.47 -0.57 0.44 -0.31 0.23 0.00 0.00 176.35 176.61 2b5m s TYR 171 N -2.71 3.48 -1.07 0.29 1.51 -1.26 -4.57 117.35 113.02 2b5m s TYR 171 Ca 0.49 0.47 -0.02 0.00 -1.01 0.00 0.00 57.07 57.00 2b5m s TYR 171 Cb -0.10 -1.95 0.00 0.00 -0.11 0.00 0.00 41.96 39.80 2b5m s TYR 171 CO 0.43 0.32 0.21 0.41 -1.11 0.00 0.00 175.55 175.81 2b5m n GLY 172 N -0.64 -0.14 3.73 0.71 0.00 -1.26 -4.55 105.19 103.04 2b5m n GLY 172 Ca -0.03 -0.26 -0.31 0.00 0.00 0.00 0.00 46.02 45.42 2b5m n GLY 172 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b5m n GLN 174 N 0.89 1.36 0.00 0.00 6.02 -1.26 -4.76 117.38 119.63 2b5m n GLN 174 Ca -0.12 -0.81 0.00 0.00 -0.01 0.00 0.00 57.00 56.06 2b5m n GLN 174 Cb 0.52 -1.32 0.00 0.00 1.02 0.00 0.00 30.24 30.46 2b5m n GLN 174 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2b5m n ALA 175 N 0.26 0.00 -1.18 -1.58 0.00 -1.26 -5.10 120.51 111.65 2b5m n ALA 175 Ca 0.16 0.00 -0.53 0.00 0.00 0.00 0.00 53.44 53.07 2b5m n ALA 175 Cb 0.75 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 20.10 2b5m n ALA 175 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2b5m n PRO 176 N -0.39 0.00 -4.93 0.00 -0.02 -1.26 -4.82 135.00 123.58 2b5m n PRO 176 Ca 0.00 0.00 -0.27 0.00 -2.02 0.00 0.00 63.50 61.21 2b5m n PRO 176 Cb 0.00 -1.29 -0.16 0.00 -0.02 0.00 0.00 33.50 32.03 2b5m n PRO 176 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2b5m s THR 177 N 4.51 1.56 0.01 3.45 2.01 -1.26 -0.05 115.64 125.87 2b5m s THR 177 Ca 1.00 -0.79 0.07 0.00 0.31 0.00 0.00 61.69 62.28 2b5m s THR 177 Cb -1.29 -1.33 -0.03 0.00 0.01 0.00 0.00 72.50 69.86 2b5m s THR 177 CO 0.60 0.45 -0.21 -0.51 -0.69 0.00 0.00 174.62 174.26 2b5m s ILE 178 N -0.03 2.52 -0.09 1.82 2.07 0.29 -1.02 121.20 126.76 2b5m s ILE 178 Ca -0.03 -1.14 0.01 0.00 -1.41 0.00 0.00 60.65 58.08 2b5m s ILE 178 Cb -0.12 -1.99 0.02 0.00 0.13 0.00 0.00 42.46 40.50 2b5m s ILE 178 CO 0.02 0.44 -0.12 0.00 -1.91 0.00 0.00 174.94 173.38 2b5m s PHE 180 N 1.08 0.31 -0.30 0.00 -0.12 -0.82 -2.65 117.98 115.48 2b5m s PHE 180 Ca -0.06 -0.78 0.01 0.00 -0.05 0.00 0.00 56.93 56.05 2b5m s PHE 180 Cb -0.15 -0.21 0.06 0.00 -0.63 0.00 0.00 43.02 42.10 2b5m s PHE 180 CO -0.02 -0.45 -0.03 0.08 -0.05 0.00 0.00 175.22 174.75 2b5m s VAL 181 N -3.74 2.56 0.40 -2.49 1.01 -1.03 -1.72 120.40 115.39 2b5m s VAL 181 Ca 0.05 -1.67 0.08 0.00 0.00 0.00 0.00 61.98 60.44 2b5m s VAL 181 Cb 0.05 -2.56 -0.04 0.00 0.00 0.00 0.00 36.38 33.83 2b5m s VAL 181 CO -0.10 -0.18 0.23 -0.72 0.00 0.00 0.00 175.10 174.33 2b5m s TYR 182 N 1.13 2.66 -0.02 5.22 -0.85 -0.75 0.31 117.35 125.05 2b5m s TYR 182 Ca -0.04 -0.52 0.07 0.00 -0.52 0.00 0.00 57.07 56.06 2b5m s TYR 182 Cb -0.20 -1.96 -0.02 0.00 0.38 0.00 0.00 41.96 40.17 2b5m s TYR 182 CO -0.04 0.13 -0.23 -1.14 -1.52 0.00 0.00 175.55 172.75 2b5m s GLN 183 N -3.96 1.94 0.29 -3.49 0.74 0.14 -2.69 119.66 112.63 2b5m s GLN 183 Ca 0.42 -0.83 -0.02 0.00 0.05 0.00 0.00 55.36 54.98 2b5m s GLN 183 Cb 0.01 -1.84 -0.01 0.00 1.10 0.00 0.00 33.01 32.27 2b5m s GLN 183 CO 0.24 0.48 0.37 0.16 -0.55 0.00 0.00 175.29 175.98 2b5m s ASP 184 N -0.48 0.69 1.13 6.67 -4.77 -1.18 -3.95 116.67 114.79 2b5m s ASP 184 Ca 0.07 -1.41 -0.17 0.00 -3.30 0.00 0.00 52.55 47.74 2b5m s ASP 184 Cb -0.10 0.57 0.19 0.00 -1.09 0.00 0.00 42.92 42.49 2b5m s ASP 184 CO -0.00 -1.13 0.33 -2.65 0.70 0.00 0.00 175.17 172.41 2b5m n PRO 185 N -0.48 -2.49 -1.03 2.11 -0.02 -1.26 -3.17 135.00 128.66 2b5m n PRO 185 Ca 0.02 -0.73 -0.01 0.00 -2.02 0.00 0.00 63.50 60.76 2b5m n PRO 185 Cb 0.63 -1.65 -0.00 0.00 -0.02 0.00 0.00 33.50 32.45 2b5m n PRO 185 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2b5m n GLN 186 N -2.68 -0.20 0.00 -0.52 6.02 -1.26 -4.81 117.38 113.92 2b5m n GLN 186 Ca 0.05 0.29 0.00 0.00 -0.01 0.00 0.00 57.00 57.33 2b5m n GLN 186 Cb 0.50 -3.65 0.00 0.00 1.02 0.00 0.00 30.24 28.10 2b5m n GLN 186 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2b5m n GLY 187 N -2.61 -1.39 3.49 1.08 0.00 -1.19 -4.94 105.19 99.63 2b5m n GLY 187 Ca -0.01 -1.28 -0.25 0.00 0.00 0.00 0.00 46.02 44.48 2b5m n GLY 187 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2b5m s ARG 188 N 0.00 1.74 0.35 1.61 1.70 -1.26 -3.12 118.95 119.96 2b5m s ARG 188 Ca 0.00 -1.61 0.02 0.00 -0.47 0.00 0.00 55.73 53.67 2b5m s ARG 188 Cb 0.00 -1.88 -0.01 0.00 -0.57 0.00 0.00 34.95 32.50 2b5m s ARG 188 CO 0.00 0.36 0.41 -1.01 -1.08 0.00 0.00 175.30 173.98 2b5m s HIS 189 N -2.17 1.37 -0.17 5.89 3.76 -1.09 -1.84 115.29 121.03 2b5m s HIS 189 Ca 0.27 -1.46 -0.01 0.00 -0.15 0.00 0.00 55.06 53.70 2b5m s HIS 189 Cb -0.06 -0.33 0.05 0.00 1.11 0.00 0.00 32.58 33.34 2b5m s HIS 189 CO 0.14 -1.05 -0.02 0.54 -0.85 0.00 0.00 174.74 173.50 2b5m s VAL 190 N -3.14 0.88 0.41 -0.90 0.11 0.55 -1.81 120.40 116.50 2b5m s VAL 190 Ca 0.35 -0.60 0.07 0.00 -2.93 0.00 0.00 61.98 58.86 2b5m s VAL 190 Cb 0.01 -1.19 -0.06 0.00 -1.53 0.00 0.00 36.38 33.60 2b5m s VAL 190 CO 0.24 -0.01 0.11 -0.75 -3.33 0.00 0.00 175.10 171.36 2b5m s LYS 191 N 1.71 2.11 0.06 1.54 2.20 -0.70 -2.63 119.74 124.04 2b5m s LYS 191 Ca -0.00 -1.95 0.05 0.00 -0.36 0.00 0.00 55.97 53.71 2b5m s LYS 191 Cb -0.16 -1.84 -0.03 0.00 -1.51 0.00 0.00 37.83 34.29 2b5m s LYS 191 CO -0.07 -0.08 -0.15 0.99 -0.36 0.00 0.00 175.35 175.68 2b5m s THR 192 N -2.64 1.18 0.01 3.43 2.01 -1.26 -1.94 115.64 116.42 2b5m s THR 192 Ca 0.38 -1.17 -0.00 0.00 0.31 0.00 0.00 61.69 61.21 2b5m s THR 192 Cb 0.06 -1.09 -0.01 0.00 0.01 0.00 0.00 72.50 71.47 2b5m s THR 192 CO 0.21 -0.08 -0.02 -0.31 -0.69 0.00 0.00 174.62 173.72 2b5m s TYR 193 N -1.04 0.18 0.34 4.92 4.12 -0.76 -3.44 117.35 121.67 2b5m s TYR 193 Ca 0.01 -0.37 -0.07 0.00 0.02 0.00 0.00 57.07 56.66 2b5m s TYR 193 Cb -0.09 -0.13 -0.06 0.00 -1.52 0.00 0.00 41.96 40.16 2b5m s TYR 193 CO 0.02 -0.14 0.64 -1.21 0.02 0.00 0.00 175.55 174.88 2b5m s GLU 194 N -1.04 3.70 -0.26 -0.62 2.02 -1.25 -0.54 118.70 120.70 2b5m s GLU 194 Ca -0.11 0.20 -0.00 0.00 0.02 0.00 0.00 54.97 55.08 2b5m s GLU 194 Cb -0.07 -2.54 0.04 0.00 0.10 0.00 0.00 34.13 31.66 2b5m s GLU 194 CO -0.01 0.11 -0.06 0.08 0.02 0.00 0.00 175.26 175.40 2b5m s VAL 195 N -2.19 2.67 -0.45 2.63 1.01 0.92 -1.79 120.40 123.19 2b5m s VAL 195 Ca 0.47 -1.29 -0.19 0.00 0.00 0.00 0.00 61.98 60.97 2b5m s VAL 195 Cb -0.11 -2.45 0.04 0.00 0.00 0.00 0.00 36.38 33.86 2b5m s VAL 195 CO 0.30 0.07 0.55 -0.55 0.00 0.00 0.00 175.10 175.47 2b5m s SER 196 N 1.24 6.24 -0.13 3.32 0.15 -0.96 -4.55 113.70 119.00 2b5m s SER 196 Ca -0.04 -0.68 0.14 0.00 0.70 0.00 0.00 55.95 56.07 2b5m s SER 196 Cb -0.18 -2.27 0.63 0.00 -1.71 0.00 0.00 66.02 62.48 2b5m s SER 196 CO -0.04 -0.74 1.49 0.00 1.20 0.00 0.00 173.24 175.16 2b5m n LEU 197 N 5.95 4.34 -0.01 3.45 -0.00 -1.26 0.02 117.00 129.48 2b5m n LEU 197 Ca -0.06 -2.19 0.12 0.00 -0.00 0.00 0.00 56.01 53.88 2b5m n LEU 197 Cb 0.47 -0.57 0.19 0.00 -0.00 0.00 0.00 43.42 43.50 2b5m n LEU 197 CO 0.51 0.64 0.37 -1.14 -0.00 0.00 0.00 177.39 177.76 2b5m n ARG 198 N 0.76 0.05 -0.14 1.47 3.00 -1.26 -4.65 116.66 115.88 2b5m n ARG 198 Ca 0.22 -0.03 0.00 0.00 -0.00 0.00 0.00 57.85 58.04 2b5m n ARG 198 Cb 0.86 -1.50 0.00 0.00 0.00 0.00 0.00 32.46 31.82 2b5m n ARG 198 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.63 176.78 2b5m n GLU 199 N -1.45 0.00 -3.19 -0.14 0.28 -1.17 -5.10 120.64 109.86 2b5m n GLU 199 Ca 0.06 0.00 -0.16 0.00 -0.16 0.00 0.00 57.16 56.90 2b5m n GLU 199 Cb 0.34 0.00 0.01 0.00 1.43 0.00 0.00 31.44 33.22 2b5m n GLU 199 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 2b5m n LYS 200 N 0.00 -1.92 -3.87 3.44 5.02 0.10 -5.03 118.16 115.90 2b5m n LYS 200 Ca 0.00 1.63 -0.07 0.00 -2.02 0.00 0.00 58.31 57.85 2b5m n LYS 200 Cb 0.31 -4.38 -0.02 0.00 -0.02 0.00 0.00 35.03 30.92 2b5m n LYS 200 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2b5m s GLU 201 N -2.99 1.79 0.20 1.97 2.02 -1.17 -4.94 118.70 115.59 2b5m s GLU 201 Ca 0.19 -1.04 0.04 0.00 0.02 0.00 0.00 54.97 54.18 2b5m s GLU 201 Cb -0.04 0.60 -0.03 0.00 0.10 0.00 0.00 34.13 34.76 2b5m s GLU 201 CO 0.81 -0.81 0.33 -0.06 0.02 0.00 0.00 175.26 175.54 2b5m s PHE 202 N -3.84 3.47 0.00 1.61 2.99 -1.26 -2.28 117.98 118.67 2b5m s PHE 202 Ca 0.12 0.05 0.00 0.00 0.00 0.00 0.00 56.93 57.10 2b5m s PHE 202 Cb -0.05 -1.62 0.00 0.00 0.00 0.00 0.00 43.02 41.35 2b5m s PHE 202 CO 0.07 0.47 0.00 0.09 -0.00 0.00 0.00 175.22 175.86 2b5m n ASN 203 N -1.01 0.00 -3.64 1.36 3.02 -0.74 -4.90 115.26 109.35 2b5m n ASN 203 Ca -0.08 0.00 -0.05 0.00 -0.03 0.00 0.00 54.58 54.42 2b5m n ASN 203 Cb 0.56 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.66 2b5m n ASN 203 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 2b5m s LYS 204 N 0.00 0.29 0.66 3.52 2.20 -1.26 -4.83 119.74 120.32 2b5m s LYS 204 Ca 0.00 0.38 -0.16 0.00 -0.36 0.00 0.00 55.97 55.83 2b5m s LYS 204 Cb 0.00 0.12 -0.00 0.00 -1.51 0.00 0.00 37.83 36.44 2b5m s LYS 204 CO 0.00 -0.04 1.16 0.20 -0.36 0.00 0.00 175.35 176.31 2b5m s GLY 205 N 0.41 2.39 0.00 5.54 0.00 -1.22 -3.91 107.32 110.53 2b5m s GLY 205 Ca 0.02 0.78 0.00 0.00 0.00 0.00 0.00 44.72 45.52 2b5m s GLY 205 CO -0.11 1.16 0.54 -1.05 0.00 0.00 0.00 173.10 173.65 2b5m n PRO 206 N -2.22 0.00 -3.62 2.90 -0.02 -1.26 -4.81 135.00 125.97 2b5m n PRO 206 Ca 0.12 0.05 -0.04 0.00 -2.02 0.00 0.00 63.50 61.61 2b5m n PRO 206 Cb 0.51 -1.50 -0.03 0.00 -0.02 0.00 0.00 33.50 32.46 2b5m n PRO 206 CO 0.00 0.00 0.00 1.67 1.98 0.00 0.00 175.50 179.15 2b5m s TRP 207 N -2.08 -0.09 0.65 6.00 -2.14 -1.26 -4.82 118.94 115.19 2b5m s TRP 207 Ca 0.00 0.11 -0.11 0.00 2.66 0.00 0.00 56.10 58.76 2b5m s TRP 207 Cb 0.00 0.50 0.17 0.00 -3.10 0.00 0.00 33.47 31.03 2b5m s TRP 207 CO 0.00 -0.11 0.46 1.63 -2.66 0.00 0.00 176.95 176.26 2b5m n LYS 208 N 0.25 -2.81 -3.89 3.25 4.76 -1.26 -4.44 118.16 114.01 2b5m n LYS 208 Ca 0.00 -0.75 -0.35 0.00 -2.87 0.00 0.00 58.31 54.34 2b5m n LYS 208 Cb 0.58 -0.85 -0.13 0.00 -1.84 0.00 0.00 35.03 32.79 2b5m n LYS 208 CO 0.00 0.00 0.00 -1.14 -1.37 0.00 0.00 177.40 174.89 2b5m s GLN 209 N -4.07 3.51 0.28 1.97 0.74 -1.26 -4.71 119.66 116.13 2b5m s GLN 209 Ca 0.33 -0.56 0.10 0.00 0.05 0.00 0.00 55.36 55.28 2b5m s GLN 209 Cb -0.05 -3.12 -0.05 0.00 1.10 0.00 0.00 33.01 30.89 2b5m s GLN 209 CO 0.26 -0.15 -0.03 -1.21 -0.55 0.00 0.00 175.29 173.60 2b5m s GLU 210 N 1.43 2.15 0.72 1.67 0.41 -1.08 -4.95 118.70 119.05 2b5m s GLU 210 Ca 0.05 -1.53 -0.10 0.00 -0.41 0.00 0.00 54.97 52.98 2b5m s GLU 210 Cb -0.15 -2.06 0.04 0.00 -1.78 0.00 0.00 34.13 30.19 2b5m s GLU 210 CO 0.00 0.32 1.07 -0.80 -0.49 0.00 0.00 175.26 175.36 2b5m s ASN 211 N -3.65 5.05 0.21 -0.19 0.01 -1.26 -0.33 114.94 114.77 2b5m s ASN 211 Ca 0.32 0.81 -0.10 0.00 -0.71 0.00 0.00 52.86 53.17 2b5m s ASN 211 Cb -0.05 -1.51 -0.01 0.00 0.41 0.00 0.00 41.25 40.09 2b5m s ASN 211 CO 0.19 -1.52 0.37 0.68 -1.51 0.00 0.00 177.10 175.31 2b5m s VAL 212 N -3.34 0.02 0.40 1.60 -7.23 -0.77 -4.71 120.40 106.37 2b5m s VAL 212 Ca 0.59 -1.44 -0.27 0.00 -1.81 0.00 0.00 61.98 59.05 2b5m s VAL 212 Cb -0.11 -2.09 -0.10 0.00 0.56 0.00 0.00 36.38 34.64 2b5m s VAL 212 CO 0.48 -0.10 1.37 1.21 -0.31 0.00 0.00 175.10 177.76 2b5m n GLU 213 N -0.31 2.26 0.13 4.82 2.13 -1.26 -4.45 120.64 123.95 2b5m n GLU 213 Ca -0.03 0.80 0.16 0.00 0.66 0.00 0.00 57.16 58.74 2b5m n GLU 213 Cb 0.63 -2.51 0.49 0.00 0.27 0.00 0.00 31.44 30.32 2b5m n GLU 213 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2b5m h ALA 214 N 2.48 2.13 -0.24 4.31 0.00 -1.99 -0.47 119.26 125.49 2b5m h ALA 214 Ca -0.49 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2b5m h ALA 214 Cb 1.27 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.09 2b5m h ALA 214 CO 0.62 -0.97 0.00 0.39 0.00 0.00 0.00 179.25 179.29 2b5m n GLU 215 N -3.07 2.73 -1.62 0.00 -0.58 -1.26 -4.83 120.64 112.01 2b5m n GLU 215 Ca 0.08 -2.51 -0.55 0.00 -0.42 0.00 0.00 57.16 53.76 2b5m n GLU 215 Cb 0.91 -1.59 -0.07 0.00 -0.57 0.00 0.00 31.44 30.12 2b5m n GLU 215 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2b5m n ALA 216 N -0.34 -1.15 -1.25 0.62 0.00 -0.19 -4.15 120.51 114.05 2b5m n ALA 216 Ca 0.17 0.49 0.00 0.00 0.00 0.00 0.00 53.44 54.10 2b5m n ALA 216 Cb 0.69 -2.06 0.00 0.00 0.00 0.00 0.00 19.45 18.08 2b5m n ALA 216 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2b5m n SER 217 N 3.22 0.00 -3.78 0.00 3.41 -0.37 -4.93 113.62 111.17 2b5m n SER 217 Ca 0.21 -1.00 -0.13 0.00 -0.26 0.00 0.00 58.87 57.69 2b5m n SER 217 Cb 0.15 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 63.96 2b5m n SER 217 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 2b5m s MET 218 N 0.00 0.12 -0.08 4.33 -1.94 -1.08 -4.72 119.30 115.93 2b5m s MET 218 Ca 0.00 0.31 0.02 0.00 -1.71 0.00 0.00 55.69 54.31 2b5m s MET 218 Cb 0.00 -0.08 -0.02 0.00 2.01 0.00 0.00 34.83 36.74 2b5m s MET 218 CO 0.00 -0.11 -0.13 0.08 -0.01 0.00 0.00 175.02 174.85 2b5m s VAL 219 N 0.75 3.10 -0.11 -6.03 1.01 -1.26 -1.28 120.40 116.58 2b5m s VAL 219 Ca -0.06 -0.68 -0.00 0.00 0.00 0.00 0.00 61.98 61.24 2b5m s VAL 219 Cb -0.07 -2.25 0.02 0.00 0.00 0.00 0.00 36.38 34.08 2b5m s VAL 219 CO -0.04 0.57 -0.07 -0.63 0.00 0.00 0.00 175.10 174.93 2b5m s ILE 220 N -0.32 0.97 -0.29 2.22 1.01 -0.20 -4.86 121.20 119.74 2b5m s ILE 220 Ca 0.03 -0.25 -0.28 0.00 0.00 0.00 0.00 60.65 60.15 2b5m s ILE 220 Cb -0.13 -1.00 0.01 0.00 0.01 0.00 0.00 42.46 41.36 2b5m s ILE 220 CO 0.03 0.36 1.01 0.00 0.00 0.00 0.00 174.94 176.33 2b5m s ALA 221 N 1.73 3.57 -0.11 9.38 0.00 -1.26 -0.72 121.76 134.34 2b5m s ALA 221 Ca 0.05 -0.05 -0.13 0.00 0.00 0.00 0.00 51.96 51.83 2b5m s ALA 221 Cb -0.13 -3.56 -0.05 0.00 0.00 0.00 0.00 23.12 19.39 2b5m s ALA 221 CO -0.08 -1.28 0.30 0.08 0.00 0.00 0.00 175.76 174.78 2b5m s VAL 222 N 3.37 5.27 0.94 0.00 1.01 -1.12 -4.91 120.40 124.96 2b5m s VAL 222 Ca 0.42 0.57 -0.11 0.00 0.00 0.00 0.00 61.98 62.86 2b5m s VAL 222 Cb -0.13 -3.62 0.13 0.00 0.00 0.00 0.00 36.38 32.75 2b5m s VAL 222 CO 0.12 0.47 0.95 -2.65 0.00 0.00 0.00 175.10 173.98 2b5m n PRO 223 N 2.89 -0.50 -0.22 2.72 -0.02 -1.26 -3.04 135.00 135.58 2b5m n PRO 223 Ca -0.14 -0.09 0.15 0.00 -2.02 0.00 0.00 63.50 61.40 2b5m n PRO 223 Cb 0.52 -2.23 0.28 0.00 -0.02 0.00 0.00 33.50 32.05 2b5m n PRO 223 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2b5m n GLU 224 N -3.62 -0.05 0.00 -0.52 -0.58 -1.26 -1.60 120.64 113.01 2b5m n GLU 224 Ca 0.10 0.93 0.03 0.00 -0.42 0.00 0.00 57.16 57.80 2b5m n GLU 224 Cb 0.53 -1.57 0.15 0.00 -0.57 0.00 0.00 31.44 29.98 2b5m n GLU 224 CO 0.00 0.00 0.00 -0.35 -0.48 0.00 0.00 177.13 176.30 2b5m n PRO 225 N -4.68 0.19 0.00 3.49 -0.05 -1.26 -3.49 135.00 129.21 2b5m n PRO 225 Ca 0.19 0.00 0.00 0.00 -0.05 0.00 0.00 63.50 63.64 2b5m n PRO 225 Cb 0.65 -1.40 0.00 0.00 -0.05 0.00 0.00 33.50 32.69 2b5m n PRO 225 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 175.50 176.64 2b5m n PHE 226 N -0.90 0.00 -3.66 0.54 0.99 -0.77 -4.73 117.46 108.93 2b5m n PHE 226 Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.49 2b5m n PHE 226 Cb 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 38.50 2b5m n PHE 226 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2b5m n GLY 227 N 0.09 0.91 6.62 1.37 0.00 -0.63 -5.01 105.19 108.54 2b5m n GLY 227 Ca 0.00 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.29 2b5m n GLY 227 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b5m n GLY 228 N 0.00 -1.95 3.10 -0.02 0.00 -1.26 -4.48 105.19 100.58 2b5m n GLY 228 Ca 0.00 -1.44 -0.09 0.00 0.00 0.00 0.00 46.02 44.50 2b5m n GLY 228 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b5m s ALA 229 N -1.05 0.05 -0.13 4.61 0.00 0.82 -2.79 121.76 123.27 2b5m s ALA 229 Ca 0.00 -0.67 -0.01 0.00 0.00 0.00 0.00 51.96 51.28 2b5m s ALA 229 Cb 0.00 0.25 -0.02 0.00 0.00 0.00 0.00 23.12 23.35 2b5m s ALA 229 CO 0.00 -0.31 -0.08 0.42 0.00 0.00 0.00 175.76 175.78 2b5m s ILE 230 N -2.73 3.49 -0.20 0.00 1.01 0.10 -0.15 121.20 122.71 2b5m s ILE 230 Ca -0.04 -0.52 -0.01 0.00 0.00 0.00 0.00 60.65 60.09 2b5m s ILE 230 Cb -0.00 -2.48 0.01 0.00 0.01 0.00 0.00 42.46 40.00 2b5m s ILE 230 CO -0.05 0.53 -0.13 -0.63 0.00 0.00 0.00 174.94 174.66 2b5m s ILE 231 N 0.12 2.61 -0.14 2.92 1.01 0.08 -1.03 121.20 126.76 2b5m s ILE 231 Ca -0.04 -0.82 -0.04 0.00 0.00 0.00 0.00 60.65 59.75 2b5m s ILE 231 Cb -0.14 -2.18 -0.03 0.00 0.01 0.00 0.00 42.46 40.12 2b5m s ILE 231 CO 0.04 0.44 0.01 -0.63 0.00 0.00 0.00 174.94 174.79 2b5m s ILE 232 N 1.35 4.33 0.00 2.92 1.01 -0.41 -1.64 121.20 128.77 2b5m s ILE 232 Ca 0.04 -0.21 0.00 0.00 0.00 0.00 0.00 60.65 60.48 2b5m s ILE 232 Cb -0.14 -2.89 0.00 0.00 0.01 0.00 0.00 42.46 39.44 2b5m s ILE 232 CO -0.08 0.53 0.00 0.61 0.00 0.00 0.00 174.94 175.99 2b5m n GLY 233 N 3.02 6.16 3.87 6.18 0.00 -1.10 -1.23 105.19 122.07 2b5m n GLY 233 Ca -0.18 -1.70 -0.30 0.00 0.00 0.00 0.00 46.02 43.85 2b5m n GLY 233 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2b5m s GLN 234 N 0.77 2.28 0.00 1.61 -0.21 -1.26 -4.42 119.66 118.43 2b5m s GLN 234 Ca 0.00 0.35 0.00 0.00 0.02 0.00 0.00 55.36 55.73 2b5m s GLN 234 Cb 0.00 -1.97 0.00 0.00 1.00 0.00 0.00 33.01 32.04 2b5m s GLN 234 CO 0.00 -1.42 0.00 -0.85 -2.12 0.00 0.00 175.29 170.90 2b5m n GLU 235 N -3.24 -1.37 -3.61 2.91 0.28 -1.26 -4.74 120.64 109.59 2b5m n GLU 235 Ca 0.07 0.00 -0.07 0.00 -0.16 0.00 0.00 57.16 57.00 2b5m n GLU 235 Cb 0.59 -2.19 -0.06 0.00 1.43 0.00 0.00 31.44 31.21 2b5m n GLU 235 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 177.13 175.43 2b5m s SER 236 N -0.80 -0.26 -0.01 -1.84 1.04 -1.26 -4.45 113.70 106.11 2b5m s SER 236 Ca 0.00 0.37 0.03 0.00 0.48 0.00 0.00 55.95 56.83 2b5m s SER 236 Cb 0.00 0.32 -0.00 0.00 0.10 0.00 0.00 66.02 66.44 2b5m s SER 236 CO 0.00 -0.19 -0.09 -0.63 0.98 0.00 0.00 173.24 173.31 2b5m s ILE 237 N -0.67 0.76 0.08 -1.02 1.01 0.63 -2.72 121.20 119.26 2b5m s ILE 237 Ca 0.03 -0.38 0.00 0.00 0.00 0.00 0.00 60.65 60.30 2b5m s ILE 237 Cb -0.02 -0.65 -0.04 0.00 0.01 0.00 0.00 42.46 41.76 2b5m s ILE 237 CO -0.04 0.22 -0.04 0.42 0.00 0.00 0.00 174.94 175.50 2b5m s THR 238 N -0.05 0.45 -0.09 2.92 -4.23 -0.65 -1.91 115.64 112.07 2b5m s THR 238 Ca 0.01 -1.88 0.03 0.00 -1.18 0.00 0.00 61.69 58.67 2b5m s THR 238 Cb -0.06 -1.63 -0.01 0.00 1.34 0.00 0.00 72.50 72.14 2b5m s THR 238 CO -0.00 -0.91 -0.19 -0.47 -0.54 0.00 0.00 174.62 172.51 2b5m s TYR 239 N -3.78 2.64 -0.07 3.99 5.04 -0.05 -0.74 117.35 124.39 2b5m s TYR 239 Ca 0.10 -0.70 0.01 0.00 -2.44 0.00 0.00 57.07 54.04 2b5m s TYR 239 Cb 0.07 -1.72 0.02 0.00 0.35 0.00 0.00 41.96 40.68 2b5m s TYR 239 CO -0.07 -0.21 -0.07 -1.01 -1.34 0.00 0.00 175.55 172.86 2b5m s HIS 240 N 0.07 1.10 -0.30 4.97 3.76 0.79 -2.31 115.29 123.38 2b5m s HIS 240 Ca -0.08 -0.42 -0.04 0.00 -0.15 0.00 0.00 55.06 54.37 2b5m s HIS 240 Cb -0.15 -0.93 0.19 0.00 1.11 0.00 0.00 32.58 32.79 2b5m s HIS 240 CO 0.05 -0.31 0.72 1.21 -0.85 0.00 0.00 174.74 175.56 2b5m s ASN 241 N 1.21 -1.15 0.92 1.40 3.04 -0.49 -0.12 114.94 119.75 2b5m s ASN 241 Ca -0.06 0.70 0.00 0.00 0.04 0.00 0.00 52.86 53.55 2b5m s ASN 241 Cb -0.14 1.96 0.00 0.00 -1.54 0.00 0.00 41.25 41.53 2b5m s ASN 241 CO -0.02 -0.22 0.00 0.61 -3.04 0.00 0.00 177.10 174.44 2b5m n GLY 242 N 5.44 1.66 0.23 1.21 0.00 -1.26 -1.04 105.19 111.43 2b5m n GLY 242 Ca -0.02 -0.56 0.01 0.00 0.00 0.00 0.00 46.02 45.45 2b5m n GLY 242 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2b5m n ASP 243 N 4.28 0.58 -4.84 1.61 2.03 -1.26 -4.84 116.55 114.11 2b5m n ASP 243 Ca 0.00 -2.02 -0.38 0.00 0.52 0.00 0.00 54.79 52.91 2b5m n ASP 243 Cb 0.00 -0.15 -0.06 0.00 -0.72 0.00 0.00 41.12 40.19 2b5m n ASP 243 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 2b5m s LYS 244 N -1.75 3.89 -0.21 -0.67 2.47 -0.20 -5.10 119.74 118.17 2b5m s LYS 244 Ca 0.04 0.38 -0.09 0.00 -1.56 0.00 0.00 55.97 54.74 2b5m s LYS 244 Cb 0.03 -3.21 0.08 0.00 -1.46 0.00 0.00 37.83 33.27 2b5m s LYS 244 CO 0.03 0.69 0.48 -0.47 0.16 0.00 0.00 175.35 176.24 2b5m s TYR 245 N -1.08 -0.84 0.20 4.03 5.04 -1.26 -1.40 117.35 122.04 2b5m s TYR 245 Ca 0.23 1.63 0.06 0.00 -2.44 0.00 0.00 57.07 56.55 2b5m s TYR 245 Cb -0.16 0.40 -0.05 0.00 0.35 0.00 0.00 41.96 42.50 2b5m s TYR 245 CO 0.13 -0.47 -0.10 -0.51 -1.34 0.00 0.00 175.55 173.26 2b5m s LEU 246 N 2.15 2.48 -0.24 6.97 1.43 -0.98 -4.96 118.68 125.54 2b5m s LEU 246 Ca -0.06 -1.07 -0.26 0.00 -1.03 0.00 0.00 54.13 51.71 2b5m s LEU 246 Cb -0.10 -0.49 0.11 0.00 0.03 0.00 0.00 46.19 45.74 2b5m s LEU 246 CO -0.14 -0.30 0.94 0.00 0.23 0.00 0.00 176.35 177.07 2b5m s ALA 247 N -3.17 -1.91 0.03 4.21 0.00 -1.26 -0.87 121.76 118.79 2b5m s ALA 247 Ca 0.22 1.81 0.03 0.00 0.00 0.00 0.00 51.96 54.01 2b5m s ALA 247 Cb 0.02 -1.14 -0.02 0.00 0.00 0.00 0.00 23.12 21.98 2b5m s ALA 247 CO 0.06 -0.28 -0.08 0.96 0.00 0.00 0.00 175.76 176.41 2b5m s ILE 248 N -0.11 0.60 -0.53 0.00 -4.36 -0.80 -4.98 121.20 111.03 2b5m s ILE 248 Ca 0.00 -0.90 0.07 0.00 -0.26 0.00 0.00 60.65 59.56 2b5m s ILE 248 Cb -0.04 -0.62 0.33 0.00 1.25 0.00 0.00 42.46 43.38 2b5m s ILE 248 CO -0.02 -0.23 0.86 0.00 0.24 0.00 0.00 174.94 175.79 2b5m n ALA 249 N 1.81 3.91 -1.79 2.27 0.00 -1.26 -0.27 120.51 125.18 2b5m n ALA 249 Ca -0.20 -4.36 -0.42 0.00 0.00 0.00 0.00 53.44 48.45 2b5m n ALA 249 Cb 0.55 -0.80 -0.03 0.00 0.00 0.00 0.00 19.45 19.18 2b5m n ALA 249 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2b5m s PRO 250 N -3.04 4.16 0.46 0.00 0.04 -1.26 -4.85 135.00 130.50 2b5m s PRO 250 Ca 0.45 2.47 0.18 0.00 0.04 0.00 0.00 61.00 64.14 2b5m s PRO 250 Cb 0.28 -4.07 1.15 0.00 0.04 0.00 0.00 34.50 31.90 2b5m s PRO 250 CO -0.11 -0.91 1.95 -1.35 0.04 0.00 0.00 177.00 176.62 2b5m h PRO 251 N 10.11 0.28 -0.85 0.56 0.11 -1.98 -2.46 132.00 137.77 2b5m h PRO 251 Ca -0.46 -0.02 0.25 0.00 0.11 0.00 0.00 66.00 65.88 2b5m h PRO 251 Cb 1.22 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 32.23 2b5m h PRO 251 CO 0.94 0.19 0.89 0.82 -0.21 0.00 0.00 178.00 180.63 2b5m h ILE 252 N 0.29 0.18 0.00 4.15 2.04 -2.00 -0.32 117.51 121.85 2b5m h ILE 252 Ca 0.32 0.00 -0.31 0.00 1.00 0.00 0.00 64.86 65.87 2b5m h ILE 252 Cb 0.86 0.29 -0.06 0.00 -0.74 0.00 0.00 36.82 37.17 2b5m h ILE 252 CO -0.08 0.00 -2.14 -0.38 0.00 0.00 0.00 178.15 175.55 2b5m n ILE 253 N -3.54 1.33 0.20 -0.67 5.41 -0.93 -4.24 119.36 116.93 2b5m n ILE 253 Ca 0.18 -0.81 0.03 0.00 1.00 0.00 0.00 62.75 63.15 2b5m n ILE 253 Cb 1.17 -0.58 0.17 0.00 -0.71 0.00 0.00 39.64 39.69 2b5m n ILE 253 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 176.55 177.05 2b5m h LYS 254 N 0.00 0.00 0.00 0.38 3.11 -1.12 -3.18 116.57 115.76 2b5m h LYS 254 Ca -0.43 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.41 2b5m h LYS 254 Cb 2.07 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 33.30 2b5m h LYS 254 CO 0.04 0.00 0.00 1.04 -2.81 0.00 0.00 179.45 177.72 2b5m n GLN 255 N -2.02 0.00 -3.57 1.90 6.02 -1.26 -4.75 117.38 113.71 2b5m n GLN 255 Ca -0.00 0.29 -0.20 0.00 -0.01 0.00 0.00 57.00 57.07 2b5m n GLN 255 Cb 0.63 -0.78 -0.03 0.00 1.02 0.00 0.00 30.24 31.09 2b5m n GLN 255 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2b5m s SER 256 N -2.24 5.22 0.07 1.08 0.15 -1.20 -5.08 113.70 111.70 2b5m s SER 256 Ca 0.00 -0.62 -0.23 0.00 0.70 0.00 0.00 55.95 55.81 2b5m s SER 256 Cb 0.00 -0.72 -0.06 0.00 -1.71 0.00 0.00 66.02 63.53 2b5m s SER 256 CO 0.00 -0.57 0.69 -0.89 1.20 0.00 0.00 173.24 173.67 2b5m s THR 257 N -2.40 4.68 -0.07 6.45 2.01 -1.26 -4.89 115.64 120.17 2b5m s THR 257 Ca 0.47 1.48 -0.27 0.00 0.31 0.00 0.00 61.69 63.67 2b5m s THR 257 Cb -0.05 -4.04 -0.03 0.00 0.01 0.00 0.00 72.50 68.40 2b5m s THR 257 CO 0.28 0.45 0.89 -0.63 -0.69 0.00 0.00 174.62 174.92 2b5m s ILE 258 N -0.56 4.90 -0.12 1.82 1.01 -1.26 -2.18 121.20 124.81 2b5m s ILE 258 Ca 0.34 1.82 0.10 0.00 0.00 0.00 0.00 60.65 62.91 2b5m s ILE 258 Cb -0.20 -4.21 -0.15 0.00 0.01 0.00 0.00 42.46 37.91 2b5m s ILE 258 CO 0.22 0.13 0.03 0.52 0.00 0.00 0.00 174.94 175.84 2b5m n VAL 259 N 4.14 0.84 -3.96 2.92 0.31 0.11 -4.95 118.33 117.74 2b5m n VAL 259 Ca 0.04 -0.50 -0.08 0.00 -0.01 0.00 0.00 64.34 63.79 2b5m n VAL 259 Cb 0.50 -0.71 -0.09 0.00 -0.91 0.00 0.00 33.84 32.64 2b5m n VAL 259 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2b5m s HIS 261 N -3.27 0.94 -0.09 0.00 -0.00 -1.26 -1.36 115.29 110.25 2b5m s HIS 261 Ca 0.01 -1.08 -0.18 0.00 -0.00 0.00 0.00 55.06 53.81 2b5m s HIS 261 Cb 0.03 -0.55 0.04 0.00 -0.00 0.00 0.00 32.58 32.10 2b5m s HIS 261 CO -0.08 -0.32 0.44 1.21 -0.00 0.00 0.00 174.74 175.99 2b5m s ASN 262 N -3.07 -0.39 -0.25 7.38 2.47 -0.26 -4.80 114.94 116.02 2b5m s ASN 262 Ca 0.19 0.55 -0.29 0.00 0.42 0.00 0.00 52.86 53.73 2b5m s ASN 262 Cb 0.07 0.62 -0.00 0.00 -1.45 0.00 0.00 41.25 40.48 2b5m s ASN 262 CO -0.00 -0.35 1.26 -0.60 -3.72 0.00 0.00 177.10 173.69 2b5m s ARG 263 N -0.63 4.05 0.00 0.43 3.52 -1.26 -0.80 118.95 124.27 2b5m s ARG 263 Ca -0.07 1.39 0.00 0.00 -0.13 0.00 0.00 55.73 56.91 2b5m s ARG 263 Cb -0.03 -3.82 0.00 0.00 -1.56 0.00 0.00 34.95 29.54 2b5m s ARG 263 CO 0.04 -0.94 0.23 0.28 -0.81 0.00 0.00 175.30 174.10 2b5m n VAL 264 N 5.85 0.00 -3.25 7.11 0.31 -0.34 -4.74 118.33 123.28 2b5m n VAL 264 Ca 0.14 0.48 -0.38 0.00 -0.01 0.00 0.00 64.34 64.57 2b5m n VAL 264 Cb 0.46 -0.99 -0.06 0.00 -0.91 0.00 0.00 33.84 32.34 2b5m n VAL 264 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 2b5m s ASP 265 N -1.65 6.75 0.56 4.52 1.01 -1.23 -5.01 116.67 121.63 2b5m s ASP 265 Ca 0.00 0.90 0.32 0.00 0.71 0.00 0.00 52.55 54.48 2b5m s ASP 265 Cb 0.00 -2.32 1.45 0.00 1.01 0.00 0.00 42.92 43.07 2b5m s ASP 265 CO 0.00 -0.04 1.81 -0.65 0.21 0.00 0.00 175.17 176.51 2b5m h PRO 266 N 6.76 0.00 -0.00 8.23 0.11 -1.93 0.78 132.00 145.95 2b5m h PRO 266 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 2b5m h PRO 266 Cb 1.18 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 2b5m h PRO 266 CO 0.76 0.00 0.61 -0.91 -0.21 0.00 0.00 178.00 178.25 2b5m h ASN 267 N 0.00 0.00 0.00 -2.05 2.35 -1.97 -3.44 115.58 110.47 2b5m h ASN 267 Ca 0.40 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.15 2b5m h ASN 267 Cb 1.81 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.18 2b5m h ASN 267 CO -0.00 0.00 0.00 0.61 -1.65 0.00 0.00 177.43 176.39 2b5m n GLY 268 N -1.34 0.41 0.12 2.83 0.00 0.26 -4.70 105.19 102.78 2b5m n GLY 268 Ca -0.01 -0.81 0.01 0.00 0.00 0.00 0.00 46.02 45.22 2b5m n GLY 268 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2b5m h SER 269 N 0.00 0.00 -4.95 1.61 0.02 -1.86 -3.44 113.55 104.94 2b5m h SER 269 Ca 0.00 0.00 -0.19 0.00 -0.84 0.00 0.00 61.79 60.76 2b5m h SER 269 Cb 0.00 0.00 -0.20 0.00 0.14 0.00 0.00 62.40 62.34 2b5m h SER 269 CO 0.00 0.55 -0.71 -0.13 -1.14 0.00 0.00 176.83 175.40 2b5m s ARG 270 N -2.94 0.39 -0.02 3.45 0.52 -1.26 -0.45 118.95 118.65 2b5m s ARG 270 Ca 0.02 -0.71 -0.07 0.00 -0.52 0.00 0.00 55.73 54.45 2b5m s ARG 270 Cb 0.08 0.02 0.01 0.00 0.52 0.00 0.00 34.95 35.58 2b5m s ARG 270 CO 0.76 -0.03 0.15 0.71 0.02 0.00 0.00 175.30 176.91 2b5m s TYR 271 N -1.70 -0.04 -0.04 -0.53 1.51 -0.15 -1.19 117.35 115.20 2b5m s TYR 271 Ca -0.12 0.08 -0.07 0.00 -1.01 0.00 0.00 57.07 55.95 2b5m s TYR 271 Cb -0.08 -0.01 -0.05 0.00 -0.11 0.00 0.00 41.96 41.72 2b5m s TYR 271 CO -0.02 -0.22 0.23 -0.51 -1.11 0.00 0.00 175.55 173.93 2b5m s LEU 272 N -0.86 4.39 -0.04 -1.29 1.43 0.02 0.11 118.68 122.44 2b5m s LEU 272 Ca -0.09 0.55 0.01 0.00 -1.03 0.00 0.00 54.13 53.57 2b5m s LEU 272 Cb -0.05 -2.44 0.02 0.00 0.03 0.00 0.00 46.19 43.74 2b5m s LEU 272 CO 0.01 0.32 -0.05 -0.76 0.23 0.00 0.00 176.35 176.10 2b5m s LEU 273 N -1.44 1.43 -0.10 1.79 1.43 -0.46 -1.10 118.68 120.23 2b5m s LEU 273 Ca 0.23 -0.13 0.02 0.00 -1.03 0.00 0.00 54.13 53.22 2b5m s LEU 273 Cb -0.13 -0.43 -0.02 0.00 0.03 0.00 0.00 46.19 45.64 2b5m s LEU 273 CO 0.12 -0.03 -0.15 -0.83 0.23 0.00 0.00 176.35 175.68 2b5m s GLY 274 N 0.75 1.50 0.86 -3.19 0.00 -0.46 0.33 107.32 107.11 2b5m s GLY 274 Ca -0.10 -0.94 -0.13 0.00 0.00 0.00 0.00 44.72 43.56 2b5m s GLY 274 CO 0.00 -0.42 1.18 0.99 0.00 0.00 0.00 173.10 174.85 2b5m s ASP 275 N -0.03 4.01 0.35 1.64 1.01 -0.83 0.09 116.67 122.91 2b5m s ASP 275 Ca -0.04 0.79 0.17 0.00 0.71 0.00 0.00 52.55 54.18 2b5m s ASP 275 Cb -0.14 -1.26 0.57 0.00 1.01 0.00 0.00 42.92 43.10 2b5m s ASP 275 CO 0.04 -2.22 1.68 0.24 0.21 0.00 0.00 175.17 175.13 2b5m h MET 276 N -1.27 0.00 -0.44 8.23 2.86 -1.78 -3.10 114.93 119.43 2b5m h MET 276 Ca -0.47 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.17 2b5m h MET 276 Cb 1.32 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.98 2b5m h MET 276 CO 0.62 0.42 0.00 -1.91 1.06 0.00 0.00 176.91 177.10 2b5m n GLU 277 N -3.52 2.35 -0.32 1.72 2.13 -1.26 -4.81 120.64 116.93 2b5m n GLU 277 Ca -0.00 -2.07 0.00 0.00 0.66 0.00 0.00 57.16 55.75 2b5m n GLU 277 Cb 0.55 -1.48 0.00 0.00 0.27 0.00 0.00 31.44 30.78 2b5m n GLU 277 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2b5m n GLY 278 N 1.44 0.84 3.79 8.31 0.00 -1.17 -4.88 105.19 113.51 2b5m n GLY 278 Ca 0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.85 2b5m n GLY 278 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2b5m s ARG 279 N -0.68 4.49 -0.11 1.61 0.52 -1.26 -0.36 118.95 123.16 2b5m s ARG 279 Ca 0.00 1.23 -0.00 0.00 -0.52 0.00 0.00 55.73 56.44 2b5m s ARG 279 Cb 0.00 -2.73 -0.02 0.00 0.52 0.00 0.00 34.95 32.71 2b5m s ARG 279 CO 0.00 0.26 -0.10 -1.17 0.02 0.00 0.00 175.30 174.31 2b5m s LEU 280 N -2.19 2.95 0.15 2.53 2.96 0.03 -1.96 118.68 123.15 2b5m s LEU 280 Ca 0.51 -0.19 0.10 0.00 -0.22 0.00 0.00 54.13 54.33 2b5m s LEU 280 Cb -0.17 -1.66 -0.04 0.00 0.50 0.00 0.00 46.19 44.82 2b5m s LEU 280 CO 0.22 0.24 -0.21 -0.36 -1.32 0.00 0.00 176.35 174.91 2b5m s PHE 281 N -0.06 2.41 -0.30 5.38 0.40 0.15 -2.26 117.98 123.71 2b5m s PHE 281 Ca -0.01 -0.32 -0.11 0.00 -0.60 0.00 0.00 56.93 55.89 2b5m s PHE 281 Cb -0.14 -1.25 -0.04 0.00 0.51 0.00 0.00 43.02 42.11 2b5m s PHE 281 CO 0.03 0.42 0.19 1.41 0.70 0.00 0.00 175.22 177.98 2b5m s MET 282 N -2.37 3.78 0.02 0.44 1.75 -0.13 -1.36 119.30 121.43 2b5m s MET 282 Ca 0.19 -0.44 -0.18 0.00 -1.25 0.00 0.00 55.69 54.01 2b5m s MET 282 Cb -0.09 -3.68 -0.06 0.00 2.84 0.00 0.00 34.83 33.84 2b5m s MET 282 CO 0.09 -0.27 0.52 -1.17 -0.65 0.00 0.00 175.02 173.55 2b5m s LEU 283 N 1.73 4.47 -0.05 4.11 2.96 0.29 -2.37 118.68 129.82 2b5m s LEU 283 Ca 0.07 1.11 0.01 0.00 -0.22 0.00 0.00 54.13 55.09 2b5m s LEU 283 Cb -0.16 -2.79 0.02 0.00 0.50 0.00 0.00 46.19 43.76 2b5m s LEU 283 CO 0.10 0.23 -0.05 -0.76 -1.32 0.00 0.00 176.35 174.55 2b5m s LEU 284 N -0.75 1.28 -0.35 -0.68 1.02 -0.23 -0.98 118.68 118.00 2b5m s LEU 284 Ca 0.27 -0.16 -0.14 0.00 0.02 0.00 0.00 54.13 54.13 2b5m s LEU 284 Cb -0.18 -0.52 -0.01 0.00 0.02 0.00 0.00 46.19 45.50 2b5m s LEU 284 CO 0.16 -0.06 0.28 -0.76 0.02 0.00 0.00 176.35 175.99 2b5m s LEU 285 N 1.04 4.55 -0.51 1.79 1.02 0.41 -1.88 118.68 125.09 2b5m s LEU 285 Ca -0.09 -0.41 -0.27 0.00 0.02 0.00 0.00 54.13 53.38 2b5m s LEU 285 Cb -0.14 -2.19 0.03 0.00 0.02 0.00 0.00 46.19 43.91 2b5m s LEU 285 CO -0.00 -0.28 1.06 -0.70 0.02 0.00 0.00 176.35 176.45 2b5m s GLU 286 N 1.80 3.55 0.00 1.70 2.12 0.65 -4.84 118.70 123.68 2b5m s GLU 286 Ca 0.07 0.23 0.00 0.00 0.36 0.00 0.00 54.97 55.64 2b5m s GLU 286 Cb -0.17 -3.97 0.00 0.00 0.26 0.00 0.00 34.13 30.25 2b5m s GLU 286 CO 0.11 -1.44 0.00 1.17 -0.54 0.00 0.00 175.26 174.56 2b5m n LYS 287 N 7.77 -0.97 0.00 4.30 4.81 -1.26 0.11 118.16 132.92 2b5m n LYS 287 Ca 0.08 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.52 2b5m n LYS 287 Cb 0.49 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.54 2b5m n LYS 287 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2b5m n GLU 288 N -1.33 0.00 -3.07 1.64 -0.58 -1.16 -3.84 120.64 112.30 2b5m n GLU 288 Ca 0.00 0.00 -0.44 0.00 -0.42 0.00 0.00 57.16 56.30 2b5m n GLU 288 Cb 0.00 0.00 -0.05 0.00 -0.57 0.00 0.00 31.44 30.82 2b5m n GLU 288 CO 0.00 0.00 0.00 -2.00 -0.48 0.00 0.00 177.13 174.65 2b5m s GLU 289 N 0.00 3.13 0.80 3.49 2.12 -1.26 -2.52 118.70 124.47 2b5m s GLU 289 Ca 0.00 -0.89 -0.11 0.00 0.36 0.00 0.00 54.97 54.34 2b5m s GLU 289 Cb 0.00 -4.14 0.07 0.00 0.26 0.00 0.00 34.13 30.32 2b5m s GLU 289 CO 0.00 -1.39 1.09 -0.65 -0.54 0.00 0.00 175.26 173.77 2b5m s GLN 290 N 2.98 2.03 0.00 4.30 -0.21 -1.21 -4.97 119.66 122.57 2b5m s GLN 290 Ca 0.17 1.06 0.00 0.00 0.02 0.00 0.00 55.36 56.61 2b5m s GLN 290 Cb -0.19 -1.88 0.00 0.00 1.00 0.00 0.00 33.01 31.94 2b5m s GLN 290 CO 0.12 -1.77 0.12 -1.33 -2.12 0.00 0.00 175.29 170.31 2b5m n MET 291 N -3.60 0.00 -0.23 2.91 2.81 -1.26 -4.51 117.12 113.24 2b5m n MET 291 Ca 0.08 0.12 0.00 0.00 -1.81 0.00 0.00 57.70 56.10 2b5m n MET 291 Cb 0.54 -0.33 0.00 0.00 -0.71 0.00 0.00 33.22 32.72 2b5m n MET 291 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 2b5m n ASP 292 N -0.42 0.00 -3.88 7.83 8.00 -1.26 -4.99 116.55 121.83 2b5m n ASP 292 Ca 0.00 -1.25 0.00 0.00 0.71 0.00 0.00 54.79 54.25 2b5m n ASP 292 Cb 0.00 -0.05 0.00 0.00 -0.02 0.00 0.00 41.12 41.05 2b5m n ASP 292 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2b5m n GLY 293 N 0.00 -3.01 0.00 0.44 0.00 -1.26 -5.06 105.19 96.30 2b5m n GLY 293 Ca 0.00 -1.18 0.00 0.00 0.00 0.00 0.00 46.02 44.84 2b5m n GLY 293 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2b5m n THR 294 N -0.64 0.00 -2.80 2.61 -1.04 -1.26 -4.77 114.28 106.37 2b5m n THR 294 Ca 0.00 0.00 -0.43 0.00 -2.04 0.00 0.00 64.05 61.58 2b5m n THR 294 Cb 0.00 -0.95 -0.04 0.00 -1.82 0.00 0.00 70.33 67.52 2b5m n THR 294 CO 0.00 0.00 0.00 0.68 -0.64 0.00 0.00 175.07 175.11 2b5m s VAL 295 N 1.00 4.26 0.57 12.58 -7.23 -1.26 -3.31 120.40 127.00 2b5m s VAL 295 Ca 0.00 -0.00 -0.08 0.00 -1.81 0.00 0.00 61.98 60.09 2b5m s VAL 295 Cb 0.00 -4.67 0.13 0.00 0.56 0.00 0.00 36.38 32.40 2b5m s VAL 295 CO 0.00 -1.39 0.77 1.07 -0.31 0.00 0.00 175.10 175.24 2b5m n THR 296 N 6.10 0.00 -4.47 5.32 5.66 -1.05 -4.64 114.28 121.20 2b5m n THR 296 Ca -0.01 -0.69 -0.23 0.00 -3.05 0.00 0.00 64.05 60.07 2b5m n THR 296 Cb 0.47 -1.55 -0.16 0.00 -1.55 0.00 0.00 70.33 67.54 2b5m n THR 296 CO 0.00 0.00 0.00 -1.48 -3.05 0.00 0.00 175.07 170.54 2b5m s LEU 297 N 0.00 1.60 -0.18 1.09 0.05 -1.26 -2.98 118.68 117.00 2b5m s LEU 297 Ca 0.45 -0.24 -0.11 0.00 0.05 0.00 0.00 54.13 54.28 2b5m s LEU 297 Cb -0.01 -0.70 -0.21 0.00 -2.05 0.00 0.00 46.19 43.22 2b5m s LEU 297 CO 0.31 0.02 0.16 1.17 -0.55 0.00 0.00 176.35 177.47 2b5m n LYS 298 N 3.75 0.67 -3.48 1.48 4.81 0.30 -4.98 118.16 120.71 2b5m n LYS 298 Ca -0.23 0.34 -0.10 0.00 -0.87 0.00 0.00 58.31 57.45 2b5m n LYS 298 Cb 0.52 -1.67 -0.02 0.00 0.02 0.00 0.00 35.03 33.88 2b5m n LYS 298 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 2b5m s ASP 299 N -6.97 -0.48 0.30 3.14 3.68 -1.22 -5.00 116.67 110.12 2b5m s ASP 299 Ca -0.28 -0.06 0.07 0.00 2.13 0.00 0.00 52.55 54.42 2b5m s ASP 299 Cb 0.08 0.55 -0.03 0.00 -1.45 0.00 0.00 42.92 42.07 2b5m s ASP 299 CO 0.66 -0.90 0.27 -0.76 0.13 0.00 0.00 175.17 174.57 2b5m s LEU 300 N -2.70 3.73 -0.25 -1.34 1.43 -1.26 -0.25 118.68 118.04 2b5m s LEU 300 Ca 0.03 -0.36 -0.26 0.00 -1.03 0.00 0.00 54.13 52.51 2b5m s LEU 300 Cb -0.01 -2.32 0.10 0.00 0.03 0.00 0.00 46.19 43.99 2b5m s LEU 300 CO -0.10 -0.23 0.91 -0.60 0.23 0.00 0.00 176.35 176.55 2b5m s ARG 301 N -3.95 0.66 -0.04 1.70 3.52 -0.79 -4.96 118.95 115.10 2b5m s ARG 301 Ca 0.38 0.64 0.04 0.00 -0.13 0.00 0.00 55.73 56.66 2b5m s ARG 301 Cb -0.07 0.32 -0.00 0.00 -1.56 0.00 0.00 34.95 33.64 2b5m s ARG 301 CO 0.26 -0.11 -0.15 0.08 -0.81 0.00 0.00 175.30 174.58 2b5m s VAL 302 N 0.01 1.25 -0.03 7.11 1.01 -1.26 -1.07 120.40 127.42 2b5m s VAL 302 Ca 0.01 -0.62 0.02 0.00 0.00 0.00 0.00 61.98 61.38 2b5m s VAL 302 Cb -0.04 -1.08 0.01 0.00 0.00 0.00 0.00 36.38 35.27 2b5m s VAL 302 CO -0.02 0.37 -0.06 -1.61 0.00 0.00 0.00 175.10 173.78 2b5m s GLU 303 N 0.06 0.77 -0.07 2.72 2.02 -1.00 -5.01 118.70 118.20 2b5m s GLU 303 Ca -0.03 -0.18 -0.30 0.00 0.02 0.00 0.00 54.97 54.48 2b5m s GLU 303 Cb -0.10 -0.75 -0.05 0.00 0.10 0.00 0.00 34.13 33.32 2b5m s GLU 303 CO 0.02 0.02 1.62 -1.17 0.02 0.00 0.00 175.26 175.77 2b5m s LEU 304 N 0.46 4.29 0.07 1.80 2.96 -1.26 -0.95 118.68 126.05 2b5m s LEU 304 Ca -0.06 2.17 0.23 0.00 -0.22 0.00 0.00 54.13 56.25 2b5m s LEU 304 Cb -0.10 -3.53 -0.02 0.00 0.50 0.00 0.00 46.19 43.04 2b5m s LEU 304 CO 0.00 -0.93 0.95 0.18 -1.32 0.00 0.00 176.35 175.24 2b5m n LEU 305 N 7.15 0.58 0.00 -0.68 4.77 -0.96 -4.91 117.00 122.94 2b5m n LEU 305 Ca 0.17 0.