#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a2v s ALA 19 N 0.00 3.61 0.54 0.55 0.00 -1.26 -4.94 121.76 120.26 1a2v s ALA 19 Ca 0.00 -0.70 -0.21 0.00 0.00 0.00 0.00 51.96 51.04 1a2v s ALA 19 Cb 0.00 -1.97 -0.06 0.00 0.00 0.00 0.00 23.12 21.10 1a2v s ALA 19 CO 0.00 0.34 1.19 0.54 0.00 0.00 0.00 175.76 177.83 1a2v n ARG 20 N 2.95 1.42 -2.05 0.00 1.74 -1.26 -4.96 116.66 114.49 1a2v n ARG 20 Ca -0.18 0.52 -0.27 0.00 -0.77 0.00 0.00 57.85 57.15 1a2v n ARG 20 Cb 0.53 -2.37 0.08 0.00 -1.02 0.00 0.00 32.46 29.68 1a2v n ARG 20 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1a2v s PRO 21 N -2.70 2.12 0.12 5.56 0.04 -1.26 -4.98 135.00 133.90 1a2v s PRO 21 Ca 0.71 -0.05 -0.18 0.00 0.04 0.00 0.00 61.00 61.52 1a2v s PRO 21 Cb -0.44 -2.06 -0.04 0.00 0.04 0.00 0.00 34.50 31.99 1a2v s PRO 21 CO 0.50 -1.39 1.68 0.00 0.04 0.00 0.00 177.00 177.83 1a2v h ALA 22 N -0.81 0.38 -3.87 8.56 0.00 -1.99 -3.43 119.26 118.10 1a2v h ALA 22 Ca -0.45 -0.10 -0.68 0.00 0.00 0.00 0.00 54.91 53.67 1a2v h ALA 22 Cb 1.32 -0.12 -0.28 0.00 0.00 0.00 0.00 17.79 18.71 1a2v h ALA 22 CO 0.63 -0.05 -0.83 -1.58 0.00 0.00 0.00 179.25 177.42 1a2v s HIS 23 N -5.67 2.59 0.62 0.00 5.65 -1.26 -5.02 115.29 112.20 1a2v s HIS 23 Ca -0.13 -0.55 0.30 0.00 0.25 0.00 0.00 55.06 54.92 1a2v s HIS 23 Cb 0.09 -1.66 1.60 0.00 -1.18 0.00 0.00 32.58 31.43 1a2v s HIS 23 CO 0.72 -0.11 1.96 -1.35 -0.65 0.00 0.00 174.74 175.31 1a2v h PRO 24 N 6.01 0.00 -0.02 2.88 0.11 -1.97 0.10 132.00 139.12 1a2v h PRO 24 Ca -0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.77 1a2v h PRO 24 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1a2v h PRO 24 CO 0.50 0.00 -0.11 1.28 -0.21 0.00 0.00 178.00 179.46 1a2v n LEU 25 N -3.37 2.00 -4.77 2.35 4.77 -1.26 -4.71 117.00 112.00 1a2v n LEU 25 Ca 0.02 -0.67 -0.41 0.00 -0.03 0.00 0.00 56.01 54.93 1a2v n LEU 25 Cb 0.47 -0.02 -0.01 0.00 -2.33 0.00 0.00 43.42 41.53 1a2v n LEU 25 CO 0.21 0.34 1.11 -1.81 -1.33 0.00 0.00 177.39 175.92 1a2v s ASP 26 N -2.15 6.45 0.93 -1.43 1.01 0.36 -4.84 116.67 117.00 1a2v s ASP 26 Ca 0.30 2.95 -0.11 0.00 0.71 0.00 0.00 52.55 56.40 1a2v s ASP 26 Cb 0.20 -2.66 0.15 0.00 1.01 0.00 0.00 42.92 41.62 1a2v s ASP 26 CO 0.39 -0.80 1.11 -2.84 0.21 0.00 0.00 175.17 173.25 1a2v s PRO 27 N -1.83 0.89 0.36 8.23 0.02 -1.26 -4.92 135.00 136.49 1a2v s PRO 27 Ca 0.53 1.32 -0.28 0.00 0.02 0.00 0.00 61.00 62.59 1a2v s PRO 27 Cb -0.45 -1.73 -0.10 0.00 0.02 0.00 0.00 34.50 32.24 1a2v s PRO 27 CO 0.59 -2.64 1.37 -0.51 -0.33 0.00 0.00 177.00 175.47 1a2v s LEU 28 N -6.58 4.36 0.82 -5.54 1.43 -1.26 -5.01 118.68 106.90 1a2v s LEU 28 Ca 0.66 2.81 -0.12 0.00 -1.03 0.00 0.00 54.13 56.45 1a2v s LEU 28 Cb -0.22 -3.69 0.08 0.00 0.03 0.00 0.00 46.19 42.39 1a2v s LEU 28 CO 0.59 -0.70 1.14 -0.94 0.23 0.00 0.00 176.35 176.67 1a2v s SER 29 N -0.40 4.39 0.54 2.29 1.04 -1.26 -4.81 113.70 115.49 1a2v s SER 29 Ca 0.51 0.95 0.23 0.00 0.48 0.00 0.00 55.95 58.12 1a2v s SER 29 Cb -0.42 -1.55 1.49 0.00 0.10 0.00 0.00 66.02 65.65 1a2v s SER 29 CO 0.56 -1.99 2.17 0.71 0.98 0.00 0.00 173.24 175.67 1a2v h THR 30 N -1.11 0.77 -0.18 2.02 1.35 -1.95 -0.25 112.91 113.57 1a2v h THR 30 Ca -0.47 -0.12 -0.14 0.00 -0.55 0.00 0.00 66.41 65.13 1a2v h THR 30 Cb 1.31 1.07 0.00 0.00 -1.73 0.00 0.00 68.15 68.80 1a2v h THR 30 CO 0.64 0.03 -0.44 0.00 -0.25 0.00 0.00 175.52 175.50 1a2v h ALA 31 N 1.97 0.29 -0.17 6.62 0.00 -1.99 -2.43 119.26 123.55 1a2v h ALA 31 Ca -0.00 -0.47 -0.14 0.00 0.00 0.00 0.00 54.91 54.30 1a2v h ALA 31 Cb 0.07 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1a2v h ALA 31 CO 0.00 0.43 -0.47 0.93 0.00 0.00 0.00 179.25 180.14 1a2v h GLU 32 N 0.28 0.44 0.13 0.00 5.08 -1.69 -0.78 114.58 118.04 1a2v h GLU 32 Ca -0.00 -0.25 -0.01 0.00 -1.00 0.00 0.00 59.36 58.10 1a2v h GLU 32 Cb 1.05 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.32 1a2v h GLU 32 CO 0.10 0.82 -0.06 0.82 -1.00 0.00 0.00 179.01 179.68 1a2v h ILE 33 N 0.36 0.87 -0.36 3.13 2.04 -1.06 0.31 117.51 122.80 1a2v h ILE 33 Ca 0.02 -0.01 -0.02 0.00 1.00 0.00 0.00 64.86 65.85 1a2v h ILE 33 Cb 0.96 0.88 -0.02 0.00 -0.74 0.00 0.00 36.82 37.90 1a2v h ILE 33 CO 0.08 0.00 0.14 0.50 0.00 0.00 0.00 178.15 178.88 1a2v h LYS 34 N -0.18 0.54 -0.45 2.37 1.63 -1.35 -0.51 116.57 118.62 1a2v h LYS 34 Ca -0.02 -0.10 0.03 0.00 -0.85 0.00 0.00 60.65 59.71 1a2v h LYS 34 Cb 0.14 -0.09 -0.02 0.00 -0.60 0.00 0.00 32.23 31.66 1a2v h LYS 34 CO 0.03 0.53 0.30 0.00 -3.45 0.00 0.00 179.45 176.85 