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.20 2b5m n LEU 305 Cb 0.43 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.44 2b5m n LEU 305 CO 0.62 -0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.28 2b5m n GLY 306 N 1.32 0.65 3.01 -0.72 0.00 -1.12 -1.50 105.19 106.83 2b5m n GLY 306 Ca 0.01 -1.56 -0.12 0.00 0.00 0.00 0.00 46.02 44.35 2b5m n GLY 306 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2b5m s GLU 307 N -2.00 0.41 0.00 1.61 -1.05 -1.26 -0.79 118.70 115.62 2b5m s GLU 307 Ca 0.00 -0.62 0.00 0.00 -0.15 0.00 0.00 54.97 54.20 2b5m s GLU 307 Cb 0.00 -0.13 0.00 0.00 -0.44 0.00 0.00 34.13 33.56 2b5m s GLU 307 CO 0.00 0.01 0.00 0.25 0.95 0.00 0.00 175.26 176.47 2b5m n THR 308 N 1.70 0.00 -4.39 1.83 -2.24 0.52 -4.91 114.28 106.79 2b5m n THR 308 Ca -0.22 0.00 -0.25 0.00 -2.27 0.00 0.00 64.05 61.31 2b5m n THR 308 Cb 0.55 0.00 -0.09 0.00 -2.10 0.00 0.00 70.33 68.69 2b5m n THR 308 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2b5m s SER 309 N 0.88 3.93 -0.14 3.42 1.04 -1.26 -4.74 113.70 116.83 2b5m s SER 309 Ca 0.00 -0.83 -0.38 0.00 0.48 0.00 0.00 55.95 55.21 2b5m s SER 309 Cb 0.00 -0.51 -0.15 0.00 0.10 0.00 0.00 66.02 65.46 2b5m s SER 309 CO 0.00 0.05 1.64 -0.38 0.98 0.00 0.00 173.24 175.53 2b5m n ILE 310 N -0.47 0.24 -3.69 -1.02 5.41 -1.26 -4.86 119.36 113.72 2b5m n ILE 310 Ca -0.07 -0.04 -0.36 0.00 1.00 0.00 0.00 62.75 63.27 2b5m n ILE 310 Cb 0.58 -1.20 -0.07 0.00 -0.71 0.00 0.00 39.64 38.24 2b5m n ILE 310 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2b5m s ALA 311 N 2.66 3.72 -0.14 -1.39 0.00 -1.26 -4.42 121.76 120.93 2b5m s ALA 311 Ca 0.93 -0.55 0.08 0.00 0.00 0.00 0.00 51.96 52.43 2b5m s ALA 311 Cb -0.98 -2.20 -0.23 0.00 0.00 0.00 0.00 23.12 19.70 2b5m s ALA 311 CO 0.58 0.31 0.30 0.39 0.00 0.00 0.00 175.76 177.33 2b5m n GLU 312 N 2.89 0.68 -3.81 0.00 -0.58 0.17 -4.78 120.64 115.21 2b5m n GLU 312 Ca -0.16 0.18 -0.13 0.00 -0.42 0.00 0.00 57.16 56.64 2b5m n GLU 312 Cb 0.53 -1.66 -0.12 0.00 -0.57 0.00 0.00 31.44 29.62 2b5m n GLU 312 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2b5m s LEU 314 N 0.09 0.76 -0.30 0.00 2.96 -1.26 0.28 118.68 121.21 2b5m s LEU 314 Ca -0.00 0.56 -0.03 0.00 -0.22 0.00 0.00 54.13 54.45 2b5m s LEU 314 Cb -0.01 0.91 0.18 0.00 0.50 0.00 0.00 46.19 47.77 2b5m s LEU 314 CO 0.00 -0.12 0.63 -0.89 -1.32 0.00 0.00 176.35 174.65 2b5m s THR 315 N 0.50 -0.97 -0.19 3.68 2.01 -0.68 -4.65 115.64 115.35 2b5m s THR 315 Ca -0.03 0.00 -0.29 0.00 0.31 0.00 0.00 61.69 61.68 2b5m s THR 315 Cb -0.04 -1.00 -0.05 0.00 0.01 0.00 0.00 72.50 71.42 2b5m s THR 315 CO -0.03 0.00 1.96 -0.47 -0.69 0.00 0.00 174.62 175.40 2b5m s TYR 316 N 2.87 1.51 -0.00 4.92 5.04 -1.26 -1.48 117.35 128.94 2b5m s TYR 316 Ca 0.17 0.36 -0.00 0.00 -2.44 0.00 0.00 57.07 55.17 2b5m s TYR 316 Cb -0.14 -4.04 -0.00 0.00 0.35 0.00 0.00 41.96 38.13 2b5m s TYR 316 CO -0.20 -3.91 0.01 -0.07 -1.34 0.00 0.00 175.55 170.03 2b5m h LEU 317 N 13.22 -0.00 0.00 6.97 3.38 -0.67 -3.48 115.31 134.74 2b5m h LEU 317 Ca -0.40 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.57 2b5m h LEU 317 Cb 1.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.96 2b5m h LEU 317 CO 0.98 0.01 0.00 -0.67 0.09 0.00 0.00 178.44 178.85 2b5m n ASP 318 N -2.08 0.00 -3.69 -0.43 2.03 -1.00 -4.96 116.55 106.42 2b5m n ASP 318 Ca -0.00 0.00 -0.22 0.00 0.52 0.00 0.00 54.79 55.09 2b5m n ASP 318 Cb 0.00 0.00 0.03 0.00 -0.72 0.00 0.00 41.12 40.43 2b5m n ASP 318 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 2b5m n ASN 319 N 0.00 -1.61 0.00 1.67 3.02 -1.26 -1.36 115.26 115.72 2b5m n ASN 319 Ca 0.00 -0.84 0.00 0.00 -0.03 0.00 0.00 54.58 53.71 2b5m n ASN 319 Cb 0.00 -4.01 0.00 0.00 -0.61 0.00 0.00 39.78 35.16 2b5m n ASN 319 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2b5m n GLY 320 N -1.58 0.70 3.84 7.41 0.00 -1.26 -4.93 105.19 109.36 2b5m n GLY 320 Ca -0.28 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.37 2b5m n GLY 320 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b5m s VAL 321 N -2.68 4.99 -0.01 1.61 1.01 -0.47 0.73 120.40 125.58 2b5m s VAL 321 Ca 0.00 0.85 0.00 0.00 0.00 0.00 0.00 61.98 62.83 2b5m s VAL 321 Cb 0.00 -3.73 0.01 0.00 0.00 0.00 0.00 36.38 32.66 2b5m s VAL 321 CO 0.00 0.53 0.00 -0.69 0.00 0.00 0.00 175.10 174.94 2b5m s VAL 322 N -1.14 0.05 -0.13 2.92 1.01 0.60 0.13 120.40 123.84 2b5m s VAL 322 Ca 0.26 0.05 -0.16 0.00 0.00 0.00 0.00 61.98 62.13 2b5m s VAL 322 Cb -0.17 -0.10 -0.04 0.00 0.00 0.00 0.00 36.38 36.06 2b5m s VAL 322 CO 0.15 0.06 0.41 0.12 0.00 0.00 0.00 175.10 175.84 2b5m s PHE 323 N 0.43 3.50 -0.26 5.22 5.36 -0.55 0.22 117.98 131.90 2b5m s PHE 323 Ca -0.04 0.79 -0.08 0.00 -0.96 0.00 0.00 56.93 56.65 2b5m s PHE 323 Cb -0.06 -2.47 -0.02 0.00 -0.34 0.00 0.00 43.02 40.13 2b5m s PHE 323 CO -0.01 0.21 0.09 0.08 -1.46 0.00 0.00 175.22 174.13 2b5m s VAL 324 N 0.49 4.35 -0.35 3.12 1.01 0.20 -1.69 120.40 127.53 2b5m s VAL 324 Ca 0.23 -0.24 -0.10 0.00 0.00 0.00 0.00 61.98 61.86 2b5m s VAL 324 Cb -0.14 -3.08 0.01 0.00 0.00 0.00 0.00 36.38 33.17 2b5m s VAL 324 CO 0.08 0.27 0.18 -0.83 0.00 0.00 0.00 175.10 174.80 2b5m s GLY 325 N 1.61 1.90 0.10 4.51 0.00 0.14 -0.66 107.32 114.92 2b5m s GLY 325 Ca 0.06 -1.58 0.09 0.00 0.00 0.00 0.00 44.72 43.28 2b5m s GLY 325 CO 0.04 0.78 -0.18 -0.45 0.00 0.00 0.00 173.10 173.29 2b5m s SER 326 N 1.57 3.88 -0.05 1.64 0.15 -1.26 0.42 113.70 120.05 2b5m s SER 326 Ca 0.03 -0.53 0.06 0.00 0.70 0.00 0.00 55.95 56.20 2b5m s SER 326 Cb -0.18 -0.56 -0.08 0.00 -1.71 0.00 0.00 66.02 63.49 2b5m s SER 326 CO 0.06 0.19 0.04 -1.14 1.20 0.00 0.00 173.24 173.59 2b5m n ARG 327 N 0.92 2.59 0.00 5.44 0.00 -1.26 -1.59 116.66 122.76 2b5m n ARG 327 Ca -0.16 -0.01 0.11 0.00 -0.00 0.00 0.00 57.85 57.79 2b5m n ARG 327 Cb 0.53 -1.15 -0.01 0.00 0.00 0.00 0.00 32.46 31.82 2b5m n ARG 327 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 2b5m n LEU 328 N -2.15 1.97 -3.89 6.15 4.77 -1.26 -4.05 117.00 118.55 2b5m n LEU 328 Ca -0.08 -0.75 -0.09 0.00 -0.03 0.00 0.00 56.01 55.05 2b5m n LEU 328 Cb 0.62 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.70 2b5m n LEU 328 CO 0.13 0.37 0.41 -0.83 -1.33 0.00 0.00 177.39 176.14 2b5m s GLY 329 N -2.44 0.46 0.42 -0.72 0.00 -1.26 -3.16 107.32 100.62 2b5m s GLY 329 Ca 0.18 -0.79 -0.25 0.00 0.00 0.00 0.00 44.72 43.86 2b5m s GLY 329 CO 0.57 -0.41 1.14 1.22 0.00 0.00 0.00 173.10 175.62 2b5m n ASP 330 N -1.07 1.88 -4.92 1.64 9.92 -1.26 -4.54 116.55 118.20 2b5m n ASP 330 Ca -0.05 1.07 -0.27 0.00 -0.53 0.00 0.00 54.79 55.01 2b5m n ASP 330 Cb 0.60 -1.42 0.06 0.00 -0.64 0.00 0.00 41.12 39.72 2b5m n ASP 330 CO 0.00 0.00 0.00 -0.44 0.13 0.00 0.00 177.20 176.89 2b5m s SER 331 N -0.65 4.99 0.24 -2.24 0.01 -0.75 -4.60 113.70 110.69 2b5m s SER 331 Ca 0.62 0.61 -0.21 0.00 1.31 0.00 0.00 55.95 58.28 2b5m s SER 331 Cb -0.53 -1.32 0.03 0.00 0.21 0.00 0.00 66.02 64.41 2b5m s SER 331 CO 0.57 -1.51 0.65 0.00 0.41 0.00 0.00 173.24 173.37 2b5m s GLN 332 N -5.25 1.59 -0.12 12.44 -2.07 0.16 -0.51 119.66 125.91 2b5m s GLN 332 Ca 0.59 -0.85 -0.02 0.00 -1.82 0.00 0.00 55.36 53.26 2b5m s GLN 332 Cb -0.11 0.59 -0.03 0.00 -1.09 0.00 0.00 33.01 32.37 2b5m s GLN 332 CO 0.46 -0.72 -0.03 -1.17 -1.32 0.00 0.00 175.29 172.51 2b5m s LEU 333 N -2.87 3.34 0.01 2.60 2.96 -0.17 0.58 118.68 125.13 2b5m s LEU 333 Ca 0.09 -0.03 -0.02 0.00 -0.22 0.00 0.00 54.13 53.95 2b5m s LEU 333 Cb -0.04 -1.78 -0.01 0.00 0.50 0.00 0.00 46.19 44.86 2b5m s LEU 333 CO 0.01 0.26 0.03 -0.69 -1.32 0.00 0.00 176.35 174.64 2b5m s VAL 334 N -0.21 0.09 -0.12 1.68 1.01 0.13 -2.14 120.40 120.84 2b5m s VAL 334 Ca 0.04 -0.71 -0.02 0.00 0.00 0.00 0.00 61.98 61.29 2b5m s VAL 334 Cb -0.13 -0.28 -0.03 0.00 0.00 0.00 0.00 36.38 35.95 2b5m s VAL 334 CO 0.02 -0.39 -0.05 -0.75 0.00 0.00 0.00 175.10 173.94 2b5m s LYS 335 N -1.20 3.30 -0.16 2.72 2.47 0.21 -0.29 119.74 126.78 2b5m s LYS 335 Ca -0.13 -0.52 -0.15 0.00 -1.56 0.00 0.00 55.97 53.61 2b5m s LYS 335 Cb -0.08 -2.79 -0.05 0.00 -1.46 0.00 0.00 37.83 33.46 2b5m s LYS 335 CO -0.00 0.43 0.32 -0.51 0.16 0.00 0.00 175.35 175.75 2b5m s LEU 336 N -0.15 4.24 0.16 5.43 1.43 0.22 -1.37 118.68 128.64 2b5m s LEU 336 Ca 0.03 0.54 0.07 0.00 -1.03 0.00 0.00 54.13 53.74 2b5m s LEU 336 Cb -0.13 -2.43 -0.04 0.00 0.03 0.00 0.00 46.19 43.62 2b5m s LEU 336 CO 0.03 0.07 0.00 0.20 0.23 0.00 0.00 176.35 176.88 2b5m s ASN 337 N 0.55 4.83 -0.02 2.29 0.01 -0.17 -4.77 114.94 117.67 2b5m s ASN 337 Ca 0.18 -0.34 -0.20 0.00 -0.71 0.00 0.00 52.86 51.78 2b5m s ASN 337 Cb -0.13 -1.06 -0.30 0.00 0.41 0.00 0.00 41.25 40.17 2b5m s ASN 337 CO 0.05 0.11 0.98 0.58 -1.51 0.00 0.00 177.10 177.31 2b5m h VAL 338 N 2.55 1.44 -3.78 1.60 2.07 -1.99 -3.44 116.25 114.71 2b5m h VAL 338 Ca -0.47 -2.43 -0.49 0.00 0.82 0.00 0.00 66.70 64.13 2b5m h VAL 338 Cb 1.19 2.99 -0.02 0.00 -1.52 0.00 0.00 31.29 33.93 2b5m h VAL 338 CO 0.58 0.70 0.27 -1.81 0.02 0.00 0.00 177.57 177.33 2b5m s ASP 339 N -7.03 7.25 0.61 0.57 1.01 -1.26 -5.05 116.67 112.76 2b5m s ASP 339 Ca -0.13 1.70 -0.14 0.00 0.71 0.00 0.00 52.55 54.70 2b5m s ASP 339 Cb 0.02 -2.53 -0.03 0.00 1.01 0.00 0.00 42.92 41.39 2b5m s ASP 339 CO 0.85 -0.03 1.04 -0.94 0.21 0.00 0.00 175.17 176.30 2b5m s SER 340 N -1.62 5.90 0.00 0.27 1.04 -1.26 -4.74 113.70 113.29 2b5m s SER 340 Ca 0.48 1.66 0.00 0.00 0.48 0.00 0.00 55.95 58.56 2b5m s SER 340 Cb -0.18 -2.51 0.00 0.00 0.10 0.00 0.00 66.02 63.43 2b5m s SER 340 CO 0.23 -1.09 0.00 -0.46 0.98 0.00 0.00 173.24 172.90 2b5m n ASN 341 N -2.34 0.17 -4.65 7.02 6.94 -1.08 -4.91 115.26 116.41 2b5m n ASN 341 Ca 0.08 0.00 -0.31 0.00 -0.02 0.00 0.00 54.58 54.33 2b5m n ASN 341 Cb 0.53 0.00 0.18 0.00 -2.36 0.00 0.00 39.78 38.13 2b5m n ASN 341 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 2b5m s GLU 342 N 3.14 0.75 0.00 -3.83 8.01 -1.26 -1.86 118.70 123.65 2b5m s GLU 342 Ca 0.00 1.48 0.00 0.00 0.01 0.00 0.00 54.97 56.46 2b5m s GLU 342 Cb 0.00 -1.70 0.00 0.00 -4.31 0.00 0.00 34.13 28.12 2b5m s GLU 342 CO 0.00 -2.79 0.00 1.04 0.01 0.00 0.00 175.26 173.52 2b5m n GLN 343 N -4.34 0.00 -3.68 1.61 1.13 -1.26 -3.32 117.38 107.52 2b5m n GLN 343 Ca 0.11 0.00 -0.25 0.00 -1.94 0.00 0.00 57.00 54.92 2b5m n GLN 343 Cb 0.52 -3.54 0.06 0.00 0.11 0.00 0.00 30.24 27.40 2b5m n GLN 343 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2b5m n GLY 344 N -2.00 -0.49 3.58 1.08 0.00 -0.78 -5.01 105.19 101.56 2b5m n GLY 344 Ca 0.00 0.21 -0.34 0.00 0.00 0.00 0.00 46.02 45.89 2b5m n GLY 344 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2b5m s SER 345 N -3.51 5.33 0.22 1.61 0.15 -1.21 -4.75 113.70 111.54 2b5m s SER 345 Ca 0.50 -0.01 0.26 0.00 0.70 0.00 0.00 55.95 57.40 2b5m s SER 345 Cb -0.23 -1.90 0.71 0.00 -1.71 0.00 0.00 66.02 62.88 2b5m s SER 345 CO 0.77 0.16 1.70 1.88 1.20 0.00 0.00 173.24 178.94 2b5m h TYR 346 N 6.83 0.00 -3.27 3.44 -1.99 -1.56 -2.85 116.97 117.56 2b5m h TYR 346 Ca -0.35 0.00 -0.57 0.00 2.00 0.00 0.00 58.73 59.81 2b5m h TYR 346 Cb 1.18 0.00 -0.04 0.00 2.00 0.00 0.00 36.73 39.86 2b5m h TYR 346 CO 0.56 0.00 -0.07 0.08 -0.00 0.00 0.00 178.16 178.73 2b5m s VAL 347 N -3.12 4.81 -0.06 -2.88 1.01 -1.08 -1.00 120.40 118.09 2b5m s VAL 347 Ca 0.10 1.00 -0.02 0.00 0.00 0.00 0.00 61.98 63.05 2b5m s VAL 347 Cb 0.12 -3.80 0.04 0.00 0.00 0.00 0.00 36.38 32.73 2b5m s VAL 347 CO 0.62 0.39 0.13 -0.69 0.00 0.00 0.00 175.10 175.55 2b5m s VAL 348 N -1.30 -0.05 -0.18 2.92 1.01 -0.47 -4.94 120.40 117.39 2b5m s VAL 348 Ca 0.33 0.18 -0.29 0.00 0.00 0.00 0.00 61.98 62.20 2b5m s VAL 348 Cb -0.17 -0.22 -0.00 0.00 0.00 0.00 0.00 36.38 35.99 2b5m s VAL 348 CO 0.19 0.07 1.09 0.00 0.00 0.00 0.00 175.10 176.45 2b5m s ALA 349 N 1.14 3.61 -0.25 5.51 0.00 -1.26 -0.62 121.76 129.90 2b5m s ALA 349 Ca -0.09 0.30 -0.17 0.00 0.00 0.00 0.00 51.96 52.00 2b5m s ALA 349 Cb -0.12 -3.54 -0.15 0.00 0.00 0.00 0.00 23.12 19.31 2b5m s ALA 349 CO -0.05 -0.97 -0.09 -1.33 0.00 0.00 0.00 175.76 173.32 2b5m n MET 350 N 6.04 0.58 -4.09 0.00 2.81 -0.91 -4.94 117.12 116.60 2b5m n MET 350 Ca 0.12 0.41 -0.15 0.00 -1.81 0.00 0.00 57.70 56.26 2b5m n MET 350 Cb 0.46 -1.61 -0.14 0.00 -0.71 0.00 0.00 33.22 31.22 2b5m n MET 350 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 2b5m s GLU 351 N -2.44 0.33 -0.11 0.03 2.12 -0.98 -4.99 118.70 112.65 2b5m s GLU 351 Ca -0.34 -0.14 0.01 0.00 0.36 0.00 0.00 54.97 54.85 2b5m s GLU 351 Cb 0.11 -0.33 -0.02 0.00 0.26 0.00 0.00 34.13 34.15 2b5m s GLU 351 CO 0.54 0.08 -0.13 0.95 -0.54 0.00 0.00 175.26 176.16 2b5m s THR 352 N -0.06 3.05 -0.23 -1.70 -4.23 -1.26 -1.00 115.64 110.21 2b5m s THR 352 Ca 0.01 -0.68 -0.07 0.00 -1.18 0.00 0.00 61.69 59.78 2b5m s THR 352 Cb -0.02 -2.26 -0.03 0.00 1.34 0.00 0.00 72.50 71.53 2b5m s THR 352 CO -0.00 0.54 0.05 -0.36 -0.54 0.00 0.00 174.62 174.30 2b5m s PHE 353 N 0.12 3.09 0.03 3.99 0.40 0.33 -4.96 117.98 120.98 2b5m s PHE 353 Ca -0.06 -0.38 -0.39 0.00 -0.60 0.00 0.00 56.93 55.50 2b5m s PHE 353 Cb -0.15 -2.17 -0.19 0.00 0.51 0.00 0.00 43.02 41.02 2b5m s PHE 353 CO 0.05 -0.27 1.09 2.41 0.70 0.00 0.00 175.22 179.20 2b5m n THR 354 N 4.56 0.11 -3.84 0.64 -1.04 -1.26 -1.81 114.28 111.65 2b5m n THR 354 Ca -0.16 -0.03 -0.27 0.00 -2.04 0.00 0.00 64.05 61.55 2b5m n THR 354 Cb 0.52 -0.16 -0.17 0.00 -1.82 0.00 0.00 70.33 68.70 2b5m n THR 354 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 2b5m s ASN 355 N 0.03 2.53 0.00 8.00 2.47 -1.26 -4.79 114.94 121.92 2b5m s ASN 355 Ca 0.88 -0.54 0.18 0.00 0.42 0.00 0.00 52.86 53.80 2b5m s ASN 355 Cb -1.19 -0.76 0.81 0.00 -1.45 0.00 0.00 41.25 38.66 2b5m s ASN 355 CO 0.55 -0.20 1.55 0.18 -3.72 0.00 0.00 177.10 175.46 2b5m n LEU 356 N 4.96 0.00 0.00 3.21 4.77 -1.26 -4.63 117.00 124.06 2b5m n LEU 356 Ca -0.11 0.41 0.00 0.00 -0.03 0.00 0.00 56.01 56.28 2b5m n LEU 356 Cb 0.48 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 2b5m n LEU 356 CO 0.15 -0.16 0.00 0.61 -1.33 0.00 0.00 177.39 176.65 2b5m n GLY 357 N 0.27 -0.11 3.64 -0.72 0.00 -1.26 -3.69 105.19 103.32 2b5m n GLY 357 Ca 0.06 -1.02 -0.43 0.00 0.00 0.00 0.00 46.02 44.64 2b5m n GLY 357 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2b5m s PRO 358 N 0.00 3.92 -0.54 1.61 0.02 -1.04 -1.78 135.00 137.20 2b5m s PRO 358 Ca 0.00 2.03 -0.28 0.00 0.02 0.00 0.00 61.00 62.77 2b5m s PRO 358 Cb 0.00 -4.07 0.03 0.00 0.02 0.00 0.00 34.50 30.48 2b5m s PRO 358 CO 0.00 -1.16 1.15 0.42 -0.33 0.00 0.00 177.00 177.08 2b5m s ILE 359 N 4.97 4.13 -0.05 2.83 1.01 -0.40 -2.12 121.20 131.56 2b5m s ILE 359 Ca 0.78 0.97 0.08 0.00 0.00 0.00 0.00 60.65 62.48 2b5m s ILE 359 Cb -0.31 -4.66 -0.24 0.00 0.01 0.00 0.00 42.46 37.26 2b5m s ILE 359 CO 0.32 -1.19 0.62 0.58 0.00 0.00 0.00 174.94 175.26 2b5m h VAL 360 N 6.17 0.82 -2.66 2.92 2.07 -1.69 -3.39 116.25 120.48 2b5m h VAL 360 Ca -0.24 -2.64 0.06 0.00 0.82 0.00 0.00 66.70 64.70 2b5m h VAL 360 Cb 1.06 2.45 -0.12 0.00 -1.52 0.00 0.00 31.29 33.16 2b5m h VAL 360 CO 1.15 0.58 0.35 -0.62 0.02 0.00 0.00 177.57 179.05 2b5m s ASP 361 N -6.31 -0.40 0.34 0.57 3.68 -1.24 -4.79 116.67 108.51 2b5m s ASP 361 Ca -0.08 -0.14 -0.13 0.00 2.13 0.00 0.00 52.55 54.33 2b5m s ASP 361 Cb 0.08 0.53 0.03 0.00 -1.45 0.00 0.00 42.92 42.11 2b5m s ASP 361 CO 0.81 -0.89 0.67 0.00 0.13 0.00 0.00 175.17 175.89 2b5m s MET 362 N -3.49 2.00 0.16 4.34 0.23 -1.26 -1.34 119.30 119.92 2b5m s MET 362 Ca 0.05 -1.41 -0.18 0.00 -1.03 0.00 0.00 55.69 53.12 2b5m s MET 362 Cb -0.02 0.56 0.04 0.00 -1.53 0.00 0.00 34.83 33.88 2b5m s MET 362 CO -0.07 -0.90 0.48 0.00 -2.03 0.00 0.00 175.02 172.50 2b5m s VAL 364 N -3.82 4.22 -0.07 0.00 1.01 -1.26 -1.49 120.40 118.99 2b5m s VAL 364 Ca 0.05 -0.25 -0.10 0.00 0.00 0.00 0.00 61.98 61.68 2b5m s VAL 364 Cb 0.00 -2.84 0.02 0.00 0.00 0.00 0.00 36.38 33.57 2b5m s VAL 364 CO -0.09 0.52 0.25 -0.69 0.00 0.00 0.00 175.10 175.09 2b5m s VAL 365 N 0.02 0.02 -1.35 2.92 1.01 -0.19 -4.89 120.40 117.94 2b5m s VAL 365 Ca 0.02 -0.18 -0.12 0.00 0.00 0.00 0.00 61.98 61.70 2b5m s VAL 365 Cb -0.13 -0.42 0.11 0.00 0.00 0.00 0.00 36.38 35.94 2b5m s VAL 365 CO 0.02 -0.10 1.97 0.47 0.00 0.00 0.00 175.10 177.47 2b5m n ASP 366 N 2.45 4.61 -0.27 3.32 9.92 -1.26 -1.44 116.55 133.88 2b5m n ASP 366 Ca -0.16 -2.98 0.06 0.00 -0.53 0.00 0.00 54.79 51.18 2b5m n ASP 366 Cb 0.57 -1.58 0.16 0.00 -0.64 0.00 0.00 41.12 39.64 2b5m n ASP 366 CO 0.00 0.00 0.00 -0.07 0.13 0.00 0.00 177.20 177.26 2b5m h LEU 367 N 9.17 -0.40 0.00 0.64 3.38 -1.90 0.40 115.31 126.60 2b5m h LEU 367 Ca 0.46 0.21 0.00 0.00 0.09 0.00 0.00 57.88 58.64 2b5m h LEU 367 Cb 0.67 0.37 0.00 0.00 0.09 0.00 0.00 40.66 41.79 2b5m h LEU 367 CO 1.69 -0.20 0.00 -0.62 0.09 0.00 0.00 178.44 179.40 2b5m n GLU 368 N -5.38 0.64 -1.12 1.13 -0.58 -1.26 -4.91 120.64 109.16 2b5m n GLU 368 Ca 0.14 0.00 -0.04 0.00 -0.42 0.00 0.00 57.16 56.84 2b5m n GLU 368 Cb 0.49 -1.47 -0.02 0.00 -0.57 0.00 0.00 31.44 29.88 2b5m n GLU 368 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2b5m n ARG 369 N -0.97 -1.23 -3.57 3.49 1.74 0.14 -4.99 116.66 111.27 2b5m n ARG 369 Ca 0.14 0.53 -0.33 0.00 -0.77 0.00 0.00 57.85 57.43 2b5m n ARG 369 Cb 0.07 -4.56 -0.05 0.00 -1.02 0.00 0.00 32.46 26.90 2b5m n ARG 369 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 2b5m s GLN 370 N -1.88 3.72 0.00 5.56 -0.21 -1.26 -4.95 119.66 120.62 2b5m s GLN 370 Ca 0.00 0.09 0.00 0.00 0.02 0.00 0.00 55.36 55.47 2b5m s GLN 370 Cb 0.00 -2.84 0.00 0.00 1.00 0.00 0.00 33.01 31.17 2b5m s GLN 370 CO 0.00 0.46 0.25 0.41 -2.12 0.00 0.00 175.29 174.29 2b5m n GLY 371 N 0.29 -0.03 0.35 3.09 0.00 -1.26 -4.65 105.19 102.98 2b5m n GLY 371 Ca -0.03 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.96 2b5m n GLY 371 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b5m n GLN 372 N -0.75 -0.43 -3.93 1.61 -0.00 -1.26 -4.54 117.38 108.08 2b5m n GLN 372 Ca 0.00 -0.18 -0.12 0.00 -0.00 0.00 0.00 57.00 56.70 2b5m n GLN 372 Cb 0.12 -0.14 -0.13 0.00 -0.00 0.00 0.00 30.24 30.09 2b5m n GLN 372 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.06 177.26 2b5m s GLY 373 N -3.11 0.10 0.04 2.61 0.00 -1.26 -4.44 107.32 101.27 2b5m s GLY 373 Ca 0.07 -0.19 0.08 0.00 0.00 0.00 0.00 44.72 44.67 2b5m s GLY 373 CO 0.05 -0.21 -0.21 1.20 0.00 0.00 0.00 173.10 173.93 2b5m s GLN 374 N -0.43 1.43 -0.02 2.90 -0.21 -0.52 -4.58 119.66 118.24 2b5m s GLN 374 Ca -0.04 -0.96 -0.21 0.00 0.02 0.00 0.00 55.36 54.17 2b5m s GLN 374 Cb -0.03 -1.55 -0.05 0.00 1.00 0.00 0.00 33.01 32.38 2b5m s GLN 374 CO -0.00 0.40 0.60 -0.51 -2.12 0.00 0.00 175.29 173.65 2b5m s LEU 375 N -1.20 4.40 -0.16 2.90 1.43 0.27 -1.02 118.68 125.29 2b5m s LEU 375 Ca 0.08 1.14 0.01 0.00 -1.03 0.00 0.00 54.13 54.33 2b5m s LEU 375 Cb -0.09 -2.93 0.01 0.00 0.03 0.00 0.00 46.19 43.21 2b5m s LEU 375 CO 0.02 0.07 -0.18 -0.69 0.23 0.00 0.00 176.35 175.80 2b5m s VAL 376 N -0.02 2.39 0.05 -1.59 1.01 -0.56 0.12 120.40 121.80 2b5m s VAL 376 Ca 0.31 -0.85 0.09 0.00 0.00 0.00 0.00 61.98 61.53 2b5m s VAL 376 Cb -0.18 -2.00 -0.03 0.00 0.00 0.00 0.00 36.38 34.17 2b5m s VAL 376 CO 0.17 0.52 -0.25 0.42 0.00 0.00 0.00 175.10 175.97 2b5m s THR 377 N 1.00 1.99 -0.28 3.92 -4.23 0.28 -1.84 115.64 116.47 2b5m s THR 377 Ca -0.02 -1.34 -0.28 0.00 -1.18 0.00 0.00 61.69 58.87 2b5m s THR 377 Cb -0.15 -1.71 0.01 0.00 1.34 0.00 0.00 72.50 71.99 2b5m s THR 377 CO -0.04 0.31 1.01 0.00 -0.54 0.00 0.00 174.62 175.35 2b5m s SER 379 N 1.47 2.19 0.00 0.00 0.01 0.54 -1.98 113.70 115.93 2b5m s SER 379 Ca 0.42 -0.68 0.00 0.00 1.31 0.00 0.00 55.95 57.00 2b5m s SER 379 Cb -0.14 -0.10 0.00 0.00 0.21 0.00 0.00 66.02 65.99 2b5m s SER 379 CO 0.11 -0.02 0.00 0.61 0.41 0.00 0.00 173.24 174.36 2b5m n GLY 380 N 1.05 -2.36 3.26 3.44 0.00 -0.90 -0.16 105.19 109.52 2b5m n GLY 380 Ca -0.19 -1.58 -0.09 0.00 0.00 0.00 0.00 46.02 44.15 2b5m n GLY 380 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b5m s ALA 381 N -1.06 -0.49 0.00 4.61 0.00 -1.19 -4.60 121.76 119.03 2b5m s ALA 381 Ca 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 51.96 51.55 2b5m s ALA 381 Cb 0.00 0.60 0.00 0.00 0.00 0.00 0.00 23.12 23.72 2b5m s ALA 381 CO 0.00 -0.58 0.00 1.19 0.00 0.00 0.00 175.76 176.37 2b5m n PHE 382 N -0.14 0.00 0.30 0.00 3.01 -1.26 -1.65 117.46 117.72 2b5m n PHE 382 Ca -0.15 0.00 0.19 0.00 1.01 0.00 0.00 57.45 58.50 2b5m n PHE 382 Cb 0.63 0.00 0.86 0.00 -0.01 0.00 0.00 39.48 40.96 2b5m n PHE 382 CO 0.00 0.00 0.00 1.57 1.01 0.00 0.00 176.76 179.34 2b5m h LYS 383 N 0.00 0.00 -0.00 -1.08 2.10 -1.88 -0.01 116.57 115.70 2b5m h LYS 383 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2b5m h LYS 383 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 2b5m h LYS 383 CO 0.00 0.01 -0.03 0.39 -2.00 0.00 0.00 179.45 177.82 2b5m n GLU 384 N -3.12 0.48 -1.73 0.07 4.71 -0.66 -3.85 120.64 116.54 2b5m n GLU 384 Ca -0.01 -0.05 -0.40 0.00 -0.01 0.00 0.00 57.16 56.69 2b5m n GLU 384 Cb 0.23 -1.50 0.01 0.00 -1.01 0.00 0.00 31.44 29.17 2b5m n GLU 384 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2b5m n GLY 385 N 1.29 0.79 3.83 0.62 0.00 -0.16 -4.22 105.19 107.34 2b5m n GLY 385 Ca 0.14 0.20 -0.07 0.00 0.00 0.00 0.00 46.02 46.29 2b5m n GLY 385 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2b5m s SER 386 N -0.48 -0.07 -0.09 1.61 1.04 0.78 -0.62 113.70 115.86 2b5m s SER 386 Ca 0.61 -0.87 -0.01 0.00 0.48 0.00 0.00 55.95 56.15 2b5m s SER 386 Cb -0.48 0.73 -0.03 0.00 0.10 0.00 0.00 66.02 66.34 2b5m s SER 386 CO 0.58 -1.42 -0.02 -0.76 0.98 0.00 0.00 173.24 172.60 2b5m s LEU 387 N -3.09 3.42 -0.06 2.42 1.43 -0.70 -0.34 118.68 121.77 2b5m s LEU 387 Ca 0.15 0.06 0.06 0.00 -1.03 0.00 0.00 54.13 53.37 2b5m s LEU 387 Cb -0.04 -1.78 -0.01 0.00 0.03 0.00 0.00 46.19 44.39 2b5m s LEU 387 CO 0.08 0.34 -0.23 -0.13 0.23 0.00 0.00 176.35 176.64 2b5m s ARG 388 N -0.67 2.44 -0.36 1.70 1.81 -0.17 -0.84 118.95 122.86 2b5m s ARG 388 Ca 0.11 -0.85 -0.13 0.00 -1.72 0.00 0.00 55.73 53.14 2b5m s ARG 388 Cb -0.12 -2.05 0.00 0.00 -0.45 0.00 0.00 34.95 32.33 2b5m s ARG 388 CO 0.02 0.34 0.24 0.42 -0.68 0.00 0.00 175.30 175.64 2b5m s ILE 389 N -0.08 5.09 -0.13 1.52 1.09 -0.63 0.10 121.20 128.16 2b5m s ILE 389 Ca -0.05 -0.46 -0.05 0.00 -1.10 0.00 0.00 60.65 58.99 2b5m s ILE 389 Cb -0.14 -3.71 -0.04 0.00 -1.06 0.00 0.00 42.46 37.52 2b5m s ILE 389 CO 0.04 -0.12 0.04 -0.63 -0.10 0.00 0.00 174.94 174.17 2b5m s ILE 390 N 1.67 4.63 0.02 2.92 1.09 0.33 -2.13 121.20 129.72 2b5m s ILE 390 Ca 0.05 -0.11 0.01 0.00 -1.10 0.00 0.00 60.65 59.50 2b5m s ILE 390 Cb -0.18 -3.02 -0.01 0.00 -1.06 0.00 0.00 42.46 38.19 2b5m s ILE 390 CO 0.09 0.54 -0.05 -0.60 -0.10 0.00 0.00 174.94 174.82 2b5m s ARG 391 N -0.30 0.41 0.07 2.79 3.00 -0.26 -0.57 118.95 124.10 2b5m s ARG 391 Ca 0.08 -0.47 -0.06 0.00 -1.00 0.00 0.00 55.73 54.27 2b5m s ARG 391 Cb -0.12 -0.24 -0.05 0.00 0.00 0.00 0.00 34.95 34.53 2b5m s ARG 391 CO 0.02 0.05 0.33 1.21 0.00 0.00 0.00 175.30 176.91 2b5m s ASN 392 N -0.92 6.52 0.10 -2.12 3.84 -1.26 -0.50 114.94 120.59 2b5m s ASN 392 Ca -0.06 0.60 0.00 0.00 0.21 0.00 0.00 52.86 53.61 2b5m s ASN 392 Cb -0.06 -2.10 0.00 0.00 -0.55 0.00 0.00 41.25 38.54 2b5m s ASN 392 CO -0.00 0.16 0.00 0.61 -2.79 0.00 0.00 177.10 175.08 2b5m n GLY 393 N 0.68 -1.66 3.90 1.21 0.00 -0.93 -4.90 105.19 103.48 2b5m n GLY 393 Ca -0.07 -1.43 -0.33 0.00 0.00 0.00 0.00 46.02 44.19 2b5m n GLY 393 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2b5m s ILE 394 N -1.65 5.33 0.28 -0.61 -1.09 0.16 -4.52 121.20 119.10 2b5m s ILE 394 Ca 0.00 -0.07 0.05 0.00 -2.23 0.00 0.00 60.65 58.40 2b5m s ILE 394 Cb 0.00 -3.59 -0.06 0.00 -1.58 0.00 0.00 42.46 37.24 2b5m s ILE 394 CO 0.00 0.24 -0.00 -0.83 -1.23 0.00 0.00 174.94 173.11 2b5m s GLY 395 N -2.09 1.82 -0.05 6.18 0.00 -1.26 -1.32 107.32 110.60 2b5m s GLY 395 Ca 0.32 -1.91 -0.02 0.00 0.00 0.00 0.00 44.72 43.11 2b5m s GLY 395 CO 0.21 -1.78 0.08 -0.26 0.00 0.00 0.00 173.10 171.36 2b5m s ILE 396 N -3.23 -0.12 -0.10 0.90 -4.36 -1.26 -2.76 121.20 110.27 2b5m s ILE 396 Ca 0.31 0.32 -0.30 0.00 -0.26 0.00 0.00 60.65 60.73 2b5m s ILE 396 Cb 0.06 -0.17 -0.01 0.00 1.25 0.00 0.00 42.46 43.59 2b5m s ILE 396 CO 0.12 0.13 1.01 -1.00 0.24 0.00 0.00 174.94 175.45 2b5m s HIS 397 N 1.73 3.50 0.12 1.37 3.76 -1.26 -4.96 115.29 119.56 2b5m s HIS 397 Ca -0.02 1.58 -0.09 0.00 -0.15 0.00 0.00 55.06 56.39 2b5m s HIS 397 Cb -0.12 -3.20 -0.06 0.00 1.11 0.00 0.00 32.58 30.31 2b5m s HIS 397 CO -0.04 -0.26 0.43 -1.21 -0.85 0.00 0.00 174.74 172.80 2b5m s GLU 398 N 2.00 3.74 0.17 1.40 2.02 -1.26 -4.06 118.70 122.71 2b5m s GLU 398 Ca 0.49 0.14 0.00 0.00 0.02 0.00 0.00 54.97 55.62 2b5m s GLU 398 Cb -0.19 -2.90 0.00 0.00 0.10 0.00 0.00 34.13 31.15 2b5m s GLU 398 CO 0.18 0.49 0.00 0.72 0.02 0.00 0.00 175.26 176.67 2b5m n HIS 399 N 0.52 -1.08 -4.00 1.61 8.25 -1.26 -5.07 115.22 114.18 2b5m n HIS 399 Ca -0.05 0.19 -0.34 0.00 -0.26 0.00 0.00 57.72 57.26 2b5m n HIS 399 Cb 0.52 0.28 -0.15 0.00 1.12 0.00 0.00 29.99 31.76 2b5m n HIS 399 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2b5m s ALA 400 N -2.00 2.61 -0.24 -1.41 0.00 -1.26 -5.09 121.76 114.37 2b5m s ALA 400 Ca 0.00 -1.36 0.02 0.00 0.00 0.00 0.00 51.96 50.61 2b5m s ALA 400 Cb 0.00 -1.54 0.06 0.00 0.00 0.00 0.00 23.12 21.63 2b5m s ALA 400 CO 0.00 -0.64 -0.08 0.45 0.00 0.00 0.00 175.76 175.48 2b5m s SER 401 N 1.33 4.03 -0.15 0.00 0.15 -1.26 -4.02 113.70 113.78 2b5m s SER 401 Ca 0.02 -1.22 -0.11 0.00 0.70 0.00 0.00 55.95 55.34 2b5m s SER 401 Cb -0.15 -1.34 -0.05 0.00 -1.71 0.00 0.00 66.02 62.77 2b5m s SER 401 CO -0.07 -0.20 0.20 -0.63 1.20 0.00 0.00 173.24 173.74 2b5m s ILE 402 N 1.28 5.37 -1.07 6.45 1.09 -1.14 -4.95 121.20 128.23 2b5m s ILE 402 Ca -0.06 0.35 -0.17 0.00 -1.10 0.00 0.00 60.65 59.67 2b5m s ILE 402 Cb -0.19 -3.52 -0.08 0.00 -1.06 0.00 0.00 42.46 37.62 2b5m s ILE 402 CO -0.06 0.49 2.11 0.47 -0.10 0.00 0.00 174.94 177.85 2b5m n ASP 403 N 2.97 3.63 -4.09 3.58 8.00 -1.26 -2.69 116.55 126.69 2b5m n ASP 403 Ca -0.16 -2.69 -0.36 0.00 0.71 0.00 0.00 54.79 52.30 2b5m n ASP 403 Cb 0.53 -1.32 -0.11 0.00 -0.02 0.00 0.00 41.12 40.20 2b5m n ASP 403 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2b5m s LEU 404 N 1.33 5.18 0.00 0.64 2.96 -1.26 -4.97 118.68 122.57 2b5m s LEU 404 Ca 0.53 -2.57 0.00 0.00 -0.22 0.00 0.00 54.13 51.87 2b5m s LEU 404 Cb 0.14 -1.83 0.00 0.00 0.50 0.00 0.00 46.19 45.00 2b5m s LEU 404 CO 0.02 -0.42 0.00 -2.65 -1.32 0.00 0.00 176.35 171.98 2b5m n PRO 405 N 3.86 2.78 0.00 0.98 -0.02 -1.26 -3.10 135.00 138.24 2b5m n PRO 405 Ca 0.04 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.52 2b5m n PRO 405 Cb 0.39 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.87 2b5m n PRO 405 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2b5m n GLY 406 N 0.00 0.00 2.69 -1.23 0.00 -1.23 -4.67 105.19 100.75 2b5m n GLY 406 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 2b5m n GLY 406 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2b5m s ILE 407 N 0.00 -0.13 -2.06 -0.61 1.01 -1.26 -4.70 121.20 113.44 2b5m s ILE 407 Ca 0.00 0.33 0.20 0.00 0.00 0.00 0.00 60.65 61.18 2b5m s ILE 407 Cb 0.00 -0.24 0.43 0.00 0.01 0.00 0.00 42.46 42.66 2b5m s ILE 407 CO 0.00 0.10 1.37 0.29 0.00 0.00 0.00 174.94 176.70 2b5m n LYS 408 N 5.30 2.45 0.00 2.79 4.76 0.75 -4.92 118.16 129.29 2b5m n LYS 408 Ca -0.04 -2.25 0.00 0.00 -2.87 0.00 0.00 58.31 53.15 2b5m n LYS 408 Cb 0.50 -1.47 0.00 0.00 -1.84 0.00 0.00 35.03 32.22 2b5m n LYS 408 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2b5m n GLY 409 N 1.33 0.47 3.44 0.72 0.00 -1.16 -4.86 105.19 105.13 2b5m n GLY 409 Ca 0.18 -0.79 -0.06 0.00 0.00 0.00 0.00 46.02 45.36 2b5m n GLY 409 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2b5m s LEU 410 N 0.00 -0.82 -0.00 0.99 1.43 -1.26 -2.63 118.68 116.39 2b5m s LEU 410 Ca 0.00 1.24 0.01 0.00 -1.03 0.00 0.00 54.13 54.35 2b5m s LEU 410 Cb 0.00 1.78 -0.00 0.00 0.03 0.00 0.00 46.19 48.00 2b5m s LEU 410 CO 0.00 -0.23 -0.03 0.26 0.23 0.00 0.00 176.35 176.59 2b5m s TRP 411 N 2.58 0.25 1.05 0.29 0.51 -1.17 -4.45 118.94 118.01 2b5m s TRP 411 Ca -0.04 -0.05 -0.24 0.00 -2.12 0.00 0.00 56.10 53.65 2b5m s TRP 411 Cb -0.11 -0.17 -0.07 0.00 -0.81 0.00 0.00 33.47 