1a2v h ALA 35 N 0.99 1.81 0.09 5.00 0.00 -0.99 -0.52 119.26 125.63 1a2v h ALA 35 Ca 0.12 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 1a2v h ALA 35 Cb 0.19 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1a2v h ALA 35 CO -0.01 0.14 -0.04 0.00 0.00 0.00 0.00 179.25 179.34 1a2v h ALA 36 N 1.74 -0.12 -0.87 0.00 0.00 -0.35 -2.07 119.26 117.60 1a2v h ALA 36 Ca 0.18 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1a2v h ALA 36 Cb 0.11 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 1a2v h ALA 36 CO -0.04 -0.30 0.50 1.79 0.00 0.00 0.00 179.25 181.20 1a2v h THR 37 N -0.64 1.25 -0.38 0.00 1.35 -0.79 -0.46 112.91 113.24 1a2v h THR 37 Ca -0.01 -0.58 0.03 0.00 -0.55 0.00 0.00 66.41 65.30 1a2v h THR 37 Cb 0.52 0.05 -0.03 0.00 -1.73 0.00 0.00 68.15 66.96 1a2v h THR 37 CO 0.02 0.27 0.17 0.78 -0.25 0.00 0.00 175.52 176.51 1a2v h ASN 38 N 1.21 0.23 -0.99 5.36 2.35 -1.15 0.39 115.58 122.98 1a2v h ASN 38 Ca 0.31 0.03 0.01 0.00 -0.55 0.00 0.00 56.30 56.09 1a2v h ASN 38 Cb -0.01 -0.02 -0.05 0.00 0.05 0.00 0.00 38.32 38.30 1a2v h ASN 38 CO -0.05 0.18 0.65 0.74 -1.65 0.00 0.00 177.43 177.29 1a2v h THR 39 N 0.35 1.26 0.06 2.81 2.02 -0.61 -1.23 112.91 117.57 1a2v h THR 39 Ca 0.16 -0.48 -0.00 0.00 0.77 0.00 0.00 66.41 66.86 1a2v h THR 39 Cb 0.09 -0.19 0.00 0.00 -1.74 0.00 0.00 68.15 66.31 1a2v h THR 39 CO -0.13 0.25 -0.03 0.58 0.37 0.00 0.00 175.52 176.56 1a2v h VAL 40 N 1.34 1.21 -0.83 3.16 2.07 -0.25 -2.23 116.25 120.73 1a2v h VAL 40 Ca 0.36 -0.95 0.16 0.00 0.82 0.00 0.00 66.70 67.09 1a2v h VAL 40 Cb -0.14 1.83 -0.10 0.00 -1.52 0.00 0.00 31.29 31.36 1a2v h VAL 40 CO -0.08 0.24 0.39 0.11 0.02 0.00 0.00 177.57 178.25 1a2v h LYS 41 N -0.50 0.53 -0.30 1.57 1.57 -0.02 -0.31 116.57 119.11 1a2v h LYS 41 Ca -0.01 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.71 1a2v h LYS 41 Cb 0.44 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.62 1a2v h LYS 41 CO 0.01 0.35 0.08 0.77 -0.57 0.00 0.00 179.45 180.09 1a2v h SER 42 N 0.54 0.45 -0.72 0.86 0.02 -1.17 -1.81 113.55 111.72 1a2v h SER 42 Ca 0.46 -0.22 0.06 0.00 -0.84 0.00 0.00 61.79 61.25 1a2v h SER 42 Cb 0.70 -0.12 -0.06 0.00 0.14 0.00 0.00 62.40 63.07 1a2v h SER 42 CO -0.40 0.55 0.42 0.22 -1.14 0.00 0.00 176.83 176.48 1a2v h TYR 43 N 0.32 0.76 -1.32 3.45 3.20 -0.61 -1.42 116.97 121.35 1a2v h TYR 43 Ca 0.09 0.03 -0.71 0.00 3.14 0.00 0.00 58.73 61.28 1a2v h TYR 43 Cb 0.27 -0.24 -0.29 0.00 1.54 0.00 0.00 36.73 38.02 1a2v h TYR 43 CO 0.01 0.37 0.92 1.19 -1.64 0.00 0.00 178.16 179.01 1a2v n PHE 44 N -4.75 3.15 -1.76 -3.82 3.72 -0.24 -4.99 117.46 108.77 1a2v n PHE 44 Ca 0.10 -2.80 -0.42 0.00 -0.05 0.00 0.00 57.45 54.28 1a2v n PHE 44 Cb 0.18 -1.36 -0.02 0.00 -0.94 0.00 0.00 39.48 37.34 1a2v n PHE 44 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1a2v s ALA 45 N -3.91 3.80 0.00 4.37 0.00 -0.54 -1.25 121.76 124.23 1a2v s ALA 45 Ca 0.61 1.58 0.00 0.00 0.00 0.00 0.00 51.96 54.15 1a2v s ALA 45 Cb 0.49 -3.66 0.00 0.00 0.00 0.00 0.00 23.12 19.94 1a2v s ALA 45 CO -0.14 -0.98 0.00 0.41 0.00 0.00 0.00 175.76 175.05 1a2v n GLY 46 N 2.63 1.48 3.80 0.00 0.00 -1.26 -5.03 105.19 106.82 1a2v n GLY 46 Ca 0.10 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.76 1a2v n GLY 46 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a2v s LYS 47 N -0.40 3.30 -1.05 1.61 -0.14 -0.38 -5.03 119.74 117.63 1a2v s LYS 47 Ca 0.00 -0.24 -0.19 0.00 -1.36 0.00 0.00 55.97 54.18 1a2v s LYS 47 Cb 0.00 -3.05 0.11 0.00 -1.68 0.00 0.00 37.83 33.21 1a2v s LYS 47 CO 0.00 0.74 1.36 0.21 -0.76 0.00 0.00 175.35 176.89 1a2v s LYS 48 N -0.93 3.73 0.19 1.68 2.20 -1.26 -4.99 119.74 120.36 1a2v s LYS 48 Ca 0.14 -1.74 0.04 0.00 -0.36 0.00 0.00 55.97 54.05 1a2v s LYS 48 Cb -0.12 -5.16 -0.03 0.00 -1.51 0.00 0.00 37.83 31.01 1a2v s LYS 48 CO 0.03 -1.96 0.26 0.96 -0.36 0.00 0.00 175.35 174.27 1a2v s ILE 49 N 3.37 4.98 0.00 5.43 -4.36 -1.26 -1.54 121.20 127.82 1a2v s ILE 49 Ca 0.41 -0.97 0.03 0.00 -0.26 0.00 0.00 60.65 59.86 1a2v s ILE 49 Cb -0.02 -3.61 -0.01 0.00 1.25 0.00 0.00 42.46 40.07 1a2v s ILE 49 CO -0.06 -0.20 -0.08 -0.94 0.24 0.00 0.00 174.94 173.90 1a2v s SER 50 N -3.49 0.97 -0.17 4.36 1.04 0.11 -4.96 113.70 111.58 1a2v s SER 50 Ca 0.33 -0.20 -0.20 0.00 0.48 0.00 0.00 55.95 56.36 1a2v s SER 50 Cb -0.10 -0.09 -0.03 0.00 0.10 0.00 0.00 66.02 65.90 1a2v s SER 50 CO 0.27 0.06 0.58 -0.36 0.98 0.00 0.00 173.24 174.77 1a2v s PHE 51 N -0.35 3.42 -0.21 5.02 0.08 -0.00 -0.37 117.98 125.58 1a2v