32.30 2b5m s TRP 411 CO -0.16 -0.01 -0.92 -2.30 -0.51 0.00 0.00 176.95 173.05 2b5m n PRO 412 N 3.04 -0.66 -3.43 4.98 -0.02 -1.26 -3.50 135.00 134.14 2b5m n PRO 412 Ca -0.13 -0.19 -0.01 0.00 -2.02 0.00 0.00 63.50 61.15 2b5m n PRO 412 Cb 0.59 -1.28 -0.04 0.00 -0.02 0.00 0.00 33.50 32.74 2b5m n PRO 412 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2b5m s LEU 413 N 4.22 -1.10 -0.77 2.45 2.96 -1.17 -4.70 118.68 120.57 2b5m s LEU 413 Ca 0.44 1.08 -0.12 0.00 -0.22 0.00 0.00 54.13 55.31 2b5m s LEU 413 Cb 0.01 1.98 0.20 0.00 0.50 0.00 0.00 46.19 48.89 2b5m s LEU 413 CO 0.66 -0.25 0.69 -0.60 -1.32 0.00 0.00 176.35 175.53 2b5m s ARG 414 N 2.80 3.36 0.00 1.98 3.52 -1.26 0.91 118.95 130.27 2b5m s ARG 414 Ca 0.07 -2.44 0.19 0.00 -0.13 0.00 0.00 55.73 53.42 2b5m s ARG 414 Cb -0.14 -4.28 1.16 0.00 -1.56 0.00 0.00 34.95 30.13 2b5m s ARG 414 CO -0.18 -1.27 1.55 0.45 -0.81 0.00 0.00 175.30 175.03 2b5m n SER 415 N 3.94 0.00 -4.97 -2.12 2.88 -1.26 -4.77 113.62 107.32 2b5m n SER 415 Ca 0.11 -0.60 -0.21 0.00 -1.33 0.00 0.00 58.87 56.83 2b5m n SER 415 Cb 0.45 -0.00 0.02 0.00 -0.75 0.00 0.00 64.21 63.93 2b5m n SER 415 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 2b5m s ASP 416 N -2.00 5.02 0.00 -3.46 -0.00 -1.26 -5.06 116.67 109.91 2b5m s ASP 416 Ca 0.29 -0.90 0.00 0.00 -0.00 0.00 0.00 52.55 51.94 2b5m s ASP 416 Cb 0.13 0.10 0.00 0.00 -0.00 0.00 0.00 42.92 43.15 2b5m s ASP 416 CO 0.22 -1.11 0.00 -2.65 -0.00 0.00 0.00 175.17 171.64 2b5m n PRO 417 N -1.96 0.00 -3.05 8.23 -0.02 -1.26 -4.70 135.00 132.25 2b5m n PRO 417 Ca 0.08 0.00 -0.40 0.00 -2.02 0.00 0.00 63.50 61.16 2b5m n PRO 417 Cb 0.62 0.00 -0.00 0.00 -0.02 0.00 0.00 33.50 34.10 2b5m n PRO 417 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2b5m n ASN 418 N 0.00 6.07 -1.14 2.55 3.02 -1.26 -4.61 115.26 119.88 2b5m n ASN 418 Ca 0.00 -3.44 0.01 0.00 -0.03 0.00 0.00 54.58 51.12 2b5m n ASN 418 Cb 0.00 -1.17 0.24 0.00 -0.61 0.00 0.00 39.78 38.24 2b5m n ASN 418 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2b5m n ARG 419 N 1.15 2.57 -1.41 3.52 1.74 -1.26 -5.13 116.66 117.84 2b5m n ARG 419 Ca 0.28 -3.00 0.18 0.00 -0.77 0.00 0.00 57.85 54.55 2b5m n ARG 419 Cb 0.34 -1.88 -0.06 0.00 -1.02 0.00 0.00 32.46 29.83 2b5m n ARG 419 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2b5m n GLU 420 N -0.73 -3.01 0.00 5.56 4.71 -1.26 -4.95 120.64 120.96 2b5m n GLU 420 Ca 0.29 2.18 0.00 0.00 -0.01 0.00 0.00 57.16 59.62 2b5m n GLU 420 Cb 1.02 -3.61 0.00 0.00 -1.01 0.00 0.00 31.44 27.85 2b5m n GLU 420 CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 2b5m n THR 421 N -4.25 0.00 -3.68 2.62 -2.24 -1.26 -4.97 114.28 100.50 2b5m n THR 421 Ca -0.02 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.61 2b5m n THR 421 Cb 0.66 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.81 2b5m n THR 421 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 2b5m s TYR 422 N 0.00 -0.36 0.00 4.78 1.51 -1.26 -4.27 117.35 117.75 2b5m s TYR 422 Ca 0.00 0.61 0.00 0.00 -1.01 0.00 0.00 57.07 56.67 2b5m s TYR 422 Cb 0.00 0.20 0.00 0.00 -0.11 0.00 0.00 41.96 42.05 2b5m s TYR 422 CO 0.00 -0.45 0.32 -0.40 -1.11 0.00 0.00 175.55 173.91 2b5m n ASP 423 N 1.26 0.12 -3.74 2.29 3.85 0.26 -3.85 116.55 116.74 2b5m n ASP 423 Ca -0.20 -1.04 -0.13 0.00 -0.71 0.00 0.00 54.79 52.70 2b5m n ASP 423 Cb 0.56 0.00 -0.10 0.00 -1.35 0.00 0.00 41.12 40.23 2b5m n ASP 423 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.20 175.30 2b5m s THR 424 N -0.04 0.01 0.02 2.12 2.01 -1.10 -0.06 115.64 118.60 2b5m s THR 424 Ca 0.00 -0.09 0.08 0.00 0.31 0.00 0.00 61.69 61.99 2b5m s THR 424 Cb 0.00 -0.56 -0.02 0.00 0.01 0.00 0.00 72.50 71.93 2b5m s THR 424 CO 0.00 -0.05 -0.24 -0.22 -0.69 0.00 0.00 174.62 173.42 2b5m s LEU 425 N -0.13 2.11 -0.12 4.42 2.96 -1.26 -3.06 118.68 123.61 2b5m s LEU 425 Ca -0.03 -0.51 0.01 0.00 -0.22 0.00 0.00 54.13 53.39 2b5m s LEU 425 Cb -0.03 -1.20 -0.01 0.00 0.50 0.00 0.00 46.19 45.45 2b5m s LEU 425 CO 0.01 0.25 -0.17 -0.69 -1.32 0.00 0.00 176.35 174.44 2b5m s VAL 426 N -0.70 2.67 -0.27 1.68 1.01 -1.23 -2.80 120.40 120.76 2b5m s VAL 426 Ca 0.10 -0.80 -0.01 0.00 0.00 0.00 0.00 61.98 61.26 2b5m s VAL 426 Cb -0.09 -2.09 0.04 0.00 0.00 0.00 0.00 36.38 34.24 2b5m s VAL 426 CO 0.01 0.54 -0.04 -0.76 0.00 0.00 0.00 175.10 174.85 2b5m s LEU 427 N 0.34 3.52 0.09 3.92 1.43 -1.26 -3.03 118.68 123.69 2b5m s LEU 427 Ca -0.14 -1.10 -0.30 0.00 -1.03 0.00 0.00 54.13 51.56 2b5m s LEU 427 Cb -0.17 -1.67 -0.06 0.00 0.03 0.00 0.00 46.19 44.32 2b5m s LEU 427 CO 0.07 -0.19 1.17 -0.94 0.23 0.00 0.00 176.35 176.69 2b5m s SER 428 N 1.27 7.12 0.29 2.29 1.04 -1.08 -2.87 113.70 121.77 2b5m s SER 428 Ca -0.03 2.03 0.10 0.00 0.48 0.00 0.00 55.95 58.53 2b5m s SER 428 Cb -0.18 -2.59 -0.05 0.00 0.10 0.00 0.00 66.02 63.31 2b5m s SER 428 CO -0.03 -0.41 -0.01 -0.36 0.98 0.00 0.00 173.24 173.41 2b5m s PHE 429 N 0.74 2.62 0.00 5.02 2.99 -0.50 -0.18 117.98 128.68 2b5m s PHE 429 Ca 0.56 -0.28 0.00 0.00 0.00 0.00 0.00 56.93 57.21 2b5m s PHE 429 Cb -0.29 -1.25 0.00 0.00 0.00 0.00 0.00 43.02 41.47 2b5m s PHE 429 CO 0.31 0.59 0.00 0.28 -0.00 0.00 0.00 175.22 176.39 2b5m n VAL 430 N -0.89 0.00 -1.73 -0.44 0.31 -1.26 -1.93 118.33 112.38 2b5m n VAL 430 Ca -0.06 0.00 0.02 0.00 -0.01 0.00 0.00 64.34 64.29 2b5m n VAL 430 Cb 0.60 0.00 0.02 0.00 -0.91 0.00 0.00 33.84 33.55 2b5m n VAL 430 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2b5m n GLY 431 N 0.00 0.89 3.51 2.92 0.00 -1.26 -4.79 105.19 106.47 2b5m n GLY 431 Ca 0.00 -0.17 -0.24 0.00 0.00 0.00 0.00 46.02 45.61 2b5m n GLY 431 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2b5m s GLN 432 N -0.45 1.76 -0.14 1.61 -0.21 -0.81 -2.85 119.66 118.57 2b5m s GLN 432 Ca 0.05 -1.98 -0.04 0.00 0.02 0.00 0.00 55.36 53.41 2b5m s GLN 432 Cb 0.04 -1.19 0.05 0.00 1.00 0.00 0.00 33.01 32.92 2b5m s GLN 432 CO 0.00 -0.12 0.09 0.99 -2.12 0.00 0.00 175.29 174.14 2b5m s THR 433 N -3.05 -0.11 -0.30 -0.19 2.01 -1.12 -1.40 115.64 111.48 2b5m s THR 433 Ca 0.36 0.01 0.03 0.00 0.31 0.00 0.00 61.69 62.39 2b5m s THR 433 Cb 0.09 -0.46 0.08 0.00 0.01 0.00 0.00 72.50 72.22 2b5m s THR 433 CO 0.16 -0.15 -0.01 -0.13 -0.69 0.00 0.00 174.62 173.80 2b5m s ARG 434 N 2.16 1.71 0.58 4.92 0.52 -1.14 -4.07 118.95 123.63 2b5m s ARG 434 Ca 0.03 -1.55 -0.20 0.00 -0.52 0.00 0.00 55.73 53.50 2b5m s ARG 434 Cb -0.15 -2.95 -0.04 0.00 0.52 0.00 0.00 34.95 32.33 2b5m s ARG 434 CO -0.08 -0.78 1.24 0.08 0.02 0.00 0.00 175.30 175.79 2b5m s VAL 435 N 1.07 2.50 0.00 3.52 1.01 -1.26 -4.17 120.40 123.07 2b5m s VAL 435 Ca 0.02 0.33 0.00 0.00 0.00 0.00 0.00 61.98 62.33 2b5m s VAL 435 Cb -0.19 -3.14 0.00 0.00 0.00 0.00 0.00 36.38 33.04 2b5m s VAL 435 CO -0.08 -0.05 0.00 0.18 0.00 0.00 0.00 175.10 175.15 2b5m n LEU 436 N -1.40 0.00 0.00 3.92 4.77 -1.12 -3.27 117.00 119.90 2b5m n LEU 436 Ca 0.13 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 2b5m n LEU 436 Cb 0.48 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 2b5m n LEU 436 CO 0.47 0.00 0.00 0.80 -1.33 0.00 0.00 177.39 177.33 2b5m n MET 437 N 0.00 0.00 -3.54 3.23 0.00 -1.10 -3.39 117.12 112.33 2b5m n MET 437 Ca 0.00 0.00 -0.27 0.00 -0.00 0.00 0.00 57.70 57.43 2b5m n MET 437 Cb 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 33.22 33.07 2b5m n MET 437 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 2b5m s LEU 438 N 0.00 0.43 -0.18 -0.89 1.43 0.91 -3.84 118.68 116.54 2b5m s LEU 438 Ca 0.00 -1.12 -0.01 0.00 -1.03 0.00 0.00 54.13 51.97 2b5m s LEU 438 Cb 0.00 -0.25 0.09 0.00 0.03 0.00 0.00 46.19 46.07 2b5m s LEU 438 CO 0.00 -0.42 2.14 -3.20 0.23 0.00 0.00 176.35 175.10 2b5m n ASN 439 N 5.26 5.96 0.00 2.29 2.85 -1.26 -4.85 115.26 125.50 2b5m n ASN 439 Ca -0.06 -2.78 0.00 0.00 -0.11 0.00 0.00 54.58 51.63 2b5m n ASN 439 Cb 0.44 -1.12 0.00 0.00 1.24 0.00 0.00 39.78 40.34 2b5m n ASN 439 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2b5m n GLY 440 N 0.96 0.65 0.28 8.20 0.00 -1.26 -4.45 105.19 109.58 2b5m n GLY 440 Ca 0.20 -1.00 0.12 0.00 0.00 0.00 0.00 46.02 45.34 2b5m n GLY 440 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2b5m n GLU 441 N 0.00 0.86 -1.73 1.61 -0.58 -1.26 -4.17 120.64 115.37 2b5m n GLU 441 Ca 0.00 -0.57 -0.42 0.00 -0.42 0.00 0.00 57.16 55.75 2b5m n GLU 441 Cb 0.00 -1.49 -0.02 0.00 -0.57 0.00 0.00 31.44 29.36 2b5m n GLU 441 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2b5m n GLU 442 N -0.57 2.60 -3.13 3.49 -0.58 -1.26 -5.01 120.64 116.17 2b5m n GLU 442 Ca 0.11 0.93 -0.21 0.00 -0.42 0.00 0.00 57.16 57.57 2b5m n GLU 442 Cb 0.37 -2.71 -0.04 0.00 -0.57 0.00 0.00 31.44 28.49 2b5m n GLU 442 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 2b5m n VAL 443 N 2.58 0.79 -2.06 2.62 0.31 -1.26 -4.32 118.33 116.99 2b5m n VAL 443 Ca 0.11 -4.84 -0.28 0.00 -0.01 0.00 0.00 64.34 59.32 2b5m n VAL 443 Cb 0.35 -0.80 0.10 0.00 -0.91 0.00 0.00 33.84 32.58 2b5m n VAL 443 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 2b5m s GLU 444 N -2.62 1.81 -0.24 5.55 2.12 -1.25 -4.93 118.70 119.15 2b5m s GLU 444 Ca 0.42 -0.19 -0.00 0.00 0.36 0.00 0.00 54.97 55.56 2b5m s GLU 444 Cb 0.31 -2.04 0.07 0.00 0.26 0.00 0.00 34.13 32.72 2b5m s GLU 444 CO -0.10 -1.59 -0.01 -1.83 -0.54 0.00 0.00 175.26 171.20 2b5m s GLU 445 N -5.47 1.27 -0.01 4.30 -1.05 -1.26 -2.69 118.70 113.79 2b5m s GLU 445 Ca 0.64 -0.91 -0.02 0.00 -0.15 0.00 0.00 54.97 54.53 2b5m s GLU 445 Cb -0.09 -2.44 -0.00 0.00 -0.44 0.00 0.00 34.13 31.16 2b5m s GLU 445 CO 0.48 -0.67 0.04 0.95 0.95 0.00 0.00 175.26 177.00 2b5m s THR 446 N 1.51 0.04 0.86 1.83 -4.23 -1.20 -4.96 115.64 109.49 2b5m s THR 446 Ca -0.02 -0.31 -0.11 0.00 -1.18 0.00 0.00 61.69 60.07 2b5m s THR 446 Cb -0.18 -0.16 0.15 0.00 1.34 0.00 0.00 72.50 73.65 2b5m s THR 446 CO -0.09 -0.17 1.20 -1.83 -0.54 0.00 0.00 174.62 173.19 2b5m s GLU 447 N -0.51 1.20 -0.00 3.99 -1.05 -1.26 -4.25 118.70 116.81 2b5m s GLU 447 Ca -0.06 -0.46 -0.06 0.00 -0.15 0.00 0.00 54.97 54.24 2b5m s GLU 447 Cb -0.04 -1.99 -0.05 0.00 -0.44 0.00 0.00 34.13 31.61 2b5m s GLU 447 CO -0.00 -1.98 0.25 -0.51 0.95 0.00 0.00 175.26 173.97 2b5m s LEU 448 N -5.63 4.37 -0.79 1.83 1.02 -1.26 -5.01 118.68 113.22 2b5m s LEU 448 Ca 0.69 0.53 -0.07 0.00 0.02 0.00 0.00 54.13 55.30 2b5m s LEU 448 Cb -0.06 -2.62 -0.15 0.00 0.02 0.00 0.00 46.19 43.38 2b5m s LEU 448 CO 0.50 0.27 2.95 0.80 0.02 0.00 0.00 176.35 180.88 2b5m n MET 449 N 1.17 2.57 0.00 1.70 1.56 -1.26 -3.38 117.12 119.49 2b5m n MET 449 Ca -0.12 -1.49 0.00 0.00 -0.27 0.00 0.00 57.70 55.82 2b5m n MET 449 Cb 0.53 -2.36 0.00 0.00 2.15 0.00 0.00 33.22 33.54 2b5m n MET 449 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 2b5m n GLY 450 N 3.16 0.16 3.72 -5.12 0.00 -1.26 -3.26 105.19 102.58 2b5m n GLY 450 Ca 0.55 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.29 2b5m n GLY 450 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2b5m s PHE 451 N 0.00 2.32 -0.15 1.61 0.08 -1.22 -4.77 117.98 115.84 2b5m s PHE 451 Ca 0.00 -0.72 -0.05 0.00 0.12 0.00 0.00 56.93 56.28 2b5m s PHE 451 Cb 0.00 -1.82 -0.03 0.00 -0.57 0.00 0.00 43.02 40.60 2b5m s PHE 451 CO 0.00 0.23 0.02 0.08 -0.10 0.00 0.00 175.22 175.44 2b5m s VAL 452 N -2.72 4.39 -0.69 -0.44 1.01 -1.26 -4.88 120.40 115.82 2b5m s VAL 452 Ca 0.30 -0.18 0.22 0.00 0.00 0.00 0.00 61.98 62.32 2b5m s VAL 452 Cb 0.05 -2.94 -0.17 0.00 0.00 0.00 0.00 36.38 33.32 2b5m s VAL 452 CO 0.16 0.50 0.94 -0.90 0.00 0.00 0.00 175.10 175.81 2b5m n ASP 453 N 3.27 0.64 -1.97 3.32 5.68 -1.26 -4.37 116.55 121.87 2b5m n ASP 453 Ca -0.17 -0.44 -0.23 0.00 -0.50 0.00 0.00 54.79 53.45 2b5m n ASP 453 Cb 0.53 0.98 0.03 0.00 -1.14 0.00 0.00 41.12 41.52 2b5m n ASP 453 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 2b5m n ASP 454 N -1.82 4.94 -3.37 -1.12 3.85 -1.26 -2.80 116.55 114.98 2b5m n ASP 454 Ca 0.02 -3.76 -0.15 0.00 -0.71 0.00 0.00 54.79 50.19 2b5m n ASP 454 Cb 0.41 -0.40 -0.08 0.00 -1.35 0.00 0.00 41.12 39.70 2b5m n ASP 454 CO 0.00 0.00 0.00 -1.10 -1.01 0.00 0.00 177.20 175.09 2b5m s GLN 455 N -3.60 0.36 -0.19 0.11 -1.52 -1.18 -4.72 119.66 108.93 2b5m s GLN 455 Ca 0.51 -0.11 -0.42 0.00 -1.95 0.00 0.00 55.36 53.40 2b5m s GLN 455 Cb 0.41 -0.56 -0.20 0.00 -0.22 0.00 0.00 33.01 32.45 2b5m s GLN 455 CO 0.03 -1.04 1.25 0.94 -0.25 0.00 0.00 175.29 176.22 2b5m n GLN 456 N 5.27 0.00 -3.54 2.91 7.27 -1.13 -4.12 117.38 124.03 2b5m n GLN 456 Ca -0.01 0.00 -0.32 0.00 0.07 0.00 0.00 57.00 56.74 2b5m n GLN 456 Cb 0.47 -1.47 -0.05 0.00 2.41 0.00 0.00 30.24 31.60 2b5m n GLN 456 CO 0.00 0.00 0.00 0.99 0.07 0.00 0.00 177.06 178.12 2b5m s THR 457 N 1.11 5.04 -0.73 1.69 2.01 -1.26 -3.38 115.64 120.12 2b5m s THR 457 Ca 0.95 0.33 0.08 0.00 0.31 0.00 0.00 61.69 63.35 2b5m s THR 457 Cb -1.33 -3.63 0.20 0.00 0.01 0.00 0.00 72.50 67.74 2b5m s THR 457 CO 0.65 0.05 1.12 0.49 -0.69 0.00 0.00 174.62 176.24 2b5m n PHE 458 N 0.19 0.28 0.00 4.92 3.72 0.11 -4.81 117.46 121.88 2b5m n PHE 458 Ca -0.02 -0.42 0.00 0.00 -0.05 0.00 0.00 57.45 56.96 2b5m n PHE 458 Cb 0.52 -0.03 0.00 0.00 -0.94 0.00 0.00 39.48 39.03 2b5m n PHE 458 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 2b5m n PHE 459 N 0.28 0.00 -2.91 1.38 7.35 -1.22 -4.66 117.46 117.67 2b5m n PHE 459 Ca 0.08 0.00 -0.13 0.00 -0.76 0.00 0.00 57.45 56.64 2b5m n PHE 459 Cb 0.35 0.00 0.02 0.00 0.35 0.00 0.00 39.48 40.20 2b5m n PHE 459 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2b5m n GLY 461 N 0.95 5.49 3.50 0.00 0.00 -1.23 -4.18 105.19 109.72 2b5m n GLY 461 Ca 0.13 -2.02 -0.24 0.00 0.00 0.00 0.00 46.02 43.90 2b5m n GLY 461 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2b5m s ASN 462 N 0.25 3.35 0.00 1.61 -0.87 -1.26 -3.11 114.94 114.91 2b5m s ASN 462 Ca 0.00 -1.19 0.00 0.00 -1.57 0.00 0.00 52.86 50.10 2b5m s ASN 462 Cb 0.00 -0.28 0.00 0.00 -0.02 0.00 0.00 41.25 40.95 2b5m s ASN 462 CO 0.00 -0.25 0.00 1.33 -2.57 0.00 0.00 177.10 175.61 2b5m n VAL 463 N -0.71 0.00 -3.64 1.60 0.24 -1.11 -4.16 118.33 110.55 2b5m n VAL 463 Ca -0.05 0.00 -0.11 0.00 -2.04 0.00 0.00 64.34 62.13 2b5m n VAL 463 Cb 0.63 0.00 -0.05 0.00 -1.47 0.00 0.00 33.84 32.95 2b5m n VAL 463 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2b5m s ALA 464 N -1.67 -0.97 0.00 2.33 0.00 -1.26 -4.86 121.76 115.33 2b5m s ALA 464 Ca 0.00 0.10 0.00 0.00 0.00 0.00 0.00 51.96 52.06 2b5m s ALA 464 Cb 0.00 0.56 0.00 0.00 0.00 0.00 0.00 23.12 23.68 2b5m s ALA 464 CO 0.00 -0.57 0.00 0.72 0.00 0.00 0.00 175.76 175.91 2b5m n HIS 465 N 0.06 0.00 -2.86 0.00 8.25 -1.26 -3.96 115.22 115.45 2b5m n HIS 465 Ca -0.17 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.21 2b5m n HIS 465 Cb 0.62 -1.16 0.03 0.00 1.12 0.00 0.00 29.99 30.60 2b5m n HIS 465 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 2b5m n GLN 466 N -0.58 -2.67 -4.65 -0.41 6.02 -1.26 -4.73 117.38 109.11 2b5m n GLN 466 Ca 0.00 0.28 -0.24 0.00 -0.01 0.00 0.00 57.00 57.03 2b5m n GLN 466 Cb 0.47 -3.64 -0.16 0.00 1.02 0.00 0.00 30.24 27.93 2b5m n GLN 466 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2b5m s GLN 467 N -5.43 1.46 -0.27 -1.09 -0.21 -1.25 -0.27 119.66 112.59 2b5m s GLN 467 Ca 0.20 -0.48 0.03 0.00 0.02 0.00 0.00 55.36 55.12 2b5m s GLN 467 Cb -0.09 -1.29 0.07 0.00 1.00 0.00 0.00 33.01 32.70 2b5m s GLN 467 CO 0.24 0.18 -0.05 -0.51 -2.12 0.00 0.00 175.29 173.03 2b5m s LEU 468 N 0.15 3.49 0.27 2.90 1.02 -1.18 -2.74 118.68 122.58 2b5m s LEU 468 Ca -0.04 -1.52 -0.25 0.00 0.02 0.00 0.00 54.13 52.33 2b5m s LEU 468 Cb -0.11 -1.45 -0.09 0.00 0.02 0.00 0.00 46.19 44.56 2b5m s LEU 468 CO 0.02 -0.25 0.87 -0.51 0.02 0.00 0.00 176.35 176.50 2b5m s ILE 469 N 1.15 4.30 -0.35 -0.59 2.07 -1.18 -1.83 121.20 124.76 2b5m s ILE 469 Ca -0.03 1.71 0.00 0.00 -1.41 0.00 0.00 60.65 60.92 2b5m s ILE 469 Cb -0.19 -4.02 0.12 0.00 0.13 0.00 0.00 42.46 38.49 2b5m s ILE 469 CO -0.07 0.24 0.16 -1.58 -1.91 0.00 0.00 174.94 171.78 2b5m s GLN 470 N -1.85 0.83 -0.47 3.50 0.74 -1.25 -3.55 119.66 117.62 2b5m s GLN 470 Ca 0.46 -1.37 -0.28 0.00 0.05 0.00 0.00 55.36 54.22 2b5m s GLN 470 Cb -0.19 -1.95 0.00 0.00 1.10 0.00 0.00 33.01 31.97 2b5m s GLN 470 CO 0.24 -1.07 1.55 0.42 -0.55 0.00 0.00 175.29 175.88 2b5m s ILE 471 N 1.18 3.71 0.43 -2.34 1.01 -1.08 -2.35 121.20 121.76 2b5m s ILE 471 Ca 0.13 0.66 0.01 0.00 0.00 0.00 0.00 60.65 61.45 2b5m s ILE 471 Cb -0.20 -4.13 -0.01 0.00 0.01 0.00 0.00 42.46 38.13 2b5m s ILE 471 CO -0.14 -0.84 0.65 0.28 0.00 0.00 0.00 174.94 174.89 2b5m s THR 472 N 6.39 4.13 0.46 2.92 -1.32 -1.13 0.08 115.64 127.18 2b5m s THR 472 Ca 0.63 -0.50 0.14 0.00 -1.21 0.00 0.00 61.69 60.74 2b5m s THR 472 Cb -0.14 -3.52 0.30 0.00 -1.51 0.00 0.00 72.50 67.62 2b5m s THR 472 CO 0.29 -0.36 2.06 0.77 -2.21 0.00 0.00 174.62 175.17 2b5m h SER 473 N 0.45 0.25 1.73 8.08 4.64 -1.80 -2.98 113.55 123.93 2b5m h SER 473 Ca -0.46 -0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 60.85 2b5m h SER 473 Cb 1.25 -0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 63.28 2b5m h SER 473 CO 0.58 0.17 -0.27 0.00 -0.87 0.00 0.00 176.83 176.43 2b5m h ALA 474 N 1.80 0.86 0.00 5.18 0.00 -1.89 0.29 119.26 125.51 2b5m h ALA 474 Ca 0.15 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2b5m h ALA 474 Cb 0.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.04 2b5m h ALA 474 CO -0.03 0.01 0.00 -1.13 0.00 0.00 0.00 179.25 178.10 2b5m n SER 475 N -2.99 0.00 -4.61 0.00 3.41 -1.12 -4.64 113.62 103.67 2b5m n SER 475 Ca 0.03 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 58.21 2b5m n SER 475 Cb 0.54 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.46 2b5m n SER 475 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2b5m s VAL 476 N 0.00 3.29 0.68 -3.33 0.11 -1.02 -2.85 120.40 117.28 2b5m s VAL 476 Ca 0.00 0.31 0.04 0.00 -2.93 0.00 0.00 61.98 59.39 2b5m s VAL 476 Cb 0.00 -3.36 0.12 0.00 -1.53 0.00 0.00 36.38 31.61 2b5m s VAL 476 CO 0.00 -0.21 0.94 -0.13 -3.33 0.00 0.00 175.10 172.37 2b5m s ARG 477 N 5.69 1.84 -0.21 1.54 0.52 -0.99 -0.14 118.95 127.19 2b5m s ARG 477 Ca 0.87 -1.41 -0.07 0.00 -0.52 0.00 0.00 55.73 54.60 2b5m s ARG 477 Cb -0.28 -2.45 0.09 0.00 0.52 0.00 0.00 34.95 32.83 2b5m s ARG 477 CO 0.34 -1.29 0.45 -0.51 0.02 0.00 0.00 175.30 174.31 2b5m s LEU 478 N -4.98 -0.69 -0.11 2.53 1.43 -0.76 -3.88 118.68 112.21 2b5m s LEU 478 Ca 0.66 1.06 -0.04 0.00 -1.03 0.00 0.00 54.13 54.78 2b5m s LEU 478 Cb -0.05 1.47 -0.04 0.00 0.03 0.00 0.00 46.19 47.61 2b5m s LEU 478 CO 0.43 -0.23 0.04 -0.69 0.23 0.00 0.00 176.35 176.13 2b5m s VAL 479 N 2.61 4.65 0.17 -1.59 1.01 -0.76 -0.97 120.40 125.52 2b5m s VAL 479 Ca -0.02 -0.11 -0.29 0.00 0.00 0.00 0.00 61.98 61.56 2b5m s VAL 479 Cb -0.12 -3.00 -0.08 0.00 0.00 0.00 0.00 36.38 33.19 2b5m s VAL 479 CO -0.14 0.59 0.90 -0.94 0.00 0.00 0.00 175.10 175.51 2b5m s SER 480 N -0.70 7.52 -0.22 3.32 1.04 -1.20 -3.08 113.70 120.38 2b5m s SER 480 Ca 0.12 1.81 0.02 0.00 0.48 0.00 0.00 55.95 58.37 2b5m s SER 480 Cb -0.12 -2.57 -0.20 0.00 0.10 0.00 0.00 66.02 63.23 2b5m s SER 480 CO 0.02 0.09 -0.07 1.67 0.98 0.00 0.00 173.24 175.93 2b5m n GLN 481 N 2.02 0.67 0.02 4.02 -0.06 0.63 -2.27 117.38 122.41 2b5m n GLN 481 Ca -0.01 0.16 -0.02 0.00 -2.00 0.00 0.00 57.00 55.13 2b5m n GLN 481 Cb 0.48 -1.56 -0.01 0.00 -4.06 0.00 0.00 30.24 25.09 2b5m n GLN 481 CO 0.00 0.00 0.00 1.49 -0.20 0.00 0.00 177.06 178.35 2b5m h GLU 482 N 0.01 -0.11 -0.51 3.69 4.81 -1.95 -3.35 114.58 117.18 2b5m h GLU 482 Ca -0.54 0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 58.67 2b5m h GLU 482 Cb 1.96 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 31.34 2b5m h GLU 482 CO -0.04 -0.07 0.20 -1.35 -0.73 0.00 0.00 179.01 177.02 2b5m h PRO 483 N -0.66 0.73 -3.01 0.92 0.11 -1.97 -3.48 132.00 124.65 2b5m h PRO 483 Ca -0.01 -0.11 0.00 0.00 0.11 0.00 0.00 66.00 65.99 2b5m h PRO 483 Cb 0.08 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.06 2b5m h PRO 483 CO 0.02 0.61 -0.00 1.17 -0.21 0.00 0.00 178.00 179.59 2b5m n LYS 484 N -4.34 -0.01 0.00 1.05 3.00 -0.96 -5.08 118.16 111.82 2b5m n LYS 484 Ca 0.04 0.51 0.00 0.00 -0.00 0.00 0.00 58.31 58.86 2b5m n LYS 484 Cb 0.16 -1.52 0.00 0.00 0.00 0.00 0.00 35.03 33.67 2b5m n LYS 484 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2b5m n ALA 485 N -0.59 0.00 -3.75 3.14 0.00 -1.00 -4.68 120.51 113.63 2b5m n ALA 485 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.11 2b5m n ALA 485 Cb 0.09 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.38 2b5m n ALA 485 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2b5m s LEU 486 N 0.00 2.34 -0.04 0.00 2.96 -1.26 -3.22 118.68 119.45 2b5m s LEU 486 Ca 0.00 -0.55 -0.01 0.00 -0.22 0.00 0.00 54.13 53.35 2b5m s LEU 486 Cb 0.00 -1.54 -0.26 0.00 0.50 0.00 0.00 46.19 44.89 2b5m s LEU 486 CO 0.00 0.04 0.68 -0.37 -1.32 0.00 0.00 176.35 175.37 2b5m h VAL 487 N 5.80 0.94 -2.53 1.68 -1.51 -1.37 -3.45 116.25 115.80 2b5m h VAL 487 Ca -0.39 -2.64 0.17 0.00 -1.23 0.00 0.00 66.70 62.61 2b5m h VAL 487 Cb 1.17 2.62 -0.03 0.00 -2.13 0.00 0.00 31.29 32.91 2b5m h VAL 487 CO 0.60 0.77 0.62 -0.55 -1.23 0.00 0.00 177.57 177.78 2b5m s SER 488 N -6.82 0.02 -0.29 4.19 0.15 -1.20 -4.57 113.70 105.17 2b5m s SER 488 Ca -0.12 -0.66 -0.13 0.00 0.70 0.00 0.00 55.95 55.75 2b5m s SER 488 Cb 0.07 0.48 0.12 0.00 -1.71 0.00 0.00 66.02 64.98 2b5m s SER 488 CO 0.82 -0.95 0.73 -0.70 1.20 0.00 0.00 173.24 174.34 2b5m s GLU 489 N -2.09 0.55 0.10 5.44 2.12 -1.26 -1.84 118.70 121.73 2b5m s GLU 489 Ca 0.23 1.24 0.01 0.00 0.36 0.00 0.00 54.97 56.82 2b5m s GLU 489 Cb -0.03 0.59 -0.04 0.00 0.26 0.00 0.00 34.13 34.92 2b5m s GLU 489 CO 0.05 -0.17 0.24 -0.46 -0.54 0.00 0.00 175.26 174.38 2b5m s TRP 490 N 2.44 3.48 -0.16 5.30 -0.00 0.80 -4.98 118.94 125.82 2b5m s TRP 490 Ca -0.07 0.18 -0.07 0.00 -0.00 0.00 0.00 56.10 56.14 2b5m s TRP 490 Cb -0.09 -1.71 0.06 0.00 -0.00 0.00 0.00 33.47 31.74 2b5m s TRP 490 CO -0.19 0.55 0.35 0.21 -0.00 0.00 0.00 176.95 177.88 2b5m s LYS 491 N -2.84 0.30 -0.35 5.86 2.20 -1.26 -2.43 119.74 121.22 2b5m s LYS 491 Ca 0.34 0.79 -0.41 0.00 -0.36 0.00 0.00 55.97 56.33 2b5m s LYS 491 Cb -0.12 0.04 -0.16 0.00 -1.51 0.00 0.00 37.83 36.07 2b5m s LYS 491 CO 0.28 -0.20 1.79 -1.91 -0.36 0.00 0.00 175.35 174.94 2b5m n GLU 492 N 4.71 0.84 -0.12 4.03 0.00 -1.26 -4.69 120.64 124.15 2b5m n GLU 492 Ca -0.17 0.30 0.00 0.00 0.00 0.00 0.00 57.16 57.29 2b5m n GLU 492 Cb 0.52 -1.98 0.00 0.00 0.00 0.00 0.00 31.44 29.99 2b5m n GLU 492 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.13 174.83 2b5m n PRO 493 N 5.52 0.00 0.00 5.31 -0.02 -1.26 0.83 135.00 145.38 2b5m n PRO 493 Ca 0.31 -0.19 0.00 0.00 -2.02 0.00 0.00 63.50 61.60 2b5m n PRO 493 Cb 0.09 -1.43 0.00 0.00 -0.02 0.00 0.00 33.50 32.14 2b5m n PRO 493 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2b5m n GLN 494 N 3.43 0.00 0.00 -0.52 1.13 -1.26 -5.02 117.38 115.14 2b5m n GLN 494 Ca 0.00 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 2b5m n GLN 494 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.35 2b5m n GLN 494 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2b5m n ALA 495 N 0.00 0.00 -2.70 -1.58 0.00 0.24 -5.10 120.51 111.38 2b5m n ALA 495 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.08 2b5m n ALA 495 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.37 2b5m n ALA 495 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2b5m s LYS 496 N -0.18 4.18 0.02 0.00 1.02 -1.26 -5.00 119.74 118.53 2b5m s LYS 496 Ca 0.00 -0.04 -0.38 0.00 0.02 0.00 0.00 55.97 55.57 2b5m s LYS 496 Cb 0.00 -3.47 -0.19 0.00 -0.52 0.00 0.00 37.83 33.64 2b5m s LYS 496 CO 0.00 0.15 1.00 0.09 -0.92 0.00 0.00 175.35 175.67 2b5m n ASN 497 N 3.91 -0.11 -4.61 2.83 4.13 -1.26 -4.63 115.26 115.53 2b5m n ASN 497 Ca -0.13 1.12 -0.43 0.00 1.68 0.00 0.00 54.58 56.83 2b5m n ASN 497 Cb 0.52 -0.90 -0.02 0.00 -1.54 0.00 0.00 39.78 37.84 2b5m n ASN 497 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2b5m s ILE 498 N -0.08 4.02 0.01 2.41 1.01 0.10 -4.76 121.20 123.91 2b5m s ILE 498 Ca 0.86 1.07 -0.20 0.00 0.00 0.00 0.00 60.65 62.39 2b5m s ILE 498 Cb -1.21 -4.28 -0.21 0.00 0.01 0.00 0.00 42.46 36.77 2b5m s ILE 498 CO 0.55 -0.74 1.14 0.77 0.00 0.00 0.00 174.94 176.66 2b5m h SER 499 N 10.06 0.50 -3.33 3.58 4.64 -1.80 -3.41 113.55 123.79 2b5m h SER 499 Ca -0.26 -0.71 -0.42 0.00 -0.47 0.00 0.00 61.79 59.92 2b5m h SER 499 Cb 1.09 -0.15 -0.36 0.00 -0.31 0.00 0.00 62.40 62.67 2b5m h SER 499 CO 1.08 1.14 -0.77 -0.69 -0.87 0.00 0.00 176.83 176.73 2b5m s VAL 500 N -3.39 0.43 0.00 0.95 1.01 -0.99 -5.05 120.40 113.36 2b5m s VAL 500 Ca -0.13 0.03 0.00 0.00 0.00 0.00 0.00 61.98 61.88 2b5m s VAL 500 Cb 0.04 -0.54 0.00 0.00 0.00 0.00 0.00 36.38 35.88 2b5m s VAL 500 CO 0.81 0.24 0.00 0.00 0.00 0.00 0.00 175.10 176.15 2b5m n ALA 501 N 4.72 0.00 0.00 5.51 0.00 -1.26 -1.05 120.51 128.42 2b5m n ALA 501 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.30 2b5m n ALA 501 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.95 2b5m n ALA 501 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2b5m n SER 502 N -2.87 0.00 -3.61 0.00 2.88 -1.23 -4.42 113.62 104.36 2b5m n SER 502 Ca 0.00 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.42 2b5m n SER 502 Cb 0.00 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.34 2b5m n SER 502 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2b5m h ASN 504 N 8.25 0.00 0.00 0.00 7.08 -1.47 -3.48 115.58 125.95 2b5m h ASN 504 Ca -0.15 -0.05 0.00 0.00 -3.08 0.00 0.00 56.30 53.02 2b5m h ASN 504 Cb 1.12 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.36 2b5m h ASN 504 CO 0.16 0.63 0.00 -0.24 -2.08 0.00 0.00 177.43 175.90 2b5m n SER 505 N -4.71 0.00 -0.31 6.14 2.88 -1.26 -4.83 113.62 111.53 2b5m n SER 505 Ca -0.04 0.00 0.03 0.00 -1.33 0.00 0.00 58.87 57.54 2b5m n SER 505 Cb 0.13 0.00 0.05 0.00 -0.75 0.00 0.00 64.21 63.64 2b5m n SER 505 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2b5m n SER 506 N 0.00 1.92 -3.56 -3.46 7.64 -1.26 -4.01 113.62 110.89 2b5m n SER 506 Ca 0.00 -1.54 -0.06 0.00 1.01 0.00 0.00 58.87 58.28 2b5m n SER 506 Cb 0.00 -0.05 -0.02 0.00 -1.01 0.00 0.00 64.21 63.13 2b5m n SER 506 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2b5m s GLN 507 N -0.72 0.72 0.23 1.43 -2.07 -1.26 -4.27 119.66 113.72 2b5m s GLN 507 Ca 0.10 -0.30 0.05 0.00 -1.82 0.00 0.00 55.36 53.40 2b5m s GLN 507 Cb 0.06 0.31 -0.05 0.00 -1.09 0.00 0.00 33.01 32.24 2b5m s GLN 507 CO 0.09 -0.32 -0.05 0.08 -1.32 0.00 0.00 175.29 173.77 2b5m s VAL 508 N -2.93 1.31 -0.38 3.63 1.01 -0.84 -1.77 120.40 120.43 2b5m s VAL 508 Ca 0.07 -2.08 0.06 0.00 0.00 0.00 0.00 61.98 60.03 2b5m s VAL 508 Cb -0.01 -2.27 0.18 0.00 0.00 0.00 0.00 36.38 34.27 2b5m s VAL 508 CO -0.06 -0.41 0.55 -0.69 0.00 0.00 0.00 175.10 174.49 2b5m s VAL 509 N -3.24 -0.82 0.76 2.92 1.01 -0.56 -3.72 120.40 116.76 2b5m s VAL 509 Ca 0.26 -0.25 -0.09 0.00 0.00 0.00 0.00 61.98 61.90 2b5m s VAL 509 Cb 0.04 -0.35 0.09 0.00 0.00 0.00 0.00 36.38 36.16 2b5m s VAL 509 CO 0.08 -0.16 1.09 0.68 0.00 0.00 0.00 175.10 176.79 2b5m s VAL 510 N 1.92 2.17 -0.13 2.92 -7.23 -0.44 -3.58 120.40 116.02 2b5m s VAL 510 Ca 0.15 -0.19 -0.09 0.00 -1.81 0.00 0.00 61.98 60.03 2b5m s VAL 510 Cb -0.08 -2.97 0.04 0.00 0.56 0.00 0.00 36.38 33.93 2b5m s VAL 510 CO -0.10 0.00 0.34 0.00 -0.31 0.00 0.00 175.10 175.02 2b5m s ALA 511 N -3.40 -0.83 -0.55 1.32 0.00 -0.22 -3.15 121.76 114.94 2b5m s ALA 511 Ca 0.62 1.12 0.06 0.00 0.00 0.00 0.00 51.96 53.77 2b5m s ALA 511 Cb -0.10 -0.68 0.32 0.00 0.00 0.00 0.00 23.12 22.67 2b5m s ALA 511 CO 0.47 -0.20 0.86 0.28 0.00 0.00 0.00 175.76 177.17 2b5m n VAL 512 N 3.60 2.28 0.00 0.00 0.31 -0.70 -2.35 118.33 121.47 2b5m n VAL 512 Ca -0.19 -5.30 0.00 0.00 -0.01 0.00 0.00 64.34 58.85 2b5m n VAL 512 Cb 0.56 -1.38 0.00 0.00 -0.91 0.00 0.00 33.84 32.11 2b5m n VAL 512 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2b5m n GLY 513 N 0.11 1.23 0.06 2.92 0.00 -1.26 -4.09 105.19 104.16 2b5m n GLY 513 Ca 0.29 -0.88 0.02 0.00 0.00 0.00 0.00 46.02 45.45 2b5m n GLY 513 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2b5m n ARG 514 N 0.00 3.67 -3.53 1.61 1.74 -1.26 -0.97 116.66 117.91 2b5m n ARG 514 Ca 0.00 -0.26 -0.20 0.00 -0.77 0.00 0.00 57.85 56.63 2b5m n ARG 514 Cb 0.00 -0.82 -0.01 0.00 -1.02 0.00 0.00 32.46 30.62 2b5m n ARG 514 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2b5m s ALA 515 N -1.03 4.14 -0.03 7.54 0.00 -1.26 0.55 121.76 131.68 2b5m s ALA 515 Ca 0.03 -1.38 -0.01 0.00 0.00 0.00 0.00 51.96 50.60 2b5m s ALA 515 Cb 0.03 -1.72 0.03 0.00 0.00 0.00 0.00 23.12 21.45 2b5m s ALA 515 CO 0.12 -0.00 0.06 -0.51 0.00 0.00 0.00 175.76 175.43 2b5m s LEU 516 N -4.16 1.12 0.02 0.00 1.43 -0.40 -1.72 118.68 114.96 2b5m s LEU 516 Ca 0.43 0.11 0.09 0.00 -1.03 0.00 0.00 54.13 53.72 2b5m s LEU 516 Cb -0.09 0.07 -0.03 0.00 0.03 0.00 0.00 46.19 46.17 2b5m s LEU 516 CO 0.31 -0.11 -0.26 -0.31 0.23 0.00 0.00 176.35 176.21 2b5m s TYR 517 N 0.93 2.33 -0.17 0.29 1.51 -1.19 -2.89 117.35 118.17 2b5m s TYR 517 Ca -0.08 -0.42 0.00 0.00 -1.01 0.00 0.00 57.07 55.57 2b5m s TYR 517 Cb -0.11 -1.44 0.00 0.00 -0.11 0.00 0.00 41.96 40.31 2b5m s TYR 517 CO -0.03 0.06 -0.16 -0.47 -1.11 0.00 0.00 175.55 173.84 2b5m s TYR 518 N -0.73 2.78 -0.01 2.71 6.04 -1.23 -1.33 117.35 125.58 2b5m s TYR 518 Ca 0.11 -1.23 0.04 0.00 0.04 0.00 0.00 57.07 56.03 2b5m s TYR 518 Cb -0.10 -1.91 -0.01 0.00 -1.04 0.00 0.00 41.96 38.90 2b5m s TYR 518 CO 0.01 -0.59 -0.13 -0.51 -1.54 0.00 0.00 175.55 172.80 2b5m s LEU 519 N 1.01 1.98 0.02 6.97 1.43 -1.24 -0.35 118.68 128.50 2b5m s LEU 519 Ca -0.02 -0.23 0.04 0.00 -1.03 0.00 0.00 54.13 52.89 2b5m s LEU 519 Cb -0.15 -0.67 -0.03 0.00 0.03 0.00 0.00 46.19 45.37 2b5m s LEU 519 CO -0.04 0.14 -0.09 -1.10 0.23 0.00 0.00 176.35 175.50 2b5m s GLN 520 N -0.20 2.42 -1.19 1.70 -0.21 -0.69 -1.99 119.66 119.50 2b5m s GLN 520 Ca 0.03 -0.80 -0.10 0.00 0.02 0.00 0.00 55.36 54.51 2b5m s GLN 520 Cb -0.06 -2.43 0.22 0.00 1.00 0.00 0.00 33.01 31.74 2b5m s GLN 520 CO -0.00 0.58 1.52 -0.89 -2.12 0.00 0.00 175.29 174.38 2b5m n ILE 521 N 1.44 4.56 -2.78 1.08 2.08 -1.26 0.95 119.36 125.42 2b5m n ILE 521 Ca -0.15 -4.99 -0.25 0.00 0.56 0.00 0.00 62.75 57.92 2b5m n ILE 521 Cb 0.52 -2.38 0.01 0.00 -0.75 0.00 0.00 39.64 37.05 2b5m n ILE 521 CO 0.00 0.00 0.00 -1.00 0.56 0.00 0.00 176.55 176.11 2b5m s HIS 522 N -0.20 3.31 -0.19 1.39 3.76 0.38 -4.82 115.29 118.91 2b5m s HIS 522 Ca 0.37 0.45 -0.02 0.00 -0.15 0.00 0.00 55.06 55.72 2b5m s HIS 522 Cb 0.01 -2.41 -0.06 0.00 1.11 0.00 0.00 32.58 31.23 2b5m s HIS 522 CO 0.01 -0.45 0.43 -2.30 -0.85 0.00 0.00 174.74 171.58 2b5m n PRO 523 N -2.24 0.00 -3.58 8.40 -0.02 -1.26 -0.16 135.00 136.14 2b5m n PRO 523 Ca 0.02 0.00 -0.21 0.00 -2.02 0.00 0.00 63.50 61.28 2b5m n PRO 523 Cb 0.57 -0.20 0.07 0.00 -0.02 0.00 0.00 33.50 33.92 2b5m n PRO 523 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2b5m n GLN 524 N 1.12 -6.65 -3.56 -0.52 6.02 -1.26 -4.99 117.38 107.54 2b5m n GLN 524 Ca 0.13 0.78 0.01 0.00 -0.01 0.00 0.00 57.00 57.91 2b5m n GLN 524 Cb 0.02 -5.72 -0.06 0.00 1.02 0.00 0.00 30.24 25.51 2b5m n GLN 524 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 2b5m s GLU 525 N -5.89 0.14 0.50 -1.09 2.12 0.77 -4.55 118.70 110.71 2b5m s GLU 525 Ca 0.25 0.27 -0.22 0.00 0.36 0.00 0.00 54.97 55.63 2b5m s GLU 525 Cb -0.11 0.07 -0.06 0.00 0.26 0.00 0.00 34.13 34.28 2b5m s GLU 525 CO 0.75 -0.03 1.22 -0.51 -0.54 0.00 0.00 175.26 176.15 2b5m s LEU 526 N 1.38 3.91 -0.42 2.70 1.43 -1.26 -0.47 118.68 125.95 2b5m s LEU 526 Ca -0.07 2.43 0.04 0.00 -1.03 0.00 0.00 54.13 55.51 2b5m s LEU 526 Cb -0.03 -4.31 0.17 0.00 0.03 0.00 0.00 46.19 42.05 2b5m s LEU 526 CO -0.13 -1.19 0.40 -0.60 0.23 0.00 0.00 176.35 175.06 2b5m s ARG 527 N -2.86 0.90 0.04 1.70 3.52 0.27 -4.85 118.95 117.67 2b5m s ARG 527 Ca 0.68 -1.85 -0.30 0.00 -0.13 0.00 0.00 55.73 54.14 2b5m s ARG 527 Cb -0.32 -1.16 -0.16 0.00 -1.56 0.00 0.00 34.95 31.76 2b5m s ARG 527 CO 0.38 -1.36 0.75 0.94 -0.81 0.00 0.00 175.30 175.19 2b5m n GLN 528 N 2.99 0.00 0.00 5.12 -0.06 -1.26 -1.70 117.38 122.47 2b5m n GLN 528 Ca 0.26 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.26 2b5m n GLN 528 Cb 0.48 -1.11 0.00 0.00 -4.06 0.00 0.00 30.24 25.56 2b5m n GLN 528 CO 0.00 