s PHE 51 Ca 0.02 0.92 0.05 0.00 0.12 0.00 0.00 56.93 58.04 1a2v s PHE 51 Cb -0.04 -2.72 -0.16 0.00 -0.57 0.00 0.00 43.02 39.53 1a2v s PHE 51 CO -0.00 -0.06 -0.13 -1.71 -0.10 0.00 0.00 175.22 173.22 1a2v n ASN 52 N 4.57 1.90 -3.67 1.36 2.85 0.08 -3.88 115.26 118.47 1a2v n ASN 52 Ca -0.03 -0.09 -0.09 0.00 -0.11 0.00 0.00 54.58 54.26 1a2v n ASN 52 Cb 0.50 -0.02 -0.09 0.00 1.24 0.00 0.00 39.78 41.42 1a2v n ASN 52 CO 0.00 0.00 0.00 -0.89 -2.11 0.00 0.00 177.26 174.26 1a2v s THR 53 N -2.43 -0.01 -0.20 -0.44 2.01 -0.94 -4.89 115.64 108.74 1a2v s THR 53 Ca -0.24 0.04 -0.04 0.00 0.31 0.00 0.00 61.69 61.76 1a2v s THR 53 Cb 0.07 -0.81 0.06 0.00 0.01 0.00 0.00 72.50 71.83 1a2v s THR 53 CO 0.56 0.02 0.07 -0.69 -0.69 0.00 0.00 174.62 173.88 1a2v s VAL 54 N 1.43 0.28 0.18 3.82 1.01 -1.26 -0.59 120.40 125.28 1a2v s VAL 54 Ca -0.09 -0.47 -0.07 0.00 0.00 0.00 0.00 61.98 61.35 1a2v s VAL 54 Cb -0.06 -0.89 -0.02 0.00 0.00 0.00 0.00 36.38 35.40 1a2v s VAL 54 CO -0.15 -0.30 0.25 0.28 0.00 0.00 0.00 175.10 175.18 1a2v s THR 55 N 1.97 0.05 0.34 3.92 -1.32 -0.19 -4.49 115.64 115.91 1a2v s THR 55 Ca 0.01 -1.60 -0.28 0.00 -1.21 0.00 0.00 61.69 58.61 1a2v s THR 55 Cb -0.17 -2.07 -0.10 0.00 -1.51 0.00 0.00 72.50 68.66 1a2v s THR 55 CO -0.11 -0.21 1.27 -0.22 -2.21 0.00 0.00 174.62 173.13 1a2v s LEU 56 N -3.03 4.40 -0.57 9.08 2.96 -1.26 0.67 118.68 130.92 1a2v s LEU 56 Ca 0.24 2.60 -0.08 0.00 -0.22 0.00 0.00 54.13 56.66 1a2v s LEU 56 Cb 0.04 -3.70 0.15 0.00 0.50 0.00 0.00 46.19 43.17 1a2v s LEU 56 CO 0.04 -0.52 0.44 -0.60 -1.32 0.00 0.00 176.35 174.39 1a2v s ARG 57 N -1.84 2.69 0.58 1.98 6.06 -0.94 -4.65 118.95 122.83 1a2v s ARG 57 Ca 0.50 -2.10 -0.19 0.00 -2.50 0.00 0.00 55.73 51.45 1a2v s ARG 57 Cb -0.38 -3.96 -0.07 0.00 0.06 0.00 0.00 34.95 30.61 1a2v s ARG 57 CO 0.50 -1.20 0.78 0.39 -2.50 0.00 0.00 175.30 173.26 1a2v n GLU 58 N 4.36 0.75 -1.04 5.12 1.02 -1.26 -4.48 120.64 125.10 1a2v n GLU 58 Ca 0.00 0.29 -0.31 0.00 -0.02 0.00 0.00 57.16 57.13 1a2v n GLU 58 Cb 0.41 -1.96 0.13 0.00 -0.02 0.00 0.00 31.44 30.00 1a2v n GLU 58 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1a2v s PRO 59 N -2.43 1.56 0.48 3.49 0.04 -1.26 -4.95 135.00 131.92 1a2v s PRO 59 Ca 0.72 1.22 -0.24 