0.00 0.00 -0.89 -0.20 0.00 0.00 177.06 175.97 2b5m n ILE 529 N 0.89 0.00 -3.72 1.69 2.08 0.53 -4.89 119.36 115.95 2b5m n ILE 529 Ca 0.16 -0.09 -0.01 0.00 0.56 0.00 0.00 62.75 63.36 2b5m n ILE 529 Cb 0.10 1.08 -0.01 0.00 -0.75 0.00 0.00 39.64 40.06 2b5m n ILE 529 CO 0.00 0.00 0.00 -0.44 0.56 0.00 0.00 176.55 176.67 2b5m s SER 530 N -0.16 -0.12 -0.30 4.38 0.01 -1.24 -4.92 113.70 111.35 2b5m s SER 530 Ca 0.00 -0.32 -0.13 0.00 1.31 0.00 0.00 55.95 56.82 2b5m s SER 530 Cb 0.00 0.36 0.14 0.00 0.21 0.00 0.00 66.02 66.73 2b5m s SER 530 CO 0.00 -0.68 0.79 -2.28 0.41 0.00 0.00 173.24 171.48 2b5m s HIS 531 N -2.90 -1.05 0.09 2.43 2.46 -1.23 -3.52 115.29 111.56 2b5m s HIS 531 Ca 0.14 1.85 -0.08 0.00 0.47 0.00 0.00 55.06 57.43 2b5m s HIS 531 Cb 0.01 0.63 -0.00 0.00 -0.13 0.00 0.00 32.58 33.08 2b5m s HIS 531 CO 0.00 -0.52 0.18 0.99 -2.47 0.00 0.00 174.74 172.92 2b5m s THR 532 N 2.56 0.15 0.06 0.89 2.01 -1.14 -4.97 115.64 115.20 2b5m s THR 532 Ca -0.05 -1.20 0.09 0.00 0.31 0.00 0.00 61.69 60.83 2b5m s THR 532 Cb -0.09 -1.34 -0.03 0.00 0.01 0.00 0.00 72.50 71.05 2b5m s THR 532 CO -0.18 -0.66 -0.24 -1.61 -0.69 0.00 0.00 174.62 171.23 2b5m s GLU 533 N -3.83 1.52 0.03 4.92 2.02 -1.26 -1.27 118.70 120.82 2b5m s GLU 533 Ca 0.05 -1.10 0.02 0.00 0.02 0.00 0.00 54.97 53.96 2b5m s GLU 533 Cb 0.05 -1.74 -0.04 0.00 0.10 0.00 0.00 34.13 32.51 2b5m s GLU 533 CO -0.11 0.44 0.04 -1.64 0.02 0.00 0.00 175.26 174.01 2b5m s MET 534 N -1.43 2.86 0.58 1.61 -1.94 0.19 -4.97 119.30 116.21 2b5m s MET 534 Ca 0.10 -0.62 0.34 0.00 -1.71 0.00 0.00 55.69 53.80 2b5m s MET 534 Cb -0.10 -2.72 1.38 0.00 2.01 0.00 0.00 34.83 35.40 2b5m s MET 534 CO 0.03 0.61 1.64 0.93 -0.01 0.00 0.00 175.02 178.22 2b5m h GLU 535 N 3.93 0.00 0.00 2.03 5.08 -2.01 -3.43 114.58 120.18 2b5m h GLU 535 Ca -0.48 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 57.66 2b5m h GLU 535 Cb 1.17 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.37 2b5m h GLU 535 CO 0.61 0.00 -0.15 0.72 -1.00 0.00 0.00 179.01 179.19 2b5m n HIS 536 N -3.74 -0.94 -2.84 4.33 8.25 -1.26 -5.06 115.22 113.97 2b5m n HIS 536 Ca 0.23 -1.61 -0.34 0.00 -0.26 0.00 0.00 57.72 55.75 2b5m n HIS 536 Cb 1.31 0.31 -0.07 0.00 1.12 0.00 0.00 29.99 32.66 2b5m n HIS 536 CO 0.00 0.00 0.00 -2.00 0.64 0.00 0.00 176.34 174.98 2b5m s GLU 537 N -2.62 4.30 -0.16 -0.41 2.12 -1.26 -4.53 118.70 116.14 2b5m s GLU 537 Ca 0.21 1.14 -0.20 0.00 0.36 0.00 0.00 54.97 56.47 2b5m s GLU 537 Cb -0.00 -2.36 -0.03 0.00 0.26 0.00 0.00 34.13 32.00 2b5m s GLU 537 CO 0.15 0.06 0.58 0.08 -0.54 0.00 0.00 175.26 175.59 2b5m s VAL 538 N -2.02 5.09 -0.13 3.70 1.01 -0.15 -1.76 120.40 126.15 2b5m s VAL 538 Ca 0.58 1.11 -0.03 0.00 0.00 0.00 0.00 61.98 63.65 2b5m s VAL 538 Cb -0.12 -3.90 -0.25 0.00 0.00 0.00 0.00 36.38 32.12 2b5m s VAL 538 CO 0.16 0.20 0.32 0.00 0.00 0.00 0.00 175.10 175.78 2b5m n ALA 539 N 4.44 1.05 -3.59 5.51 0.00 -0.27 -4.87 120.51 122.78 2b5m n ALA 539 Ca -0.04 -0.69 -0.11 0.00 0.00 0.00 0.00 53.44 52.60 2b5m n ALA 539 Cb 0.51 -0.62 -0.06 0.00 0.00 0.00 0.00 19.45 19.28 2b5m n ALA 539 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2b5m s LEU 541 N -0.67 2.15 -0.03 0.00 1.43 -1.26 -2.84 118.68 117.45 2b5m s LEU 541 Ca -0.02 -0.44 0.04 0.00 -1.03 0.00 0.00 54.13 52.68 2b5m s LEU 541 Cb -0.02 -0.69 -0.00 0.00 0.03 0.00 0.00 46.19 45.51 2b5m s LEU 541 CO 0.01 0.07 -0.14 -0.62 0.23 0.00 0.00 176.35 175.90 2b5m s ASP 542 N -1.04 1.75 -0.05 2.29 3.68 -1.23 -4.67 116.67 117.40 2b5m s ASP 542 Ca 0.03 -0.28 -0.01 0.00 2.13 0.00 0.00 52.55 54.42 2b5m s ASP 542 Cb -0.08 -0.41 0.03 0.00 -1.45 0.00 0.00 42.92 41.01 2b5m s ASP 542 CO 0.01 0.13 0.03 0.27 0.13 0.00 0.00 175.17 175.74 2b5m s ILE 543 N -0.01 0.10 -0.28 4.11 -4.36 -1.26 -3.39 121.20 116.12 2b5m s ILE 543 Ca -0.01 0.26 -0.18 0.00 -0.26 0.00 0.00 60.65 60.45 2b5m s ILE 543 Cb -0.09 -0.29 0.10 0.00 1.25 0.00 0.00 42.46 43.43 2b5m s ILE 543 CO 0.01 0.20 0.81 -0.89 0.24 0.00 0.00 174.94 175.30 2b5m s THR 544 N 1.84 0.00 -0.59 8.37 2.01 -1.26 -3.98 115.64 122.02 2b5m s THR 544 Ca 0.02 0.00 -0.27 0.00 0.31 0.00 0.00 61.69 61.74 2b5m s THR 544 Cb -0.12 -1.00 -0.10 0.00 0.01 0.00 0.00 72.50 71.28 2b5m s THR 544 CO -0.03 0.00 2.47 -0.81 -0.69 0.00 0.00 174.62 175.56 2b5m n PRO 545 N 3.68 0.83 -0.06 4.92 -0.04 -1.26 -4.83 135.00 138.23 2b5m n PRO 545 Ca -0.18 0.00 0.06 0.00 -0.04 0.00 0.00 63.50 63.34 2b5m n PRO 545 Cb 0.58 -3.03 0.25 0.00 -0.04 0.00 0.00 33.50 31.25 2b5m n PRO 545 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2b5m n LEU 546 N 14.73 0.82 0.00 1.53 4.77 -1.26 -4.92 117.00 132.67 2b5m n LEU 546 Ca 0.43 -0.38 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 2b5m n LEU 546 Cb 0.44 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.44 2b5m n LEU 546 CO 0.76 0.19 0.00 0.61 -1.33 0.00 0.00 177.39 177.62 2b5m n GLY 547 N 0.84 -1.13 1.88 -0.72 0.00 -1.26 -4.69 105.19 100.11 2b5m n GLY 547 Ca 0.10 0.72 -0.08 0.00 0.00 0.00 0.00 46.02 46.75 2b5m n GLY 547 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2b5m n ASP 548 N 0.00 5.11 -3.67 1.61 3.85 -1.26 -4.79 116.55 117.40 2b5m n ASP 548 Ca 0.00 -2.43 -0.11 0.00 -0.71 0.00 0.00 54.79 51.55 2b5m n ASP 548 Cb 0.00 -1.30 -0.09 0.00 -1.35 0.00 0.00 41.12 38.38 2b5m n ASP 548 CO 0.00 0.00 0.00 -0.94 -1.01 0.00 0.00 177.20 175.25 2b5m s SER 549 N 2.02 -0.67 -1.03 -1.12 1.04 -1.26 -5.09 113.70 107.59 2b5m s SER 549 Ca 0.47 1.17 -0.01 0.00 0.48 0.00 0.00 55.95 58.05 2b5m s SER 549 Cb 0.22 1.10 0.32 0.00 0.10 0.00 0.00 66.02 67.77 2b5m s SER 549 CO 0.00 -0.21 1.78 0.59 0.98 0.00 0.00 173.24 176.39 2b5m n ASN 550 N 3.64 7.24 0.00 7.02 3.02 -1.26 -4.75 115.26 130.17 2b5m n ASN 550 Ca -0.18 -3.66 0.00 0.00 -0.03 0.00 0.00 54.58 50.71 2b5m n ASN 550 Cb 0.57 -1.18 0.00 0.00 -0.61 0.00 0.00 39.78 38.56 2b5m n ASN 550 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2b5m n GLY 551 N 0.10 2.99 3.59 7.41 0.00 -1.26 -4.94 105.19 113.08 2b5m n GLY 551 Ca 0.44 -0.74 -0.42 0.00 0.00 0.00 0.00 46.02 45.30 2b5m n GLY 551 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2b5m s LEU 552 N 0.00 3.51 -0.29 0.99 1.43 -1.26 -4.12 118.68 118.94 2b5m s LEU 552 Ca 0.00 0.88 -0.13 0.00 -1.03 0.00 0.00 54.13 53.85 2b5m s LEU 552 Cb 0.00 -3.40 -0.04 0.00 0.03 0.00 0.00 46.19 42.78 2b5m s LEU 552 CO 0.00 -1.63 0.29 -0.55 0.23 0.00 0.00 176.35 174.69 2b5m s SER 553 N 5.01 6.13 0.04 2.29 0.15 -1.26 -4.82 113.70 121.24 2b5m s SER 553 Ca 0.67 0.02 -0.12 0.00 0.70 0.00 0.00 55.95 57.21 2b5m s SER 553 Cb -0.16 -2.17 -0.05 0.00 -1.71 0.00 0.00 66.02 61.93 2b5m s SER 553 CO 0.31 -0.16 1.19 -0.65 1.20 0.00 0.00 173.24 175.14 2b5m h PRO 554 N 8.33 -0.25 0.00 5.44 0.11 -1.94 -3.43 132.00 140.26 2b5m h PRO 554 Ca -0.33 0.02 -0.13 0.00 0.11 0.00 0.00 66.00 65.67 2b5m h PRO 554 Cb 1.17 0.06 0.01 0.00 0.11 0.00 0.00 31.00 32.35 2b5m h PRO 554 CO 0.61 -0.17 -0.01 1.28 -0.21 0.00 0.00 178.00 179.50 2b5m n LEU 555 N -3.51 0.00 -3.55 2.35 4.77 -1.26 -2.26 117.00 113.53 2b5m n LEU 555 Ca -0.03 -0.66 0.00 0.00 -0.03 0.00 0.00 56.01 55.29 2b5m n LEU 555 Cb 0.14 -0.12 -0.04 0.00 -2.33 0.00 0.00 43.42 41.07 2b5m n LEU 555 CO 0.05 -0.57 0.40 0.00 -1.33 0.00 0.00 177.39 175.95 2b5m s ALA 557 N 2.72 3.87 -0.23 0.00 0.00 -1.22 -0.77 121.76 126.13 2b5m s ALA 557 Ca -0.05 -0.96 -0.19 0.00 0.00 0.00 0.00 51.96 50.76 2b5m s ALA 557 Cb -0.10 -1.69 0.06 0.00 0.00 0.00 0.00 23.12 21.40 2b5m s ALA 557 CO -0.18 0.70 0.60 -1.50 0.00 0.00 0.00 175.76 175.38 2b5m s ILE 558 N -1.57 -0.00 -0.11 0.00 2.07 0.21 -3.51 121.20 118.28 2b5m s ILE 558 Ca 0.33 0.01 -0.01 0.00 -1.41 0.00 0.00 60.65 59.57 2b5m s ILE 558 Cb -0.12 -0.84 -0.03 0.00 0.13 0.00 0.00 42.46 41.60 2b5m s ILE 558 CO 0.26 0.00 -0.06 -0.83 -1.91 0.00 0.00 174.94 172.41 2b5m s GLY 559 N 0.70 1.69 0.03 1.50 0.00 -1.13 -0.54 107.32 109.56 2b5m s GLY 559 Ca -0.03 -0.86 0.00 0.00 0.00 0.00 0.00 44.72 43.83 2b5m s GLY 559 CO -0.05 -0.34 0.02 1.04 0.00 0.00 0.00 173.10 173.77 2b5m n LEU 560 N 2.96 0.00 -0.02 0.66 4.77 -0.57 -1.11 117.00 123.69 2b5m n LEU 560 Ca -0.18 -0.15 -0.02 0.00 -0.03 0.00 0.00 56.01 55.63 2b5m n LEU 560 Cb 0.53 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.58 2b5m n LEU 560 CO 0.30 -0.24 -0.65 0.79 -1.33 0.00 0.00 177.39 176.26 2b5m n TRP 561 N -0.51 0.00 -0.07 -1.77 7.02 -0.72 -4.25 117.44 117.14 2b5m n TRP 561 Ca -0.00 0.00 -0.11 0.00 -1.02 0.00 0.00 57.50 56.36 2b5m n TRP 561 Cb 0.03 -0.23 -0.07 0.00 -2.42 0.00 0.00 31.31 28.62 2b5m n TRP 561 CO 0.00 0.00 0.00 2.41 -2.02 0.00 0.00 177.69 178.08 2b5m n THR 562 N -2.10 0.85 1.48 -0.99 -1.04 -1.26 -4.54 114.28 106.68 2b5m n THR 562 Ca -0.07 -0.31 0.14 0.00 -2.04 0.00 0.00 64.05 61.77 2b5m n THR 562 Cb 0.57 -1.13 0.52 0.00 -1.82 0.00 0.00 70.33 68.46 2b5m n THR 562 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 2b5m n ASP 563 N -3.06 1.49 -3.00 8.00 5.75 -1.26 -4.89 116.55 119.58 2b5m n ASP 563 Ca -0.27 -1.48 -0.13 0.00 -0.01 0.00 0.00 54.79 52.91 2b5m n ASP 563 Cb 0.77 0.01 0.06 0.00 -1.03 0.00 0.00 41.12 40.92 2b5m n ASP 563 CO 0.00 0.00 0.00 -0.38 -0.11 0.00 0.00 177.20 176.71 2b5m n ILE 564 N 0.15 -7.98 -4.31 2.12 -0.00 -1.26 -4.37 119.36 103.71 2b5m n ILE 564 Ca 0.19 -1.15 -0.32 0.00 -0.00 0.00 0.00 62.75 61.47 2b5m n ILE 564 Cb 0.36 -6.01 -0.09 0.00 -0.00 0.00 0.00 39.64 33.89 2b5m n ILE 564 CO 0.00 0.00 0.00 -0.94 -0.00 0.00 0.00 176.55 175.61 2b5m s SER 565 N -3.34 4.97 0.03 4.38 1.04 -1.26 -2.37 113.70 117.14 2b5m s SER 565 Ca 0.39 -0.07 0.08 0.00 0.48 0.00 0.00 55.95 56.83 2b5m s SER 565 Cb -0.05 -1.24 -0.03 0.00 0.10 0.00 0.00 66.02 64.80 2b5m s SER 565 CO 0.63 0.27 -0.24 0.00 0.98 0.00 0.00 173.24 174.88 2b5m s ALA 566 N -1.09 2.05 -0.09 5.32 0.00 0.61 -1.51 121.76 127.04 2b5m s ALA 566 Ca 0.20 -1.16 -0.13 0.00 0.00 0.00 0.00 51.96 50.87 2b5m s ALA 566 Cb -0.11 -0.44 0.03 0.00 0.00 0.00 0.00 23.12 22.60 2b5m s ALA 566 CO 0.11 0.48 0.33 1.03 0.00 0.00 0.00 175.76 177.70 2b5m s ARG 567 N -1.10 0.47 -0.01 0.00 0.52 0.30 0.15 118.95 119.27 2b5m s ARG 567 Ca 0.10 0.26 0.07 0.00 -0.52 0.00 0.00 55.73 55.64 2b5m s ARG 567 Cb -0.09 0.22 -0.02 0.00 0.52 0.00 0.00 34.95 35.58 2b5m s ARG 567 CO 0.01 -0.09 -0.21 0.42 0.02 0.00 0.00 175.30 175.45 2b5m s ILE 568 N -0.28 1.67 -0.02 1.52 -1.09 -0.45 0.66 121.20 123.22 2b5m s ILE 568 Ca -0.04 -0.92 -0.27 0.00 -2.23 0.00 0.00 60.65 57.19 2b5m s ILE 568 Cb -0.03 -1.39 0.06 0.00 -1.58 0.00 0.00 42.46 39.52 2b5m s ILE 568 CO 0.02 0.46 0.60 -0.76 -1.23 0.00 0.00 174.94 174.03 2b5m s LEU 569 N -0.53 -0.36 -0.45 2.97 1.43 0.05 -2.55 118.68 119.25 2b5m s LEU 569 Ca 0.08 0.52 -0.28 0.00 -1.03 0.00 0.00 54.13 53.42 2b5m s LEU 569 Cb -0.08 2.31 0.00 0.00 0.03 0.00 0.00 46.19 48.45 2b5m s LEU 569 CO -0.01 -0.62 1.50 -0.54 0.23 0.00 0.00 176.35 176.91 2b5m s LYS 570 N -1.51 3.41 0.12 1.70 1.02 -1.15 0.16 119.74 123.50 2b5m s LYS 570 Ca -0.10 0.88 -0.25 0.00 0.02 0.00 0.00 55.97 56.52 2b5m s LYS 570 Cb -0.01 -4.10 -0.06 0.00 -0.52 0.00 0.00 37.83 33.14 2b5m s LYS 570 CO 0.06 -1.77 1.65 1.25 -0.92 0.00 0.00 175.35 175.62 2b5m h LEU 571 N 12.91 -0.60 -1.44 3.17 6.46 -1.67 0.29 115.31 134.44 2b5m h LEU 571 Ca -0.28 0.08 0.46 0.00 -0.12 0.00 0.00 57.88 58.02 2b5m h LEU 571 Cb 1.12 0.24 -0.10 0.00 -0.73 0.00 0.00 40.66 41.19 2b5m h LEU 571 CO 1.11 -0.28 0.98 -2.65 -0.62 0.00 0.00 178.44 176.98 2b5m n PRO 572 N -5.33 -0.02 0.00 5.25 -0.02 -1.26 -3.11 135.00 130.51 2b5m n PRO 572 Ca -0.05 1.05 0.00 0.00 -2.02 0.00 0.00 63.50 62.48 2b5m n PRO 572 Cb 0.25 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.53 2b5m n PRO 572 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2b5m n SER 573 N -4.16 4.64 0.00 2.55 3.41 -1.06 -4.74 113.62 114.27 2b5m n SER 573 Ca 0.37 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.98 2b5m n SER 573 Cb 1.55 0.47 0.00 0.00 -0.26 0.00 0.00 64.21 65.97 2b5m n SER 573 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 2b5m n PHE 574 N -1.89 0.00 -1.61 7.33 0.99 0.10 -4.83 117.46 117.55 2b5m n PHE 574 Ca 0.00 0.00 -0.47 0.00 -0.00 0.00 0.00 57.45 56.98 2b5m n PHE 574 Cb 0.46 -1.33 -0.03 0.00 -1.00 0.00 0.00 39.48 37.58 2b5m n PHE 574 CO 0.00 0.00 0.00 -0.85 -0.00 0.00 0.00 176.76 175.91 2b5m n GLU 575 N -0.47 1.48 -1.84 -1.08 0.28 -1.25 -4.66 120.64 113.09 2b5m n GLU 575 Ca 0.00 0.52 -0.41 0.00 -0.16 0.00 0.00 57.16 57.12 2b5m n GLU 575 Cb 0.30 -2.05 -0.00 0.00 1.43 0.00 0.00 31.44 31.12 2b5m n GLU 575 CO 0.00 0.00 0.00 -1.17 -0.16 0.00 0.00 177.13 175.80 2b5m s LEU 576 N 0.42 4.29 -0.07 -1.84 1.98 -1.26 -2.91 118.68 119.29 2b5m s LEU 576 Ca 0.69 2.98 -0.10 0.00 -2.89 0.00 0.00 54.13 54.80 2b5m s LEU 576 Cb -0.76 -3.72 -0.04 0.00 0.66 0.00 0.00 46.19 42.33 2b5m s LEU 576 CO 0.53 -0.90 -0.20 0.18 -1.89 0.00 0.00 176.35 174.07 2b5m n LEU 577 N 0.36 1.57 0.00 -0.68 4.32 -1.09 -4.91 117.00 116.57 2b5m n LEU 577 Ca 0.02 0.25 0.00 0.00 -0.02 0.00 0.00 56.01 56.25 2b5m n LEU 577 Cb 0.40 -0.57 0.00 0.00 -1.62 0.00 0.00 43.42 41.63 2b5m n LEU 577 CO 0.62 -0.43 0.00 1.57 -1.22 0.00 0.00 177.39 177.94 2b5m n HIS 578 N -4.04 0.00 -3.93 -1.77 -0.00 -1.06 -5.06 115.22 99.37 2b5m n HIS 578 Ca -0.10 0.00 -0.09 0.00 0.46 0.00 0.00 57.72 58.00 2b5m n HIS 578 Cb 0.33 0.00 -0.08 0.00 -0.12 0.00 0.00 29.99 30.11 2b5m n HIS 578 CO 0.00 0.00 0.00 -1.59 0.46 0.00 0.00 176.34 175.21 2b5m s LYS 579 N -2.00 0.73 -0.23 1.57 -2.85 -1.26 -1.34 119.74 114.36 2b5m s LYS 579 Ca 0.00 -0.96 0.00 0.00 -1.00 0.00 0.00 55.97 54.02 2b5m s LYS 579 Cb 0.00 0.28 0.06 0.00 -2.06 0.00 0.00 37.83 36.12 2b5m s LYS 579 CO 0.00 -0.20 -0.04 -2.00 0.10 0.00 0.00 175.35 173.21 2b5m s GLU 580 N -3.53 1.52 0.41 1.78 2.56 0.38 -4.96 118.70 116.86 2b5m s GLU 580 Ca 0.03 -0.95 -0.24 0.00 0.00 0.00 0.00 54.97 53.81 2b5m s GLU 580 Cb 0.04 -2.55 -0.08 0.00 2.00 0.00 0.00 34.13 33.54 2b5m s GLU 580 CO -0.09 -0.61 1.12 -1.64 -0.56 0.00 0.00 175.26 173.48 2b5m s MET 581 N 1.43 4.07 0.00 4.30 -1.94 -1.26 -0.28 119.30 125.62 2b5m s MET 581 Ca -0.05 1.70 0.00 0.00 -1.71 0.00 0.00 55.69 55.62 2b5m s MET 581 Cb -0.19 -2.60 0.00 0.00 2.01 0.00 0.00 34.83 34.06 2b5m s MET 581 CO -0.06 -0.27 0.00 1.28 -0.01 0.00 0.00 175.02 175.96 2b5m n LEU 582 N -0.04 0.00 0.00 -0.03 4.77 -1.00 -4.94 117.00 115.77 2b5m n LEU 582 Ca 0.05 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.91 2b5m n LEU 582 Cb 0.48 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.57 2b5m n LEU 582 CO 0.48 0.00 0.02 0.61 -1.33 0.00 0.00 177.39 177.17 2b5m n GLY 583 N 5.00 2.96 7.00 -0.72 0.00 -1.26 -4.92 105.19 113.25 2b5m n GLY 583 Ca 0.00 -2.23 0.00 0.00 0.00 0.00 0.00 46.02 43.79 2b5m n GLY 583 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b5m n GLY 584 N 2.07 -0.14 0.00 -0.02 0.00 -1.26 -4.73 105.19 101.11 2b5m n GLY 584 Ca -0.01 -0.90 0.00 0.00 0.00 0.00 0.00 46.02 45.10 2b5m n GLY 584 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2b5m n GLU 585 N -1.14 3.43 -1.65 1.61 0.00 -1.26 -4.80 120.64 116.84 2b5m n GLU 585 Ca 0.00 -0.08 -0.46 0.00 0.00 0.00 0.00 57.16 56.62 2b5m n GLU 585 Cb 0.00 -0.46 -0.04 0.00 0.00 0.00 0.00 31.44 30.94 2b5m n GLU 585 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.13 176.24 2b5m n ILE 586 N -0.51 0.58 -1.55 3.84 2.08 -1.26 -4.97 119.36 117.56 2b5m n ILE 586 Ca 0.00 -0.17 -0.31 0.00 0.56 0.00 0.00 62.75 62.83 2b5m n ILE 586 Cb 0.02 -2.08 0.06 0.00 -0.75 0.00 0.00 39.64 36.89 2b5m n ILE 586 CO 0.00 0.00 0.00 0.27 0.56 0.00 0.00 176.55 177.38 2b5m s ILE 587 N 4.99 3.84 0.14 1.39 -0.00 -1.26 -4.80 121.20 125.50 2b5m s ILE 587 Ca 0.94 0.60 -0.31 0.00 -0.00 0.00 0.00 60.65 61.87 2b5m s ILE 587 Cb -0.59 -3.33 -0.09 0.00 -0.00 0.00 0.00 42.46 38.45 2b5m s ILE 587 CO 0.47 -0.78 1.56 -2.84 -0.00 0.00 0.00 174.94 173.35 2b5m s PRO 588 N -5.06 4.23 -0.12 0.37 0.02 -1.26 -2.91 135.00 130.26 2b5m s PRO 588 Ca 0.59 2.31 -0.20 0.00 0.02 0.00 0.00 61.00 63.72 2b5m s PRO 588 Cb -0.14 -3.25 -0.26 0.00 0.02 0.00 0.00 34.50 30.86 2b5m s PRO 588 CO 0.55 -0.61 0.59 -0.09 -0.33 0.00 0.00 177.00 177.11 2b5m h ARG 589 N 7.10 0.17 -4.59 5.54 1.12 -1.58 -3.43 114.38 118.71 2b5m h ARG 589 Ca -0.42 -0.29 -0.27 0.00 -1.11 0.00 0.00 59.98 57.89 2b5m h ARG 589 Cb 1.20 0.11 -0.20 0.00 -0.01 0.00 0.00 29.97 31.07 2b5m h ARG 589 CO 0.91 1.14 -0.73 0.45 -3.11 0.00 0.00 179.97 178.63 2b5m s SER 590 N -6.85 0.90 0.00 -3.80 0.15 -1.18 -4.75 113.70 98.17 2b5m s SER 590 Ca -0.20 -0.60 0.01 0.00 0.70 0.00 0.00 55.95 55.85 2b5m s SER 590 Cb 0.03 0.04 -0.01 0.00 -1.71 0.00 0.00 66.02 64.37 2b5m s SER 590 CO 0.73 -0.23 -0.04 -0.51 1.20 0.00 0.00 173.24 174.39 2b5m s ILE 591 N -1.64 0.27 -0.03 6.45 2.07 -1.26 -0.12 121.20 126.93 2b5m s ILE 591 Ca -0.07 -0.27 -0.05 0.00 -1.41 0.00 0.00 60.65 58.85 2b5m s ILE 591 Cb -0.08 -0.26 0.01 0.00 0.13 0.00 0.00 42.46 42.26 2b5m s ILE 591 CO -0.00 -0.00 0.12 -0.22 -1.91 0.00 0.00 174.94 172.92 2b5m s LEU 592 N -0.29 1.57 -0.34 8.50 2.96 0.42 -4.66 118.68 126.83 2b5m s LEU 592 Ca -0.01 0.12 0.03 0.00 -0.22 0.00 0.00 54.13 54.04 2b5m s LEU 592 Cb -0.03 0.46 0.10 0.00 0.50 0.00 0.00 46.19 47.22 2b5m s LEU 592 CO -0.00 -0.13 0.05 0.00 -1.32 0.00 0.00 176.35 174.96 2b5m s MET 593 N -0.32 1.68 0.03 1.98 0.23 -1.26 0.30 119.30 121.94 2b5m s MET 593 Ca -0.04 -1.79 0.03 0.00 -1.03 0.00 0.00 55.69 52.86 2b5m s MET 593 Cb -0.03 -3.23 -0.02 0.00 -1.53 0.00 0.00 34.83 30.03 2b5m s MET 593 CO 0.00 -0.91 -0.09 0.99 -2.03 0.00 0.00 175.02 172.99 2b5m s THR 594 N 0.97 0.64 0.01 3.16 2.01 -0.07 -4.83 115.64 117.52 2b5m s THR 594 Ca 0.08 -0.81 0.01 0.00 0.31 0.00 0.00 61.69 61.28 2b5m s THR 594 Cb -0.20 -0.63 -0.04 0.00 0.01 0.00 0.00 72.50 71.65 2b5m s THR 594 CO -0.07 -0.14 0.05 -0.89 -0.69 0.00 0.00 174.62 172.88 2b5m s THR 595 N -0.88 4.49 0.02 -0.82 2.01 -1.26 -2.58 115.64 116.62 2b5m s THR 595 Ca -0.04 -0.53 -0.01 0.00 0.31 0.00 0.00 61.69 61.42 2b5m s THR 595 Cb -0.07 -3.05 -0.01 0.00 0.01 0.00 0.00 72.50 69.38 2b5m s THR 595 CO 0.00 0.33 -0.03 0.49 -0.69 0.00 0.00 174.62 174.73 2b5m n PHE 596 N 1.16 0.00 0.00 4.92 0.99 -1.26 -4.95 117.46 118.32 2b5m n PHE 596 Ca -0.13 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.32 2b5m n PHE 596 Cb 0.53 -0.06 0.00 0.00 -1.00 0.00 0.00 39.48 38.95 2b5m n PHE 596 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.76 177.15 2b5m n GLU 597 N -3.31 0.39 0.00 -1.08 1.02 -1.26 -4.97 120.64 111.42 2b5m n GLU 597 Ca -0.03 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.11 2b5m n GLU 597 Cb 0.31 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.73 2b5m n GLU 597 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 2b5m n SER 598 N 0.00 1.04 -3.75 1.62 7.64 -1.26 -4.54 113.62 114.36 2b5m n SER 598 Ca 0.00 -1.61 -0.15 0.00 1.01 0.00 0.00 58.87 58.11 2b5m n SER 598 Cb 0.00 -0.40 -0.16 0.00 -1.01 0.00 0.00 64.21 62.64 2b5m n SER 598 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2b5m s SER 599 N -0.02 0.17 0.05 6.43 0.01 -1.26 -5.15 113.70 113.92 2b5m s SER 599 Ca 0.00 0.11 -0.16 0.00 1.31 0.00 0.00 55.95 57.21 2b5m s SER 599 Cb 0.00 -0.01 -0.06 0.00 0.21 0.00 0.00 66.02 66.16 2b5m s SER 599 CO 0.00 -0.15 0.49 -1.00 0.41 0.00 0.00 173.24 172.98 2b5m s HIS 600 N 1.25 3.73 0.03 2.43 3.76 -1.26 -4.06 115.29 121.18 2b5m s HIS 600 Ca -0.07 1.09 0.05 0.00 -0.15 0.00 0.00 55.06 55.98 2b5m s HIS 600 Cb -0.13 -2.37 -0.02 0.00 1.11 0.00 0.00 32.58 31.18 2b5m s HIS 600 CO -0.04 0.59 -0.15 0.71 -0.85 0.00 0.00 174.74 175.00 2b5m s TYR 601 N -1.16 1.36 -0.13 1.40 1.51 -1.06 -2.27 117.35 116.99 2b5m s TYR 601 Ca 0.28 -0.33 -0.03 0.00 -1.01 0.00 0.00 57.07 55.98 2b5m s TYR 601 Cb -0.17 -0.83 0.05 0.00 -0.11 0.00 0.00 41.96 40.90 2b5m s TYR 601 CO 0.16 0.03 0.05 -1.17 -1.11 0.00 0.00 175.55 173.52 2b5m s LEU 602 N -0.92 0.58 -0.01 -1.29 1.98 -1.00 -0.89 118.68 117.13 2b5m s LEU 602 Ca 0.04 -0.43 0.06 0.00 -2.89 0.00 0.00 54.13 50.91 2b5m s LEU 602 Cb -0.07 -0.36 -0.03 0.00 0.66 0.00 0.00 46.19 46.39 2b5m s LEU 602 CO 0.01 -0.29 -0.20 -0.76 -1.89 0.00 0.00 176.35 173.22 2b5m s LEU 603 N 2.03 2.45 -0.16 -0.68 1.43 0.89 0.39 118.68 125.03 2b5m s LEU 603 Ca 0.02 -0.36 -0.03 0.00 -1.03 0.00 0.00 54.13 52.73 2b5m s LEU 603 Cb -0.15 -1.46 0.05 0.00 0.03 0.00 0.00 46.19 44.67 2b5m s LEU 603 CO -0.07 0.31 0.05 0.00 0.23 0.00 0.00 176.35 176.87 2b5m s ALA 605 N 1.98 3.76 0.73 0.00 0.00 0.83 -1.36 121.76 127.70 2b5m s ALA 605 Ca 0.01 -0.67 -0.02 0.00 0.00 0.00 0.00 51.96 51.28 2b5m s ALA 605 Cb -0.16 -2.01 0.06 0.00 0.00 0.00 0.00 23.12 21.01 2b5m s ALA 605 CO -0.08 0.44 0.36 1.28 0.00 0.00 0.00 175.76 177.76 2b5m n LEU 606 N 2.58 0.00 -0.27 0.00 4.77 0.22 -1.99 117.00 122.31 2b5m n LEU 606 Ca -0.18 -0.55 0.04 0.00 -0.03 0.00 0.00 56.01 55.28 2b5m n LEU 606 Cb 0.54 -0.25 0.02 0.00 -2.33 0.00 0.00 43.42 41.40 2b5m n LEU 606 CO 0.33 -0.72 0.33 0.61 -1.33 0.00 0.00 177.39 176.61 2b5m n GLY 607 N 2.49 -0.59 0.07 -0.72 0.00 -1.15 -3.40 105.19 101.89 2b5m n GLY 607 Ca 0.05 -0.21 -0.07 0.00 0.00 0.00 0.00 46.02 45.79 2b5m n GLY 607 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 2b5m h ASP 608 N 1.31 0.00 0.00 1.61 -0.00 -1.85 -3.23 116.42 114.27 2b5m h ASP 608 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.03 2b5m h ASP 608 Cb 0.30 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.63 2b5m h ASP 608 CO 0.00 0.97 0.00 0.61 -0.00 0.00 0.00 179.24 180.82 2b5m n GLY 609 N 1.39 0.63 3.83 7.15 0.00 -1.25 -3.97 105.19 112.97 2b5m n GLY 609 Ca -0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.66 2b5m n GLY 609 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b5m s ALA 610 N 0.00 3.08 -0.01 4.61 0.00 -1.26 -2.30 121.76 125.88 2b5m s ALA 610 Ca 0.00 0.25 0.02 0.00 0.00 0.00 0.00 51.96 52.23 2b5m s ALA 610 Cb 0.00 -3.10 -0.00 0.00 0.00 0.00 0.00 23.12 20.02 2b5m s ALA 610 CO 0.00 -0.04 -0.07 -1.17 0.00 0.00 0.00 175.76 174.48 2b5m s LEU 611 N -3.62 1.96 0.12 0.00 0.20 -0.59 0.71 118.68 117.45 2b5m s LEU 611 Ca 0.60 -0.13 0.08 0.00 0.69 0.00 0.00 54.13 55.36 2b5m s LEU 611 Cb -0.10 -0.38 -0.04 0.00 -0.43 0.00 0.00 46.19 45.24 2b5m s LEU 611 CO 0.23 0.08 -0.19 -0.36 -0.29 0.00 0.00 176.35 175.81 2b5m s PHE 612 N -0.09 1.72 -0.03 5.38 2.99 -0.46 -3.04 117.98 124.45 2b5m s PHE 612 Ca 0.02 -0.44 0.02 0.00 0.00 0.00 0.00 56.93 56.52 2b5m s PHE 612 Cb -0.04 -0.92 0.01 0.00 0.00 0.00 0.00 43.02 42.07 2b5m s PHE 612 CO -0.00 0.22 -0.07 1.52 -0.00 0.00 0.00 175.22 176.88 2b5m s TYR 613 N -1.44 0.88 0.12 0.36 -0.85 -1.26 0.05 117.35 115.21 2b5m s TYR 613 Ca 0.08 -0.23 0.08 0.00 -0.52 0.00 0.00 57.07 56.47 2b5m s TYR 613 Cb -0.09 -0.67 -0.04 0.00 0.38 0.00 0.00 41.96 41.55 2b5m s TYR 613 CO 0.05 -0.13 -0.19 -0.06 -1.52 0.00 0.00 175.55 173.70 2b5m s PHE 614 N 0.43 1.70 -0.04 -3.49 0.40 0.16 -4.12 117.98 113.02 2b5m s PHE 614 Ca -0.07 -0.45 -0.09 0.00 -0.60 0.00 0.00 56.93 55.72 2b5m s PHE 614 Cb -0.11 -0.90 -0.05 0.00 0.51 0.00 0.00 43.02 42.48 2b5m s PHE 614 CO 0.01 0.22 0.26 0.20 0.70 0.00 0.00 175.22 176.61 2b5m s GLY 615 N -2.18 2.29 -0.02 4.36 0.00 -1.26 -2.38 107.32 108.12 2b5m s GLY 615 Ca 0.09 -0.48 0.01 0.00 0.00 0.00 0.00 44.72 44.33 2b5m s GLY 615 CO 0.05 -0.21 -0.03 -2.27 0.00 0.00 0.00 173.10 170.64 2b5m s LEU 616 N -1.26 1.49 -0.10 0.66 2.96 -0.96 -3.28 118.68 118.19 2b5m s LEU 616 Ca 0.22 -0.07 -0.30 0.00 -0.22 0.00 0.00 54.13 53.76 2b5m s LEU 616 Cb -0.14 -0.28 -0.01 0.00 0.50 0.00 0.00 46.19 46.26 2b5m s LEU 616 CO 0.10 -0.04 1.02 0.20 -1.32 0.00 0.00 176.35 176.32 2b5m s ASN 617 N 0.61 7.23 0.64 3.68 0.01 -1.26 -4.14 114.94 121.72 2b5m s ASN 617 Ca -0.07 1.56 0.16 0.00 -0.71 0.00 0.00 52.86 53.80 2b5m s ASN 617 Cb -0.10 -2.56 0.74 0.00 0.41 0.00 0.00 41.25 39.74 2b5m s ASN 617 CO -0.01 -0.46 1.38 0.16 -1.51 0.00 0.00 177.10 176.66 2b5m h ILE 618 N 5.08 0.04 0.00 0.60 3.07 -1.94 -3.03 117.51 121.33 2b5m h ILE 618 Ca -0.31 0.00 -0.35 0.00 1.55 0.00 0.00 64.86 65.75 2b5m h ILE 618 Cb 1.15 0.22 -0.05 0.00 -0.27 0.00 0.00 36.82 37.87 2b5m h ILE 618 CO 0.86 0.00 -1.95 -0.62 -1.05 0.00 0.00 178.15 175.39 2b5m n GLU 619 N -2.88 0.57 0.00 0.16 -0.58 -1.26 -4.92 120.64 111.73 2b5m n GLU 619 Ca 0.06 0.39 0.00 0.00 -0.42 0.00 0.00 57.16 57.18 2b5m n GLU 619 Cb 0.94 -1.59 0.00 0.00 -0.57 0.00 0.00 31.44 30.22 2b5m n GLU 619 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 2b5m n THR 620 N -4.34 0.00 0.00 2.62 -2.24 -1.15 -5.12 114.28 104.05 2b5m n THR 620 Ca -0.43 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.35 2b5m n THR 620 Cb 0.78 -0.28 0.00 0.00 -2.10 0.00 0.00 70.33 68.73 2b5m n THR 620 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2b5m n GLY 621 N 4.31 0.00 3.74 3.38 0.00 -1.23 -4.76 105.19 110.63 2b5m n GLY 621 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2b5m n GLY 621 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2b5m n LEU 622 N 0.00 4.32 -4.55 0.99 4.32 -1.26 -4.70 117.00 116.12 2b5m n LEU 622 Ca 0.00 1.16 -0.20 0.00 -0.02 0.00 0.00 56.01 56.94 2b5m n LEU 622 Cb 0.00 -1.59 -0.08 0.00 -1.62 0.00 0.00 43.42 40.14 2b5m n LEU 622 CO 0.00 0.10 1.52 0.18 -1.22 0.00 0.00 177.39 177.97 2b5m n LEU 623 N 1.93 1.61 0.00 2.23 4.77 -1.26 -4.40 117.00 121.88 2b5m n LEU 623 Ca 0.08 -1.13 0.00 0.00 -0.03 0.00 0.00 56.01 54.93 2b5m n LEU 623 Cb 0.37 -1.53 0.00 0.00 -2.33 0.00 0.00 43.42 39.93 2b5m n LEU 623 CO 0.64 -2.23 0.00 -1.20 -1.33 0.00 0.00 177.39 173.27 2b5m n SER 624 N 16.73 0.00 -4.73 -1.43 7.64 -1.20 -5.00 113.62 125.62 2b5m n SER 624 Ca 0.47 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.94 2b5m n SER 624 Cb 0.42 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.58 2b5m n SER 624 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 2b5m s ASP 625 N -1.00 7.25 -0.01 6.43 1.11 -1.26 -4.66 116.67 124.53 2b5m s ASP 625 Ca 0.00 2.04 0.00 0.00 0.18 0.00 0.00 52.55 54.77 2b5m s ASP 625 Cb 0.00 -2.60 0.01 0.00 1.07 0.00 0.00 42.92 41.40 2b5m s ASP 625 CO 0.00 -0.26 0.01 -0.60 1.18 0.00 0.00 175.17 175.50 2b5m s ARG 626 N -0.03 0.01 -0.29 8.23 3.52 -1.26 -3.92 118.95 125.21 2b5m s ARG 626 Ca 0.51 0.06 -0.22 0.00 -0.13 0.00 0.00 55.73 55.95 2b5m s ARG 626 Cb -0.29 -0.11 0.14 0.00 -1.56 0.00 0.00 34.95 33.14 2b5m s ARG 626 CO 0.33 -0.06 1.10 0.21 -0.81 0.00 0.00 175.30 176.07 2b5m s LYS 627 N 0.37 0.37 -0.56 5.12 2.20 -1.26 -5.09 119.74 120.89 2b5m s LYS 627 Ca -0.03 0.50 -0.28 0.00 -0.36 0.00 0.00 55.97 55.80 2b5m s LYS 627 Cb -0.05 0.15 0.02 0.00 -1.51 0.00 0.00 37.83 36.45 2b5m s LYS 627 CO -0.01 -0.05 1.26 0.21 -0.36 0.00 0.00 175.35 176.40 2b5m s LYS 628 N 0.56 3.47 -0.06 4.03 2.20 -1.26 -4.39 119.74 124.29 2b5m s LYS 628 Ca -0.00 0.35 0.02 0.00 -0.36 0.00 0.00 55.97 55.98 2b5m s LYS 628 Cb -0.04 -4.04 -0.03 0.00 -1.51 0.00 0.00 37.83 32.21 2b5m s LYS 628 CO -0.11 -1.74 -0.10 0.08 -0.36 0.00 0.00 175.35 173.12 2b5m s VAL 629 N 5.27 3.39 0.28 4.02 1.01 -1.17 -5.06 120.40 128.15 2b5m s VAL 629 Ca 0.47 -0.61 0.09 0.00 0.00 0.00 0.00 61.98 61.93 2b5m s VAL 629 Cb -0.09 -2.36 -0.04 0.00 0.00 0.00 0.00 36.38 33.89 2b5m s VAL 629 CO 0.26 0.59 0.06 0.42 0.00 0.00 0.00 175.10 176.43 2b5m s THR 630 N -0.78 3.52 0.00 3.92 -4.23 -1.26 -1.54 115.64 115.28 2b5m s THR 630 Ca 0.12 -1.78 0.00 0.00 -1.18 0.00 0.00 61.69 58.85 2b5m s THR 630 Cb -0.11 -2.97 0.00 0.00 1.34 0.00 0.00 72.50 70.76 2b5m s THR 630 CO 0.01 -0.33 0.00 0.18 -0.54 0.00 0.00 174.62 173.94 2b5m n LEU 631 N -1.00 0.00 0.00 4.79 4.77 -0.97 -4.91 117.00 119.67 2b5m n LEU 631 Ca -0.06 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 2b5m n LEU 631 Cb 0.59 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.68 2b5m n LEU 631 CO 0.41 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.08 2b5m n GLY 632 N 2.61 -2.70 0.23 -0.72 0.00 -1.26 -4.92 105.19 98.44 2b5m n GLY 632 Ca 0.00 -0.91 0.05 0.00 0.00 0.00 0.00 46.02 45.16 2b5m n GLY 632 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2b5m n THR 633 N -0.72 0.00 -3.45 2.61 -2.24 -1.26 -4.53 114.28 104.70 2b5m n THR 633 Ca 0.00 -0.38 -0.20 0.00 -2.27 0.00 0.00 64.05 61.20 2b5m n THR 633 Cb 0.00 1.12 -0.00 0.00 -2.10 0.00 0.00 70.33 69.35 2b5m n THR 633 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2b5m s GLN 634 N -1.46 3.17 0.17 -0.78 -1.52 -1.25 -3.90 119.66 114.09 2b5m s GLN 634 Ca 0.09 -0.85 -0.32 0.00 -1.95 0.00 0.00 55.36 52.34 2b5m s GLN 634 Cb 0.09 -2.77 -0.10 0.00 -0.22 0.00 0.00 33.01 30.00 2b5m s GLN 634 CO 0.28 0.06 1.57 -1.25 -0.25 0.00 0.00 175.29 175.70 2b5m s PRO 635 N -4.22 4.21 0.56 2.91 0.04 -1.22 -3.84 135.00 133.44 2b5m s PRO 635 Ca 0.44 2.37 -0.15 0.00 0.04 0.00 0.00 61.00 63.69 2b5m s PRO 635 Cb -0.10 -3.15 -0.06 0.00 0.04 0.00 0.00 34.50 31.24 2b5m s PRO 635 CO 0.32 -0.61 1.01 0.99 0.04 0.00 0.00 177.00 178.76 2b5m s THR 636 N 1.10 4.35 -0.38 1.26 2.01 -1.22 -4.65 115.64 118.11 2b5m s THR 636 Ca 0.70 1.05 0.01 0.00 0.31 0.00 0.00 61.69 63.76 2b5m s THR 636 Cb -0.44 -3.64 0.12 0.00 0.01 0.00 0.00 72.50 68.55 2b5m s THR 636 CO 0.32 -0.71 0.17 -0.69 -0.69 0.00 0.00 174.62 173.01 2b5m s VAL 637 N -2.68 1.21 0.98 3.82 1.01 -1.00 -4.10 120.40 119.64 2b5m s VAL 637 Ca 0.60 -2.05 -0.12 0.00 0.00 0.00 0.00 61.98 60.41 2b5m s VAL 637 Cb -0.12 -1.87 0.18 0.00 0.00 0.00 0.00 36.38 34.57 2b5m s VAL 637 CO 0.37 -0.79 1.09 -0.76 0.00 0.00 0.00 175.10 175.01 2b5m s LEU 638 N 0.92 1.72 0.00 3.92 1.02 -1.26 -2.44 118.68 122.56 2b5m s LEU 638 Ca 0.14 1.25 0.00 0.00 0.02 0.00 0.00 54.13 55.54 2b5m s LEU 638 Cb -0.21 -3.48 0.00 0.00 0.02 0.00 0.00 46.19 42.52 2b5m s LEU 638 CO -0.10 -3.05 0.00 -1.14 0.02 0.00 0.00 176.35 172.07 2b5m n ARG 639 N -4.13 0.00 -5.07 1.70 3.00 -1.22 -4.95 116.66 105.99 2b5m n ARG 639 Ca 0.06 0.00 -0.32 0.00 -0.00 0.00 0.00 57.85 57.58 2b5m n ARG 639 Cb 0.57 0.00 -0.16 0.00 0.00 0.00 0.00 32.46 32.87 2b5m n ARG 639 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.63 178.62 2b5m s THR 640 N -2.00 2.43 0.19 5.15 2.01 -1.26 -2.38 115.64 119.79 2b5m s THR 640 Ca 0.00 -0.89 0.08 0.00 0.31 0.00 0.00 61.69 61.19 2b5m s THR 640 Cb 0.00 -1.96 -0.04 0.00 0.01 0.00 0.00 72.50 70.51 2b5m s THR 640 CO 0.00 0.55 -0.16 0.72 -0.69 0.00 0.00 174.62 175.04 2b5m s PHE 641 N 0.22 1.75 -0.45 4.92 -0.12 0.18 -4.40 117.98 120.09 2b5m s PHE 641 Ca -0.13 -0.53 -0.23 0.00 -0.05 0.00 0.00 56.93 55.99 2b5m s PHE 641 Cb -0.16 -0.83 0.03 0.00 -0.63 0.00 0.00 43.02 41.42 2b5m s PHE 641 CO 0.07 0.35 0.77 0.50 -0.05 0.00 0.00 175.22 176.87 2b5m s ARG 642 N -3.35 3.40 0.00 1.99 3.52 -1.26 -2.20 118.95 121.06 2b5m s ARG 642 Ca 0.20 -0.12 0.00 0.00 -0.13 0.00 0.00 55.73 55.68 2b5m s ARG 642 Cb -0.03 -3.94 0.00 0.00 -1.56 0.00 0.00 34.95 29.43 2b5m s ARG 642 CO 0.07 -1.10 0.00 -1.13 -0.81 0.00 0.00 175.30 172.33 2b5m n SER 643 N 6.67 0.00 0.00 -2.12 3.41 -1.26 -4.99 113.62 115.33 2b5m n SER 643 Ca 0.02 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.63 2b5m n SER 643 Cb 0.48 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.43 2b5m n SER 643 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2b5m n LEU 644 N 0.00 0.00 -0.02 1.04 -0.00 -1.26 -4.96 117.00 111.79 2b5m n LEU 644 Ca 0.00 0.00 -0.18 0.00 -0.00 0.00 0.00 56.01 55.83 2b5m n LEU 644 Cb 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 43.42 43.28 2b5m n LEU 644 CO 0.00 0.00 -0.84 -1.54 -0.00 0.00 0.00 177.39 175.01 2b5m n SER 645 N 0.00 1.78 -1.38 1.45 3.41 -1.26 -4.60 113.62 113.02 2b5m n SER 645 Ca 0.00 0.19 0.00 0.00 -0.26 0.00 0.00 58.87 58.80 2b5m n SER 645 Cb 0.00 -0.58 0.00 0.00 -0.26 0.00 0.00 64.21 63.37 2b5m n SER 645 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2b5m n THR 646 N -3.34 1.26 -1.35 6.66 -2.24 -1.26 -4.95 114.28 109.06 2b5m n THR 646 Ca -0.31 -0.24 -0.40 0.00 -2.27 0.00 0.00 64.05 60.83 2b5m n THR 646 Cb 1.05 -1.20 0.01 0.00 -2.10 0.00 0.00 70.33 68.09 2b5m n THR 646 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2b5m n THR 647 N 1.23 1.03 -3.51 4.28 -2.24 -1.26 -4.82 114.28 108.99 2b5m n THR 647 Ca 0.00 -0.50 -0.02 0.00 -2.27 0.00 0.00 64.05 61.26 2b5m n THR 647 Cb 0.39 -0.27 -0.00 0.00 -2.10 0.00 0.00 70.33 68.35 2b5m n THR 647 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2b5m n ASN 648 N 1.74 -0.30 -4.45 3.42 3.02 -0.93 -4.80 115.26 112.96 2b5m n ASN 648 Ca 0.10 -1.33 -0.33 0.00 -0.03 0.00 0.00 54.58 52.99 2b5m n ASN 648 Cb 0.44 0.53 -0.13 0.00 -0.61 0.00 0.00 39.78 40.01 2b5m n ASN 648 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 2b5m s VAL 649 N -2.60 3.55 -0.11 2.41 -7.23 -1.22 0.52 120.40 115.71 2b5m s VAL 649 Ca 0.05 -0.48 -0.17 0.00 -1.81 0.00 0.00 61.98 59.56 2b5m s VAL 649 Cb -0.00 -2.53 -0.04 0.00 0.56 0.00 0.00 36.38 34.36 2b5m s VAL 649 CO 0.03 0.51 0.45 0.12 -0.31 0.00 0.00 175.10 175.90 2b5m s PHE 650 N 0.36 3.53 -0.44 2.82 5.36 -1.00 -1.52 117.98 127.09 2b5m s PHE 650 Ca -0.07 0.87 -0.12 0.00 -0.96 0.00 0.00 56.93 56.66 2b5m s PHE 650 Cb -0.15 -2.51 0.08 0.00 -0.34 0.00 0.00 43.02 40.10 2b5m s PHE 650 CO 0.04 0.22 0.32 0.00 -1.46 0.00 0.00 175.22 174.34 2b5m s ALA 651 N 0.44 3.40 0.16 11.12 0.00 0.56 -3.41 121.76 134.03 2b5m s ALA 651 Ca 0.25 -2.15 -0.30 0.00 0.00 0.00 0.00 51.96 49.76 2b5m s ALA 651 Cb -0.15 -2.82 -0.07 0.00 0.00 0.00 0.00 23.12 20.08 2b5m s ALA 651 CO 0.10 -1.69 1.05 0.00 0.00 0.00 0.00 175.76 175.22 2b5m s SER 653 N -0.14 -0.05 0.00 0.00 0.15 -0.77 -2.37 113.70 110.51 2b5m s SER 653 Ca 0.48 -0.14 0.01 0.00 0.70 0.00 0.00 55.95 57.00 2b5m s SER 653 Cb -0.27 0.16 0.06 0.00 -1.71 0.00 0.00 66.02 64.26 2b5m s SER 653 CO 0.33 -0.30 0.35 -0.90 1.20 0.00 0.00 173.24 173.92 2b5m n ASP 654 N -0.52 0.00 -2.99 5.45 5.75 -1.26 -2.75 116.55 120.23 2b5m n ASP 654 Ca -0.08 -0.08 -0.16 0.00 -0.01 0.00 0.00 54.79 54.46 2b5m n ASP 654 Cb 0.63 0.00 -0.02 0.00 -1.03 0.00 0.00 41.12 40.70 2b5m n ASP 654 CO 0.00 0.00 0.00 -1.14 -0.11 0.00 0.00 177.20 175.95 2b5m n ARG 655 N -0.78 0.68 -1.67 0.11 0.63 -1.26 -4.72 116.66 109.65 2b5m n ARG 655 Ca 0.01 -2.50 -0.46 0.00 -0.92 0.00 0.00 57.85 53.97 2b5m n ARG 655 Cb 0.00 -1.38 -0.04 0.00 0.45 0.00 0.00 32.46 31.49 2b5m n ARG 655 CO 0.00 0.00 0.00 -2.30 -2.51 0.00 0.00 177.63 172.82 2b5m n PRO 656 N 1.77 2.16 -4.13 -0.14 -0.02 -1.23 -4.41 135.00 129.00 2b5m n PRO 656 Ca 0.17 0.78 -0.15 0.00 -2.02 0.00 0.00 63.50 62.28 2b5m n PRO 656 Cb 0.57 -2.56 -0.12 0.00 -0.02 0.00 0.00 33.50 31.37 2b5m n PRO 656 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2b5m s THR 657 N 1.24 0.61 0.05 3.45 2.01 -1.00 -0.94 115.64 121.06 2b5m s THR 657 Ca 0.80 -0.86 0.05 0.00 0.31 0.00 0.00 61.69 62.00 2b5m s THR 657 Cb -0.68 -0.61 -0.04 0.00 0.01 0.00 0.00 72.50 71.18 2b5m s THR 657 CO 0.39 -0.20 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.34 2b5m s VAL 658 N -0.98 3.40 -0.50 3.82 1.01 -0.71 -0.32 120.40 126.11 2b5m s VAL 658 Ca -0.05 -1.04 0.03 0.00 0.00 0.00 0.00 61.98 60.92 2b5m s VAL 658 Cb -0.08 -2.52 0.13 0.00 0.00 0.00 0.00 36.38 33.91 2b5m s VAL 658 CO 0.00 0.27 0.24 -0.63 0.00 0.00 0.00 175.10 174.98 2b5m s ILE 659 N -1.08 2.66 0.00 2.22 1.01 -0.57 -2.84 121.20 122.59 2b5m s ILE 659 Ca 0.19 -3.12 0.00 0.00 0.00 0.00 0.00 60.65 57.71 2b5m s ILE 659 Cb -0.11 -2.85 0.00 0.00 0.01 0.00 0.00 42.46 39.51 2b5m s ILE 659 CO 0.10 -0.77 0.00 -1.22 0.00 0.00 0.00 174.94 173.04 2b5m n TYR 660 N 3.34 0.00 -3.73 3.97 4.02 -1.24 -3.43 117.16 120.09 2b5m n TYR 660 Ca 0.05 0.00 -0.13 0.00 -0.01 0.00 0.00 57.90 57.81 2b5m n TYR 660 Cb 0.34 0.00 -0.09 0.00 -0.02 0.00 0.00 39.34 39.57 2b5m n TYR 660 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 176.86 174.73 2b5m s SER 661 N -1.00 -0.39 0.00 7.72 0.01 -1.26 -2.74 113.70 116.05 2b5m s SER 661 Ca 0.00 0.65 0.00 0.00 1.31 0.00 0.00 55.95 57.91 2b5m s SER 661 Cb 0.00 0.70 0.00 0.00 0.21 0.00 0.00 66.02 66.93 2b5m s SER 661 CO 0.00 -0.24 0.00 -1.54 0.41 0.00 0.00 173.24 171.87 2b5m n SER 662 N 2.38 0.00 -0.11 2.44 3.41 -0.89 -4.81 113.62 116.04 2b5m n SER 662 Ca -0.15 0.00 -0.22 0.00 -0.26 0.00 0.00 58.87 58.24 2b5m n SER 662 Cb 0.57 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.45 2b5m n SER 662 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2b5m n ASN 663 N -1.43 1.68 0.00 4.04 5.15 -1.26 -4.92 115.26 118.53 2b5m n ASN 663 Ca 0.00 0.29 0.00 0.00 -0.60 0.00 0.00 54.58 54.27 2b5m n ASN 663 Cb 0.00 -0.69 0.00 0.00 -0.53 0.00 0.00 39.78 38.56 2b5m n ASN 663 CO 0.00 0.00 0.00 1.57 1.40 0.00 0.00 177.26 180.23 2b5m n HIS 664 N -4.11 0.00 -2.31 1.20 -0.00 -1.26 -5.00 115.22 103.75 2b5m n HIS 664 Ca -0.39 0.00 -0.15 0.00 -0.00 0.00 0.00 57.72 57.18 2b5m n HIS 664 Cb 0.75 0.11 0.08 0.00 -0.00 0.00 0.00 29.99 30.93 2b5m n HIS 664 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.34 177.51 2b5m n LYS 665 N 0.00 0.02 -5.12 1.57 4.81 -1.26 -5.01 118.16 113.17 2b5m n LYS 665 Ca 0.00 -1.57 -0.31 0.00 -0.87 0.00 0.00 58.31 55.57 2b5m n LYS 665 Cb 0.34 -0.47 -0.17 0.00 0.02 0.00 0.00 35.03 34.75 2b5m n LYS 665 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2b5m s LEU 666 N 0.00 2.02 0.98 3.14 1.43 -1.26 -2.10 118.68 122.89 2b5m s LEU 666 Ca 0.41 -0.51 -0.12 0.00 -1.03 0.00 0.00 54.13 52.88 2b5m s LEU 666 Cb -0.02 -1.31 0.18 0.00 0.03 0.00 0.00 46.19 45.07 2b5m s LEU 666 CO 0.27 0.15 1.08 -0.69 0.23 0.00 0.00 176.35 177.39 2b5m s VAL 667 N 0.34 2.31 -0.31 -1.59 1.01 -1.11 -4.74 120.40 116.31 2b5m s VAL 667 Ca -0.17 0.10 0.18 0.00 0.00 0.00 0.00 61.98 62.09 2b5m s VAL 667 Cb -0.17 -2.47 0.46 0.00 0.00 0.00 0.00 36.38 34.20 2b5m s VAL 667 CO 0.08 -0.13 1.12 0.49 0.00 0.00 0.00 175.10 176.65 2b5m n PHE 668 N -4.21 0.37 -3.68 5.22 3.01 -1.23 -3.64 117.46 113.31 2b5m n PHE 668 Ca 0.06 -2.36 -0.22 0.00 1.01 0.00 0.00 57.45 55.94 2b5m n PHE 668 Cb 0.55 0.13 -0.01 0.00 -0.01 0.00 0.00 39.48 40.14 2b5m n PHE 668 CO 0.00 0.00 0.00 -1.12 1.01 0.00 0.00 176.76 176.65 2b5m s SER 669 N -2.88 6.25 0.24 4.37 0.01 -1.13 -4.89 113.70 115.67 2b5m s SER 669 Ca 0.25 0.18 -0.23 0.00 1.31 0.00 0.00 55.95 57.45 2b5m s SER 669 Cb 0.41 -1.83 -0.09 0.00 0.21 0.00 0.00 66.02 64.72 2b5m s SER 669 CO -0.02 -0.21 0.80 0.20 0.41 0.00 0.00 173.24 174.42 2b5m s ASN 670 N -4.03 7.22 -0.18 2.44 0.02 -1.26 -1.74 114.94 117.40 2b5m s ASN 670 Ca 0.38 1.60 -0.17 0.00 -1.02 0.00 0.00 52.86 53.64 2b5m s ASN 670 Cb -0.09 -2.49 -0.04 0.00 0.02 0.00 0.00 41.25 38.65 2b5m s ASN 670 CO 0.32 0.04 0.46 -0.69 0.02 0.00 0.00 177.10 177.26 2b5m s VAL 671 N -1.46 5.16 -1.31 1.60 1.01 -0.11 -0.66 120.40 124.62 2b5m s VAL 671 Ca 0.43 0.86 -0.18 0.00 0.00 0.00 0.00 61.98 63.10 2b5m s VAL 671 Cb -0.19 -3.79 0.07 0.00 0.00 0.00 0.00 36.38 32.47 2b5m s VAL 671 CO 0.23 0.24 1.78 0.59 0.00 0.00 0.00 175.10 177.94 2b5m n ASN 672 N 4.42 4.86 -3.97 3.32 3.02 -0.43 -4.54 115.26 121.93 2b5m n ASN 672 Ca -0.07 -2.91 -0.08 0.00 -0.03 0.00 0.00 54.58 51.49 2b5m n ASN 672 Cb 0.51 -1.74 -0.09 0.00 -0.61 0.00 0.00 39.78 37.85 2b5m n ASN 672 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2b5m s LEU 673 N 4.08 1.93 0.08 3.41 1.43 -1.26 -4.81 118.68 123.54 2b5m s LEU 673 Ca 0.53 -0.83 -0.36 0.00 -1.03 0.00 0.00 54.13 52.45 2b5m s LEU 673 Cb 0.05 0.63 -0.18 0.00 0.03 0.00 0.00 46.19 46.72 2b5m s LEU 673 CO 0.07 -0.67 1.58 0.50 0.23 0.00 0.00 176.35 178.05 2b5m h LYS 674 N 2.94 -1.02 0.00 1.70 1.63 -1.95 -3.44 116.57 116.43 2b5m h LYS 674 Ca -0.34 0.07 0.00 0.00 -0.85 0.00 0.00 60.65 59.53 2b5m h LYS 674 Cb 1.17 0.23 0.00 0.00 -0.60 0.00 0.00 32.23 33.03 2b5m h LYS 674 CO 0.61 -0.68 0.00 -1.91 -3.45 0.00 0.00 179.45 174.02 2b5m n GLU 675 N -5.58 0.00 -3.99 1.90 2.13 -1.26 -4.67 120.64 109.17 2b5m n GLU 675 Ca -0.13 0.00 -0.34 0.00 0.66 0.00 0.00 57.16 57.35 2b5m n GLU 675 Cb 0.46 0.00 -0.14 0.00 0.27 0.00 0.00 31.44 32.03 2b5m n GLU 675 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 2b5m s VAL 676 N 0.00 2.64 0.15 6.31 1.01 -1.11 -4.71 120.40 124.70 2b5m s VAL 676 Ca 0.00 -1.32 0.05 0.00 0.00 0.00 0.00 61.98 60.70 2b5m s VAL 676 Cb 0.00 -2.45 -0.17 0.00 0.00 0.00 0.00 36.38 33.76 2b5m s VAL 676 CO 0.00 0.05 1.35 0.78 0.00 0.00 0.00 175.10 177.28 2b5m h ASN 677 N 7.93 0.14 -5.04 3.32 2.35 -1.60 -2.06 115.58 120.62 2b5m h ASN 677 Ca -0.26 -0.13 -0.06 0.00 -0.55 0.00 0.00 56.30 55.30 2b5m h ASN 677 Cb 1.07 -0.04 -0.16 0.00 0.05 0.00 0.00 38.32 39.24 2b5m h ASN 677 CO 0.53 0.99 -0.04 -0.31 -1.65 0.00 0.00 177.43 176.94 2b5m s TYR 678 N -3.02 -0.31 -0.28 1.19 1.51 -1.24 -4.84 117.35 110.35 2b5m s TYR 678 Ca -0.01 0.24 -0.17 0.00 -1.01 0.00 0.00 57.07 56.12 2b5m s TYR 678 Cb 0.10 0.28 0.11 0.00 -0.11 0.00 0.00 41.96 42.34 2b5m s TYR 678 CO 0.82 -0.63 0.83 1.41 -1.11 0.00 0.00 175.55 176.87 2b5m s MET 679 N -2.78 0.56 0.09 -0.62 -2.45 -1.26 -0.69 119.30 112.15 2b5m s MET 679 Ca -0.03 0.94 0.08 0.00 -1.25 0.00 0.00 55.69 55.43 2b5m s MET 679 Cb -0.00 0.13 -0.04 0.00 1.25 0.00 0.00 34.83 36.17 2b5m s MET 679 CO -0.04 -0.11 -0.19 0.00 1.05 0.00 0.00 175.02 175.73 2b5m n PRO 681 N 1.11 0.49 -3.64 0.00 -0.02 -1.26 -0.58 135.00 131.10 2b5m n PRO 681 Ca -0.16 0.00 -0.04 0.00 -2.02 0.00 0.00 63.50 61.28 2b5m n PRO 681 Cb 0.52 0.00 -0.01 0.00 -0.02 0.00 0.00 33.50 33.99 2b5m n PRO 681 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2b5m s LEU 682 N 0.00 -0.22 0.00 2.45 2.96 -1.18 -4.49 118.68 118.21 2b5m s LEU 682 Ca 0.00 -0.20 0.00 0.00 -0.22 0.00 0.00 54.13 53.71 2b5m s LEU 682 Cb 0.00 1.94 0.00 0.00 0.50 0.00 0.00 46.19 48.63 2b5m s LEU 682 CO 0.00 -0.67 0.00 -3.20 -1.32 0.00 0.00 176.35 171.16 2b5m n ASN 683 N -0.37 2.22 0.00 3.68 2.85 -1.26 -4.05 115.26 118.33 2b5m n ASN 683 Ca -0.07 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.40 2b5m n ASN 683 Cb 0.61 0.25 0.00 0.00 1.24 0.00 0.00 39.78 41.88 2b5m n ASN 683 CO 0.00 0.00 0.00 -0.24 -2.11 0.00 0.00 177.26 174.91 2b5m n SER 684 N -1.11 0.00 0.18 1.20 2.88 -1.26 -3.79 113.62 111.72 2b5m n SER 684 Ca 0.00 0.00 -0.14 0.00 -1.33 0.00 0.00 58.87 57.40 2b5m n SER 684 Cb 0.20 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.58 2b5m n SER 684 CO 0.00 0.00 0.00 -2.24 -1.23 0.00 0.00 175.04 171.57 2b5m h ASP 685 N 0.00 -0.35 0.00 -3.46 2.03 -1.94 -2.24 116.42 110.47 2b5m h ASP 685 Ca 0.00 -0.05 0.00 0.00 -0.73 0.00 0.00 57.03 56.25 2b5m h ASP 685 Cb 0.00 0.09 0.00 0.00 -0.83 0.00 0.00 39.33 38.59 2b5m h ASP 685 CO 0.00 -0.17 0.00 0.61 -1.03 0.00 0.00 179.24 178.65 2b5m n GLY 686 N -1.00 -0.50 2.70 7.15 0.00 -1.26 -4.18 105.19 108.10 2b5m n GLY 686 Ca -0.10 -0.05 -0.09 0.00 0.00 0.00 0.00 46.02 45.78 2b5m n GLY 686 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2b5m n TYR 687 N -0.73 -2.73 -0.38 1.61 4.01 -0.89 -4.31 117.16 113.74 2b5m n TYR 687 Ca 0.06 -2.21 -0.05 0.00 -0.16 0.00 0.00 57.90 55.54 2b5m n TYR 687 Cb 0.03 1.54 -0.02 0.00 -0.31 0.00 0.00 39.34 40.58 2b5m n TYR 687 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 2b5m n PRO 688 N 0.35 -0.31 -2.58 -0.72 -0.02 -0.94 -3.47 135.00 127.32 2b5m n PRO 688 Ca 0.07 1.44 -0.26 0.00 -2.02 0.00 0.00 63.50 62.72 2b5m n PRO 688 Cb 0.70 -2.12 -0.01 0.00 -0.02 0.00 0.00 33.50 32.05 2b5m n PRO 688 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2b5m n ASP 689 N -5.29 4.53 -1.97 2.55 4.64 -1.26 -4.15 116.55 115.59 2b5m n ASP 689 Ca 0.06 -3.67 0.00 0.00 -1.38 0.00 0.00 54.79 49.80 2b5m n ASP 689 Cb 0.32 -0.48 0.00 0.00 -1.04 0.00 0.00 41.12 39.92 2b5m n ASP 689 CO 0.00 0.00 0.00 -1.20 -0.82 0.00 0.00 177.20 175.18 2b5m n SER 690 N -0.42 0.00 -3.61 1.67 7.64 -1.23 -4.36 113.62 113.32 2b5m n SER 690 Ca 0.36 -0.92 -0.15 0.00 1.01 0.00 0.00 58.87 59.17 2b5m n SER 690 Cb 0.61 0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.74 2b5m n SER 690 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2b5m s LEU 691 N 0.00 -0.51 0.16 -3.43 1.43 -0.81 -3.10 118.68 112.41 2b5m s LEU 691 Ca 0.00 1.04 0.09 0.00 -1.03 0.00 0.00 54.13 54.23 2b5m s LEU 691 Cb 0.00 2.32 -0.04 0.00 0.03 0.00 0.00 46.19 48.50 2b5m s LEU 691 CO 0.00 -0.38 -0.12 0.00 0.23 0.00 0.00 176.35 176.08 2b5m s ALA 692 N -0.31 2.87 -0.29 4.21 0.00 0.26 -2.23 121.76 126.27 2b5m s ALA 692 Ca -0.05 -1.42 -0.00 0.00 0.00 0.00 0.00 51.96 50.49 2b5m s ALA 692 Cb -0.03 -0.72 0.18 0.00 0.00 0.00 0.00 23.12 22.55 2b5m s ALA 692 CO 0.04 0.52 0.55 -0.51 0.00 0.00 0.00 175.76 176.37 2b5m s LEU 693 N -2.58 -1.27 0.41 0.00 1.02 -0.22 -2.55 118.68 113.50 2b5m s LEU 693 Ca 0.23 0.63 0.08 0.00 0.02 0.00 0.00 54.13 55.08 2b5m s LEU 693 Cb -0.09 1.93 0.00 0.00 0.02 0.00 0.00 46.19 48.05 2b5m s LEU 693 CO 0.14 -0.28 0.52 0.00 0.02 0.00 0.00 176.35 176.75 2b5m s ALA 694 N 2.79 4.41 0.15 4.21 0.00 0.13 -2.88 121.76 130.57 2b5m s ALA 694 Ca 0.18 -1.69 -0.03 0.00 0.00 0.00 0.00 51.96 50.41 2b5m s ALA 694 Cb -0.14 -1.51 0.01 0.00 0.00 0.00 0.00 23.12 21.48 2b5m s ALA 694 CO -0.21 -0.25 0.25 0.27 0.00 0.00 0.00 175.76 175.82 2b5m n ASN 695 N -1.77 -0.72 0.00 0.00 6.94 -1.23 -1.68 115.26 116.81 2b5m n ASN 695 Ca 0.06 -1.70 0.00 0.00 -0.02 0.00 0.00 54.58 52.92 2b5m n ASN 695 Cb 0.59 1.26 0.00 0.00 -2.36 0.00 0.00 39.78 39.27 2b5m n ASN 695 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 2b5m n ASN 696 N -1.59 0.00 -2.71 0.53 3.02 -1.26 -3.77 115.26 109.47 2b5m n ASN 696 Ca -0.01 0.00 -0.06 0.00 -0.03 0.00 0.00 54.58 54.47 2b5m n ASN 696 Cb 0.24 0.00 0.06 0.00 -0.61 0.00 0.00 39.78 39.47 2b5m n ASN 696 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2b5m n SER 697 N -1.55 -2.15 -3.43 6.41 3.41 -1.26 -3.51 113.62 111.54 2b5m n SER 697 Ca 0.00 -2.62 -0.12 0.00 -0.26 0.00 0.00 58.87 55.87 2b5m n SER 697 Cb 0.00 1.33 -0.02 0.00 -0.26 0.00 0.00 64.21 65.26 2b5m n SER 697 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2b5m s THR 698 N 0.41 0.00 0.02 6.66 2.01 -1.18 -4.07 115.64 119.50 2b5m s THR 698 Ca 0.29 0.00 0.03 0.00 0.31 0.00 0.00 61.69 62.32 2b5m s THR 698 Cb 0.22 -1.00 -0.01 0.00 0.01 0.00 0.00 72.50 71.72 2b5m s THR 698 CO -0.17 0.00 -0.09 -0.22 -0.69 0.00 0.00 174.62 173.45 2b5m s LEU 699 N -2.59 2.11 0.12 4.42 2.96 -1.10 -3.50 118.68 121.11 2b5m s LEU 699 Ca 0.00 -0.32 -0.16 0.00 -0.22 0.00 0.00 54.13 53.43 2b5m s LEU 699 Cb -0.01 -0.39 0.03 0.00 0.50 0.00 0.00 46.19 46.33 2b5m s LEU 699 CO -0.11 0.00 0.40 0.42 -1.32 0.00 0.00 176.35 175.74 2b5m s THR 700 N -0.64 0.07 0.17 3.68 -4.23 -1.14 -2.89 115.64 110.65 2b5m s THR 700 Ca -0.01 -0.58 0.02 0.00 -1.18 0.00 0.00 61.69 59.94 2b5m s THR 700 Cb -0.06 -1.16 -0.05 0.00 1.34 0.00 0.00 72.50 72.58 2b5m s THR 700 CO 0.00 -0.32 -0.01 0.27 -0.54 0.00 0.00 174.62 174.02 2b5m s ILE 701 N -3.73 0.72 0.00 2.99 -0.00 -1.20 -1.05 121.20 118.93 2b5m s ILE 701 Ca 0.02 -1.98 0.00 0.00 -0.00 0.00 0.00 60.65 58.69 2b5m s ILE 701 Cb 0.02 -2.08 0.00 0.00 -0.00 0.00 0.00 42.46 40.40 2b5m s ILE 701 CO -0.11 -0.52 0.00 0.61 -0.00 0.00 0.00 174.94 174.92 2b5m n GLY 702 N -0.23 0.45 1.53 6.27 0.00 -0.95 -4.07 105.19 108.19 2b5m n GLY 702 Ca -0.07 -1.19 -0.08 0.00 0.00 0.00 0.00 46.02 44.68 2b5m n GLY 702 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2b5m n THR 703 N -0.91 0.00 -4.70 2.61 -2.24 -1.26 -1.93 114.28 105.85 2b5m n THR 703 Ca 0.00 -0.77 -0.24 0.00 -2.27 0.00 0.00 64.05 60.77 2b5m n THR 703 Cb 0.00 -0.75 -0.16 0.00 -2.10 0.00 0.00 70.33 67.33 2b5m n THR 703 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2b5m s ILE 704 N -0.49 1.23 0.00 2.28 -1.09 -1.26 -4.16 121.20 117.70 2b5m s ILE 704 Ca 0.22 -0.62 0.00 0.00 -2.23 0.00 0.00 60.65 58.02 2b5m s ILE 704 Cb -0.02 -1.05 0.00 0.00 -1.58 0.00 0.00 42.46 39.81 2b5m s ILE 704 CO 0.14 0.36 0.00 0.47 -1.23 0.00 0.00 174.94 174.68 2b5m n ASP 705 N 3.08 -0.47 0.00 3.58 8.00 -1.11 -5.05 116.55 124.57 2b5m n ASP 705 Ca -0.17 -0.76 0.00 0.00 0.71 0.00 0.00 54.79 54.57 2b5m n ASP 705 Cb 0.54 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.64 2b5m n ASP 705 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 2b5m n GLU 706 N -1.23 1.66 0.00 -1.24 4.07 -1.26 -4.96 120.64 117.68 2b5m n GLU 706 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 2b5m n GLU 706 Cb 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.38 2b5m n GLU 706 CO 0.00 0.00 0.00 -0.89 -0.06 0.00 0.00 177.13 176.18 2b5m n ILE 707 N 0.00 0.00 0.00 6.31 -0.00 -1.26 -4.98 119.36 119.43 2b5m n ILE 707 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.75 2b5m n ILE 707 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 39.64 39.64 2b5m n ILE 707 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 2b5m n GLN 708 N 0.00 0.00 -0.42 0.38 10.64 -1.26 -4.65 117.38 122.07 2b5m n GLN 708 Ca 0.00 0.00 0.37 0.00 -1.83 0.00 0.00 57.00 55.54 2b5m n GLN 708 Cb 0.00 0.00 0.70 0.00 -0.86 0.00 0.00 30.24 30.08 2b5m n GLN 708 CO 0.00 0.00 0.00 -0.22 -1.83 0.00 0.00 177.06 175.01 2b5m h LYS 709 N 0.00 0.09 -5.32 2.61 1.63 -1.96 -3.41 116.57 110.20 2b5m h LYS 709 Ca 0.00 -0.01 -0.67 0.00 -0.85 0.00 0.00 60.65 59.12 2b5m h LYS 709 Cb 0.00 -0.02 -0.31 0.00 -0.60 0.00 0.00 32.23 31.30 2b5m h LYS 709 CO 0.00 0.06 -0.85 -0.51 -3.45 0.00 0.00 179.45 174.70 2b5m s LEU 710 N -8.72 2.27 -0.07 5.20 1.43 -1.26 -2.19 118.68 115.34 2b5m s LEU 710 Ca -0.06 -0.50 -0.15 0.00 -1.03 0.00 0.00 54.13 52.39 2b5m s LEU 710 Cb 0.26 -1.47 -0.05 0.00 0.03 0.00 0.00 46.19 44.96 2b5m s LEU 710 CO 0.83 0.16 0.39 -2.28 0.23 0.00 0.00 176.35 175.67 2b5m s HIS 711 N 0.38 3.61 -0.11 0.29 5.65 0.35 -4.92 115.29 120.53 2b5m s HIS 711 Ca -0.16 0.86 0.00 0.00 0.25 0.00 0.00 55.06 56.01 2b5m s HIS 711 Cb -0.17 -2.36 0.02 0.00 -1.18 0.00 0.00 32.58 28.89 2b5m s HIS 711 CO 0.07 0.43 -0.09 0.42 -0.65 0.00 0.00 174.74 174.92 2b5m s ILE 712 N -0.26 1.12 -0.16 0.89 1.01 -1.26 -1.10 121.20 121.44 2b5m s ILE 712 Ca 0.22 -0.37 -0.06 0.00 0.00 0.00 0.00 60.65 60.44 2b5m s ILE 712 Cb -0.15 -1.10 -0.04 0.00 0.01 0.00 0.00 42.46 41.18 2b5m s ILE 712 CO 0.10 0.38 0.04 -0.60 0.00 0.00 0.00 174.94 174.86 2b5m s ARG 713 N 1.47 3.75 -0.13 2.79 3.52 -0.91 -4.94 118.95 124.50 2b5m s ARG 713 Ca 0.01 -0.37 -0.07 0.00 -0.13 0.00 0.00 55.73 55.17 2b5m s ARG 713 Cb -0.13 -3.10 -0.04 0.00 -1.56 0.00 0.00 34.95 30.11 2b5m s ARG 713 CO -0.06 0.36 0.13 0.99 -0.81 0.00 0.00 175.30 175.91 2b5m s THR 714 N 0.09 5.44 -0.38 4.11 2.01 -1.26 -1.60 115.64 124.05 2b5m s THR 714 Ca 0.04 0.18 0.03 0.00 0.31 0.00 0.00 61.69 62.25 2b5m s THR 714 Cb -0.12 -3.38 0.11 0.00 0.01 0.00 0.00 72.50 69.11 2b5m s THR 714 CO 0.01 0.59 0.12 -0.69 -0.69 0.00 0.00 174.62 173.96 2b5m s VAL 715 N -0.79 1.86 0.47 3.82 1.01 -0.02 -5.00 120.40 121.76 2b5m s VAL 715 Ca 0.14 -2.30 -0.24 0.00 0.00 0.00 0.00 61.98 59.58 2b5m s VAL 715 Cb -0.12 -2.36 -0.08 0.00 0.00 0.00 0.00 36.38 33.83 2b5m s VAL 715 CO 0.03 -0.69 1.38 -2.65 0.00 0.00 0.00 175.10 173.17 2b5m n PRO 716 N 4.12 2.04 0.00 2.72 -0.02 -1.26 -1.71 135.00 140.88 2b5m n PRO 716 Ca 0.03 0.73 0.00 0.00 -2.02 0.00 0.00 63.50 62.24 2b5m n PRO 716 Cb 0.39 -2.57 0.00 0.00 -0.02 0.00 0.00 33.50 31.31 2b5m n PRO 716 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2b5m n LEU 717 N -0.33 0.00 -1.90 2.45 4.77 0.21 -4.87 117.00 117.33 2b5m n LEU 717 Ca 0.07 -0.14 -0.19 0.00 -0.03 0.00 0.00 56.01 55.72 2b5m n LEU 717 Cb 0.42 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.47 2b5m n LEU 717 CO 0.58 0.00 -0.22 -1.22 -1.33 0.00 0.00 177.39 175.20 2b5m n TYR 718 N -0.99 -0.55 -3.55 -1.77 4.02 -1.20 -1.46 117.16 111.65 2b5m n TYR 718 Ca 0.00 0.00 -0.08 0.00 -0.01 0.00 0.00 57.90 57.81 2b5m n TYR 718 Cb 0.00 -3.53 -0.03 0.00 -0.02 0.00 0.00 39.34 35.76 2b5m n TYR 718 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 176.86 174.02 2b5m s GLU 719 N -4.43 0.60 0.10 -0.72 -1.05 -0.36 -4.31 118.70 108.54 2b5m s GLU 719 Ca 0.00 -0.08 -0.31 0.00 -0.15 0.00 0.00 54.97 54.43 2b5m s GLU 719 Cb 0.00 0.28 -0.09 0.00 -0.44 0.00 0.00 34.13 33.88 2b5m s GLU 719 CO 0.00 -0.24 1.69 -1.12 0.95 0.00 0.00 175.26 176.54 2b5m s SER 720 N -1.84 6.55 0.10 0.83 0.01 -1.04 -3.90 113.70 114.39 2b5m s SER 720 Ca 0.03 2.59 -0.01 0.00 1.31 0.00 0.00 55.95 59.87 2b5m s SER 720 Cb -0.01 -2.57 -0.04 0.00 0.21 0.00 0.00 66.02 63.61 2b5m s SER 720 CO -0.04 -0.91 0.27 -2.16 0.41 0.00 0.00 173.24 170.81 2b5m s PRO 721 N 2.37 3.49 0.00 12.44 0.05 -1.26 -1.83 135.00 150.26 2b5m s PRO 721 Ca 0.75 -0.35 0.00 0.00 0.05 0.00 0.00 61.00 61.45 2b5m s PRO 721 Cb -0.42 -2.97 0.00 0.00 0.05 0.00 0.00 34.50 31.16 2b5m s PRO 721 CO 0.33 0.55 0.00 0.54 0.05 0.00 0.00 177.00 178.47 2b5m n ARG 722 N 0.12 0.01 -4.11 4.56 5.12 -0.19 -4.81 116.66 117.37 2b5m n ARG 722 Ca -0.04 0.00 -0.09 0.00 -1.93 0.00 0.00 57.85 55.78 2b5m n ARG 722 Cb 0.52 -0.69 -0.10 0.00 -1.16 0.00 0.00 32.46 31.03 2b5m n ARG 722 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 2b5m s LYS 723 N -1.39 0.89 -0.21 5.56 -0.14 -1.17 -4.48 119.74 118.80 2b5m s LYS 723 Ca 0.00 -1.35 -0.19 0.00 -1.36 0.00 0.00 55.97 53.07 2b5m s LYS 723 Cb 0.00 0.25 0.06 0.00 -1.68 0.00 0.00 37.83 36.46 2b5m s LYS 723 CO 0.00 -0.25 0.56 -1.50 -0.76 0.00 0.00 175.35 173.40 2b5m s ILE 724 N -4.01 -0.00 -0.09 2.17 2.07 -1.26 -2.26 121.20 117.82 2b5m s ILE 724 Ca 0.19 0.01 -0.03 0.00 -1.41 0.00 0.00 60.65 59.41 2b5m s ILE 724 Cb 0.07 -0.79 0.05 0.00 0.13 0.00 0.00 42.46 41.92 2b5m s ILE 724 CO -0.01 0.00 0.17 0.00 -1.91 0.00 0.00 174.94 173.19 2b5m s TYR 726 N 2.19 3.31 -0.47 0.00 5.04 -1.26 -1.72 117.35 124.44 2b5m s TYR 726 Ca 0.02 1.38 0.03 0.00 -2.44 0.00 0.00 57.07 56.06 2b5m s TYR 726 Cb -0.12 -3.53 0.14 0.00 0.35 0.00 0.00 41.96 38.81 2b5m s TYR 726 CO -0.06 -1.51 0.28 -1.14 -1.34 0.00 0.00 175.55 171.78 2b5m s GLN 727 N -0.70 1.38 0.12 4.97 0.74 -0.88 -4.83 119.66 120.45 2b5m s GLN 727 Ca 0.52 -2.17 -0.28 0.00 0.05 0.00 0.00 55.36 53.48 2b5m s GLN 727 Cb -0.36 -2.35 -0.09 0.00 1.10 0.00 0.00 33.01 31.32 2b5m s GLN 727 CO 0.41 -1.20 1.47 1.49 -0.55 0.00 0.00 175.29 176.91 2b5m h GLU 728 N 6.44 -0.25 -1.09 1.67 4.81 -1.96 -1.86 114.58 122.35 2b5m h GLU 728 Ca 0.04 0.02 0.30 0.00 -0.13 0.00 0.00 59.36 59.59 2b5m h GLU 728 Cb 0.90 0.06 -0.07 0.00 0.63 0.00 0.00 28.75 30.27 2b5m h GLU 728 CO 0.50 -0.17 0.74 -0.39 -0.73 0.00 0.00 179.01 178.95 2b5m h VAL 729 N -0.26 0.48 0.00 0.32 -1.51 -1.96 1.21 116.25 114.53 2b5m h VAL 729 Ca 0.08 -0.07 0.00 0.00 -1.23 0.00 0.00 66.70 65.48 2b5m h VAL 729 Cb 0.47 0.25 0.00 0.00 -2.13 0.00 0.00 31.29 29.88 2b5m h VAL 729 CO -0.58 0.04 -0.38 -1.20 -1.23 0.00 0.00 177.57 174.22 2b5m n SER 730 N -4.43 0.65 -3.24 4.19 7.64 -0.89 -4.95 113.62 112.58 2b5m n SER 730 Ca 0.25 0.24 -0.16 0.00 1.01 0.00 0.00 58.87 60.21 2b5m n SER 730 Cb 1.03 -0.16 0.08 0.00 -1.01 0.00 0.00 64.21 64.15 2b5m n SER 730 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2b5m n GLN 731 N -2.04 -6.14 -3.82 1.43 1.13 0.42 -4.98 117.38 103.38 2b5m n GLN 731 Ca 0.04 0.78 -0.08 0.00 -1.94 0.00 0.00 57.00 55.81 2b5m n GLN 731 Cb 0.42 -5.61 0.01 0.00 0.11 0.00 0.00 30.24 25.17 2b5m n GLN 731 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2b5m s PHE 733 N -2.71 2.27 -0.10 0.00 0.40 0.17 -2.08 117.98 115.93 2b5m s PHE 733 Ca 0.15 -0.34 0.00 0.00 -0.60 0.00 0.00 56.93 56.14 2b5m s PHE 733 Cb -0.05 -1.00 -0.02 0.00 0.51 0.00 0.00 43.02 42.46 2b5m s PHE 733 CO 0.10 0.68 -0.10 0.20 0.70 0.00 0.00 175.22 176.80 2b5m s GLY 734 N -3.40 1.62 -0.03 4.36 0.00 -0.70 -1.66 107.32 107.51 2b5m s GLY 734 Ca 0.29 -0.90 -0.00 0.00 0.00 0.00 0.00 44.72 44.11 2b5m s GLY 734 CO 0.14 -0.44 0.02 0.14 0.00 0.00 0.00 173.10 172.96 2b5m s VAL 735 N -0.23 0.07 -0.11 1.40 1.01 -0.65 -1.84 120.40 120.04 2b5m s VAL 735 Ca 0.02 0.19 -0.30 0.00 0.00 0.00 0.00 61.98 61.90 2b5m s VAL 735 Cb -0.13 -0.21 -0.01 0.00 0.00 0.00 0.00 36.38 36.02 2b5m s VAL 735 CO 0.03 0.14 1.06 -0.76 0.00 0.00 0.00 175.10 175.57 2b5m s LEU 736 N 1.33 4.23 0.23 3.92 1.43 -0.96 -0.30 118.68 128.57 2b5m s LEU 736 Ca -0.06 1.57 0.06 0.00 -1.03 0.00 0.00 54.13 54.68 2b5m s LEU 736 Cb -0.13 -3.55 -0.05 0.00 0.03 0.00 0.00 46.19 42.48 2b5m s LEU 736 CO -0.03 -0.51 -0.07 -0.94 0.23 0.00 0.00 176.35 175.03 2b5m s SER 737 N 1.21 2.39 0.05 2.29 1.04 -0.82 -1.02 113.70 118.83 2b5m s SER 737 Ca 0.49 -1.13 0.03 0.00 0.48 0.00 0.00 55.95 55.83 2b5m s SER 737 Cb -0.19 -0.10 -0.02 0.00 0.10 0.00 0.00 66.02 65.80 2b5m s SER 737 CO 0.17 -0.33 -0.10 -0.94 0.98 0.00 0.00 173.24 173.02 2b5m s SER 738 N -3.35 1.11 0.12 7.02 1.04 -0.76 -0.54 113.70 118.34 2b5m s SER 738 Ca 0.26 -0.53 0.02 0.00 0.48 0.00 0.00 55.95 56.18 2b5m s SER 738 Cb 0.03 -0.00 -0.04 0.00 0.10 0.00 0.00 66.02 66.10 2b5m s SER 738 CO 0.08 -0.14 -0.07 0.00 0.98 0.00 0.00 173.24 174.10 2b5m s ARG 739 N -1.49 0.91 -0.17 4.02 1.70 -0.24 -2.51 118.95 121.17 2b5m s ARG 739 Ca -0.06 -1.38 -0.09 0.00 -0.47 0.00 0.00 55.73 53.73 2b5m s ARG 739 Cb -0.09 -0.32 -0.05 0.00 -0.57 0.00 0.00 34.95 33.92 2b5m s ARG 739 CO 0.01 -0.00 0.12 0.42 -1.08 0.00 0.00 175.30 174.77 2b5m s ILE 740 N -3.55 5.37 0.49 4.99 1.01 -1.26 -1.36 121.20 126.89 2b5m s ILE 740 Ca 0.14 0.17 0.02 0.00 0.00 0.00 0.00 60.65 60.98 2b5m s ILE 740 Cb 0.05 -3.41 -0.02 0.00 0.01 0.00 0.00 42.46 39.08 2b5m s ILE 740 CO -0.03 0.50 0.03 -1.61 0.00 0.00 0.00 174.94 173.83 2b5m s GLU 741 N -0.10 2.16 0.34 2.79 2.02 -0.47 -4.24 118.70 121.20 2b5m s GLU 741 Ca 0.10 -2.33 0.04 0.00 0.02 0.00 0.00 54.97 52.80 2b5m s GLU 741 Cb -0.11 -1.58 -0.06 0.00 0.10 0.00 0.00 34.13 32.47 2b5m s GLU 741 CO 0.00 -0.32 0.07 0.14 0.02 0.00 0.00 175.26 175.17 2b5m s VAL 742 N -2.84 1.12 -0.37 2.63 -7.23 -1.26 -1.94 120.40 110.51 2b5m s VAL 742 Ca 0.13 -2.00 -0.26 0.00 -1.81 0.00 0.00 61.98 58.03 2b5m s VAL 742 Cb 0.03 -2.73 0.02 0.00 0.56 0.00 0.00 36.38 34.25 2b5m s VAL 742 CO 0.07 0.00 0.95 -1.10 -0.31 0.00 0.00 175.10 174.71 2b5m s GLN 743 N -3.87 3.85 0.00 4.82 -1.52 -1.04 -2.07 119.66 119.82 2b5m s GLN 743 Ca 0.35 0.61 0.00 0.00 -1.95 0.00 0.00 55.36 54.37 2b5m s GLN 743 Cb 0.08 -3.81 0.00 0.00 -0.22 0.00 0.00 33.01 29.06 2b5m s GLN 743 CO 0.15 -0.97 0.00 -3.47 -0.25 0.00 0.00 175.29 170.75 2b5m n ASP 744 N 6.85 0.00 0.24 5.90 2.03 -0.44 -4.42 116.55 126.71 2b5m n ASP 744 Ca 0.08 -0.89 -0.15 0.00 0.52 0.00 0.00 54.79 54.35 2b5m n ASP 744 Cb 0.48 0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 40.80 2b5m n ASP 744 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 2b5m h THR 745 N -0.88 0.57 0.00 5.18 1.35 -1.88 -0.59 112.91 116.66 2b5m h THR 745 Ca 0.00 -0.19 0.00 0.00 -0.55 0.00 0.00 66.41 65.67 2b5m h THR 745 Cb 0.00 0.66 0.00 0.00 -1.73 0.00 0.00 68.15 67.08 2b5m h THR 745 CO 0.00 0.04 0.00 -0.24 -0.25 0.00 0.00 175.52 175.07 2b5m n SER 746 N -5.30 0.00 0.00 5.36 2.88 -1.26 -4.81 113.62 110.49 2b5m n SER 746 Ca -0.11 -0.25 0.00 0.00 -1.33 0.00 0.00 58.87 57.18 2b5m n SER 746 Cb 0.27 -0.10 0.00 0.00 -0.75 0.00 0.00 64.21 63.63 2b5m n SER 746 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2b5m n GLY 747 N -0.14 2.06 0.00 0.46 0.00 -0.23 -4.92 105.19 102.42 2b5m n GLY 747 Ca 0.09 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.81 2b5m n GLY 747 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b5m n GLY 748 N 0.00 0.00 3.79 -0.02 0.00 -1.26 -1.32 105.19 106.38 2b5m n GLY 748 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 2b5m n GLY 748 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2b5m s THR 749 N 0.00 3.73 0.00 2.61 -4.23 -1.24 -2.55 115.64 113.96 2b5m s THR 749 Ca 0.00 1.09 0.00 0.00 -1.18 0.00 0.00 61.69 61.60 2b5m s THR 749 Cb 0.00 -3.44 0.00 0.00 1.34 0.00 0.00 72.50 70.40 2b5m s THR 749 CO 0.00 -0.23 0.00 0.35 -0.54 0.00 0.00 174.62 174.20 2b5m n THR 750 N -0.97 0.00 0.00 3.99 -2.24 -0.88 -4.90 114.28 109.29 2b5m n THR 750 Ca 0.09 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.87 2b5m n THR 750 Cb 0.52 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.75 2b5m n THR 750 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2b5m n ALA 751 N -3.00 0.00 0.02 6.98 0.00 -1.26 -4.69 120.51 118.55 2b5m n ALA 751 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.36 2b5m n ALA 751 Cb 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.32 2b5m n ALA 751 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2b5m h LEU 752 N 0.00 0.01 -7.39 0.00 3.38 -1.96 -3.48 115.31 105.86 2b5m h LEU 752 Ca 0.00 -0.01 0.04 0.00 0.09 0.00 0.00 57.88 57.99 2b5m h LEU 752 Cb 0.00 -0.00 -0.10 0.00 0.09 0.00 0.00 40.66 40.65 2b5m h LEU 752 CO 0.00 1.01 0.26 0.00 0.09 0.00 0.00 178.44 179.80 2b5m s ARG 753 N -2.65 1.41 0.81 1.13 1.70 -1.26 -5.17 118.95 114.92 2b5m s ARG 753 Ca -0.02 -0.65 -0.11 0.00 -0.47 0.00 0.00 55.73 54.48 2b5m s ARG 753 Cb 0.09 0.57 0.08 0.00 -0.57 0.00 0.00 34.95 35.11 2b5m s ARG 753 CO 0.82 -0.63 1.09 -2.14 -1.08 0.00 0.00 175.30 173.36 2b5m s PRO 754 N -3.73 1.97 -0.07 3.89 0.02 -1.26 -5.03 135.00 130.79 2b5m s PRO 754 Ca 0.06 0.88 -0.31 0.00 0.02 0.00 0.00 61.00 61.64 2b5m s PRO 754 Cb -0.03 -1.89 0.11 0.00 0.02 0.00 0.00 34.50 32.72 2b5m s PRO 754 CO -0.05 -1.76 1.37 -1.54 -0.33 0.00 0.00 177.00 174.69 2b5m s SER 755 N -3.60 -0.00 0.17 2.53 1.04 -1.26 -4.88 113.70 107.70 2b5m s SER 755 Ca 0.61 -0.06 -0.20 0.00 0.48 0.00 0.00 55.95 56.79 2b5m s SER 755 Cb -0.16 0.04 0.10 0.00 0.10 0.00 0.00 66.02 66.10 2b5m s SER 755 CO 0.56 -0.09 1.62 0.00 0.98 0.00 0.00 173.24 176.31 2b5m h ALA 756 N 2.00 0.04 0.00 5.32 0.00 -1.57 -0.48 119.26 124.57 2b5m h ALA 756 Ca -0.24 0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 2b5m h ALA 756 Cb 1.18 0.55 -0.00 0.00 0.00 0.00 0.00 17.79 19.52 2b5m h ALA 756 CO 0.30 -0.60 -0.01 0.66 0.00 0.00 0.00 179.25 179.59 2b5m h SER 757 N -0.16 0.00 0.04 0.00 4.64 -1.97 -2.78 113.55 113.32 2b5m h SER 757 Ca 0.20 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 61.14 2b5m h SER 757 Cb 0.47 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.50 2b5m h SER 757 CO -0.51 0.01 -2.35 0.35 -0.87 0.00 0.00 176.83 173.46 2b5m n THR 758 N -3.11 1.54 1.90 2.95 -2.24 -0.59 -4.23 114.28 110.50 2b5m n THR 758 Ca 0.01 -0.63 0.08 0.00 -2.27 0.00 0.00 64.05 61.24 2b5m n THR 758 Cb 0.33 -1.36 0.47 0.00 -2.10 0.00 0.00 70.33 67.67 2b5m n THR 758 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2b5m n GLN 759 N -3.24 0.95 -0.80 -0.78 6.02 -0.29 -4.92 117.38 114.33 2b5m n GLN 759 Ca -0.41 0.00 -0.32 0.00 -0.01 0.00 0.00 57.00 56.26 2b5m n GLN 759 Cb 1.02 -1.26 0.14 0.00 1.02 0.00 0.00 30.24 31.16 2b5m n GLN 759 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2b5m n ALA 760 N -0.76 -1.59 0.13 -1.58 0.00 -1.05 -4.96 120.51 110.70 2b5m n ALA 760 Ca 0.12 -0.55 -0.10 0.00 0.00 0.00 0.00 53.44 52.91 2b5m n ALA 760 Cb 0.05 -2.01 -0.06 0.00 0.00 0.00 0.00 19.45 17.44 2b5m n ALA 760 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2b5m h LEU 761 N -1.59 -0.34-10.24 0.00 3.38 -1.38 -3.47 115.31 101.68 2b5m h LEU 761 Ca -0.44 -0.15 -0.47 0.00 0.09 0.00 0.00 57.88 56.91 2b5m h LEU 761 Cb 1.28 0.09 -0.02 0.00 0.09 0.00 0.00 40.66 42.10 2b5m h LEU 761 CO 0.38 0.14 -0.35 -0.44 0.09 0.00 0.00 178.44 178.27 2b5m s SER 762 N -5.17 5.26 0.29 -0.43 0.01 -0.61 -5.01 113.70 108.04 2b5m s SER 762 Ca -0.10 -0.62 -0.15 0.00 1.31 0.00 0.00 55.95 56.39 2b5m s SER 762 Cb 0.01 -0.64 0.01 0.00 0.21 0.00 0.00 66.02 65.61 2b5m s SER 762 CO 0.36 -0.66 0.61 -0.55 0.41 0.00 0.00 173.24 173.42 2b5m s SER 763 N -4.18 -0.01 -0.28 2.44 0.15 -1.26 -2.72 113.70 107.84 2b5m s SER 763 Ca 0.50 -0.93 -0.31 0.00 0.70 0.00 0.00 55.95 55.90 2b5m s SER 763 Cb -0.05 0.69 0.18 0.00 -1.71 0.00 0.00 66.02 65.13 2b5m s SER 763 CO 0.29 -1.32 1.35 -0.94 1.20 0.00 0.00 173.24 173.81 2b5m s SER 764 N -3.02 -0.05 0.02 5.45 1.04 -1.10 -4.90 113.70 111.13 2b5m s SER 764 Ca 0.19 0.04 0.04 0.00 0.48 0.00 0.00 55.95 56.69 2b5m s SER 764 Cb -0.03 0.04 -0.02 0.00 0.10 0.00 0.00 66.02 66.11 2b5m s SER 764 CO 0.10 -0.05 -0.12 0.68 0.98 0.00 0.00 173.24 174.83 2b5m s VAL 765 N -1.29 0.91 0.76 5.02 -7.23 -1.26 -1.12 120.40 116.19 2b5m s VAL 765 Ca 0.09 -0.75 -0.15 0.00 -1.81 0.00 0.00 61.98 59.37 2b5m s VAL 765 Cb -0.01 -0.81 0.05 0.00 0.56 0.00 0.00 36.38 36.17 2b5m s VAL 765 CO -0.06 0.07 1.21 -1.20 -0.31 0.00 0.00 175.10 174.81 2b5m n SER 766 N 2.29 1.27 -0.22 4.85 7.64 0.21 -4.90 113.62 124.76 2b5m n SER 766 Ca -0.16 0.66 0.00 0.00 1.01 0.00 0.00 58.87 60.37 2b5m n SER 766 Cb 0.56 -1.52 0.00 0.00 -1.01 0.00 0.00 64.21 62.24 2b5m n SER 766 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2b5m n SER 767 N -2.80 0.00 -4.86 6.43 3.41 -1.26 -4.86 113.62 109.68 2b5m n SER 767 Ca 0.14 -1.39 -0.30 0.00 -0.26 0.00 0.00 58.87 57.05 2b5m n SER 767 Cb 0.50 -0.08 