0.00 0.04 0.00 0.00 61.00 62.74 1a2v s PRO 59 Cb -0.44 -1.81 -0.07 0.00 0.04 0.00 0.00 34.50 32.22 1a2v s PRO 59 CO 0.51 -2.15 1.35 0.00 0.04 0.00 0.00 177.00 176.74 1a2v s ALA 60 N -2.81 3.05 0.19 8.56 0.00 -1.26 -4.80 121.76 124.68 1a2v s ALA 60 Ca 0.64 1.31 -0.13 0.00 0.00 0.00 0.00 51.96 53.78 1a2v s ALA 60 Cb -0.19 -3.54 0.18 0.00 0.00 0.00 0.00 23.12 19.57 1a2v s ALA 60 CO 0.57 -1.13 1.74 -0.09 0.00 0.00 0.00 175.76 176.85 1a2v h ARG 61 N 2.02 0.32 -0.05 0.00 2.43 -1.99 0.16 114.38 117.27 1a2v h ARG 61 Ca -0.50 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 58.65 1a2v h ARG 61 Cb 1.27 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 30.75 1a2v h ARG 61 CO 0.60 0.21 0.03 -0.22 -1.51 0.00 0.00 179.97 179.08 1a2v h LYS 62 N 0.33 0.07 -0.32 0.20 3.64 -1.99 -1.11 116.57 117.38 1a2v h LYS 62 Ca 0.24 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.61 1a2v h LYS 62 Cb 0.28 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.07 1a2v h LYS 62 CO -0.26 0.10 0.18 0.00 -2.27 0.00 0.00 179.45 177.20 1a2v h ALA 63 N 0.96 0.41 -0.08 5.00 0.00 -1.85 -0.34 119.26 123.35 1a2v h ALA 63 Ca 0.02 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.89 1a2v h ALA 63 Cb 0.06 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1a2v h ALA 63 CO -0.00 -0.08 -0.06 -0.92 0.00 0.00 0.00 179.25 178.19 1a2v h TYR 64 N 0.40 -0.13 -0.50 0.00 3.20 -0.53 -0.62 116.97 118.78 1a2v h TYR 64 Ca 0.11 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.99 1a2v h TYR 64 Cb 0.03 0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.35 1a2v h TYR 64 CO -0.04 -0.09 0.30 0.82 -1.64 0.00 0.00 178.16 177.52 1a2v h ILE 65 N -0.06 1.16 -0.53 1.81 2.04 -1.04 0.12 117.51 121.01 1a2v h ILE 65 Ca 0.05 -0.35 0.04 0.00 1.00 0.00 0.00 64.86 65.60 1a2v h ILE 65 Cb 0.14 0.48 -0.04 0.00 -0.74 0.00 0.00 36.82 36.66 1a2v h ILE 65 CO -0.12 0.16 0.29 1.56 0.00 0.00 0.00 178.15 180.04 1a2v h GLN 66 N 0.67 0.55 -0.47 2.37 4.20 -0.78 0.65 115.11 122.30 1a2v h GLN 66 Ca 0.18 -0.03 -0.03 0.00 0.06 0.00 0.00 58.65 58.83 1a2v h GLN 66 Cb -0.01 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 27.63 1a2v h GLN 66 CO -0.03 0.37 0.18 2.35 -0.67 0.00 0.00 178.83 181.02 1a2v h TRP 67 N 0.57 0.72 -0.37 2.96 7.01 -0.74 0.49 115.95 126.60 1a2v h TRP 67 Ca 0.23 -0.06 -0.15 0.00 2.11 0.00 0.00 58.89 61.02 1a2v h TRP 67 Cb 0.09 -0.21 -0.01 0.00 -2.10 0.00 0.00 29.16 26.93 1a2v h TRP 67 CO -0.08 0.62 -0.36 -0.22 -2.79 0.00 0.00 178.44 175.61 1a2v h LYS 68 N 0.62 0.88 0.00 2.65 3.64 -0.06 -3.34 116.57 120.96 1a2v h LYS 68 Ca 0.15 -0.45 0.00 0.00 -1.27 0.00 0.00 60.65 59.09 1a2v h LYS 68 Cb 0.21 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.04 1a2v h LYS 68 CO -0.01 1.09 0.00 0.39 -2.27 0.00 0.00 179.45 178.65 1a2v n GLU 69 N -4.06 3.99 -0.24 1.90 1.02 0.22 -4.74 120.64 118.73 1a2v n GLU 69 Ca -0.02 -0.13 0.08 0.00 -0.02 0.00 0.00 57.16 57.07 1a2v n GLU 69 Cb 0.53 -0.58 0.13 0.00 -0.02 0.00 0.00 31.44 31.49 1a2v n GLU 69 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1a2v n GLN 70 N -0.61 1.13 -1.72 3.49 6.02 0.15 -4.96 117.38 120.89 1a2v n GLN 70 Ca 0.00 -2.48 -0.19 0.00 -0.01 0.00 0.00 57.00 54.32 1a2v n GLN 70 Cb 0.01 -1.35 -0.07 0.00 1.02 0.00 0.00 30.24 29.85 1a2v n GLN 70 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1a2v n GLY 71 N -1.16 1.41 3.65 1.08 0.00 -1.01 -4.89 105.19 104.26 1a2v n GLY 71 Ca 0.14 -0.09 -0.29 0.00 0.00 0.00 0.00 46.02 45.79 1a2v n GLY 71 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1a2v s GLY 72 N -2.66 1.57 0.70 -0.02 0.00 0.04 -4.91 107.32 102.03 1a2v s GLY 72 Ca 0.00 -0.28 -0.14 0.00 0.00 0.00 0.00 44.72 44.30 1a2v s GLY 72 CO 0.00 0.33 1.10 2.56 0.00 0.00 0.00 173.10 177.10 1a2v s PRO 73 N -4.87 2.62 0.04 2.90 0.04 -1.26 -4.30 135.00 130.17 1a2v s PRO 73 Ca 0.66 1.32 -0.31 0.00 0.04 0.00 0.00 61.00 62.71 1a2v s PRO 73 Cb -0.20 -1.93 -0.07 0.00 0.04 0.00 0.00 34.50 32.34 1a2v s PRO 73 CO 0.59 -1.38 1.50 -1.17 0.04 0.00 0.00 177.00 176.58 1a2v s LEU 74 N -5.21 4.34 0.61 -3.56 2.96 -1.26 -4.51 118.68 112.06 1a2v s LEU 74 Ca 0.65 2.29 -0.18 0.00 -0.22 0.00 0.00 54.13 56.67 1a2v s LEU 74 Cb -0.19 -3.56 -0.03 0.00 0.50 0.00 0.00 46.19 42.90 1a2v s LEU 74 CO 0.46 -0.78 1.23 -2.84 -1.32 0.00 0.00 176.35 173.10 1a2v s PRO 75 N 2.33 2.82 0.42 0.98 0.02 -1.26 -4.94 135.00 135.37 1a2v s PRO 75 Ca 0.68 1.90 -0.26 0.00 0.02 0.00 0.00 61.00 63.34 1a2v s PRO 75 Cb -0.36 -1.90 -0.09 0.00 0.02 0.00 0.00 