0.04 0.00 -0.26 0.00 0.00 64.21 64.41 2b5m n SER 767 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2b5m s SER 768 N -0.39 5.52 -0.24 4.04 1.04 -1.26 -4.96 113.70 117.45 2b5m s SER 768 Ca 0.00 1.30 0.11 0.00 0.48 0.00 0.00 55.95 57.84 2b5m s SER 768 Cb 0.00 -2.16 0.46 0.00 0.10 0.00 0.00 66.02 64.42 2b5m s SER 768 CO 0.00 -1.31 1.36 0.29 0.98 0.00 0.00 173.24 174.56 2b5m n LYS 769 N -3.01 1.82 0.15 4.02 4.76 -1.26 -4.77 118.16 119.87 2b5m n LYS 769 Ca 0.07 -3.13 0.02 0.00 -2.87 0.00 0.00 58.31 52.40 2b5m n LYS 769 Cb 0.56 -1.73 0.36 0.00 -1.84 0.00 0.00 35.03 32.38 2b5m n LYS 769 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 2b5m h LEU 770 N 0.98 0.12 -9.74 -0.35 3.38 -2.04 -3.42 115.31 104.24 2b5m h LEU 770 Ca 0.11 -0.03 -0.58 0.00 0.09 0.00 0.00 57.88 57.47 2b5m h LEU 770 Cb 1.38 -0.03 -0.10 0.00 0.09 0.00 0.00 40.66 42.00 2b5m h LEU 770 CO 0.22 0.40 -0.56 -0.36 0.09 0.00 0.00 178.44 178.22 2b5m s PHE 771 N -4.43 2.58 0.00 1.13 0.40 -1.26 -5.09 117.98 111.31 2b5m s PHE 771 Ca -0.04 -0.52 0.00 0.00 -0.60 0.00 0.00 56.93 55.77 2b5m s PHE 771 Cb 0.15 -1.72 0.00 0.00 0.51 0.00 0.00 43.02 41.96 2b5m s PHE 771 CO 0.73 0.35 0.00 -1.13 0.70 0.00 0.00 175.22 175.87 2b5m n SER 772 N -1.08 0.00 0.00 1.36 3.41 -1.26 -5.14 113.62 110.91 2b5m n SER 772 Ca -0.03 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.58 2b5m n SER 772 Cb 0.64 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.59 2b5m n SER 772 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2b5m n SER 773 N 0.00 0.00 -3.30 4.04 3.41 -1.26 -5.29 113.62 111.22 2b5m n SER 773 Ca 0.00 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.49 2b5m n SER 773 Cb 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 2b5m n SER 773 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2b5m s GLU 779 N 0.00 1.93 0.13 4.33 2.02 -1.26 -5.37 118.70 120.49 2b5m s GLU 779 Ca 0.00 -1.59 0.00 0.00 0.02 0.00 0.00 54.97 53.41 2b5m s GLU 779 Cb 0.00 0.50 -0.04 0.00 0.10 0.00 0.00 34.13 34.69 2b5m s GLU 779 CO 0.00 -0.83 0.29 0.99 0.02 0.00 0.00 175.26 175.73 2b5m s THR 780 N -3.04 5.31 -0.07 3.63 2.01 -1.26 -5.03 115.64 117.19 2b5m s THR 780 Ca 0.25 -0.46 -0.15 0.00 0.31 0.00 0.00 61.69 61.64 2b5m s THR 780 Cb -0.02 -3.70 -0.05 0.00 0.01 0.00 0.00 72.50 68.75 2b5m s THR 780 CO 0.16 -0.03 0.38 -0.55 -0.69 0.00 0.00 174.62 173.89 2b5m s SER 781 N -2.92 6.66 0.48 3.53 0.15 -1.26 -5.02 113.70 115.32 2b5m s SER 781 Ca 0.36 0.79 0.29 0.00 0.70 0.00 0.00 55.95 58.09 2b5m s SER 781 Cb -0.12 -2.23 1.36 0.00 -1.71 0.00 0.00 66.02 63.32 2b5m s SER 781 CO 0.28 0.20 1.80 -0.26 1.20 0.00 0.00 173.24 176.46 2b5m h PHE 782 N 5.68 0.28 -3.28 3.44 0.05 -1.94 -3.35 116.94 117.82 2b5m h PHE 782 Ca -0.47 0.01 -0.51 0.00 3.82 0.00 0.00 57.97 60.82 2b5m h PHE 782 Cb 1.20 -0.08 -0.40 0.00 2.00 0.00 0.00 35.95 38.67 2b5m h PHE 782 CO 0.67 0.02 -0.76 0.20 -0.18 0.00 0.00 178.31 178.25 2b5m s GLY 783 N -3.94 0.70 0.00 -1.45 0.00 -1.26 -4.29 107.32 97.08 2b5m s GLY 783 Ca -0.07 -0.67 0.00 0.00 0.00 0.00 0.00 44.72 43.99 2b5m s GLY 783 CO 0.80 1.39 0.00 1.18 0.00 0.00 0.00 173.10 176.47 2b5m n GLU 784 N 5.05 0.00 -4.57 2.90 1.02 -1.26 -4.95 120.64 118.83 2b5m n GLU 784 Ca -0.09 0.00 -0.22 0.00 -0.02 0.00 0.00 57.16 56.83 2b5m n GLU 784 Cb 0.47 0.00 -0.15 0.00 -0.02 0.00 0.00 31.44 31.75 2b5m n GLU 784 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2b5m s GLU 785 N 1.81 1.11 0.10 3.49 2.02 -1.26 -2.51 118.70 123.46 2b5m s GLU 785 Ca 0.00 -0.60 0.04 0.00 0.02 0.00 0.00 54.97 54.43 2b5m s GLU 785 Cb 0.00 -1.09 -0.04 0.00 0.10 0.00 0.00 34.13 33.10 2b5m s GLU 785 CO 0.00 0.29 -0.11 0.08 0.02 0.00 0.00 175.26 175.54 2b5m s VAL 786 N -0.50 1.03 0.06 2.63 1.01 -0.82 -4.99 120.40 118.82 2b5m s VAL 786 Ca 0.05 -1.64 -0.04 0.00 0.00 0.00 0.00 61.98 60.34 2b5m s VAL 786 Cb -0.06 -1.38 -0.05 0.00 0.00 0.00 0.00 36.38 34.89 2b5m s VAL 786 CO 0.00 -0.51 0.28 -1.61 0.00 0.00 0.00 175.10 173.26 2b5m s GLU 787 N -2.71 3.55 -0.10 2.72 2.02 -1.26 -1.37 118.70 121.55 2b5m s GLU 787 Ca 0.06 -0.18 0.01 0.00 0.02 0.00 0.00 54.97 54.88 2b5m s GLU 787 Cb -0.04 -3.01 0.02 0.00 0.10 0.00 0.00 34.13 31.21 2b5m s GLU 787 CO 0.01 0.59 -0.11 0.08 0.02 0.00 0.00 175.26 175.85 2b5m s VAL 788 N -1.45 1.18 0.13 2.63 1.01 -0.47 -4.64 120.40 118.79 2b5m s VAL 788 Ca 0.33 -0.43 0.05 0.00 0.00 0.00 0.00 61.98 61.93 2b5m s VAL 788 Cb -0.13 -1.13 -0.04 0.00 0.00 0.00 0.00 36.38 35.08 2b5m s VAL 788 CO 0.21 0.38 0.09 -1.00 0.00 0.00 0.00 175.10 174.78 2b5m s HIS 789 N 1.26 3.11 0.08 5.22 3.76 -1.26 -1.07 115.29 126.38 2b5m s HIS 789 Ca -0.03 -0.00 -0.06 0.00 -0.15 0.00 0.00 55.06 54.82 2b5m s HIS 789 Cb -0.14 -1.53 -0.02 0.00 1.11 0.00 0.00 32.58 32.00 2b5m s HIS 789 CO -0.04 0.51 0.12 -0.80 -0.85 0.00 0.00 174.74 173.68 2b5m s ASN 790 N -2.77 0.24 -0.19 1.40 0.01 0.30 -1.64 114.94 112.29 2b5m s ASN 790 Ca 0.29 -0.79 -0.02 0.00 -0.71 0.00 0.00 52.86 51.63 2b5m s ASN 790 Cb -0.11 0.30 -0.00 0.00 0.41 0.00 0.00 41.25 41.84 2b5m s ASN 790 CO 0.22 -0.69 -0.09 -0.22 -1.51 0.00 0.00 177.10 174.80 2b5m s LEU 791 N -2.89 2.72 0.01 0.60 2.96 -0.90 -1.95 118.68 119.22 2b5m s LEU 791 Ca 0.06 -0.42 -0.01 0.00 -0.22 0.00 0.00 54.13 53.55 2b5m s LEU 791 Cb 0.06 -1.66 -0.04 0.00 0.50 0.00 0.00 46.19 45.05 2b5m s LEU 791 CO -0.10 0.03 0.13 -0.76 -1.32 0.00 0.00 176.35 174.33 2b5m s LEU 792 N 1.17 4.11 -0.32 -0.68 1.43 0.59 -1.44 118.68 123.54 2b5m s LEU 792 Ca 0.02 0.21 -0.01 0.00 -1.03 0.00 0.00 54.13 53.32 2b5m s LEU 792 Cb -0.14 -2.51 0.07 0.00 0.03 0.00 0.00 46.19 43.64 2b5m s LEU 792 CO -0.03 0.24 0.04 -0.63 0.23 0.00 0.00 176.35 176.20 2b5m s ILE 793 N -1.31 2.89 -0.19 -0.59 -1.09 0.76 -1.63 121.20 120.04 2b5m s ILE 793 Ca 0.27 -1.66 -0.12 0.00 -2.23 0.00 0.00 60.65 56.90 2b5m s ILE 793 Cb -0.12 -2.79 -0.05 0.00 -1.58 0.00 0.00 42.46 37.92 2b5m s ILE 793 CO 0.18 -0.28 0.22 -0.63 -1.23 0.00 0.00 174.94 173.20 2b5m s ILE 794 N 1.17 5.35 0.15 2.92 1.09 -0.66 -1.31 121.20 129.91 2b5m s ILE 794 Ca -0.01 0.37 -0.30 0.00 -1.10 0.00 0.00 60.65 59.60 2b5m s ILE 794 Cb -0.20 -3.56 -0.08 0.00 -1.06 0.00 0.00 42.46 37.56 2b5m s ILE 794 CO -0.03 0.39 1.27 -0.62 -0.10 0.00 0.00 174.94 175.85 2b5m s ASP 795 N 0.55 6.98 0.52 3.58 -1.08 -1.09 0.44 116.67 126.58 2b5m s ASP 795 Ca 0.12 2.24 0.31 0.00 -0.52 0.00 0.00 52.55 54.71 2b5m s ASP 795 Cb -0.12 -2.60 1.29 0.00 -1.46 0.00 0.00 42.92 40.03 2b5m s ASP 795 CO 0.02 -0.49 1.96 0.06 0.52 0.00 0.00 175.17 177.24 2b5m h GLN 796 N 5.95 0.00 0.00 4.34 3.07 -1.82 0.98 115.11 127.64 2b5m h GLN 796 Ca -0.43 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.31 2b5m h GLN 796 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.77 2b5m h GLN 796 CO 0.79 0.07 -0.24 0.45 0.09 0.00 0.00 178.83 179.99 2b5m h HIS 797 N 0.00 0.00 0.00 0.06 3.86 -1.91 -3.42 115.15 113.74 2b5m h HIS 797 Ca -0.00 0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 59.10 2b5m h HIS 797 Cb 0.54 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.00 2b5m h HIS 797 CO 0.00 0.00 -0.51 1.79 0.86 0.00 0.00 177.93 180.07 2b5m h THR 798 N -0.58 1.11 -2.34 2.45 1.35 -1.97 -3.47 112.91 109.45 2b5m h THR 798 Ca 0.00 -1.92 -0.38 0.00 -0.55 0.00 0.00 66.41 63.56 2b5m h THR 798 Cb 0.24 2.12 -0.04 0.00 -1.73 0.00 0.00 68.15 68.74 2b5m h THR 798 CO 0.00 0.50 -0.46 0.49 -0.25 0.00 0.00 175.52 175.80 2b5m n PHE 799 N -3.56 -0.72 -2.61 4.73 3.01 0.34 -4.97 117.46 113.67 2b5m n PHE 799 Ca -0.00 0.00 -0.30 0.00 1.01 0.00 0.00 57.45 58.15 2b5m n PHE 799 Cb 0.60 -3.59 -0.02 0.00 -0.01 0.00 0.00 39.48 36.46 2b5m n PHE 799 CO 0.00 0.00 0.00 -1.21 1.01 0.00 0.00 176.76 176.56 2b5m s GLU 800 N -4.68 3.77 -0.98 -1.08 2.02 -1.26 -4.75 118.70 111.74 2b5m s GLU 800 Ca 0.00 0.58 -0.22 0.00 0.02 0.00 0.00 54.97 55.35 2b5m s GLU 800 Cb 0.00 -2.29 0.07 0.00 0.10 0.00 0.00 34.13 32.00 2b5m s GLU 800 CO 0.00 -0.17 1.37 0.08 0.02 0.00 0.00 175.26 176.55 2b5m s VAL 801 N -2.57 4.09 0.10 2.63 1.01 -1.26 -2.69 120.40 121.72 2b5m s VAL 801 Ca 0.53 -0.87 -0.27 0.00 0.00 0.00 0.00 61.98 61.37 2b5m s VAL 801 Cb -0.10 -4.99 -0.11 0.00 0.00 0.00 0.00 36.38 31.18 2b5m s VAL 801 CO 0.35 -1.84 1.67 -0.07 0.00 0.00 0.00 175.10 175.21 2b5m h LEU 802 N 12.28 -0.52 -7.68 3.92 3.38 -1.56 -1.57 115.31 123.56 2b5m h LEU 802 Ca 0.16 0.05 -0.14 0.00 0.09 0.00 0.00 57.88 58.04 2b5m h LEU 802 Cb 1.02 0.18 -0.21 0.00 0.09 0.00 0.00 40.66 41.74 2b5m h LEU 802 CO 1.35 -0.29 -0.44 -2.28 0.09 0.00 0.00 178.44 176.87 2b5m s HIS 803 N -6.11 -0.03 -0.06 1.13 5.04 -1.18 -1.58 115.29 112.52 2b5m s HIS 803 Ca -0.15 0.00 -0.00 0.00 -1.54 0.00 0.00 55.06 53.37 2b5m s HIS 803 Cb 0.07 -0.01 0.02 0.00 0.04 0.00 0.00 32.58 32.71 2b5m s HIS 803 CO 0.65 -0.30 -0.02 0.00 -2.34 0.00 0.00 174.74 172.73 2b5m s ALA 804 N -1.26 0.70 -0.16 1.58 0.00 -1.10 -0.17 121.76 121.33 2b5m s ALA 804 Ca -0.13 -0.10 -0.06 0.00 0.00 0.00 0.00 51.96 51.67 2b5m s ALA 804 Cb -0.07 -0.58 -0.03 0.00 0.00 0.00 0.00 23.12 22.44 2b5m s ALA 804 CO 0.02 -0.24 0.02 -1.58 0.00 0.00 0.00 175.76 173.98 2b5m s HIS 805 N 1.43 3.16 -0.07 0.00 5.04 -0.52 -2.72 115.29 121.61 2b5m s HIS 805 Ca -0.03 -0.06 -0.04 0.00 -1.54 0.00 0.00 55.06 53.40 2b5m s HIS 805 Cb -0.13 -2.01 -0.04 0.00 0.04 0.00 0.00 32.58 30.44 2b5m s HIS 805 CO -0.03 0.11 0.10 -1.14 -2.34 0.00 0.00 174.74 171.44 2b5m s GLN 806 N 0.25 3.24 0.38 2.88 0.74 -0.28 -2.13 119.66 124.75 2b5m s GLN 806 Ca 0.01 -0.31 -0.03 0.00 0.05 0.00 0.00 55.36 55.09 2b5m s GLN 806 Cb -0.13 -3.00 0.08 0.00 1.10 0.00 0.00 33.01 31.06 2b5m s GLN 806 CO 0.01 0.72 0.52 1.19 -0.55 0.00 0.00 175.29 177.19 2b5m n PHE 807 N 1.71 -3.45 -1.29 1.67 3.01 -0.65 -0.62 117.46 117.83 2b5m n PHE 807 Ca -0.17 -0.74 -0.31 0.00 1.01 0.00 0.00 57.45 57.25 2b5m n PHE 807 Cb 0.54 -0.39 0.10 0.00 -0.01 0.00 0.00 39.48 39.72 2b5m n PHE 807 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 2b5m s LEU 808 N 0.00 2.78 0.46 4.37 1.43 -1.26 -4.59 118.68 121.88 2b5m s LEU 808 Ca 0.33 1.67 -0.24 0.00 -1.03 0.00 0.00 54.13 54.86 2b5m s LEU 808 Cb -0.01 -4.30 -0.08 0.00 0.03 0.00 0.00 46.19 41.82 2b5m s LEU 808 CO 0.22 -2.16 1.24 0.00 0.23 0.00 0.00 176.35 175.88 2b5m n GLN 809 N -3.59 1.74 -2.42 1.70 6.02 -1.26 -2.32 117.38 117.25 2b5m n GLN 809 Ca 0.08 0.63 -0.05 0.00 -0.01 0.00 0.00 57.00 57.65 2b5m n GLN 809 Cb 0.54 -2.38 -0.00 0.00 1.02 0.00 0.00 30.24 29.42 2b5m n GLN 809 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2b5m n ASN 810 N -0.11 -2.18 -4.66 1.08 3.02 -1.26 -4.91 115.26 106.23 2b5m n ASN 810 Ca 0.08 0.36 -0.35 0.00 -0.03 0.00 0.00 54.58 54.65 2b5m n ASN 810 Cb 0.41 -1.96 -0.09 0.00 -0.61 0.00 0.00 39.78 37.54 2b5m n ASN 810 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 2b5m s GLU 811 N -4.90 4.05 -0.16 3.52 2.12 -0.98 -1.11 118.70 121.24 2b5m s GLU 811 Ca 0.00 -0.30 -0.04 0.00 0.36 0.00 0.00 54.97 54.99 2b5m s GLU 811 Cb 0.00 -3.30 -0.02 0.00 0.26 0.00 0.00 34.13 31.06 2b5m s GLU 811 CO 0.00 0.26 -0.04 0.71 -0.54 0.00 0.00 175.26 175.65 2b5m s TYR 812 N 0.42 3.01 0.04 5.30 4.12 -0.53 -4.31 117.35 125.40 2b5m s TYR 812 Ca 0.05 -0.38 -0.28 0.00 0.02 0.00 0.00 57.07 56.48 2b5m s TYR 812 Cb -0.12 -1.97 -0.05 0.00 -1.52 0.00 0.00 41.96 38.30 2b5m s TYR 812 CO -0.00 -0.10 0.88 0.00 0.02 0.00 0.00 175.55 176.35 2b5m s ALA 813 N 0.50 3.26 -0.00 3.71 0.00 -1.26 -0.88 121.76 127.09 2b5m s ALA 813 Ca -0.03 0.44 0.02 0.00 0.00 0.00 0.00 51.96 52.38 2b5m s ALA 813 Cb -0.14 -3.18 -0.02 0.00 0.00 0.00 0.00 23.12 19.77 2b5m s ALA 813 CO 0.03 -0.07 0.04 1.28 0.00 0.00 0.00 175.76 177.04 2b5m n LEU 814 N 3.21 0.00 -3.94 0.00 4.77 0.18 -4.97 117.00 116.25 2b5m n LEU 814 Ca 0.02 -0.02 -0.10 0.00 -0.03 0.00 0.00 56.01 55.88 2b5m n LEU 814 Cb 0.50 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.49 2b5m n LEU 814 CO 0.50 0.00 -0.28 -0.94 -1.33 0.00 0.00 177.39 175.34 2b5m s SER 815 N -2.14 0.18 -0.04 -1.43 1.04 -1.02 -4.80 113.70 105.48 2b5m s SER 815 Ca -0.01 -0.44 -0.03 0.00 0.48 0.00 0.00 55.95 55.95 2b5m s SER 815 Cb 0.01 0.16 0.02 0.00 0.10 0.00 0.00 66.02 66.30 2b5m s SER 815 CO 0.06 -0.37 0.09 -0.22 0.98 0.00 0.00 173.24 173.78 2b5m s LEU 816 N -1.63 1.47 0.02 2.42 2.96 -1.26 -1.62 118.68 121.03 2b5m s LEU 816 Ca -0.12 0.18 0.01 0.00 -0.22 0.00 0.00 54.13 53.97 2b5m s LEU 816 Cb -0.07 0.27 -0.01 0.00 0.50 0.00 0.00 46.19 46.88 2b5m s LEU 816 CO -0.01 -0.06 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.24 2b5m s VAL 817 N 0.32 0.20 -0.24 1.68 1.01 -0.63 -4.93 120.40 117.81 2b5m s VAL 817 Ca -0.02 -0.63 -0.03 0.00 0.00 0.00 0.00 61.98 61.30 2b5m s VAL 817 Cb -0.03 -0.27 0.01 0.00 0.00 0.00 0.00 36.38 36.08 2b5m s VAL 817 CO -0.01 -0.28 -0.05 -0.55 0.00 0.00 0.00 175.10 174.21 2b5m s SER 818 N -0.96 4.31 0.29 3.32 0.15 -1.26 -0.85 113.70 118.70 2b5m s SER 818 Ca -0.09 -0.62 -0.20 0.00 0.70 0.00 0.00 55.95 55.75 2b5m s SER 818 Cb -0.07 -1.71 0.04 0.00 -1.71 0.00 0.00 66.02 62.58 2b5m s SER 818 CO -0.00 -0.08 0.81 0.00 1.20 0.00 0.00 173.24 175.17 2b5m s LYS 820 N -3.11 3.43 0.01 0.00 1.02 -1.26 -0.88 119.74 118.95 2b5m s LYS 820 Ca 0.14 -0.21 0.05 0.00 0.02 0.00 0.00 55.97 55.97 2b5m s LYS 820 Cb -0.05 -3.15 -0.02 0.00 -0.52 0.00 0.00 37.83 34.10 2b5m s LYS 820 CO 0.08 0.74 -0.15 -0.51 -0.92 0.00 0.00 175.35 174.59 2b5m s LEU 821 N -1.36 2.09 0.00 3.17 1.43 -1.26 -4.98 118.68 117.76 2b5m s LEU 821 Ca 0.19 -0.35 0.00 0.00 -1.03 0.00 0.00 54.13 52.95 2b5m s LEU 821 Cb -0.12 -0.72 0.00 0.00 0.03 0.00 0.00 46.19 45.38 2b5m s LEU 821 CO 0.09 0.13 0.00 0.61 0.23 0.00 0.00 176.35 177.41 2b5m n GLY 822 N 2.37 1.00 0.00 -3.19 0.00 -0.84 -2.37 105.19 102.16 2b5m n GLY 822 Ca -0.16 -0.67 0.15 0.00 0.00 0.00 0.00 46.02 45.34 2b5m n GLY 822 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2b5m n LYS 823 N 0.00 0.48 -1.94 1.61 5.02 -1.26 -4.86 118.16 117.20 2b5m n LYS 823 Ca 0.00 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.87 2b5m n LYS 823 Cb 0.00 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.48 2b5m n LYS 823 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2b5m s ASP 824 N -2.51 6.59 0.13 4.39 -1.08 -1.00 -4.92 116.67 118.27 2b5m s ASP 824 Ca 0.30 2.63 -0.12 0.00 -0.52 0.00 0.00 52.55 54.84 2b5m s ASP 824 Cb 0.20 -2.60 -0.07 0.00 -1.46 0.00 0.00 42.92 39.00 2b5m s ASP 824 CO 0.45 -0.81 1.44 -0.65 0.52 0.00 0.00 175.17 176.12 2b5m h PRO 825 N 6.48 0.87 -6.37 4.34 0.11 -1.89 -3.38 132.00 132.16 2b5m h PRO 825 Ca -0.43 -0.49 -0.50 0.00 0.11 0.00 0.00 66.00 64.69 2b5m h PRO 825 Cb 1.21 0.03 0.24 0.00 0.11 0.00 0.00 31.00 32.59 2b5m h PRO 825 CO 0.89 1.13 -1.59 0.09 -0.21 0.00 0.00 178.00 178.31 2b5m n ASN 826 N -4.09 -3.29 -3.97 -2.05 3.02 -1.26 -4.96 115.26 98.66 2b5m n ASN 826 Ca -0.03 0.07 -0.30 0.00 -0.03 0.00 0.00 54.58 54.29 2b5m n ASN 826 Cb 0.55 -0.85 -0.16 0.00 -0.61 0.00 0.00 39.78 38.72 2b5m n ASN 826 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2b5m s THR 827 N -2.16 1.59 0.40 3.41 2.01 -1.26 -4.43 115.64 115.20 2b5m s THR 827 Ca 0.47 -1.14 -0.00 0.00 0.31 0.00 0.00 61.69 61.34 2b5m s THR 827 Cb -0.09 -1.77 -0.02 0.00 0.01 0.00 0.00 72.50 70.63 2b5m s THR 827 CO 0.70 0.02 0.62 -0.31 -0.69 0.00 0.00 174.62 174.95 2b5m s TYR 828 N 1.39 3.41 -0.19 4.92 1.51 -0.05 -4.73 117.35 123.61 2b5m s TYR 828 Ca -0.04 0.36 -0.13 0.00 -1.01 0.00 0.00 57.07 56.25 2b5m s TYR 828 Cb -0.18 -2.08 -0.05 0.00 -0.11 0.00 0.00 41.96 39.55 2b5m s TYR 828 CO -0.07 -0.08 0.27 -0.06 -1.11 0.00 0.00 175.55 174.50 2b5m s PHE 829 N -2.44 3.41 -0.03 2.71 0.08 -0.66 -2.13 117.98 118.92 2b5m s PHE 829 Ca 0.44 0.51 0.07 0.00 0.12 0.00 0.00 56.93 58.06 2b5m s PHE 829 Cb -0.10 -2.35 -0.02 0.00 -0.57 0.00 0.00 43.02 39.98 2b5m s PHE 829 CO 0.38 0.16 -0.24 0.42 -0.10 0.00 0.00 175.22 175.84 2b5m s ILE 830 N 0.73 2.23 -0.04 0.64 1.01 -0.03 -0.56 121.20 125.20 2b5m s ILE 830 Ca 0.14 -1.04 0.03 0.00 0.00 0.00 0.00 60.65 59.79 2b5m s ILE 830 Cb -0.13 -1.79 0.00 0.00 0.01 0.00 0.00 42.46 40.55 2b5m s ILE 830 CO 0.04 0.58 -0.13 -0.69 0.00 0.00 0.00 174.94 174.74 2b5m s VAL 831 N -0.62 1.09 -0.16 2.92 1.01 -0.50 -1.61 120.40 122.53 2b5m s VAL 831 Ca 0.10 -0.52 -0.10 0.00 0.00 0.00 0.00 61.98 61.45 2b5m s VAL 831 Cb -0.10 -0.96 -0.05 0.00 0.00 0.00 0.00 36.38 35.27 2b5m s VAL 831 CO -0.01 0.33 0.17 -0.83 0.00 0.00 0.00 175.10 174.76 2b5m s GLY 832 N 0.17 2.12 0.42 4.51 0.00 -0.64 -0.90 107.32 113.00 2b5m s GLY 832 Ca -0.04 -0.61 0.03 0.00 0.00 0.00 0.00 44.72 44.09 2b5m s GLY 832 CO 0.01 0.05 0.12 -1.30 0.00 0.00 0.00 173.10 171.98 2b5m n THR 833 N 3.02 0.00 -3.71 0.90 -2.24 0.26 -0.65 114.28 111.86 2b5m n THR 833 Ca -0.16 -2.36 -0.11 0.00 -2.27 0.00 0.00 64.05 59.14 2b5m n THR 833 Cb 0.53 0.78 -0.12 0.00 -2.10 0.00 0.00 70.33 69.42 2b5m n THR 833 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2b5m s ALA 834 N -3.06 -0.81 -0.58 6.98 0.00 -0.06 -2.32 121.76 121.91 2b5m s ALA 834 Ca 0.17 1.27 -0.28 0.00 0.00 0.00 0.00 51.96 53.11 2b5m s ALA 834 Cb 0.01 -0.78 0.02 0.00 0.00 0.00 0.00 23.12 22.37 2b5m s ALA 834 CO 0.12 -0.23 1.34 -1.64 0.00 0.00 0.00 175.76 175.34 2b5m s MET 835 N 1.31 3.36 -0.88 0.00 -1.94 0.93 -1.46 119.30 120.62 2b5m s MET 835 Ca -0.09 0.35 -0.14 0.00 -1.71 0.00 0.00 55.69 54.09 2b5m s MET 835 Cb -0.09 -4.09 0.21 0.00 2.01 0.00 0.00 34.83 32.87 2b5m s MET 835 CO -0.10 -1.87 0.87 0.08 -0.01 0.00 0.00 175.02 173.98 2b5m s VAL 836 N 5.69 5.53 0.11 -6.03 1.01 -0.27 -4.54 120.40 121.90 2b5m s VAL 836 Ca 0.48 -2.46 -0.28 0.00 0.00 0.00 0.00 61.98 59.73 2b5m s VAL 836 Cb -0.10 -4.54 -0.06 0.00 0.00 0.00 0.00 36.38 31.69 2b5m s VAL 836 CO 0.24 -1.12 0.87 -0.31 0.00 0.00 0.00 175.10 174.78 2b5m s TYR 837 N 0.38 3.82 0.11 5.22 4.12 -1.26 -4.84 117.35 124.89 2b5m s TYR 837 Ca 0.22 1.68 -0.25 0.00 0.02 0.00 0.00 57.07 58.74 2b5m s TYR 837 Cb -0.09 -2.93 -0.07 0.00 -1.52 0.00 0.00 41.96 37.35 2b5m s TYR 837 CO -0.09 0.30 1.42 -1.35 0.02 0.00 0.00 175.55 175.85 2b5m h PRO 838 N 5.28 -0.14 0.00 -1.71 0.11 -1.95 -3.35 132.00 130.24 2b5m h PRO 838 Ca -0.44 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.68 2b5m h PRO 838 Cb 1.21 0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2b5m h PRO 838 CO 0.70 -0.09 0.00 -0.85 -0.21 0.00 0.00 178.00 177.55 2b5m n GLU 839 N -4.76 0.00 -1.53 1.05 0.28 -1.26 -4.73 120.64 109.69 2b5m n GLU 839 Ca -0.00 0.00 -0.38 0.00 -0.16 0.00 0.00 57.16 56.61 2b5m n GLU 839 Cb 0.23 -0.34 -0.06 0.00 1.43 0.00 0.00 31.44 32.70 2b5m n GLU 839 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 2b5m n GLU 840 N 0.00 0.86 0.00 3.44 4.71 -1.26 -4.91 120.64 123.48 2b5m n GLU 840 Ca 0.00 0.04 0.00 0.00 -0.01 0.00 0.00 57.16 57.19 2b5m n GLU 840 Cb 0.00 -2.96 0.00 0.00 -1.01 0.00 0.00 31.44 27.47 2b5m n GLU 840 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2b5m n ALA 841 N 14.22 0.00 -1.57 0.62 0.00 -1.26 -4.65 120.51 127.87 2b5m n ALA 841 Ca 0.43 0.00 -0.46 0.00 0.00 0.00 0.00 53.44 53.41 2b5m n ALA 841 Cb 0.41 0.10 -0.04 0.00 0.00 0.00 0.00 19.45 19.92 2b5m n ALA 841 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2b5m n GLU 842 N -0.62 1.77 -1.50 0.00 0.00 -1.26 -4.82 120.64 114.21 2b5m n GLU 842 Ca 0.00 0.52 -0.52 0.00 0.00 0.00 0.00 57.16 57.16 2b5m n GLU 842 Cb 0.00 -2.92 -0.05 0.00 0.00 0.00 0.00 31.44 28.47 2b5m n GLU 842 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.13 174.83 2b5m n PRO 843 N 8.28 0.46 -0.04 5.31 -0.02 -1.26 -4.91 135.00 142.81 2b5m n PRO 843 Ca 0.32 0.16 0.02 0.00 -2.02 0.00 0.00 63.50 61.98 2b5m n PRO 843 Cb 0.36 -1.51 -0.13 0.00 -0.02 0.00 0.00 33.50 32.20 2b5m n PRO 843 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2b5m n LYS 844 N 1.43 0.87 -4.04 -0.52 4.01 -1.26 -4.27 118.16 114.38 2b5m n LYS 844 Ca 0.17 -0.10 -0.10 0.00 -0.51 0.00 0.00 58.31 57.78 2b5m n LYS 844 Cb 0.20 -1.41 -0.11 0.00 -0.51 0.00 0.00 35.03 33.19 2b5m n LYS 844 CO 0.00 0.00 0.00 -0.65 -1.11 0.00 0.00 177.40 175.64 2b5m s GLN 845 N -2.87 0.47 0.30 1.97 -0.21 -1.26 -3.18 119.66 114.88 2b5m s GLN 845 Ca -0.07 -0.84 -0.20 0.00 0.02 0.00 0.00 55.36 54.28 2b5m s GLN 845 Cb 0.08 0.00 0.03 0.00 1.00 0.00 0.00 33.01 34.13 2b5m s GLN 845 CO 0.70 -0.03 0.76 0.20 -2.12 0.00 0.00 175.29 174.80 2b5m s GLY 846 N -1.93 0.03 0.10 3.09 0.00 -0.89 -0.05 107.32 107.68 2b5m s GLY 846 Ca -0.07 -0.41 0.06 0.00 0.00 0.00 0.00 44.72 44.30 2b5m s GLY 846 CO -0.03 -0.09 -0.15 0.50 0.00 0.00 0.00 173.10 173.34 2b5m s ARG 847 N -3.39 0.97 -0.31 2.90 0.52 -1.25 -1.66 118.95 116.73 2b5m s ARG 847 Ca 0.13 -1.14 0.02 0.00 -0.52 0.00 0.00 55.73 54.21 2b5m s ARG 847 Cb -0.05 -0.92 0.08 0.00 0.52 0.00 0.00 34.95 34.57 2b5m s ARG 847 CO 0.08 0.19 0.00 0.42 0.02 0.00 0.00 175.30 176.01 2b5m s ILE 848 N -1.79 2.47 -0.09 1.52 1.01 -0.56 -0.58 121.20 123.18 2b5m s ILE 848 Ca 0.05 -1.90 -0.09 0.00 0.00 0.00 0.00 60.65 58.72 2b5m s ILE 848 Cb -0.07 -2.61 -0.04 0.00 0.01 0.00 0.00 42.46 39.75 2b5m s ILE 848 CO 0.03 -0.32 0.20 -0.69 0.00 0.00 0.00 174.94 174.16 2b5m s VAL 849 N 1.06 5.40 -0.20 2.92 1.01 -0.08 -3.89 120.40 126.61 2b5m s VAL 849 Ca 0.01 0.35 -0.05 0.00 0.00 0.00 0.00 61.98 62.28 2b5m s VAL 849 Cb -0.20 -3.47 -0.02 0.00 0.00 0.00 0.00 36.38 32.68 2b5m s VAL 849 CO -0.05 0.60 -0.00 -0.69 0.00 0.00 0.00 175.10 174.96 2b5m s VAL 850 N -1.05 3.90 0.07 2.92 1.01 0.16 -1.41 120.40 126.00 2b5m s VAL 850 Ca 0.17 -0.33 0.08 0.00 0.00 0.00 0.00 61.98 61.91 2b5m s VAL 850 Cb -0.13 -2.77 -0.04 0.00 0.00 0.00 0.00 36.38 33.45 2b5m s VAL 850 CO 0.07 0.43 -0.19 -0.36 0.00 0.00 0.00 175.10 175.04 2b5m s PHE 851 N 1.04 2.52 -0.05 5.22 2.99 0.28 -0.81 117.98 129.17 2b5m s PHE 851 Ca 0.02 -0.27 0.06 0.00 0.00 0.00 0.00 56.93 56.73 2b5m s PHE 851 Cb -0.14 -1.41 -0.01 0.00 0.00 0.00 0.00 43.02 41.46 2b5m s PHE 851 CO 0.01 0.30 -0.24 -1.14 -0.00 0.00 0.00 175.22 174.15 2b5m s GLN 852 N -1.70 2.42 -0.27 0.44 0.74 -0.45 -1.66 119.66 119.18 2b5m s GLN 852 Ca 0.16 -0.87 -0.07 0.00 0.05 0.00 0.00 55.36 54.63 2b5m s GLN 852 Cb -0.10 -2.07 -0.00 0.00 1.10 0.00 0.00 33.01 31.93 2b5m s GLN 852 CO 0.07 0.37 0.06 -0.47 -0.55 0.00 0.00 175.29 174.77 2b5m s TYR 853 N -0.16 3.10 0.00 1.67 5.04 -1.26 0.48 117.35 126.22 2b5m s TYR 853 Ca -0.03 -0.81 0.00 0.00 -2.44 0.00 0.00 57.07 53.79 2b5m s TYR 853 Cb -0.13 -2.23 0.00 0.00 0.35 0.00 0.00 41.96 39.95 2b5m s TYR 853 CO 0.03 -0.51 0.00 0.43 -1.34 0.00 0.00 175.55 174.16 2b5m n SER 854 N 4.87 0.00 -0.13 4.32 7.64 -0.70 -4.90 113.62 124.73 2b5m n SER 854 Ca -0.15 0.00 0.03 0.00 1.01 0.00 0.00 58.87 59.76 2b5m n SER 854 Cb 0.49 0.00 0.07 0.00 -1.01 0.00 0.00 64.21 63.76 2b5m n SER 854 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2b5m n ASP 855 N 0.00 -0.10 0.00 6.43 2.03 -1.26 -3.97 116.55 119.67 2b5m n ASP 855 Ca 0.00 0.64 0.00 0.00 0.52 0.00 0.00 54.79 55.95 2b5m n ASP 855 Cb 0.00 -0.21 0.00 0.00 -0.72 0.00 0.00 41.12 40.19 2b5m n ASP 855 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2b5m n GLY 856 N -1.22 0.40 3.71 0.27 0.00 -1.26 -5.16 105.19 101.93 2b5m n GLY 856 Ca 0.07 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.85 2b5m n GLY 856 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2b5m s LYS 857 N 0.00 2.27 -0.42 1.61 1.02 -1.26 -5.01 119.74 117.96 2b5m s LYS 857 Ca 0.00 -1.65 0.02 0.00 0.02 0.00 0.00 55.97 54.36 2b5m s LYS 857 Cb 0.00 -2.08 0.11 0.00 -0.52 0.00 0.00 37.83 35.35 2b5m s LYS 857 CO 0.00 0.08 0.16 -1.17 -0.92 0.00 0.00 175.35 173.50 2b5m s LEU 858 N -3.82 4.82 0.55 3.17 1.98 -1.25 -1.72 118.68 122.41 2b5m s LEU 858 Ca 0.38 -2.36 -0.11 0.00 -2.89 0.00 0.00 54.13 49.15 2b5m s LEU 858 Cb -0.01 -1.69 -0.05 0.00 0.66 0.00 0.00 46.19 45.10 2b5m s LEU 858 CO 0.22 -0.38 0.94 -1.10 -1.89 0.00 0.00 176.35 174.13 2b5m s GLN 859 N 0.63 3.67 -0.84 1.98 -0.21 0.18 -4.89 119.66 120.17 2b5m s GLN 859 Ca 0.12 0.63 0.01 0.00 0.02 0.00 0.00 55.36 56.14 2b5m s GLN 859 Cb -0.21 -2.19 0.22 0.00 1.00 0.00 0.00 33.01 31.83 2b5m s GLN 859 CO -0.05 -0.37 0.79 2.41 -2.12 0.00 0.00 175.29 175.94 2b5m n THR 860 N -2.27 2.87 -0.07 -0.19 -1.04 -1.26 -1.34 114.28 110.97 2b5m n THR 860 Ca 0.04 -5.16 -0.10 0.00 -2.04 0.00 0.00 64.05 56.79 2b5m n THR 860 Cb 0.54 -2.27 -0.04 0.00 -1.82 0.00 0.00 70.33 66.74 2b5m n THR 860 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 2b5m h VAL 861 N 3.90 0.18 -3.99 12.58 2.07 -1.31 -3.46 116.25 126.21 2b5m h VAL 861 Ca 0.17 0.00 -0.12 0.00 0.82 0.00 0.00 66.70 67.57 2b5m h VAL 861 Cb 0.75 0.18 -0.13 0.00 -1.52 0.00 0.00 31.29 30.57 2b5m h VAL 861 CO 0.87 0.00 -0.38 0.00 0.02 0.00 0.00 177.57 178.08 2b5m s ALA 862 N -5.92 0.18 0.19 1.67 0.00 -1.15 -4.98 121.76 111.74 2b5m s ALA 862 Ca -0.15 -1.02 0.00 0.00 0.00 0.00 0.00 51.96 50.79 2b5m s ALA 862 Cb 0.11 0.89 0.00 0.00 0.00 0.00 0.00 23.12 24.12 2b5m s ALA 862 CO 0.66 -0.63 0.00 -1.91 0.00 0.00 0.00 175.76 173.88 2b5m n GLU 863 N -0.20 0.00 -2.80 0.00 2.13 -1.26 0.38 120.64 118.89 2b5m n GLU 863 Ca -0.06 0.00 -0.03 0.00 0.66 0.00 0.00 57.16 57.72 2b5m n GLU 863 Cb 0.63 -0.25 -0.03 0.00 0.27 0.00 0.00 31.44 32.06 2b5m n GLU 863 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 2b5m n LYS 864 N -3.45 -3.25 -2.34 5.31 4.81 -1.25 -3.04 118.16 114.95 2b5m n LYS 864 Ca 0.00 2.56 -0.34 0.00 -0.87 0.00 0.00 58.31 59.66 2b5m n LYS 864 Cb 0.02 -3.34 -0.01 0.00 0.02 0.00 0.00 35.03 31.71 2b5m n LYS 864 CO 0.00 0.00 0.00 -2.00 1.17 0.00 0.00 177.40 176.57 2b5m s GLU 865 N -0.42 3.56 0.03 1.64 2.12 -1.26 -1.50 118.70 122.88 2b5m s GLU 865 Ca -0.17 1.37 -0.10 0.00 0.36 0.00 0.00 54.97 56.43 2b5m s GLU 865 Cb 0.01 -2.06 0.01 0.00 0.26 0.00 0.00 34.13 32.35 2b5m s GLU 865 CO 0.47 -0.64 0.21 0.08 -0.54 0.00 0.00 175.26 174.85 2b5m s VAL 866 N -2.07 0.10 -0.88 3.70 1.01 -0.66 -4.93 120.40 116.66 2b5m s VAL 866 Ca 0.67 -0.83 -0.00 0.00 0.00 0.00 0.00 61.98 61.82 2b5m s VAL 866 Cb -0.18 -0.86 0.34 0.00 0.00 0.00 0.00 36.38 35.68 2b5m s VAL 866 CO 0.26 -0.46 1.74 0.29 0.00 0.00 0.00 175.10 176.94 2b5m n LYS 867 N 0.77 4.24 0.00 2.72 5.02 -1.26 -2.10 118.16 127.54 2b5m n LYS 867 Ca -0.19 -4.33 0.00 0.00 -2.02 0.00 0.00 58.31 51.77 2b5m n LYS 867 Cb 0.58 -2.37 0.00 0.00 -0.02 0.00 0.00 35.03 33.23 2b5m n LYS 867 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2b5m n GLY 868 N -0.26 -0.40 3.80 0.72 0.00 -1.19 -4.61 105.19 103.26 2b5m n GLY 868 Ca 0.47 -1.49 -0.34 0.00 0.00 0.00 0.00 46.02 44.66 2b5m n GLY 868 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b5m s ALA 869 N -1.75 2.93 -0.63 4.61 0.00 -1.26 -2.94 121.76 122.73 2b5m s ALA 869 Ca 0.00 0.58 -0.02 0.00 0.00 0.00 0.00 51.96 52.52 2b5m s ALA 869 Cb 0.00 -3.24 0.16 0.00 0.00 0.00 0.00 23.12 20.04 2b5m s ALA 869 CO 0.00 -0.22 0.44 0.08 0.00 0.00 0.00 175.76 176.06 2b5m s VAL 870 N -1.97 3.64 0.25 0.00 1.01 -0.98 -1.90 120.40 120.46 2b5m s VAL 870 Ca 0.65 -3.02 0.05 0.00 0.00 0.00 0.00 61.98 59.66 2b5m s VAL 870 Cb -0.16 -3.38 -0.03 0.00 0.00 0.00 0.00 36.38 32.81 2b5m s VAL 870 CO 0.20 -0.88 1.59 1.88 0.00 0.00 0.00 175.10 177.89 2b5m h TYR 871 N 6.95 0.27 -1.77 5.22 -1.99 -1.76 -3.37 116.97 120.51 2b5m h TYR 871 Ca -0.01 -0.10 0.16 0.00 2.00 0.00 0.00 58.73 60.78 2b5m h TYR 871 Cb 0.94 -0.05 -0.19 0.00 2.00 0.00 0.00 36.73 39.44 2b5m h TYR 871 CO 0.70 0.73 0.65 -1.54 -0.00 0.00 0.00 178.16 178.70 2b5m s SER 872 N -6.89 -0.26 0.09 3.88 1.04 -1.25 -4.61 113.70 105.70 2b5m s SER 872 Ca -0.04 0.09 -0.13 0.00 0.48 0.00 0.00 55.95 56.35 2b5m s SER 872 Cb 0.12 0.26 0.02 0.00 0.10 0.00 0.00 66.02 66.52 2b5m s SER 872 CO 0.79 -0.39 0.31 0.00 0.98 0.00 0.00 173.24 174.93 2b5m s MET 873 N -2.33 0.93 -0.01 4.02 0.23 -1.26 -0.41 119.30 120.47 2b5m s MET 873 Ca 0.05 -0.73 -0.12 0.00 -1.03 0.00 0.00 55.69 53.86 2b5m s MET 873 Cb -0.01 0.40 0.02 0.00 -1.53 0.00 0.00 34.83 33.71 2b5m s MET 873 CO -0.05 -0.33 0.26 0.54 -2.03 0.00 0.00 175.02 173.41 2b5m s VAL 874 N -3.48 0.06 -0.19 5.16 0.11 0.78 -4.85 120.40 117.99 2b5m s VAL 874 Ca 0.01 -0.53 -0.29 0.00 -2.93 0.00 0.00 61.98 58.24 2b5m s VAL 874 Cb 0.02 -0.55 -0.02 0.00 -1.53 0.00 0.00 36.38 34.30 2b5m s VAL 874 CO -0.09 -0.29 1.36 -0.70 -3.33 0.00 0.00 175.10 172.04 2b5m s GLU 875 N -1.31 4.11 0.00 1.54 -6.30 -1.26 -1.63 118.70 113.85 2b5m s GLU 875 Ca -0.14 1.64 0.00 0.00 -2.50 0.00 0.00 54.97 53.97 2b5m s GLU 875 Cb -0.06 -3.84 0.00 0.00 0.00 0.00 0.00 34.13 30.23 2b5m s GLU 875 CO 0.03 -0.87 0.00 0.34 0.02 0.00 0.00 175.26 174.78 2b5m n PHE 876 N 7.08 0.00 -0.08 5.30 7.35 -1.22 -4.93 117.46 130.97 2b5m n PHE 876 Ca 0.15 0.00 -0.13 0.00 -0.76 0.00 0.00 57.45 56.71 2b5m n PHE 876 Cb 0.45 0.00 -0.06 0.00 0.35 0.00 0.00 39.48 40.22 2b5m n PHE 876 CO 0.00 0.00 0.00 0.09 -0.76 0.00 0.00 176.76 176.09 2b5m n ASN 877 N 0.00 2.25 0.00 -2.13 3.02 -1.26 -4.89 115.26 112.25 2b5m n ASN 877 Ca 0.00 0.01 0.00 0.00 -0.03 0.00 0.00 54.58 54.56 2b5m n ASN 877 Cb 0.00 -0.31 0.00 0.00 -0.61 0.00 0.00 39.78 38.86 2b5m n ASN 877 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2b5m n GLY 878 N 2.53 0.33 0.00 7.41 0.00 -1.26 -5.00 105.19 109.19 2b5m n GLY 878 Ca -0.28 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.74 2b5m n GLY 878 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2b5m n LYS 879 N 0.00 0.80 -4.52 1.61 5.02 -1.26 -1.99 118.16 117.82 2b5m n LYS 879 Ca 0.00 0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 56.02 2b5m n LYS 879 Cb 0.00 0.00 -0.17 0.00 -0.02 0.00 0.00 35.03 34.84 2b5m n LYS 879 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2b5m s LEU 880 N 0.00 1.67 -0.25 -0.35 2.96 0.18 -3.37 118.68 119.52 2b5m s LEU 880 Ca 0.00 -0.38 -0.08 0.00 -0.22 0.00 0.00 54.13 53.45 2b5m s LEU 880 Cb 0.00 -0.99 -0.04 0.00 0.50 0.00 0.00 46.19 45.67 2b5m s LEU 880 CO 0.00 0.02 0.10 -0.22 -1.32 0.00 0.00 176.35 174.93 2b5m s LEU 881 N 0.87 3.62 0.14 -0.68 2.96 -0.65 0.12 118.68 125.07 2b5m s LEU 881 Ca -0.10 -0.13 0.07 0.00 -0.22 0.00 0.00 54.13 53.76 2b5m s LEU 881 Cb -0.15 -1.98 -0.04 0.00 0.50 0.00 0.00 46.19 44.52 2b5m s LEU 881 CO 0.01 -0.02 -0.16 0.00 -1.32 0.00 0.00 176.35 174.86 2b5m s ALA 882 N 1.52 1.73 -0.34 5.97 0.00 -0.33 -0.16 121.76 130.15 2b5m s ALA 882 Ca 0.06 -1.39 -0.01 0.00 0.00 0.00 0.00 51.96 50.62 2b5m s ALA 882 Cb -0.15 -0.12 0.08 0.00 0.00 0.00 0.00 23.12 22.92 2b5m s ALA 882 CO 0.05 0.16 0.07 0.45 0.00 0.00 0.00 175.76 176.49 2b5m s SER 883 N -2.58 4.99 -0.57 0.00 0.15 0.46 -1.88 113.70 114.26 2b5m s SER 883 Ca 0.12 -1.63 -0.07 0.00 0.70 0.00 0.00 55.95 55.07 2b5m s SER 883 Cb -0.05 -1.74 0.15 0.00 -1.71 0.00 0.00 66.02 62.67 2b5m s SER 883 CO 0.05 -0.37 0.42 -0.63 1.20 0.00 0.00 173.24 173.91 2b5m s ILE 884 N 1.17 4.15 -0.26 6.45 1.01 0.74 -2.17 121.20 132.28 2b5m s ILE 884 Ca 0.01 -2.31 -0.14 0.00 0.00 0.00 0.00 60.65 58.21 2b5m s ILE 884 Cb -0.21 -3.70 0.02 0.00 0.01 0.00 0.00 42.46 38.58 2b5m s ILE 884 CO -0.03 -0.84 0.29 -3.20 0.00 0.00 0.00 174.94 171.16 2b5m n ASN 885 N 4.27 -6.81 -0.88 3.58 2.85 -0.80 -1.40 115.26 116.06 2b5m n ASN 885 Ca 0.01 0.48 -0.10 0.00 -0.11 0.00 0.00 54.58 54.87 2b5m n ASN 885 Cb 0.41 -3.03 -0.04 0.00 1.24 0.00 0.00 39.78 38.36 2b5m n ASN 885 CO 0.00 0.00 0.00 -1.20 -2.11 0.00 0.00 177.26 173.95 2b5m n SER 886 N 0.48 -4.29 -3.94 1.20 7.64 -1.24 -4.93 113.62 108.54 2b5m n SER 886 Ca -0.00 0.24 -0.17 0.00 1.01 0.00 0.00 58.87 59.95 2b5m n SER 886 Cb 0.44 -3.38 -0.15 0.00 -1.01 0.00 0.00 64.21 60.11 2b5m n SER 886 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2b5m s THR 887 N -1.71 0.43 -0.11 0.44 2.01 0.35 -2.08 115.64 114.97 2b5m s THR 887 Ca 0.00 -0.20 -0.01 0.00 0.31 0.00 0.00 61.69 61.80 2b5m s THR 887 Cb 0.00 -0.39 -0.02 0.00 0.01 0.00 0.00 72.50 72.09 2b5m s THR 887 CO 0.00 0.14 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.29 2b5m s VAL 888 N 0.11 3.46 0.08 3.82 1.01 0.60 -0.18 120.40 129.29 2b5m s VAL 888 Ca -0.01 -0.53 0.03 0.00 0.00 0.00 0.00 61.98 61.47 2b5m s VAL 888 Cb -0.05 -2.46 -0.03 0.00 0.00 0.00 0.00 36.38 33.84 2b5m s VAL 888 CO -0.00 0.54 -0.10 -0.13 0.00 0.00 0.00 175.10 175.41 2b5m s ARG 889 N -0.04 0.76 -0.12 2.72 0.52 -0.79 -1.86 118.95 120.14 2b5m s ARG 889 Ca -0.01 -1.04 0.01 0.00 -0.52 0.00 0.00 55.73 54.17 2b5m s ARG 889 Cb -0.14 -0.48 -0.01 0.00 0.52 0.00 0.00 34.95 34.84 2b5m s ARG 889 CO 0.03 0.08 -0.16 -1.17 0.02 0.00 0.00 175.30 174.10 2b5m s LEU 890 N -2.17 2.57 -0.08 2.53 2.96 -1.26 -1.19 118.68 122.04 2b5m s LEU 890 Ca 0.01 -0.37 0.01 0.00 -0.22 0.00 0.00 54.13 53.56 2b5m s LEU 890 Cb -0.05 -1.56 -0.03 0.00 0.50 0.00 0.00 46.19 45.05 2b5m s LEU 890 CO -0.00 0.18 -0.10 -0.31 -1.32 0.00 0.00 176.35 174.80 2b5m s TYR 891 N 0.27 2.86 -0.03 5.38 1.51 0.32 -4.63 117.35 123.03 2b5m s TYR 891 Ca -0.11 -0.17 -0.09 0.00 -1.01 0.00 0.00 57.07 55.69 2b5m s TYR 891 Cb -0.16 -1.73 -0.05 0.00 -0.11 0.00 0.00 41.96 39.91 2b5m s TYR 891 CO 0.06 0.17 0.28 -2.00 -1.11 0.00 0.00 175.55 172.94 2b5m s GLU 892 N -0.48 3.64 -0.66 -0.62 2.12 0.15 0.47 118.70 123.32 2b5m s GLU 892 Ca 0.07 0.06 -0.17 0.00 0.36 0.00 0.00 54.97 55.29 2b5m s GLU 892 Cb -0.12 -3.15 0.14 0.00 0.26 0.00 0.00 34.13 31.27 2b5m s GLU 892 CO 0.02 0.70 0.68 -0.46 -0.54 0.00 0.00 175.26 175.66 2b5m s TRP 893 N -1.16 3.27 0.58 5.30 -0.11 -1.26 -0.45 118.94 125.11 2b5m s TRP 893 Ca 0.23 -1.35 -0.13 0.00 1.22 0.00 0.00 56.10 56.07 2b5m s TRP 893 Cb -0.14 -3.92 -0.11 0.00 -1.50 0.00 0.00 33.47 27.80 2b5m s TRP 893 CO 0.12 -1.15 -0.37 2.41 -4.62 0.00 0.00 176.95 173.34 2b5m n THR 894 N 5.07 0.00 0.35 5.86 -1.04 -0.51 -4.69 114.28 119.32 2b5m n THR 894 Ca -0.03 -0.38 0.12 0.00 -2.04 0.00 0.00 64.05 61.72 2b5m n THR 894 Cb 0.43 0.00 0.09 0.00 -1.82 0.00 0.00 70.33 69.03 2b5m n THR 894 CO 0.00 0.00 0.00 0.71 -0.64 0.00 0.00 175.07 175.14 2b5m h THR 895 N -0.41 0.00 0.00 12.58 1.35 -1.96 -2.98 112.91 121.49 2b5m h THR 895 Ca -0.32 -0.74 0.00 0.00 -0.55 0.00 0.00 66.41 64.80 2b5m h THR 895 Cb 1.03 1.30 0.00 0.00 -1.73 0.00 0.00 68.15 68.75 2b5m h THR 895 CO 0.24 0.00 0.00 -0.62 -0.25 0.00 0.00 175.52 174.89 2b5m n GLU 896 N -2.41 0.98 -1.67 4.72 4.71 -1.26 -4.98 120.64 120.73 2b5m n GLU 896 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.17 2b5m n GLU 896 Cb 0.49 -1.38 0.00 0.00 -1.01 0.00 0.00 31.44 29.55 2b5m n GLU 896 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 2b5m n LYS 897 N -0.88 0.00 -3.83 3.49 5.02 -1.13 -5.08 118.16 115.76 2b5m n LYS 897 Ca 0.18 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.34 2b5m n LYS 897 Cb 0.08 -2.00 -0.12 0.00 -0.02 0.00 0.00 35.03 32.96 2b5m n LYS 897 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2b5m s ASP 898 N -2.82 -0.13 -0.29 4.39 3.68 -1.26 -4.72 116.67 115.53 2b5m s ASP 898 Ca 0.00 0.23 -0.10 0.00 2.13 0.00 0.00 52.55 54.81 2b5m s ASP 898 Cb 0.00 0.28 -0.03 0.00 -1.45 0.00 0.00 42.92 41.71 2b5m s ASP 898 CO 0.00 -0.08 0.17 -0.69 0.13 0.00 0.00 175.17 174.69 2b5m s VAL 899 N -0.08 4.99 0.03 1.11 1.01 -1.26 -1.42 120.40 124.78 2b5m s VAL 899 Ca -0.02 -0.04 0.04 0.00 0.00 0.00 0.00 61.98 61.96 2b5m s VAL 899 Cb -0.02 -3.42 -0.02 0.00 0.00 0.00 0.00 36.38 32.93 2b5m s VAL 899 CO 0.00 0.21 -0.12 0.00 0.00 0.00 0.00 175.10 175.20 2b5m s ARG 900 N 1.70 0.79 0.19 2.72 1.04 0.40 -4.87 118.95 120.92 2b5m s ARG 900 Ca 0.06 -0.65 0.00 0.00 -1.04 0.00 0.00 55.73 54.10 2b5m s ARG 900 Cb -0.16 -0.75 -0.00 0.00 -2.04 0.00 0.00 34.95 32.00 2b5m s ARG 900 CO 0.09 0.19 0.01 -2.37 -0.04 0.00 0.00 175.30 173.17 2b5m n THR 901 N 2.03 0.00 -3.59 4.99 5.66 -1.26 0.31 114.28 122.43 2b5m n THR 901 Ca -0.18 -0.94 -0.29 0.00 -3.05 0.00 0.00 64.05 59.59 2b5m n THR 901 Cb 0.55 0.21 -0.13 0.00 -1.55 0.00 0.00 70.33 69.42 2b5m n THR 901 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 175.07 170.41 2b5m s GLU 902 N -2.70 0.77 0.63 1.09 2.02 -1.26 -5.00 118.70 114.24 2b5m s GLU 902 Ca 0.01 -1.42 0.26 0.00 0.02 0.00 0.00 54.97 53.84 2b5m s GLU 902 Cb 0.00 -1.71 1.30 0.00 0.10 0.00 0.00 34.13 33.82 2b5m s GLU 902 CO 0.01 -1.14 1.73 0.00 0.02 0.00 0.00 175.26 175.88 2b5m n ASN 904 N -3.24 0.00 -3.71 0.00 5.15 -1.26 -4.69 115.26 107.51 2b5m n ASN 904 Ca 0.06 -0.05 -0.11 0.00 -0.60 0.00 0.00 54.58 53.87 2b5m n ASN 904 Cb 0.72 0.00 -0.11 0.00 -0.53 0.00 0.00 39.78 39.86 2b5m n ASN 904 CO 0.00 0.00 0.00 -1.00 1.40 0.00 0.00 177.26 177.66 2b5m s HIS 905 N -2.00 -0.52 0.00 1.20 3.76 0.12 -5.05 115.29 112.79 2b5m s HIS 905 Ca 0.02 1.15 0.00 0.00 -0.15 0.00 0.00 55.06 56.08 2b5m s HIS 905 Cb 0.01 0.21 0.00 0.00 1.11 0.00 0.00 32.58 33.90 2b5m s HIS 905 CO 0.01 -0.30 0.00 2.48 -0.85 0.00 0.00 174.74 176.08 2b5m n TYR 906 N 4.01 0.00 -3.72 1.40 -0.00 -1.26 -4.67 117.16 112.91 2b5m n TYR 906 Ca -0.22 0.00 -0.15 0.00 -0.00 0.00 0.00 57.90 57.54 2b5m n TYR 906 Cb 0.55 0.00 -0.15 0.00 -0.00 0.00 0.00 39.34 39.74 2b5m n TYR 906 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.86 178.07 2b5m s ASN 907 N 0.00 0.16 -0.81 9.48 3.04 -0.78 -4.58 114.94 121.46 2b5m s ASN 907 Ca 0.00 0.31 -0.26 0.00 0.04 0.00 0.00 52.86 52.95 2b5m s ASN 907 Cb 0.00 0.21 0.03 0.00 -1.54 0.00 0.00 41.25 39.96 2b5m s ASN 907 CO 0.00 -0.18 1.32 0.20 -3.04 0.00 0.00 177.10 175.40 2b5m s ASN 908 N 1.53 6.24 0.05 -4.21 0.01 -1.26 -0.29 114.94 117.01 2b5m s ASN 908 Ca -0.05 -0.69 -0.27 0.00 -0.71 0.00 0.00 52.86 51.13 2b5m s ASN 908 Cb -0.12 -2.56 0.07 0.00 0.41 0.00 0.00 41.25 39.05 2b5m s ASN 908 CO -0.06 -1.76 0.66 -0.63 -1.51 0.00 0.00 177.10 173.81 2b5m s ILE 909 N 5.56 0.00 -0.71 0.60 1.01 -0.88 -4.97 121.20 121.79 2b5m s ILE 909 Ca 0.38 0.00 0.04 0.00 0.00 0.00 0.00 60.65 61.07 2b5m s ILE 909 Cb -0.06 -1.00 0.20 0.00 0.01 0.00 0.00 42.46 41.61 2b5m s ILE 909 CO 0.09 0.00 0.63 0.80 0.00 0.00 0.00 174.94 176.46 2b5m n MET 910 N 0.19 2.20 -2.39 2.79 0.00 -1.26 -0.49 117.12 118.15 2b5m n MET 910 Ca -0.17 -4.56 -0.40 0.00 -0.00 0.00 0.00 57.70 52.58 2b5m n MET 910 Cb 0.61 -2.30 -0.03 0.00 0.00 0.00 0.00 33.22 31.51 2b5m n MET 910 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2b5m s ALA 911 N -1.82 2.55 0.30 -5.12 0.00 -1.25 -4.42 121.76 111.99 2b5m s ALA 911 Ca 0.30 -1.26 0.03 0.00 0.00 0.00 0.00 51.96 51.03 2b5m s ALA 911 Cb 0.02 -4.31 0.46 0.00 0.00 0.00 0.00 23.12 19.29 2b5m s ALA 911 CO -0.11 -3.55 1.77 -0.07 0.00 0.00 0.00 175.76 173.81 2b5m h LEU 912 N 14.13 0.51 -8.34 0.00 3.38 -1.88 -3.40 115.31 119.71 2b5m h LEU 912 Ca -0.22 -0.14 -0.42 0.00 0.09 0.00 0.00 57.88 57.19 2b5m h LEU 912 Cb 1.08 -0.14 -0.24 0.00 0.09 0.00 0.00 40.66 41.45 2b5m h LEU 912 CO 1.27 0.69 -0.78 -0.31 0.09 0.00 0.00 178.44 179.40 2b5m s TYR 913 N -4.69 1.18 -0.16 1.13 1.51 -1.26 -4.64 117.35 110.42 2b5m s TYR 913 Ca -0.07 -0.39 -0.18 0.00 -1.01 0.00 0.00 57.07 55.42 2b5m s TYR 913 Cb 0.14 -0.69 0.05 0.00 -0.11 0.00 0.00 41.96 41.35 2b5m s TYR 913 CO 0.78 0.04 0.50 -1.17 -1.11 0.00 0.00 175.55 174.59 2b5m s LEU 914 N -1.34 0.11 0.18 -1.29 2.96 -1.26 -3.71 118.68 114.32 2b5m s LEU 914 Ca -0.00 0.90 -0.01 0.00 -0.22 0.00 0.00 54.13 54.80 2b5m s LEU 914 Cb -0.09 1.73 -0.04 0.00 0.50 0.00 0.00 46.19 48.30 2b5m s LEU 914 CO 0.02 -0.23 0.10 -0.54 -1.32 0.00 0.00 176.35 174.37 2b5m s LYS 915 N 0.01 1.12 0.02 1.98 -0.14 -0.68 -4.95 119.74 117.10 2b5m s LYS 915 Ca -0.02 -1.57 0.02 0.00 -1.36 0.00 0.00 55.97 53.03 2b5m s LYS 915 Cb -0.03 0.20 -0.01 0.00 -1.68 0.00 0.00 37.83 36.30 2b5m s LYS 915 CO 0.02 -0.33 -0.06 0.99 -0.76 0.00 0.00 175.35 175.20 2b5m s THR 916 N -4.07 0.47 -0.14 2.17 2.01 -1.26 -1.31 115.64 113.51 2b5m s THR 916 Ca 0.33 -0.66 0.03 0.00 0.31 0.00 0.00 61.69 61.69 2b5m s THR 916 Cb 0.07 -0.48 0.01 0.00 0.01 0.00 0.00 72.50 72.12 2b5m s THR 916 CO 0.08 -0.15 -0.22 -0.75 -0.69 0.00 0.00 174.62 172.90 2b5m s LYS 917 N -0.88 3.02 0.00 4.92 2.47 -0.96 -4.96 119.74 123.35 2b5m s LYS 917 Ca -0.04 -0.85 0.00 0.00 -1.56 0.00 0.00 55.97 53.51 2b5m s LYS 917 Cb -0.06 -2.42 0.00 0.00 -1.46 0.00 0.00 37.83 33.89 2b5m s LYS 917 CO 0.00 -0.00 0.00 0.41 0.16 0.00 0.00 175.35 175.92 2b5m n GLY 918 N 4.03 0.00 0.00 5.54 0.00 -1.26 -3.00 105.19 110.50 2b5m n GLY 918 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.82 2b5m n GLY 918 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2b5m n ASP 919 N -2.40 -0.19 -2.11 1.61 2.03 -1.26 -4.83 116.55 109.39 2b5m n ASP 919 Ca 0.00 -0.03 -0.26 0.00 0.52 0.00 0.00 54.79 55.02 2b5m n ASP 919 Cb 0.00 0.00 0.06 0.00 -0.72 0.00 0.00 41.12 40.46 2b5m n ASP 919 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 2b5m n PHE 920 N -1.00 2.40 -4.21 -0.67 0.99 -1.22 -4.92 117.46 108.83 2b5m n PHE 920 Ca 0.00 -2.50 -0.28 0.00 -0.00 0.00 0.00 57.45 54.67 2b5m n PHE 920 Cb 0.00 -1.21 -0.08 0.00 -1.00 0.00 0.00 39.48 37.19 2b5m n PHE 920 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.76 177.18 2b5m s ILE 921 N -3.57 3.63 -0.10 4.37 1.01 -1.16 -1.57 121.20 123.81 2b5m s ILE 921 Ca 0.48 -1.36 -0.08 0.00 0.00 0.00 0.00 60.65 59.69 2b5m s ILE 921 Cb 0.38 -2.78 0.03 0.00 0.01 0.00 0.00 42.46 40.09 2b5m s ILE 921 CO -0.01 -0.04 0.25 -0.22 0.00 0.00 0.00 174.94 174.93 2b5m s LEU 922 N -2.70 0.86 -0.21 2.97 2.96 -0.38 -2.26 118.68 119.92 2b5m s LEU 922 Ca 0.26 0.51 0.00 0.00 -0.22 0.00 0.00 54.13 54.68 2b5m s LEU 922 Cb -0.10 0.82 0.05 0.00 0.50 0.00 0.00 46.19 47.46 2b5m s LEU 922 CO 0.17 -0.11 -0.06 -0.69 -1.32 0.00 0.00 176.35 174.34 2b5m s VAL 923 N 0.46 1.46 0.09 1.68 1.01 -0.43 -1.63 120.40 123.05 2b5m s VAL 923 Ca -0.03 -1.06 0.01 0.00 0.00 0.00 0.00 61.98 60.90 2b5m s VAL 923 Cb -0.04 -1.68 0.01 0.00 0.00 0.00 0.00 36.38 34.67 2b5m s VAL 923 CO -0.02 -0.00 0.05 0.61 0.00 0.00 0.00 175.10 175.74 2b5m n GLY 924 N 4.72 3.21 2.96 4.51 0.00 -0.89 -1.69 105.19 118.00 2b5m n GLY 924 Ca -0.13 -2.20 -0.06 0.00 0.00 0.00 0.00 46.02 43.63 2b5m n GLY 924 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2b5m s ASP 925 N -1.51 -0.08 0.00 1.61 -1.08 -1.24 -3.25 116.67 111.12 2b5m s ASP 925 Ca 0.04 0.24 0.00 0.00 -0.52 0.00 0.00 52.55 52.31 2b5m s ASP 925 Cb -0.00 1.33 0.00 0.00 -1.46 0.00 0.00 42.92 42.78 2b5m s ASP 925 CO 0.03 -0.30 0.00 -0.11 0.52 0.00 0.00 175.17 175.30 2b5m n LEU 926 N 5.38 0.00 -4.37 -1.34 7.94 -1.19 -3.15 117.00 120.26 2b5m n LEU 926 Ca -0.02 0.00 -0.45 0.00 -1.11 0.00 0.00 56.01 54.43 2b5m n LEU 926 Cb 0.50 0.00 -0.01 0.00 0.53 0.00 0.00 43.42 44.44 2b5m n LEU 926 CO 0.04 0.00 0.84 -0.04 -1.11 0.00 0.00 177.39 177.12 2b5m s MET 927 N 0.75 3.97 -1.40 1.96 -1.94 -1.26 -4.63 119.30 116.74 2b5m s MET 927 Ca 0.00 -2.74 -0.06 0.00 -1.71 0.00 0.00 55.69 51.18 2b5m s MET 927 Cb 0.00 -4.67 0.03 0.00 2.01 0.00 0.00 34.83 32.20 2b5m s MET 927 CO 0.00 -1.42 0.48 0.54 -0.01 0.00 0.00 175.02 174.61 2b5m n ARG 928 N 4.04 -3.90 -4.05 2.03 5.12 -1.26 -4.91 116.66 113.72 2b5m n ARG 928 Ca 0.24 0.70 -0.07 0.00 -1.93 0.00 0.00 57.85 56.79 2b5m n ARG 928 Cb 0.43 -5.47 -0.10 0.00 -1.16 0.00 0.00 32.46 26.17 2b5m n ARG 928 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 2b5m s SER 929 N -2.62 0.42 0.04 0.55 1.04 -1.26 -1.24 113.70 110.62 2b5m s SER 929 Ca 0.31 -0.92 0.05 0.00 0.48 0.00 0.00 55.95 55.87 2b5m s SER 929 Cb -0.15 0.22 -0.04 0.00 0.10 0.00 0.00 66.02 66.15 2b5m s SER 929 CO 0.38 -0.60 -0.08 -0.69 0.98 0.00 0.00 173.24 173.22 2b5m s VAL 930 N -3.77 3.52 -0.02 5.02 1.01 -1.25 -3.14 120.40 121.77 2b5m s VAL 930 Ca 0.05 -0.95 -0.07 0.00 0.00 0.00 0.00 61.98 61.02 2b5m s VAL 930 Cb 0.07 -2.56 0.01 0.00 0.00 0.00 0.00 36.38 33.89 2b5m s VAL 930 CO -0.10 0.30 0.15 -0.76 0.00 0.00 0.00 175.10 174.70 2b5m s LEU 931 N -1.67 1.48 -0.17 3.92 1.43 -1.20 -1.92 118.68 120.56 2b5m s LEU 931 Ca 0.18 -0.01 0.01 0.00 -1.03 0.00 0.00 54.13 53.28 2b5m s LEU 931 Cb -0.11 0.64 0.02 0.00 0.03 0.00 0.00 46.19 46.77 2b5m s LEU 931 CO 0.10 -0.26 -0.17 -0.22 0.23 0.00 0.00 176.35 176.03 2b5m s LEU 932 N -0.85 2.00 0.01 1.79 2.96 0.12 -2.10 118.68 122.61 2b5m s LEU 932 Ca -0.09 -0.62 0.02 0.00 -0.22 0.00 0.00 54.13 53.22 2b5m s LEU 932 Cb -0.05 -1.36 -0.01 0.00 0.50 0.00 0.00 46.19 45.27 2b5m s LEU 932 CO 0.01 -0.03 -0.07 -0.76 -1.32 0.00 0.00 176.35 174.18 2b5m s LEU 933 N 1.36 2.08 -0.01 -0.68 1.02 -0.65 -1.47 118.68 120.34 2b5m s LEU 933 Ca 0.04 -0.24 0.05 0.00 0.02 0.00 0.00 54.13 54.00 2b5m s LEU 933 Cb -0.13 -0.29 -0.01 0.00 0.02 0.00 0.00 46.19 45.77 2b5m s LEU 933 CO -0.12 0.00 -0.17 0.00 0.02 0.00 0.00 176.35 176.08 2b5m s ALA 934 N -0.50 1.40 -0.68 4.21 0.00 -0.82 -1.24 121.76 124.13 2b5m s ALA 934 Ca -0.01 -0.73 -0.27 0.00 0.00 0.00 0.00 51.96 50.95 2b5m s ALA 934 Cb -0.05 -0.35 0.02 0.00 0.00 0.00 0.00 23.12 22.74 2b5m s ALA 934 CO 0.00 0.34 1.40 -0.47 0.00 0.00 0.00 175.76 177.03 2b5m s TYR 935 N -0.41 2.20 -0.60 0.00 5.04 -0.61 -1.13 117.35 121.84 2b5m s TYR 935 Ca 0.06 0.22 -0.25 0.00 -2.44 0.00 0.00 57.07 54.66 2b5m s TYR 935 Cb -0.07 -4.49 0.04 0.00 0.35 0.00 0.00 41.96 37.80 2b5m s TYR 935 CO -0.01 -2.07 1.05 0.15 -1.34 0.00 0.00 175.55 173.34 2b5m s LYS 936 N 5.87 3.33 0.12 4.97 1.02 -1.12 -4.96 119.74 128.97 2b5m s LYS 936 Ca 0.44 -0.20 0.06 0.00 0.02 0.00 0.00 55.97 56.29 2b5m s LYS 936 Cb -0.09 -4.08 0.32 0.00 -0.52 0.00 0.00 37.83 33.46 2b5m s LYS 936 CO 0.18 -1.67 1.06 -2.30 -0.92 0.00 0.00 175.35 171.71 2b5m n PRO 937 N 8.00 0.04 0.00 -1.68 -0.02 -1.26 -2.27 135.00 137.80 2b5m n PRO 937 Ca 0.03 0.44 0.00 0.00 -2.02 0.00 0.00 63.50 61.95 2b5m n PRO 937 Cb 0.48 -1.80 0.00 0.00 -0.02 0.00 0.00 33.50 32.16 2b5m n PRO 937 CO 0.00 0.00 0.00 -0.12 1.98 0.00 0.00 175.50 177.36 2b5m n MET 938 N -1.64 0.00 0.00 -0.52 1.56 -1.26 -4.00 117.12 111.26 2b5m n MET 938 Ca -0.00 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.43 2b5m n MET 938 Cb 0.18 -0.26 0.00 0.00 2.15 0.00 0.00 33.22 35.29 2b5m n MET 938 CO 0.00 0.00 0.00 0.39 -0.73 0.00 0.00 175.97 175.63 2b5m n GLU 939 N 0.00 0.00 -0.94 2.12 1.02 -1.22 -4.67 120.64 116.94 2b5m n GLU 939 Ca 0.00 0.31 0.00 0.00 -0.02 0.00 0.00 57.16 57.45 2b5m n GLU 939 Cb 0.00 -1.62 0.00 0.00 -0.02 0.00 0.00 31.44 29.80 2b5m n GLU 939 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2b5m n GLY 940 N -1.29 0.28 0.00 0.62 0.00 -0.96 -4.91 105.19 98.93 2b5m n GLY 940 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2b5m n GLY 940 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2b5m n ASN 941 N -0.42 0.16 -4.99 1.61 3.02 -1.26 -4.73 115.26 108.65 2b5m n ASN 941 Ca 0.00 -0.94 -0.20 0.00 -0.03 0.00 0.00 54.58 53.41 2b5m n ASN 941 Cb 0.21 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.39 2b5m n ASN 941 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2b5m s PHE 942 N 0.91 3.05 -0.06 3.10 0.40 -1.26 -2.81 117.98 121.31 2b5m s PHE 942 Ca 0.00 -0.14 0.05 0.00 -0.60 0.00 0.00 56.93 56.23 2b5m s PHE 942 Cb 0.00 -2.21 -0.02 0.00 0.51 0.00 0.00 43.02 41.31 2b5m s PHE 942 CO 0.00 -0.24 -0.21 -2.00 0.70 0.00 0.00 175.22 173.47 2b5m s GLU 943 N -4.34 2.61 -0.98 0.44 2.12 -0.29 -4.84 118.70 113.43 2b5m s GLU 943 Ca 0.49 -0.83 -0.17 0.00 0.36 0.00 0.00 54.97 54.82 2b5m s GLU 943 Cb -0.10 -2.26 0.15 0.00 0.26 0.00 0.00 34.13 32.18 2b5m s GLU 943 CO 0.34 0.43 1.15 -2.00 -0.54 0.00 0.00 175.26 174.63 2b5m s GLU 944 N -0.27 3.71 0.26 4.30 2.12 -1.26 -1.95 118.70 125.61 2b5m s GLU 944 Ca 0.00 -2.04 -0.03 0.00 0.36 0.00 0.00 54.97 53.26 2b5m s GLU 944 Cb -0.13 -4.88 0.41 0.00 0.26 0.00 0.00 34.13 29.79 2b5m s GLU 944 CO 0.03 -1.70 1.86 0.82 -0.54 0.00 0.00 175.26 175.72 2b5m h ILE 945 N 5.43 1.03 -1.43 -3.70 2.04 -1.61 -3.47 117.51 115.79 2b5m h ILE 945 Ca 0.18 -0.36 0.20 0.00 1.00 0.00 0.00 64.86 65.88 2b5m h ILE 945 Cb 0.99 -0.12 -0.22 0.00 -0.74 0.00 0.00 36.82 36.73 2b5m h ILE 945 CO 1.09 0.19 0.77 0.00 0.00 0.00 0.00 178.15 180.20 2b5m s ALA 946 N -6.03 -2.04 0.20 1.87 0.00 -0.70 -4.46 121.76 110.61 2b5m s ALA 946 Ca -0.12 1.64 -0.03 0.00 0.00 0.00 0.00 51.96 53.45 2b5m s ALA 946 Cb 0.20 -0.61 -0.03 0.00 0.00 0.00 0.00 23.12 22.67 2b5m s ALA 946 CO 0.80 -0.44 0.18 -0.98 0.00 0.00 0.00 175.76 175.33 2b5m s ARG 947 N -1.77 1.23 -0.43 0.00 1.70 -0.85 0.13 118.95 118.95 2b5m s ARG 947 Ca 0.06 -1.55 -0.11 0.00 -0.47 0.00 0.00 55.73 53.66 2b5m s ARG 947 Cb -0.01 0.30 0.08 0.00 -0.57 0.00 0.00 34.95 34.75 2b5m s ARG 947 CO -0.04 -0.42 0.30 0.34 -1.08 0.00 0.00 175.30 174.40 2b5m s ASP 948 N -3.13 5.78 1.08 -2.89 2.15 -0.81 0.85 116.67 119.71 2b5m s ASP 948 Ca 0.35 -1.46 -0.07 0.00 0.43 0.00 0.00 52.55 51.81 2b5m s ASP 948 Cb 0.06 -2.04 0.10 0.00 -0.30 0.00 0.00 42.92 40.74 2b5m s ASP 948 CO 0.11 -0.57 0.34 0.49 -0.17 0.00 0.00 175.17 175.37 2b5m n PHE 949 N 4.99 -3.25 -2.08 -5.34 3.01 -1.26 -3.75 117.46 109.78 2b5m n PHE 949 Ca -0.11 -0.31 0.00 0.00 1.01 0.00 0.00 57.45 58.04 2b5m n PHE 949 Cb 0.43 -0.36 0.00 0.00 -0.01 0.00 0.00 39.48 39.54 2b5m n PHE 949 CO 0.00 0.00 0.00 0.27 1.01 0.00 0.00 176.76 178.04 2b5m n ASN 950 N -3.61 -8.22 -3.21 4.37 0.23 -1.26 -4.96 115.26 98.60 2b5m n ASN 950 Ca 0.05 1.41 -0.03 0.00 -0.53 0.00 0.00 54.58 55.49 2b5m n ASN 950 Cb 0.19 -4.82 0.02 0.00 -2.08 0.00 0.00 39.78 33.09 2b5m n ASN 950 CO 0.00 0.00 0.00 -2.65 -0.93 0.00 0.00 177.26 173.68 2b5m n PRO 951 N 1.94 0.81 0.00 -0.53 -0.02 -1.26 -4.86 135.00 131.08 2b5m n PRO 951 Ca 0.00 -0.12 0.00 0.00 -2.02 0.00 0.00 63.50 61.36 2b5m n PRO 951 Cb 0.00 -0.42 0.00 0.00 -0.02 0.00 0.00 33.50 33.06 2b5m n PRO 951 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2b5m n ASN 952 N -0.17 0.00 -4.58 2.55 3.02 -0.37 -4.90 115.26 110.81 2b5m n ASN 952 Ca 0.01 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.14 2b5m n ASN 952 Cb 0.05 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.19 2b5m n ASN 952 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 2b5m s TRP 953 N 0.00 2.67 0.52 3.10 0.52 -1.26 -4.15 118.94 120.32 2b5m s TRP 953 Ca 0.00 0.44 -0.11 0.00 0.02 0.00 0.00 56.10 56.45 2b5m s TRP 953 Cb 0.00 -4.46 -0.05 0.00 -1.15 0.00 0.00 33.47 27.81 2b5m s TRP 953 CO 0.00 -1.50 0.91 -1.64 0.02 0.00 0.00 176.95 174.74 2b5m s MET 954 N 4.76 3.71 0.00 4.98 -1.94 -1.26 -1.47 119.30 128.08 2b5m s MET 954 Ca 0.43 0.61 0.00 0.00 -1.71 0.00 0.00 55.69 55.02 2b5m s MET 954 Cb -0.08 -2.23 0.00 0.00 2.01 0.00 0.00 34.83 34.53 2b5m s MET 954 CO 0.26 -0.30 0.00 -1.13 -0.01 0.00 0.00 175.02 173.85 2b5m n SER 955 N -2.03 0.62 -3.68 3.03 3.41 -0.16 -4.78 113.62 110.03 2b5m n SER 955 Ca 0.04 -0.02 -0.07 0.00 -0.26 0.00 0.00 58.87 58.56 2b5m n SER 955 Cb 0.54 0.16 -0.02 0.00 -0.26 0.00 0.00 64.21 64.63 2b5m n SER 955 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2b5m s ALA 956 N -0.28 -1.52 -0.27 7.33 0.00 -1.16 -4.61 121.76 121.25 2b5m s ALA 956 Ca 0.00 0.20 -0.25 0.00 0.00 0.00 0.00 51.96 51.90 2b5m s ALA 956 Cb 0.00 0.73 0.08 0.00 0.00 0.00 0.00 23.12 23.93 2b5m s ALA 956 CO 0.00 -0.93 0.81 0.08 0.00 0.00 0.00 175.76 175.72 2b5m s VAL 957 N -3.57 0.00 -0.13 0.00 1.01 -1.26 -2.49 120.40 113.96 2b5m s VAL 957 Ca 0.08 0.00 -0.21 0.00 0.00 0.00 0.00 61.98 61.85 2b5m s VAL 957 Cb -0.03 -1.00 0.05 0.00 0.00 0.00 0.00 36.38 35.40 2b5m s VAL 957 CO -0.01 0.00 0.53 -0.70 0.00 0.00 0.00 175.10 174.92 2b5m s GLU 958 N 0.30 0.75 -0.34 2.72 2.56 -0.56 -4.72 118.70 119.42 2b5m s GLU 958 Ca 0.01 0.44 -0.22 0.00 0.00 0.00 0.00 54.97 55.20 2b5m s GLU 958 Cb -0.05 0.36 0.00 0.00 2.00 0.00 0.00 34.13 36.44 2b5m s GLU 958 CO -0.01 -0.16 0.70 0.42 -0.56 0.00 0.00 175.26 175.65 2b5m s ILE 959 N -0.41 4.84 -0.07 -3.70 1.01 -1.26 0.51 121.20 122.12 2b5m s ILE 959 Ca -0.06 0.82 -0.24 0.00 0.00 0.00 0.00 60.65 61.17 2b5m s ILE 959 Cb -0.03 -4.11 -0.28 0.00 0.01 0.00 0.00 42.46 38.06 2b5m s ILE 959 CO 0.04 -0.30 0.91 -0.07 0.00 0.00 0.00 174.94 175.53 2b5m h LEU 960 N 9.44 0.30 0.00 2.97 3.38 -1.51 -3.48 115.31 126.41 2b5m h LEU 960 Ca -0.26 -0.91 0.03 0.00 0.09 0.00 0.00 57.88 56.83 2b5m h LEU 960 Cb 1.11 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.76 2b5m h LEU 960 CO 0.86 1.18 0.35 -0.90 0.09 0.00 0.00 178.44 180.02 2b5m n ASP 961 N -4.34 -1.97 -0.06 -0.43 3.85 -0.85 -4.98 116.55 107.76 2b5m n ASP 961 Ca -0.12 -2.28 0.24 0.00 -0.71 0.00 0.00 54.79 51.92 2b5m n ASP 961 Cb 0.65 3.26 0.52 0.00 -1.35 0.00 0.00 41.12 44.21 2b5m n ASP 961 CO 0.00 0.00 0.00 0.44 -1.01 0.00 0.00 177.20 176.63 2b5m h ASP 962 N 1.83 0.00 0.00 -1.12 5.19 -2.01 -2.47 116.42 117.84 2b5m h ASP 962 Ca -0.29 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.12 2b5m h ASP 962 Cb 1.14 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.65 2b5m h ASP 962 CO 0.38 0.00 0.00 0.47 -3.12 0.00 0.00 179.24 176.97 2b5m n ASP 963 N -3.32 0.20 -4.17 6.45 8.00 -1.26 -5.00 116.55 117.45 2b5m n ASP 963 Ca 0.16 -0.53 -0.27 0.00 0.71 0.00 0.00 54.79 54.86 2b5m n ASP 963 Cb 1.17 0.38 -0.16 0.00 -0.02 0.00 0.00 41.12 42.49 2b5m n ASP 963 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 2b5m s ASN 964 N -0.38 2.28 -0.03 -2.24 0.01 -0.93 -2.48 114.94 111.17 2b5m s ASN 964 Ca 0.00 -0.36 0.01 0.00 -0.71 0.00 0.00 52.86 51.79 2b5m s ASN 964 Cb 0.00 -0.48 0.02 0.00 0.41 0.00 0.00 41.25 41.20 2b5m s ASN 964 CO 0.00 0.19 -0.02 -0.36 -1.51 0.00 0.00 177.10 175.41 2b5m s PHE 965 N -0.18 0.42 -0.12 2.20 2.99 -0.60 -1.18 117.98 121.52 2b5m s PHE 965 Ca 0.01 -0.06 -0.06 0.00 0.00 0.00 0.00 56.93 56.82 2b5m s PHE 965 Cb -0.10 -0.44 -0.04 0.00 0.00 0.00 0.00 43.02 42.44 2b5m s PHE 965 CO 0.01 -0.13 0.12 -1.17 -0.00 0.00 0.00 175.22 174.06 2b5m s LEU 966 N 0.84 4.28 0.06 -0.37 0.20 0.18 -1.81 118.68 122.06 2b5m s LEU 966 Ca -0.09 0.42 0.05 0.00 0.69 0.00 0.00 54.13 55.20 2b5m s LEU 966 Cb -0.12 -2.04 -0.03 0.00 -0.43 0.00 0.00 46.19 43.58 2b5m s LEU 966 CO -0.01 0.41 -0.13 -0.83 -0.29 0.00 0.00 176.35 175.49 2b5m s GLY 967 N -1.01 0.79 -0.06 7.98 0.00 0.11 -1.49 107.32 113.63 2b5m s GLY 967 Ca 0.15 -0.90 0.02 0.00 0.00 0.00 0.00 44.72 43.99 2b5m s GLY 967 CO 0.04 -0.91 -0.12 0.00 0.00 0.00 0.00 173.10 172.11 2b5m s ALA 968 N -1.11 1.21 0.30 3.20 0.00 -1.04 -1.00 121.76 123.33 2b5m s ALA 968 Ca -0.01 -0.39 0.04 0.00 0.00 0.00 0.00 51.96 51.60 2b5m s ALA 968 Cb -0.09 -0.56 -0.06 0.00 0.00 0.00 0.00 23.12 22.41 2b5m s ALA 968 CO 0.02 0.10 0.05 -2.00 0.00 0.00 0.00 175.76 173.93 2b5m s GLU 969 N 0.69 1.56 -0.07 0.00 -6.30 -0.89 -0.98 118.70 112.71 2b5m s GLU 969 Ca -0.14 -1.85 0.03 0.00 -2.50 0.00 0.00 54.97 50.51 2b5m s GLU 969 Cb -0.16 -0.76 0.21 0.00 0.00 0.00 0.00 34.13 33.43 2b5m s GLU 969 CO 0.03 -0.18 0.89 0.27 0.02 0.00 0.00 175.26 176.29 2b5m n ASN 970 N -0.61 2.38 -0.71 -1.70 6.94 -0.54 -2.05 115.26 118.96 2b5m n ASN 970 Ca -0.02 -2.27 0.07 0.00 -0.02 0.00 0.00 54.58 52.34 2b5m n ASN 970 Cb 0.66 -0.55 0.20 0.00 -2.36 0.00 0.00 39.78 37.72 2b5m n ASN 970 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2b5m n ALA 971 N 0.15 2.56 -1.56 -2.53 0.00 -1.26 -4.96 120.51 112.91 2b5m n ALA 971 Ca 0.08 -1.73 -0.09 0.00 0.00 0.00 0.00 53.44 51.70 2b5m n ALA 971 Cb 0.54 -0.55 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 2b5m n ALA 971 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2b5m n PHE 972 N -0.07 -0.14 -4.12 0.00 0.99 -0.87 -4.88 117.46 108.35 2b5m n PHE 972 Ca 0.16 0.00 -0.26 0.00 -0.00 0.00 0.00 57.45 57.35 2b5m n PHE 972 Cb 0.64 -1.98 -0.06 0.00 -1.00 0.00 0.00 39.48 37.08 2b5m n PHE 972 CO 0.00 0.00 0.00 -0.80 -0.00 0.00 0.00 176.76 175.96 2b5m s ASN 973 N -2.80 5.28 0.24 4.37 0.01 -1.26 0.21 114.94 120.99 2b5m s ASN 973 Ca 0.00 -0.23 0.11 0.00 -0.71 0.00 0.00 52.86 52.04 2b5m s ASN 973 Cb 0.00 -1.30 -0.05 0.00 0.41 0.00 0.00 41.25 40.31 2b5m s ASN 973 CO 0.00 0.07 -0.19 -0.76 -1.51 0.00 0.00 177.10 174.71 2b5m s LEU 974 N -3.12 2.62 0.12 0.60 1.43 0.29 -2.10 118.68 118.52 2b5m s LEU 974 Ca 0.30 -0.89 -0.19 0.00 -1.03 0.00 0.00 54.13 52.32 2b5m s LEU 974 Cb -0.10 -1.23 0.05 0.00 0.03 0.00 0.00 46.19 44.94 2b5m s LEU 974 CO 0.22 0.07 0.48 0.72 0.23 0.00 0.00 176.35 178.07 2b5m s PHE 975 N -2.10 -0.33 -0.06 0.29 -0.12 -0.17 -2.43 117.98 113.06 2b5m s PHE 975 Ca 0.26 0.10 -0.00 0.00 -0.05 0.00 0.00 56.93 57.24 2b5m s PHE 975 Cb -0.07 0.36 0.02 0.00 -0.63 0.00 0.00 43.02 42.71 2b5m s PHE 975 CO 0.13 -0.73 -0.03 0.08 -0.05 0.00 0.00 175.22 174.62 2b5m s VAL 976 N -3.58 0.54 0.14 -2.49 1.01 -0.05 -0.72 120.40 115.25 2b5m s VAL 976 Ca 0.01 -0.05 0.03 0.00 0.00 0.00 0.00 61.98 61.97 2b5m s VAL 976 Cb 0.01 -0.61 -0.04 0.00 0.00 0.00 0.00 36.38 35.74 2b5m s VAL 976 CO -0.11 0.26 0.24 0.00 0.00 0.00 0.00 175.10 175.49 2b5m s GLN 978 N -3.10 0.47 -0.20 0.00 0.74 -0.48 -1.56 119.66 115.53 2b5m s GLN 978 Ca 0.34 -0.06 -0.29 0.00 0.05 0.00 0.00 55.36 55.40 2b5m s GLN 978 Cb -0.11 0.21 -0.02 0.00 1.10 0.00 0.00 33.01 34.19 2b5m s GLN 978 CO 0.27 -0.11 1.45 0.15 -0.55 0.00 0.00 175.29 176.51 2b5m s LYS 979 N -0.81 3.99 0.21 1.67 1.02 -1.04 -2.53 119.74 122.26 2b5m s LYS 979 Ca -0.09 1.64 -0.30 0.00 0.02 0.00 0.00 55.97 57.24 2b5m s LYS 979 Cb -0.05 -3.92 -0.09 0.00 -0.52 0.00 0.00 37.83 33.25 2b5m s LYS 979 CO 0.02 -1.04 1.28 0.34 -0.92 0.00 0.00 175.35 175.03 2b5m s ASP 980 N 3.17 6.93 -1.02 2.83 2.15 -1.26 -4.97 116.67 124.50 2b5m s ASP 980 Ca 0.64 2.39 -0.08 0.00 0.43 0.00 0.00 52.55 55.93 2b5m s ASP 980 Cb -0.23 -2.61 0.26 0.00 -0.30 0.00 0.00 42.92 40.03 2b5m s ASP 980 CO 0.24 -0.49 0.98 -0.44 -0.17 0.00 0.00 175.17 175.30 2b5m s SER 981 N 0.18 6.93 0.22 -0.34 0.01 -1.26 -4.71 113.70 114.74 2b5m s SER 981 Ca 0.55 -3.49 0.10 0.00 1.31 0.00 0.00 55.95 54.43 2b5m s SER 981 Cb -0.36 -2.14 -0.05 0.00 0.21 0.00 0.00 66.02 63.68 2b5m s SER 981 CO 0.39 -0.31 -0.20 0.00 0.41 0.00 0.00 173.24 173.54 2b5m s ALA 982 N -1.07 2.42 1.16 1.44 0.00 -1.26 -5.16 121.76 119.29 2b5m s ALA 982 Ca 0.28 -1.70 -0.09 0.00 0.00 0.00 0.00 51.96 50.45 2b5m s ALA 982 Cb -0.10 -0.24 0.14 0.00 0.00 0.00 0.00 23.12 22.93 2b5m s ALA 982 CO -0.09 0.28 0.33 0.00 0.00 0.00 0.00 175.76 176.28 2b5m n ALA 983 N -0.13 -1.98 -3.69 0.00 0.00 -1.26 -4.33 120.51 109.12 2b5m n ALA 983 Ca -0.09 -0.58 -0.29 0.00 0.00 0.00 0.00 53.44 52.48 2b5m n ALA 983 Cb 0.58 -0.05 0.04 0.00 0.00 0.00 0.00 19.45 20.02 2b5m n ALA 983 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2b5m n THR 984 N -4.05 -5.62 0.00 0.00 -2.24 -1.26 -4.61 114.28 96.50 2b5m n THR 984 Ca 0.05 -0.90 0.00 0.00 -2.27 0.00 0.00 64.05 60.93 2b5m n THR 984 Cb 0.23 -4.23 0.00 0.00 -2.10 0.00 0.00 70.33 64.23 2b5m n THR 984 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2b5m n THR 985 N -4.16 0.00 0.00 4.28 -2.24 -1.26 -3.10 114.28 107.80 2b5m n THR 985 Ca -0.13 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 2b5m n THR 985 Cb 0.61 -0.34 0.00 0.00 -2.10 0.00 0.00 70.33 68.50 2b5m n THR 985 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2b5m n ASP 986 N 0.84 0.00 -0.10 3.42 4.64 -1.26 -4.71 116.55 119.38 2b5m n ASP 986 Ca 0.00 0.00 -0.01 0.00 -1.38 0.00 0.00 54.79 53.40 2b5m n ASP 986 Cb 0.00 0.00 0.24 0.00 -1.04 0.00 0.00 41.12 40.32 2b5m n ASP 986 CO 0.00 0.00 0.00 -0.08 -0.82 0.00 0.00 177.20 176.30 2b5m h GLU 987 N 0.00 0.76 -0.58 -0.67 4.57 -1.90 -2.72 114.58 114.04 2b5m h GLU 987 Ca 0.00 -0.13 0.04 0.00 -1.18 0.00 0.00 59.36 58.09 2b5m h GLU 987 Cb 0.00 -0.12 -0.03 0.00 -0.16 0.00 0.00 28.75 28.43 2b5m h GLU 987 CO 0.00 0.66 0.38 0.93 -1.18 0.00 0.00 179.01 179.81 2b5m h GLU 988 N 0.74 0.61 0.00 1.92 5.08 -1.82 -1.42 114.58 119.68 2b5m h GLU 988 Ca 0.17 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 2b5m h GLU 988 Cb 0.23 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.34 2b5m h GLU 988 CO -0.01 0.40 -0.36 -2.13 -1.00 0.00 0.00 179.01 175.92 2b5m n ARG 989 N -4.47 0.15 0.18 2.33 3.00 -1.15 -3.21 116.66 113.49 2b5m n ARG 989 Ca 0.07 0.07 0.12 0.00 -0.00 0.00 0.00 57.85 58.11 2b5m n ARG 989 Cb 0.18 -1.62 0.12 0.00 0.00 0.00 0.00 32.46 31.14 2b5m n ARG 989 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.63 178.00 2b5m h GLN 990 N 0.00 0.00 -4.54 -0.14 5.75 -0.94 -3.44 115.11 111.80 2b5m h GLN 990 Ca 0.00 0.00 -0.70 0.00 -0.15 0.00 0.00 58.65 57.80 2b5m h GLN 990 Cb 0.63 0.00 -0.29 0.00 1.07 0.00 0.00 27.48 28.88 2b5m h GLN 990 CO 0.00 0.01 -0.54 -1.01 -2.65 0.00 0.00 178.83 174.65 2b5m s HIS 991 N -3.25 3.35 -0.17 3.99 3.76 -1.15 -2.01 115.29 119.81 2b5m s HIS 991 Ca 0.05 -1.65 -0.29 0.00 -0.15 0.00 0.00 55.06 53.01 2b5m s HIS 991 Cb 0.06 -2.74 -0.01 0.00 1.11 0.00 0.00 32.58 31.00 2b5m s HIS 991 CO 0.71 -0.83 1.24 -0.48 -0.85 0.00 0.00 174.74 174.53 2b5m s LEU 992 N 1.36 4.17 0.59 0.89 0.05 0.25 -4.63 118.68 121.37 2b5m s LEU 992 Ca 0.02 1.66 -0.16 0.00 0.05 0.00 0.00 54.13 55.70 2b5m s LEU 992 Cb -0.22 -3.54 -0.04 0.00 -2.05 0.00 0.00 46.19 40.35 2b5m s LEU 992 CO 0.01 -0.75 1.06 -1.10 -0.55 0.00 0.00 176.35 175.02 2b5m s GLN 993 N 3.44 3.31 -0.69 1.48 1.11 -1.05 -4.43 119.66 122.82 2b5m s GLN 993 Ca 0.54 1.23 -0.22 0.00 0.01 0.00 0.00 55.36 56.91 2b5m s GLN 993 Cb -0.21 -2.03 0.08 0.00 -1.01 0.00 0.00 33.01 29.84 2b5m s GLN 993 CO 0.14 -0.82 0.99 -1.21 0.01 0.00 0.00 175.29 174.39 2b5m s GLU 994 N -4.03 3.17 0.00 2.91 2.02 -1.26 -1.39 118.70 120.12 2b5m s GLU 994 Ca 0.64 -0.95 0.29 0.00 0.02 0.00 0.00 54.97 54.97 2b5m s GLU 994 Cb -0.16 -4.33 1.32 0.00 0.10 0.00 0.00 34.13 31.06 2b5m s GLU 994 CO 0.36 -1.81 1.90 1.33 0.02 0.00 0.00 175.26 177.06 2b5m n VAL 995 N 5.88 0.00 -3.58 2.63 0.24 0.46 -4.91 118.33 119.05 2b5m n VAL 995 Ca -0.00 -0.11 -0.17 0.00 -2.04 0.00 0.00 64.34 62.02 2b5m n VAL 995 Cb 0.46 0.02 -0.07 0.00 -1.47 0.00 0.00 33.84 32.78 2b5m n VAL 995 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2b5m s GLY 996 N -2.21 -0.47 0.06 7.63 0.00 -1.03 -4.40 107.32 106.90 2b5m s GLY 996 Ca 0.36 1.08 -0.18 0.00 0.00 0.00 0.00 44.72 45.98 2b5m s GLY 996 CO 0.41 0.76 0.42 1.08 0.00 0.00 0.00 173.10 175.77 2b5m s LEU 997 N -1.20 0.34 0.00 0.66 1.43 -0.50 -0.87 118.68 118.55 2b5m s LEU 997 Ca -0.11 -0.02 0.00 0.00 -1.03 0.00 0.00 54.13 52.96 2b5m s LEU 997 Cb -0.01 1.80 0.00 0.00 0.03 0.00 0.00 46.19 48.01 2b5m s LEU 997 CO 0.08 -0.70 0.00 0.33 0.23 0.00 0.00 176.35 176.30 2b5m n PHE 998 N 0.39 0.00 -3.46 0.29 7.35 -1.02 -1.24 117.46 119.78 2b5m n PHE 998 Ca -0.18 0.00 -0.41 0.00 -0.76 0.00 0.00 57.45 56.10 2b5m n PHE 998 Cb 0.60 0.00 -0.10 0.00 0.35 0.00 0.00 39.48 40.34 2b5m n PHE 998 CO 0.00 0.00 0.00 -1.58 -0.76 0.00 0.00 176.76 174.42 2b5m s HIS 999 N -0.58 3.22 -0.09 -5.13 5.65 -0.83 -0.55 115.29 116.97 2b5m s HIS 999 Ca 0.00 -0.22 -0.08 0.00 0.25 0.00 0.00 55.06 55.01 2b5m s HIS 999 Cb 0.00 -2.60 -0.07 0.00 -1.18 0.00 0.00 32.58 28.73 2b5m s HIS 999 CO 0.00 -0.45 0.28 1.25 -0.65 0.00 0.00 174.74 175.17 2b5m h LEU 1000N 8.65 -0.07 0.00 8.88 6.46 -0.57 -3.43 115.31 135.24 2b5m h LEU 1000Ca -0.30 -0.20 0.00 0.00 -0.12 0.00 0.00 57.88 57.27 2b5m h LEU 1000Cb 1.14 0.02 0.00 0.00 -0.73 0.00 0.00 40.66 41.09 2b5m h LEU 1000CO 0.68 0.51 0.00 0.61 -0.62 0.00 0.00 178.44 179.62 2b5m n GLY 1001N 1.49 0.94 3.67 3.75 0.00 -0.96 -5.05 105.19 109.02 2b5m n GLY 1001Ca -0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.70 2b5m n GLY 1001CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2b5m s GLU 1002N -0.36 2.04 -0.32 1.61 0.41 -1.26 -4.92 118.70 115.90 2b5m s GLU 1002Ca 0.00 -2.17 -0.01 0.00 -0.41 0.00 0.00 54.97 52.37 2b5m s GLU 1002Cb 0.00 -1.63 0.06 0.00 -1.78 0.00 0.00 34.13 30.78 2b5m s GLU 1002CO 0.00 -0.15 0.03 0.12 -0.49 0.00 0.00 175.26 174.77 2b5m s PHE 1003N -2.75 3.36 -0.11 1.61 5.36 -1.26 -4.23 117.98 119.96 2b5m s PHE 1003Ca 0.27 -2.10 -0.27 0.00 -0.96 0.00 0.00 56.93 53.87 2b5m s PHE 1003Cb 0.07 -2.35 -0.02 0.00 -0.34 0.00 0.00 43.02 40.39 2b5m s PHE 1003CO 0.14 -0.85 0.91 0.08 -1.46 0.00 0.00 175.22 174.04 2b5m s VAL 1004N 1.19 4.86 -0.44 3.12 1.01 -1.26 -1.97 120.40 126.90 2b5m s VAL 1004Ca -0.02 1.84 0.14 0.00 0.00 0.00 0.00 61.98 63.94 2b5m s VAL 1004Cb -0.20 -4.23 -0.18 0.00 0.00 0.00 0.00 36.38 31.77 2b5m s VAL 1004CO -0.02 0.06 0.50 0.59 0.00 0.00 0.00 175.10 176.23 2b5m n ASN 1005N 4.80 1.01 -3.63 3.32 3.02 -0.44 -4.23 115.26 119.12 2b5m n ASN 1005Ca 0.06 -0.55 -0.11 0.00 -0.03 0.00 0.00 54.58 53.95 2b5m n ASN 1005Cb 0.49 1.23 -0.07 0.00 -0.61 0.00 0.00 39.78 40.82 2b5m n ASN 1005CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2b5m s VAL 1006N -2.56 0.00 0.14 2.41 0.11 -1.20 -4.84 120.40 114.45 2b5m s VAL 1006Ca 0.02 0.00 0.08 0.00 -2.93 0.00 0.00 61.98 59.14 2b5m s VAL 1006Cb 0.10 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.91 2b5m s VAL 1006CO 0.59 0.00 -0.09 -0.36 -3.33 0.00 0.00 175.10 171.91 2b5m s PHE 1007N 0.23 2.72 -0.28 1.54 0.40 -1.26 -1.73 117.98 119.59 2b5m s PHE 1007Ca 0.02 -0.18 -0.20 0.00 -0.60 0.00 0.00 56.93 55.97 2b5m s PHE 1007Cb -0.05 -1.38 0.11 0.00 0.51 0.00 0.00 43.02 42.21 2b5m s PHE 1007CO -0.03 0.47 0.86 0.00 0.70 0.00 0.00 175.22 177.22 2b5m s HIS 1009N 0.95 2.89 0.00 0.00 3.76 -1.26 -1.71 115.29 119.92 2b5m s HIS 1009Ca -0.04 0.71 0.00 0.00 -0.15 0.00 0.00 55.06 55.58 2b5m s HIS 1009Cb -0.05 -4.01 0.00 0.00 1.11 0.00 0.00 32.58 29.63 2b5m s HIS 1009CO -0.11 -3.53 0.00 0.41 -0.85 0.00 0.00 174.74 170.66 2b5m n GLY 1010N 2.82 2.61 3.13 -2.22 0.00 -1.11 -4.78 105.19 105.64 2b5m n GLY 1010Ca 0.10 -1.22 -0.09 0.00 0.00 0.00 0.00 46.02 44.81 2b5m n GLY 1010CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2b5m s SER 1011N 0.00 0.64 0.00 1.61 0.15 -1.26 -4.14 113.70 110.69 2b5m s SER 1011Ca 0.00 -1.06 0.13 0.00 0.70 0.00 0.00 55.95 55.72 2b5m s SER 1011Cb 0.00 0.19 0.10 0.00 -1.71 0.00 0.00 66.02 64.60 2b5m s SER 1011CO 0.00 -0.60 0.90 0.18 1.20 0.00 0.00 173.24 174.92 2b5m n LEU 1012N 0.01 2.04 -4.65 3.45 4.77 -1.26 -4.20 117.00 117.15 2b5m n LEU 1012Ca -0.11 -0.98 -0.26 0.00 -0.03 0.00 0.00 56.01 54.63 2b5m n LEU 1012Cb 0.62 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.61 2b5m n LEU 1012CO 0.29 0.38 -0.26 0.68 -1.33 0.00 0.00 177.39 177.16 2b5m s VAL 1013N -1.13 2.26 0.00 4.08 -7.23 -1.26 -4.25 120.40 112.87 2b5m s VAL 1013Ca 0.15 -1.91 0.03 0.00 -1.81 0.00 0.00 61.98 58.44 2b5m s VAL 1013Cb 0.11 -2.92 -0.01 0.00 0.56 0.00 0.00 36.38 34.11 2b5m s VAL 1013CO 0.18 -0.06 -0.10 -0.32 -0.31 0.00 0.00 175.10 174.49 2b5m s MET 1014N -3.77 0.74 0.00 4.82 0.00 -1.26 -4.67 119.30 115.16 2b5m s MET 1014Ca 0.37 -0.42 0.00 0.00 0.00 0.00 0.00 55.69 55.64 2b5m s MET 1014Cb 0.05 -0.70 0.00 0.00 0.00 0.00 0.00 34.83 34.18 2b5m s MET 1014CO 0.20 0.19 0.00 0.94 0.00 0.00 0.00 175.02 176.34 2b5m n GLN 1015N 2.60 0.00 -3.45 4.11 0.00 -1.26 -5.06 117.38 114.32 2b5m n GLN 1015Ca -0.15 0.00 -0.29 0.00 -0.00 0.00 0.00 57.00 56.56 2b5m n GLN 1015Cb 0.56 0.00 -0.12 0.00 0.00 0.00 0.00 30.24 30.69 2b5m n GLN 1015CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.06 175.81 2b5m s PRO 1023N 0.00 0.58 0.00 3.69 0.05 -1.26 -4.86 135.00 133.20 2b5m s PRO 1023Ca 0.00 -1.40 0.00 0.00 0.05 0.00 0.00 61.00 59.65 2b5m s PRO 1023Cb 0.00 -1.30 0.00 0.00 0.05 0.00 0.00 34.50 33.25 2b5m s PRO 1023CO 0.00 -1.23 0.00 0.25 0.05 0.00 0.00 177.00 176.07 2b5m n THR 1024N 3.93 0.00 0.00 1.26 -2.24 -1.26 -4.92 114.28 111.05 2b5m n THR 1024Ca 0.14 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.92 2b5m n THR 1024Cb 0.38 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.61 2b5m n THR 1024CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 2b5m n GLN 1025N 0.00 0.00 0.00 -0.78 -0.06 -1.13 -4.95 117.38 110.46 2b5m n GLN 1025Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.00 2b5m n GLN 1025Cb 0.00 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.18 2b5m n GLN 1025CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2b5m n GLY 1026N 0.00 -1.64 3.62 1.69 0.00 -1.26 -2.55 105.19 105.04 2b5m n GLY 1026Ca 0.00 -1.55 -0.04 0.00 0.00 0.00 0.00 46.02 44.44 2b5m n GLY 1026CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2b5m s SER 1027N -3.41 -0.82 -0.08 1.61 0.15 -1.26 -4.51 113.70 105.38 2b5m s SER 1027Ca 0.00 1.25 -0.03 0.00 0.70 0.00 0.00 55.95 57.86 2b5m s SER 1027Cb 0.00 1.51 0.05 0.00 -1.71 0.00 0.00 66.02 65.87 2b5m s SER 1027CO 0.00 -0.19 0.16 -0.69 1.20 0.00 0.00 173.24 173.72 2b5m s VAL 1028N 1.84 -0.24 0.21 4.45 1.01 -0.80 -2.77 120.40 124.10 2b5m s VAL 1028Ca -0.08 0.33 0.06 0.00 0.00 0.00 0.00 61.98 62.29 2b5m s VAL 1028Cb -0.06 -0.29 -0.04 0.00 0.00 0.00 0.00 36.38 35.99 2b5m s VAL 1028CO -0.18 0.14 0.20 -0.76 0.00 0.00 0.00 175.10 174.50 2b5m s LEU 1029N 2.17 3.91 -0.01 3.92 1.43 -0.70 0.10 118.68 129.50 2b5m s LEU 1029Ca 0.02 -0.14 -0.04 0.00 -1.03 0.00 0.00 54.13 52.93 2b5m s LEU 1029Cb -0.12 -2.47 -0.00 0.00 0.03 0.00 0.00 46.19 43.63 2b5m s LEU 1029CO -0.06 -0.00 0.08 0.72 0.23 0.00 0.00 176.35 177.32 2b5m s PHE 1030N -1.97 0.04 0.15 0.29 -0.12 -1.07 -1.79 117.98 113.52 2b5m s PHE 1030Ca 0.32 -0.08 0.06 0.00 -0.05 0.00 0.00 56.93 57.18 2b5m s PHE 1030Cb -0.09 -0.05 -0.04 0.00 -0.63 0.00 0.00 43.02 42.21 2b5m s PHE 1030CO 0.25 -0.17 0.06 0.20 -0.05 0.00 0.00 175.22 175.51 2b5m s GLY 1031N -0.84 1.76 0.29 1.99 0.00 -0.71 -1.64 107.32 108.18 2b5m s GLY 1031Ca -0.09 -1.26 0.05 0.00 0.00 0.00 0.00 44.72 43.42 2b5m s GLY 1031CO 0.00 -1.27 0.01 -0.51 0.00 0.00 0.00 173.10 171.33 2b5m s THR 1032N -1.67 1.33 0.27 0.90 -4.23 -1.09 -1.32 115.64 109.84 2b5m s THR 1032Ca 0.29 -2.05 -0.00 0.00 -1.18 0.00 0.00 61.69 58.75 2b5m s THR 1032Cb -0.10 -2.59 0.26 0.00 1.34 0.00 0.00 72.50 71.41 2b5m s THR 1032CO 0.21 -0.17 1.81 0.58 -0.54 0.00 0.00 174.62 176.51 2b5m h VAL 1033N 2.23 0.87 0.00 2.29 2.07 -1.60 -0.93 116.25 121.18 2b5m h VAL 1033Ca -0.40 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 66.82 2b5m h VAL 1033Cb 1.24 -0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.93 2b5m h VAL 1033CO 0.68 0.16 0.00 0.59 0.02 0.00 0.00 177.57 179.02 2b5m n ASN 1034N -4.70 0.00 0.00 0.57 3.02 -1.26 -2.49 115.26 110.40 2b5m n ASN 1034Ca 0.18 -0.26 0.00 0.00 -0.03 0.00 0.00 54.58 54.46 2b5m n ASN 1034Cb 0.36 -0.22 0.00 0.00 -0.61 0.00 0.00 39.78 39.32 2b5m n ASN 1034CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2b5m n GLY 1035N 0.84 2.30 3.74 7.41 0.00 -0.73 -1.58 105.19 117.16 2b5m n GLY 1035Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 2b5m n GLY 1035CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2b5m s MET 1036N -0.81 4.20 -0.20 1.61 0.00 -1.26 -4.59 119.30 118.25 2b5m s MET 1036Ca 0.00 2.43 -0.06 0.00 0.00 0.00 0.00 55.69 58.06 2b5m s MET 1036Cb 0.00 -3.10 -0.03 0.00 0.00 0.00 0.00 34.83 31.71 2b5m s MET 1036CO 0.00 -0.57 0.03 0.42 0.00 0.00 0.00 175.02 174.90 2b5m s ILE 1037N 0.48 4.23 0.32 10.11 1.01 -0.25 -2.66 121.20 134.44 2b5m s ILE 1037Ca 0.65 -0.22 0.05 0.00 0.00 0.00 0.00 60.65 61.13 2b5m s ILE 1037Cb -0.45 -2.92 0.05 0.00 0.01 0.00 0.00 42.46 39.14 2b5m s ILE 1037CO 0.40 0.42 0.38 0.61 0.00 0.00 0.00 174.94 176.74 2b5m n GLY 1038N 4.15 2.25 3.30 6.18 0.00 -0.65 -0.22 105.19 120.20 2b5m n GLY 1038Ca -0.17 -2.20 -0.13 0.00 0.00 0.00 0.00 46.02 43.52 2b5m n GLY 1038CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2b5m s LEU 1039N 0.00 0.29 -0.08 0.99 2.96 0.20 -2.60 118.68 120.44 2b5m s LEU 1039Ca 0.29 0.86 0.03 0.00 -0.22 0.00 0.00 54.13 55.08 2b5m s LEU 1039Cb -0.02 1.42 0.01 0.00 0.50 0.00 0.00 46.19 48.09 2b5m s LEU 1039CO 0.18 -0.16 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.19 2b5m s VAL 1040N 0.48 1.56 0.27 1.68 1.01 0.29 -1.85 120.40 123.85 2b5m s VAL 1040Ca -0.02 -0.74 0.04 0.00 0.00 0.00 0.00 61.98 61.26 2b5m s VAL 1040Cb -0.04 -1.38 -0.06 0.00 0.00 0.00 0.00 36.38 34.91 2b5m s VAL 1040CO -0.02 0.45 0.02 -0.89 0.00 0.00 0.00 175.10 174.66 2b5m s THR 1041N 0.44 1.07 0.25 3.92 2.01 -0.25 -1.91 115.64 121.16 2b5m s THR 1041Ca -0.15 -2.03 0.05 0.00 0.31 0.00 0.00 61.69 59.88 2b5m s THR 1041Cb -0.16 -2.52 -0.03 0.00 0.01 0.00 0.00 72.50 69.80 2b5m s THR 1041CO 0.06 -0.19 0.33 -0.44 -0.69 0.00 0.00 174.62 173.70 2b5m s SER 1042N -3.37 6.16 0.17 3.53 0.01 -1.06 -0.79 113.70 118.35 2b5m s SER 1042Ca 0.32 -0.00 -0.00 0.00 1.31 0.00 0.00 55.95 57.58 2b5m s SER 1042Cb 0.07 -1.75 -0.04 0.00 0.21 0.00 0.00 66.02 64.50 2b5m s SER 1042CO 0.12 -0.08 0.06 -0.76 0.41 0.00 0.00 173.24 172.99 2b5m s LEU 1043N -3.96 1.72 0.63 2.44 1.43 -0.50 -2.83 118.68 117.61 2b5m s LEU 1043Ca 0.34 -1.26 -0.08 0.00 -1.03 0.00 0.00 54.13 52.11 2b5m s LEU 1043Cb -0.09 0.19 0.01 0.00 0.03 0.00 0.00 46.19 46.33 2b5m s LEU 1043CO 0.28 -0.71 0.97 -0.94 0.23 0.00 0.00 176.35 176.19 2b5m s SER 1044N -3.13 5.60 0.41 2.29 1.04 -1.26 -4.74 113.70 113.90 2b5m s SER 1044Ca 0.28 0.91 0.08 0.00 0.48 0.00 0.00 55.95 57.70 2b5m s SER 1044Cb 0.07 -1.85 0.85 0.00 0.10 0.00 0.00 66.02 65.20 2b5m s SER 1044CO 0.06 -1.14 2.02 1.05 0.98 0.00 0.00 173.24 176.21 2b5m h GLU 1045N -0.34 0.45 0.16 4.02 9.09 -1.99 0.32 114.58 126.28 2b5m h GLU 1045Ca -0.45 -0.05 -0.01 0.00 0.05 0.00 0.00 59.36 58.90 2b5m h GLU 1045Cb 1.25 -0.09 0.00 0.00 -1.65 0.00 0.00 28.75 28.26 2b5m h GLU 1045CO 0.62 0.36 -0.08 0.66 0.05 0.00 0.00 179.01 180.62 2b5m h SER 1046N 0.45 -0.18 -0.49 3.06 4.64 -1.99 -1.94 113.55 117.10 2b5m h SER 1046Ca 0.12 -0.34 0.08 0.00 -0.47 0.00 0.00 61.79 61.18 2b5m h SER 1046Cb 0.06 0.05 -0.06 0.00 -0.31 0.00 0.00 62.40 62.13 2b5m h SER 1046CO -0.02 0.29 0.13 -0.50 -0.87 0.00 0.00 176.83 175.86 2b5m h TRP 1047N -0.70 0.21 -0.84 4.77 4.06 -1.84 0.20 115.95 121.82 2b5m h TRP 1047Ca -0.02 0.03 0.18 0.00 2.06 0.00 0.00 58.89 61.14 2b5m h TRP 1047Cb 0.50 -0.02 -0.11 0.00 -1.00 0.00 0.00 29.16 28.53 2b5m h TRP 1047CO 0.07 0.04 0.34 -0.92 -3.56 0.00 0.00 178.44 174.41 2b5m h TYR 1048N 0.28 0.57 -0.02 0.49 3.20 -0.86 0.72 116.97 121.36 2b5m h TYR 1048Ca 0.24 0.04 -0.13 0.00 3.14 0.00 0.00 58.73 62.02 2b5m h TYR 1048Cb 0.30 -0.12 0.01 0.00 1.54 0.00 0.00 36.73 38.45 2b5m h TYR 1048CO -0.20 0.00 -0.52 -0.91 -1.64 0.00 0.00 178.16 174.90 2b5m h ASN 1049N 0.42 0.48 0.16 -2.11 2.35 0.07 0.49 115.58 117.43 2b5m h ASN 1049Ca 0.49 -0.74 0.02 0.00 -0.55 0.00 0.00 56.30 55.52 2b5m h ASN 1049Cb 0.86 -0.15 -0.03 0.00 0.05 0.00 0.00 38.32 39.05 2b5m h ASN 1049CO -0.48 1.16 -0.31 0.25 -1.65 0.00 0.00 177.43 176.40 2b5m h LEU 1050N -0.15 -0.87 -0.97 1.61 6.46 -0.57 0.12 115.31 120.94 2b5m h LEU 1050Ca -0.06 0.10 0.02 0.00 -0.12 0.00 0.00 57.88 57.81 2b5m h LEU 1050Cb 1.22 0.32 -0.05 0.00 -0.73 0.00 0.00 40.66 41.43 2b5m h LEU 1050CO 0.10 -0.40 0.64 -0.07 -0.62 0.00 0.00 178.44 178.09 2b5m h LEU 1051N -0.55 1.09 -0.97 2.25 3.38 -0.88 0.49 115.31 120.12 2b5m h LEU 1051Ca 0.02 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 2b5m h LEU 1051Cb 0.56 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.02 2b5m h LEU 1051CO -0.16 0.78 0.25 0.25 0.09 0.00 0.00 178.44 179.65 2b5m h LEU 1052N 1.28 0.92 0.41 1.67 6.46 0.83 -1.66 115.31 125.22 2b5m h LEU 1052Ca 0.36 -0.14 -0.02 0.00 -0.12 0.00 0.00 57.88 57.97 2b5m h LEU 1052Cb -0.10 -0.24 0.00 0.00 -0.73 0.00 0.00 40.66 39.59 2b5m h LEU 1052CO -0.09 0.83 -0.20 -0.78 -0.62 0.00 0.00 178.44 177.58 2b5m h ASP 1053N 0.97 -0.47 -0.54 1.25 -0.00 -0.48 -2.76 116.42 114.39 2b5m h ASP 1053Ca 0.22 -0.08 0.17 0.00 -0.00 0.00 0.00 57.03 57.34 2b5m h ASP 1053Cb 0.21 0.12 -0.10 0.00 -0.00 0.00 0.00 39.33 39.56 2b5m h ASP 1053CO -0.02 -0.18 0.09 0.23 -0.00 0.00 0.00 179.24 179.36 2b5m n MET 1054N -5.25 -0.04 0.12 0.28 2.81 0.14 -1.30 117.12 113.87 2b5m n MET 1054Ca -0.11 0.79 -0.11 0.00 -1.81 0.00 0.00 57.70 56.46 2b5m n MET 1054Cb 0.28 -1.30 -0.07 0.00 -0.71 0.00 0.00 33.22 31.41 2b5m n MET 1054CO 0.00 0.00 0.00 1.96 1.51 0.00 0.00 175.97 179.44 2b5m h GLN 1055N 0.00 -0.34 -0.01 0.03 4.20 -1.02 -0.67 115.11 117.30 2b5m h GLN 1055Ca 0.37 0.02 0.03 0.00 0.06 0.00 0.00 58.65 59.13 2b5m h GLN 1055Cb 0.84 0.08 -0.05 0.00 0.30 0.00 0.00 27.48 28.64 2b5m h GLN 1055CO -0.48 0.01 -0.32 -0.91 -0.67 0.00 0.00 178.83 176.46 2b5m h ASN 1056N -0.89 -0.96 -0.89 1.46 4.21 -1.12 0.18 115.58 117.57 2b5m h ASN 1056Ca -0.04 0.13 0.15 0.00 1.21 0.00 0.00 56.30 57.75 2b5m h ASN 1056Cb 0.51 0.39 -0.07 0.00 -1.12 0.00 0.00 38.32 38.02 2b5m h ASN 1056CO 0.06 -0.38 0.57 0.03 -1.29 0.00 0.00 177.43 176.42 2b5m h ARG 1057N -0.47 0.64 0.00 0.81 3.08 -1.46 -1.62 114.38 115.37 2b5m h ARG 1057Ca 0.06 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.06 2b5m h ARG 1057Cb 0.56 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 30.46 2b5m h ARG 1057CO -0.27 0.43 -0.05 -0.07 -1.07 0.00 0.00 179.97 178.94 2b5m h LEU 1058N 0.66 0.00 0.05 3.04 3.38 0.96 -3.22 115.31 120.17 2b5m h LEU 1058Ca 0.45 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 58.17 2b5m h LEU 1058Cb 0.77 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.49 2b5m h LEU 1058CO -0.21 0.05 -1.38 0.78 0.09 0.00 0.00 178.44 177.77 2b5m h ASN 1059N 0.00 0.16 -0.75 -0.43 2.35 -0.58 -2.45 115.58 113.88 2b5m h ASN 1059Ca -0.00 -0.69 0.30 0.00 -0.55 0.00 0.00 56.30 55.36 2b5m h ASN 1059Cb 0.46 -0.05 -0.14 0.00 0.05 0.00 0.00 38.32 38.65 2b5m h ASN 1059CO 0.01 1.57 0.34 0.29 -1.65 0.00 0.00 177.43 177.99 2b5m n LYS 1060N -4.15 -0.05 -0.06 0.81 5.02 -1.17 -2.98 118.16 115.58 2b5m n LYS 1060Ca -0.30 1.04 -0.03 0.00 -2.02 0.00 0.00 58.31 57.00 2b5m n LYS 1060Cb 0.79 -1.84 -0.01 0.00 -0.02 0.00 0.00 35.03 33.95 2b5m n LYS 1060CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2b5m h VAL 1061N 0.00 0.00 -3.15 -0.18 2.07 -1.56 -3.47 116.25 109.96 2b5m h VAL 1061Ca 0.61 -0.96 -0.53 0.00 0.82 0.00 0.00 66.70 66.64 2b5m h VAL 1061Cb 1.57 0.00 0.04 0.00 -1.52 0.00 0.00 31.29 31.37 2b5m h VAL 1061CO -0.59 0.00 0.75 -0.63 0.02 0.00 0.00 177.57 177.12 2b5m s ILE 1062N -2.01 2.97 -0.38 4.57 1.01 -0.93 -4.95 121.20 121.48 2b5m s ILE 1062Ca -0.10 0.75 -0.27 0.00 0.00 0.00 0.00 60.65 61.03 2b5m s ILE 1062Cb 0.01 -3.48 0.02 0.00 0.01 0.00 0.00 42.46 39.02 2b5m s ILE 1062CO 0.15 0.09 0.98 -1.59 0.00 0.00 0.00 174.94 174.57 2b5m s LYS 1063N 0.45 3.85 -0.13 2.79 -2.85 -1.26 -4.83 119.74 117.76 2b5m s LYS 1063Ca 0.63 0.64 -0.29 0.00 -1.00 0.00 0.00 55.97 55.94 2b5m s LYS 1063Cb -0.39 -3.81 -0.01 0.00 -2.06 0.00 0.00 37.83 31.55 2b5m s LYS 1063CO 0.36 -1.01 1.14 0.45 0.10 0.00 0.00 175.35 176.38 2b5m s SER 1064N 1.93 7.08 0.00 0.03 0.15 -1.26 -5.00 113.70 116.63 2b5m s SER 1064Ca 0.41 1.63 0.00 0.00 0.70 0.00 0.00 55.95 58.68 2b5m s SER 1064Cb -0.11 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.65 2b5m s SER 1064CO 0.20 -0.61 0.16 0.52 1.20 0.00 0.00 173.24 174.71 2b5m n VAL 1065N 4.93 0.00 0.56 4.45 0.31 -1.26 -0.65 118.33 126.66 2b5m n VAL 1065Ca 0.11 0.55 -0.02 0.00 -0.01 0.00 0.00 64.34 64.96 2b5m n VAL 1065Cb 0.46 -0.94 0.02 0.00 -0.91 0.00 0.00 33.84 32.47 2b5m n VAL 1065CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2b5m n GLY 1066N -0.36 2.34 3.63 2.92 0.00 -1.26 -4.65 105.19 107.81 2b5m n GLY 1066Ca 0.00 -0.12 -0.27 0.00 0.00 0.00 0.00 46.02 45.63 2b5m n GLY 1066CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2b5m n LYS 1067N 0.50 -2.08 -4.42 1.61 5.02 0.17 -4.86 118.16 114.10 2b5m n LYS 1067Ca 0.06 0.54 -0.33 0.00 -2.02 0.00 0.00 58.31 56.56 2b5m n LYS 1067Cb 0.60 -4.59 -0.15 0.00 -0.02 0.00 0.00 35.03 30.87 2b5m n LYS 1067CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2b5m s ILE 1068N -3.52 2.72 0.01 -0.18 1.01 -1.26 -4.98 121.20 115.01 2b5m s ILE 1068Ca 0.37 -0.74 -0.30 0.00 0.00 0.00 0.00 60.65 59.98 2b5m s ILE 1068Cb -0.11 -2.16 -0.07 0.00 0.01 0.00 0.00 42.46 40.12 2b5m s ILE 1068CO 0.84 0.51 1.74 -1.61 0.00 0.00 0.00 174.94 176.41 2b5m s GLU 1069N 0.92 4.17 0.56 2.79 8.01 -1.26 -4.84 118.70 129.05 2b5m s GLU 1069Ca -0.03 2.36 0.30 0.00 0.01 0.00 0.00 54.97 57.60 2b5m s GLU 1069Cb -0.15 -3.90 1.46 0.00 -4.31 0.00 0.00 34.13 27.23 2b5m s GLU 1069CO -0.01 -0.84 1.89 1.25 0.01 0.00 0.00 175.26 177.55 2b5m h HIS 1070N 9.42 0.00 -0.40 1.61 -0.00 -1.99 -0.46 115.15 123.33 2b5m h HIS 1070Ca -0.43 0.00 -0.13 0.00 -0.00 0.00 0.00 60.37 59.81 2b5m h HIS 1070Cb 1.20 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 28.60 2b5m h HIS 1070CO 0.87 0.00 -0.25 1.03 -0.00 0.00 0.00 177.93 179.58 2b5m h SER 1071N 0.00 0.91 0.09 3.26 0.87 -1.97 -1.97 113.55 114.74 2b5m h SER 1071Ca 0.33 -0.42 -0.00 0.00 -1.23 0.00 0.00 61.79 60.47 2b5m h SER 1071Cb 1.48 -0.25 0.00 0.00 -0.44 0.00 0.00 62.40 63.19 2b5m h SER 1071CO -0.00 1.14 -0.04 0.15 -0.53 0.00 0.00 176.83 177.54 2b5m h PHE 1072N 0.69 -0.11 -0.39 2.24 3.57 -1.51 -2.64 116.94 118.80 2b5m h PHE 1072Ca 0.08 -0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.66 2b5m h PHE 1072Cb 0.82 0.04 -0.09 0.00 2.79 0.00 0.00 35.95 39.50 2b5m h PHE 1072CO 0.06 0.29 -0.28 2.35 -2.23 0.00 0.00 178.31 178.50 2b5m h TRP 1073N -0.54 -0.75 -0.00 0.41 -0.00 -1.37 -1.98 115.95 111.71 2b5m h TRP 1073Ca -0.01 0.05 0.00 0.00 -0.00 0.00 0.00 58.89 58.93 2b5m h TRP 1073Cb 0.45 0.39 0.00 0.00 -0.00 0.00 0.00 29.16 30.00 2b5m h TRP 1073CO 0.06 -0.35 -0.03 0.54 -0.00 0.00 0.00 178.44 178.66 2b5m n ARG 1074N -5.41 1.04 -2.41 2.65 5.12 -0.74 -4.71 116.66 112.20 2b5m n ARG 1074Ca 0.01 -0.29 -0.42 0.00 -1.93 0.00 0.00 57.85 55.22 2b5m n ARG 1074Cb 0.32 -1.49 -0.03 0.00 -1.16 0.00 0.00 32.46 30.10 2b5m n ARG 1074CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 2b5m s SER 1075N -2.16 7.08 0.24 0.55 1.04 -0.75 -1.97 113.70 117.74 2b5m s SER 1075Ca 0.39 2.07 -0.30 0.00 0.48 0.00 0.00 55.95 58.60 2b5m s SER 1075Cb 0.21 -2.59 -0.15 0.00 0.10 0.00 0.00 66.02 63.60 2b5m s SER 1075CO 0.39 -0.44 1.03 0.33 0.98 0.00 0.00 173.24 175.53 2b5m n PHE 1076N 3.56 1.13 -3.42 5.02 7.35 -0.65 -4.45 117.46 125.99 2b5m n PHE 1076Ca 0.08 0.72 -0.04 0.00 -0.76 0.00 0.00 57.45 57.44 2b5m n PHE 1076Cb 0.46 -2.24 -0.06 0.00 0.35 0.00 0.00 39.48 37.99 2b5m n PHE 1076CO 0.00 0.00 0.00 -1.58 -0.76 0.00 0.00 176.76 174.42 2b5m s HIS 1077N -0.72 -1.09 0.12 -5.13 5.65 -1.26 -2.77 115.29 110.08 2b5m s HIS 1077Ca 0.65 1.46 0.06 0.00 0.25 0.00 0.00 55.06 57.48 2b5m s HIS 1077Cb -0.78 0.35 -0.04 0.00 -1.18 0.00 0.00 32.58 30.94 2b5m s HIS 1077CO 0.57 -0.69 -0.15 0.95 -0.65 0.00 0.00 174.74 174.77 2b5m s THR 1078N 2.70 1.34 0.53 0.89 -4.23 -0.82 -4.87 115.64 111.18 2b5m s THR 1078Ca 0.08 -1.67 0.31 0.00 -1.18 0.00 0.00 61.69 59.24 2b5m s THR 1078Cb -0.14 -1.49 0.49 0.00 1.34 0.00 0.00 72.50 72.69 2b5m s THR 1078CO -0.17 -0.37 1.87 -0.08 -0.54 0.00 0.00 174.62 175.33 2b5m h GLU 1079N 3.62 0.03 0.01 3.99 4.57 -2.00 -2.31 114.58 122.49 2b5m h GLU 1079Ca -0.40 -0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 57.77 2b5m h GLU 1079Cb 1.19 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.78 2b5m h GLU 1079CO 0.49 0.02 -0.00 -0.09 -1.18 0.00 0.00 179.01 178.24 2b5m h ARG 1080N 0.03 -0.01 -5.97 1.92 2.43 -2.04 -3.49 114.38 107.26 2b5m h ARG 1080Ca 0.45 0.00 -0.55 0.00 -0.81 0.00 0.00 59.98 59.07 2b5m h ARG 1080Cb 1.76 0.00 -0.08 0.00 -0.42 0.00 0.00 29.97 31.24 2b5m h ARG 1080CO -0.02 -0.01 -0.49 -1.59 -1.51 0.00 0.00 179.97 176.36 2b5m s LYS 1081N -1.94 2.29 -0.21 0.20 -2.85 -0.87 -5.14 119.74 111.22 2b5m s LYS 1081Ca -0.00 -1.76 -0.05 0.00 -1.00 0.00 0.00 55.97 53.16 2b5m s LYS 1081Cb 0.00 -2.07 0.11 0.00 -2.06 0.00 0.00 37.83 33.81 2b5m s LYS 1081CO 0.00 -0.09 0.38 0.99 0.10 0.00 0.00 175.35 176.73 2b5m s THR 1082N -2.56 -0.60 0.13 3.79 2.01 -1.26 -1.94 115.64 115.22 2b5m s THR 1082Ca 0.42 0.07 0.07 0.00 0.31 0.00 0.00 61.69 62.55 2b5m s THR 1082Cb 0.02 -0.71 -0.04 0.00 0.01 0.00 0.00 72.50 71.78 2b5m s THR 1082CO 0.23 -0.02 -0.16 -1.61 -0.69 0.00 0.00 174.62 172.38 2b5m s GLU 1083N 2.55 1.10 0.88 4.92 0.41 -1.11 -5.03 118.70 122.42 2b5m s GLU 1083Ca 0.05 -1.28 -0.11 0.00 -0.41 0.00 0.00 54.97 53.23 2b5m s GLU 1083Cb -0.14 -1.07 0.12 0.00 -1.78 0.00 0.00 34.13 31.26 2b5m s GLU 1083CO -0.14 0.21 1.09 -2.14 -0.49 0.00 0.00 175.26 173.80 2b5m s PRO 1084N -2.62 1.42 0.72 0.39 0.02 -1.26 -1.64 135.00 132.02 2b5m s PRO 1084Ca 0.10 0.93 -0.11 0.00 0.02 0.00 0.00 61.00 61.94 2b5m s PRO 1084Cb -0.06 -1.82 0.02 0.00 0.02 0.00 0.00 34.50 32.67 2b5m s PRO 1084CO 0.04 -2.16 1.07 0.00 -0.33 0.00 0.00 177.00 175.62 2b5m s ALA 1085N -2.90 2.55 -0.00 -1.55 0.00 -1.26 -4.63 121.76 113.97 2b5m s ALA 1085Ca 0.63 0.04 -0.28 0.00 0.00 0.00 0.00 51.96 52.35 2b5m s ALA 1085Cb -0.18 -3.17 0.07 0.00 0.00 0.00 0.00 23.12 19.84 2b5m s ALA 1085CO 0.57 -1.37 0.64 0.99 0.00 0.00 0.00 175.76 176.59 2b5m s THR 1086N -3.05 0.00 -0.80 0.00 2.01 -0.37 -4.87 115.64 108.56 2b5m s THR 1086Ca 0.59 -0.04 0.00 0.00 0.31 0.00 0.00 61.69 62.55 2b5m s THR 1086Cb -0.14 -0.99 0.00 0.00 0.01 0.00 0.00 72.50 71.38 2b5m s THR 1086CO 0.55 -0.02 0.00 0.61 -0.69 0.00 0.00 174.62 175.07 2b5m n GLY 1087N 0.63 -0.06 2.85 4.40 0.00 -1.26 -1.41 105.19 110.35 2b5m n GLY 1087Ca -0.19 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.70 2b5m n GLY 1087CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2b5m s PHE 1088N -2.20 -0.04 -0.04 1.61 0.40 -1.25 -1.09 117.98 115.37 2b5m s PHE 1088Ca 0.00 0.20 0.06 0.00 -0.60 0.00 0.00 56.93 56.59 2b5m s PHE 1088Cb 0.00 -0.12 -0.01 0.00 0.51 0.00 0.00 43.02 43.40 2b5m s PHE 1088CO 0.00 -0.08 -0.22 0.42 0.70 0.00 0.00 175.22 176.04 2b5m s ILE 1089N 0.74 1.81 -0.27 0.64 1.01 -0.04 -4.98 121.20 120.11 2b5m s ILE 1089Ca -0.06 -0.94 -0.08 0.00 0.00 0.00 0.00 60.65 59.57 2b5m s ILE 1089Cb -0.08 -1.53 -0.01 0.00 0.01 0.00 0.00 42.46 40.84 2b5m s ILE 1089CO -0.03 0.51 0.09 1.51 0.00 0.00 0.00 174.94 177.02 2b5m s ASP 1090N -0.20 5.22 0.12 3.58 3.84 -1.26 -0.43 116.67 127.54 2b5m s ASP 1090Ca -0.01 -0.40 0.15 0.00 -0.00 0.00 0.00 52.55 52.30 2b5m s ASP 1090Cb -0.12 -1.93 0.68 0.00 -1.38 0.00 0.00 42.92 40.18 2b5m s ASP 1090CO 0.02 -0.11 1.47 0.61 -0.00 0.00 0.00 175.17 177.17 2b5m n GLY 1091N 4.92 -0.96 0.26 2.12 0.00 0.12 -1.13 105.19 110.52 2b5m n GLY 1091Ca -0.15 0.04 -0.16 0.00 0.00 0.00 0.00 46.02 45.75 2b5m n GLY 1091CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2b5m h ASP 1092N 0.00 -0.51 -0.72 1.61 5.19 -1.90 0.97 116.42 121.07 2b5m h ASP 1092Ca 0.00 -0.03 -0.03 0.00 -0.62 0.00 0.00 57.03 56.36 2b5m h ASP 1092Cb 0.20 0.13 -0.03 0.00 0.18 0.00 0.00 39.33 39.81 2b5m h ASP 1092CO 0.00 -0.30 0.34 0.25 -3.12 0.00 0.00 179.24 176.41 2b5m h LEU 1093N -0.68 0.94 -0.84 1.55 6.46 -1.49 -2.54 115.31 118.72 2b5m h LEU 1093Ca -0.06 -0.14 0.00 0.00 -0.12 0.00 0.00 57.88 57.56 2b5m h LEU 1093Cb 0.50 -0.24 0.00 0.00 -0.73 0.00 0.00 40.66 40.19 2b5m h LEU 1093CO 0.10 0.81 0.00 0.40 -0.62 0.00 0.00 178.44 179.13 2b5m h ILE 1094N 1.00 0.00 0.00 4.05 2.04 -0.68 -2.79 117.51 121.14 2b5m h ILE 1094Ca 0.25 -0.32 0.00 0.00 1.00 0.00 0.00 64.86 65.78 2b5m h ILE 1094Cb 0.13 1.13 0.00 0.00 -0.74 0.00 0.00 36.82 37.34 2b5m h ILE 1094CO -0.03 0.00 -1.47 -0.62 0.00 0.00 0.00 178.15 176.03 2b5m n GLU 1095N -2.45 0.48 0.23 2.37 1.02 0.33 -3.68 120.64 118.93 2b5m n GLU 1095Ca 0.02 -0.07 0.13 0.00 -0.02 0.00 0.00 57.16 57.21 2b5m n GLU 1095Cb 0.26 -1.59 0.67 0.00 -0.02 0.00 0.00 31.44 30.76 2b5m n GLU 1095CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2b5m h SER 1096N 0.00 0.00 0.42 1.62 4.64 -1.17 -2.51 113.55 116.55 2b5m h SER 1096Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2b5m h SER 1096Cb 0.87 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.96 2b5m h SER 1096CO 0.00 0.00 0.00 0.15 -0.87 0.00 0.00 176.83 176.11 2b5m h PHE 1097N 0.00 0.00 0.00 4.77 3.57 -1.70 -1.97 116.94 121.61 2b5m h PHE 1097Ca 0.00 0.00 -0.21 0.00 3.53 0.00 0.00 57.97 61.29 2b5m h PHE 1097Cb 0.32 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.03 2b5m h PHE 1097CO 0.00 0.00 -1.00 -0.07 -2.23 0.00 0.00 178.31 175.01 2b5m h LEU 1098N 0.00 0.00 -0.31 0.59 3.38 -1.74 -3.30 115.31 113.93 2b5m h LEU 1098Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2b5m h LEU 1098Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 2b5m h LEU 1098CO 0.00 0.99 0.00 0.47 0.09 0.00 0.00 178.44 179.99 2b5m n ASP 1099N -3.34 0.47 -4.92 -0.43 10.43 -0.74 -4.85 116.55 113.17 2b5m n ASP 1099Ca -0.00 -1.50 -0.27 0.00 2.57 0.00 0.00 54.79 55.59 2b5m n ASP 1099Cb 0.94 -0.03 0.06 0.00 1.84 0.00 0.00 41.12 43.93 2b5m n ASP 1099CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 2b5m s ILE 1100N -1.94 2.73 0.05 0.53 1.01 -1.24 -5.07 121.20 117.26 2b5m s ILE 1100Ca 0.29 -0.06 -0.05 0.00 0.00 0.00 0.00 60.65 60.83 2b5m s ILE 1100Cb 0.14 -3.17 -0.05 0.00 0.01 0.00 0.00 42.46 39.39 2b5m s ILE 1100CO 0.23 -0.20 0.29 -0.94 0.00 0.00 0.00 174.94 174.32 2b5m s SER 1101N -4.45 6.48 0.28 3.58 1.04 -1.26 -4.94 113.70 114.42 2b5m s SER 1101Ca 0.59 0.53 -0.03 0.00 0.48 0.00 0.00 55.95 57.51 2b5m s SER 1101Cb -0.11 -2.07 0.60 0.00 0.10 0.00 0.00 66.02 64.54 2b5m s SER 1101CO 0.46 0.20 1.59 0.03 0.98 0.00 0.00 173.24 176.50 2b5m h ARG 1102N 3.59 0.04 -0.15 4.02 3.08 -1.97 0.52 114.38 123.51 2b5m h ARG 1102Ca -0.48 -0.00 0.02 0.00 0.07 0.00 0.00 59.98 59.59 2b5m h ARG 1102Cb 1.18 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 31.20 2b5m h ARG 1102CO 0.69 0.02 -0.00 -1.35 -1.07 0.00 0.00 179.97 178.26 2b5m h PRO 1103N 0.04 0.05 0.00 0.04 0.11 -2.00 0.64 132.00 130.87 2b5m h PRO 1103Ca 0.52 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.61 2b5m h PRO 1103Cb 0.98 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.08 2b5m h PRO 1103CO -0.86 0.03 -0.07 0.87 -0.21 0.00 0.00 178.00 177.76 2b5m h LYS 1104N 0.05 0.00 0.00 1.05 1.57 -0.62 -3.06 116.57 115.56 2b5m h LYS 1104Ca 0.07 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.84 2b5m h LYS 1104Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.39 2b5m h LYS 1104CO -0.12 0.07 -0.05 1.98 -0.57 0.00 0.00 179.45 180.76 2b5m h MET 1105N 0.00 0.03 0.00 3.15 4.05 0.45 -3.00 114.93 119.61 2b5m h MET 1105Ca -0.00 -0.04 -0.00 0.00 -0.28 0.00 0.00 59.70 59.38 2b5m h MET 1105Cb 0.14 0.01 -0.00 0.00 -0.80 0.00 0.00 31.60 30.95 2b5m h MET 1105CO 0.01 0.84 -0.02 1.96 0.23 0.00 0.00 176.91 179.93 2b5m h GLN 1106N -0.76 0.00 -0.21 0.39 4.20 -0.36 -1.19 115.11 117.19 2b5m h GLN 1106Ca -0.01 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.68 2b5m h GLN 1106Cb 0.86 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.63 2b5m h GLN 1106CO 0.01 0.02 0.04 1.49 -0.67 0.00 0.00 178.83 179.72 2b5m h GLU 1107N 0.00 0.30 -7.07 1.46 4.81 -1.42 -3.38 114.58 109.27 2b5m h GLU 1107Ca -0.00 -0.04 -0.46 0.00 -0.13 0.00 0.00 59.36 58.73 2b5m h GLU 1107Cb 0.29 -0.06 0.06 0.00 0.63 0.00 0.00 28.75 29.67 2b5m h GLU 1107CO 0.00 0.30 0.12 0.08 -0.73 0.00 0.00 179.01 178.78 2b5m s VAL 1108N -5.06 3.00 -1.10 0.32 1.01 -0.45 -4.68 120.40 113.43 2b5m s VAL 1108Ca -0.06 -0.29 -0.07 0.00 0.00 0.00 0.00 61.98 61.55 2b5m s VAL 1108Cb 0.16 -3.20 -0.05 0.00 0.00 0.00 0.00 36.38 33.30 2b5m s VAL 1108CO 0.72 -0.19 0.90 0.52 0.00 0.00 0.00 175.10 177.05 2b5m n VAL 1109N -2.59 -8.02 0.00 2.92 0.31 -1.26 -4.86 118.33 104.82 2b5m n VAL 1109Ca 0.06 -1.13 0.00 0.00 -0.01 0.00 0.00 64.34 63.26 2b5m n VAL 1109Cb 0.59 -5.86 0.00 0.00 -0.91 0.00 0.00 33.84 27.66 2b5m n VAL 1109CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2b5m n ALA 1110N -3.55 1.81 -3.34 3.52 0.00 -1.26 -4.72 120.51 112.97 2b5m n ALA 1110Ca -0.12 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.18 2b5m n ALA 1110Cb 0.63 0.11 -0.07 0.00 0.00 0.00 0.00 19.45 20.12 2b5m n ALA 1110CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2b5m s ASN 1111N -2.26 0.77 0.53 0.00 -0.87 -1.26 -5.08 114.94 106.76 2b5m s ASN 1111Ca 0.00 -1.42 0.00 0.00 -1.57 0.00 0.00 52.86 49.87 2b5m s ASN 1111Cb 0.00 0.78 0.00 0.00 -0.02 0.00 0.00 41.25 42.01 2b5m s ASN 1111CO 0.00 -0.25 0.00 -0.11 -2.57 0.00 0.00 177.10 174.17 2b5m n LEU 1112N 4.32 -1.85 -2.91 0.60 7.94 -1.26 -5.09 117.00 118.75 2b5m n LEU 1112Ca 0.11 2.77 -0.14 0.00 -1.11 0.00 0.00 56.01 57.63 2b5m n LEU 1112Cb 0.47 -2.81 -0.00 0.00 0.53 0.00 0.00 43.42 41.61 2b5m n LEU 1112CO 0.07 -0.19 -0.15 -2.11 -1.11 0.00 0.00 177.39 173.90 2b5m n ARG 1122N -1.75 1.22 -0.02 1.96 1.85 -1.26 -4.71 116.66 113.94 2b5m n ARG 1122Ca 0.00 -3.41 -0.18 0.00 -1.00 0.00 0.00 57.85 53.25 2b5m n ARG 1122Cb 0.23 -1.53 -0.13 0.00 -1.05 0.00 0.00 32.46 29.98 2b5m n ARG 1122CO 0.00 0.00 0.00 0.93 -0.01 0.00 0.00 177.63 178.55 2b5m h GLU 1123N 2.98 0.14 -4.06 2.89 3.07 -2.03 -3.49 114.58 114.09 2b5m h GLU 1123Ca 0.02 -0.24 0.00 0.00 -0.50 0.00 0.00 59.36 58.64 2b5m h GLU 1123Cb 1.05 0.09 0.00 0.00 -0.84 0.00 0.00 28.75 29.05 2b5m h GLU 1123CO 0.52 1.11 -0.14 0.00 -1.40 0.00 0.00 179.01 179.11 2b5m n ALA 1124N -2.79 -2.58 -2.46 3.43 0.00 -1.26 -4.98 120.51 109.86 2b5m n ALA 1124Ca -0.17 0.32 -0.30 0.00 0.00 0.00 0.00 53.44 53.30 2b5m n ALA 1124Cb 0.69 -1.31 -0.12 0.00 0.00 0.00 0.00 19.45 18.71 2b5m n ALA 1124CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2b5m s THR 1125N -2.25 2.70 -0.01 0.00 2.01 -1.26 -4.79 115.64 112.04 2b5m s THR 1125Ca 0.07 -1.44 -0.22 0.00 0.31 0.00 0.00 61.69 60.41 2b5m s THR 1125Cb -0.02 -2.19 -0.12 0.00 0.01 0.00 0.00 72.50 70.18 2b5m s THR 1125CO 0.35 0.19 0.91 0.00 -0.69 0.00 0.00 174.62 175.37 2b5m h ALA 1126N 4.06 -0.75 -0.85 7.40 0.00 -1.93 0.70 119.26 127.88 2b5m h ALA 1126Ca -0.49 -0.17 0.21 0.00 0.00 0.00 0.00 54.91 54.46 2b5m h ALA 1126Cb 1.16 0.29 -0.15 0.00 0.00 0.00 0.00 17.79 19.09 2b5m h ALA 1126CO 0.45 -0.71 0.03 -0.44 0.00 0.00 0.00 179.25 178.58 2b5m h ASP 1127N -1.18 -0.38 -0.52 0.00 3.32 -1.99 0.29 116.42 115.96 2b5m h ASP 1127Ca -0.08 0.23 -0.07 0.00 0.02 0.00 0.00 57.03 57.13 2b5m h ASP 1127Cb 0.59 0.39 -0.02 0.00 0.22 0.00 0.00 39.33 40.51 2b5m h ASP 1127CO 0.13 -0.24 0.09 -0.78 -1.72 0.00 0.00 179.24 176.72 2b5m h ASP 1128N 0.08 0.86 1.51 6.45 -0.00 -1.91 -2.70 116.42 120.72 2b5m h ASP 1128Ca 0.49 -0.18 -0.02 0.00 -0.00 0.00 0.00 57.03 57.31 2b5m h ASP 1128Cb 0.92 -0.23 -0.00 0.00 -0.00 0.00 0.00 39.33 40.02 2b5m h ASP 1128CO -0.76 0.87 -0.50 0.25 -0.00 0.00 0.00 179.24 179.10 2b5m h LEU 1129N 0.86 0.00 -1.18 2.28 7.12 0.29 -2.89 115.31 121.79 2b5m h LEU 1129Ca 0.18 0.00 -0.08 0.00 0.13 0.00 0.00 57.88 58.11 2b5m h LEU 1129Cb 0.38 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 40.50 2b5m h LEU 1129CO 0.01 0.09 -0.31 0.40 -0.13 0.00 0.00 178.44 178.50 2b5m h ILE 1130N 0.00 1.25 -0.45 4.05 2.04 -0.39 -2.93 117.51 121.09 2b5m h ILE 1130Ca -0.01 -1.21 -0.12 0.00 1.00 0.00 0.00 64.86 64.53 2b5m h ILE 1130Cb 1.07 1.53 -0.02 0.00 -0.74 0.00 0.00 36.82 38.67 2b5m h ILE 1130CO 0.01 0.36 -0.18 0.50 0.00 0.00 0.00 178.15 178.84 2b5m h LYS 1131N 0.16 0.88 -0.17 2.37 3.64 -1.26 -0.24 116.57 121.95 2b5m h LYS 1131Ca 0.02 -0.34 -0.21 0.00 -1.27 0.00 0.00 60.65 58.85 2b5m h LYS 1131Cb 0.63 -0.05 0.01 0.00 -0.41 0.00 0.00 32.23 32.41 2b5m h LYS 1131CO 0.05 0.99 -0.70 0.28 -2.27 0.00 0.00 179.45 177.80 2b5m h VAL 1132N 0.78 1.29 -0.32 2.00 2.07 -1.58 -2.59 116.25 117.90 2b5m h VAL 1132Ca 0.11 -1.90 -0.09 0.00 0.82 0.00 0.00 66.70 65.64 2b5m h VAL 1132Cb 0.71 1.95 -0.02 0.00 -1.52 0.00 0.00 31.29 32.41 2b5m h VAL 1132CO 0.05 0.60 -0.19 0.58 0.02 0.00 0.00 177.57 178.63 2b5m h VAL 1133N 0.50 1.26 -0.48 2.57 2.07 -1.28 -2.54 116.25 118.35 2b5m h VAL 1133Ca -0.04 -1.21 -0.10 0.00 0.82 0.00 0.00 66.70 66.17 2b5m h VAL 1133Cb 1.32 1.23 -0.02 0.00 -1.52 0.00 0.00 31.29 32.30 2b5m h VAL 1133CO 0.15 0.39 -0.12 -0.33 0.02 0.00 0.00 177.57 177.68 2b5m h GLU 1134N 0.52 0.89 0.00 1.57 5.08 -1.07 -1.22 114.58 120.35 2b5m h GLU 1134Ca 0.08 -0.32 0.00 0.00 -1.00 0.00 0.00 59.36 58.13 2b5m h GLU 1134Cb 0.63 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.81 2b5m h GLU 1134CO 0.04 0.96 0.05 0.93 -1.00 0.00 0.00 179.01 179.99 2b5m h GLU 1135N 0.79 0.00 0.00 2.33 5.08 -1.24 -2.55 114.58 118.99 2b5m h GLU 1135Ca 0.13 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 2b5m h GLU 1135Cb 0.64 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.89 2b5m h GLU 1135CO 0.04 0.00 -1.37 1.28 -1.00 0.00 0.00 179.01 177.97 2b5m n LEU 1136N -2.85 0.49 0.22 1.33 4.77 -0.49 -3.91 117.00 116.56 2b5m n LEU 1136Ca -0.02 0.11 0.15 0.00 -0.03 0.00 0.00 56.01 56.22 2b5m n LEU 1136Cb 0.10 -0.05 0.57 0.00 -2.33 0.00 0.00 43.42 41.71 2b5m n LEU 1136CO 0.17 -0.06 0.93 0.71 -1.33 0.00 0.00 177.39 177.81 2b5m h THR 1137N 0.00 0.00 -0.34 -5.08 1.35 -1.13 -3.12 112.91 104.59 2b5m h THR 1137Ca 0.00 -0.48 0.00 0.00 -0.55 0.00 0.00 66.41 65.38 2b5m h THR 1137Cb 0.93 1.41 0.00 0.00 -1.73 0.00 0.00 68.15 68.76 2b5m h THR 1137CO 0.00 0.00 0.00 0.54 -0.25 0.00 0.00 175.52 175.81 2b5m n ARG 1138N -2.81 1.81 0.15 4.72 1.74 -1.22 -3.42 116.66 117.64 2b5m n ARG 1138Ca 0.02 -1.22 0.02 0.00 -0.77 0.00 0.00 57.85 55.90 2b5m n ARG 1138Cb 0.31 -1.28 0.16 0.00 -1.02 0.00 0.00 32.46 30.64 2b5m n ARG 1138CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 2b5m h ILE 1139N 1.96 1.08 0.00 0.55 2.04 -1.78 -3.48 117.51 117.89 2b5m h ILE 1139Ca 0.00 -2.07 0.00 0.00 1.00 0.00 0.00 64.86 63.79 2b5m h ILE 1139Cb 0.47 2.23 0.00 0.00 -0.74 0.00 0.00 36.82 38.78 2b5m h ILE 1139CO 0.01 0.53 0.00 0.00 0.00 0.00 0.00 178.15 178.68