34.50 32.18 1a2v s PRO 75 CO 0.29 -1.34 1.37 -2.14 -0.33 0.00 0.00 177.00 174.84 1a2v s PRO 76 N -3.36 3.90 -0.47 5.54 0.02 -1.26 -4.94 135.00 134.42 1a2v s PRO 76 Ca 0.79 2.29 -0.26 0.00 0.02 0.00 0.00 61.00 63.84 1a2v s PRO 76 Cb -0.33 -2.75 0.03 0.00 0.02 0.00 0.00 34.50 31.47 1a2v s PRO 76 CO 0.35 -0.60 0.98 0.50 -0.33 0.00 0.00 177.00 177.90 1a2v s ARG 77 N -2.28 3.56 0.16 5.54 6.06 -1.26 -4.87 118.95 125.86 1a2v s ARG 77 Ca 0.58 0.23 0.10 0.00 -2.50 0.00 0.00 55.73 54.13 1a2v s ARG 77 Cb -0.41 -3.93 -0.04 0.00 0.06 0.00 0.00 34.95 30.63 1a2v s ARG 77 CO 0.53 -1.29 -0.19 -0.51 -2.50 0.00 0.00 175.30 171.34 1a2v s LEU 78 N 3.96 2.63 -0.05 -0.88 1.43 -1.26 -2.23 118.68 122.27 1a2v s LEU 78 Ca 0.39 -0.68 0.05 0.00 -1.03 0.00 0.00 54.13 52.86 1a2v s LEU 78 Cb -0.09 -1.41 -0.01 0.00 0.03 0.00 0.00 46.19 44.71 1a2v s LEU 78 CO 0.27 0.14 -0.20 0.00 0.23 0.00 0.00 176.35 176.80 1a2v s ALA 79 N -1.41 1.75 -0.16 4.21 0.00 -0.59 -2.21 121.76 123.35 1a2v s ALA 79 Ca 0.20 -0.81 -0.07 0.00 0.00 0.00 0.00 51.96 51.28 1a2v s ALA 79 Cb -0.09 -0.57 -0.04 0.00 0.00 0.00 0.00 23.12 22.42 1a2v s ALA 79 CO 0.11 0.32 0.07 -0.47 0.00 0.00 0.00 175.76 175.79 1a2v s TYR 80 N -0.02 3.30 0.15 0.00 5.04 0.21 -0.78 117.35 125.25 1a2v s TYR 80 Ca -0.04 0.17 0.07 0.00 -2.44 0.00 0.00 57.07 54.83 1a2v s TYR 80 Cb -0.12 -2.02 -0.04 0.00 0.35 0.00 0.00 41.96 40.13 1a2v s TYR 80 CO 0.03 0.30 -0.16 1.52 -1.34 0.00 0.00 175.55 175.89 1a2v s TYR 81 N -0.03 1.62 -0.09 4.97 1.13 -0.50 -1.02 117.35 123.43 1a2v s TYR 81 Ca 0.06 -0.52 -0.02 0.00 -1.41 0.00 0.00 57.07 55.19 1a2v s TYR 81 Cb -0.12 -0.82 0.03 0.00 -1.10 0.00 0.00 41.96 39.95 1a2v s TYR 81 CO 0.01 0.24 0.02 0.08 -2.51 0.00 0.00 175.55 173.39 1a2v s VAL 82 N -2.12 0.29 0.33 -3.49 1.01 0.25 -2.18 120.40 114.49 1a2v s VAL 82 Ca 0.13 0.06 0.08 0.00 0.00 0.00 0.00 61.98 62.25 1a2v s VAL 82 Cb -0.05 -0.55 -0.06 0.00 0.00 0.00 0.00 36.38 35.72 1a2v s VAL 82 CO 0.05 0.15 -0.07 0.27 0.00 0.00 0.00 175.10 175.50 1a2v s ILE 83 N 2.00 2.03 0.04 2.22 -4.36 0.49 -0.74 121.20 122.87 1a2v s ILE 83 Ca 0.04 -2.16 0.08 0.00 -0.26 0.00 0.00 60.65 58.36 1a2v s ILE 83 Cb -0.13 -2.64 -0.03 0.00 1.25 0.00 0.00 42.46 40.91 1a2v s ILE 83 CO -0.06 -0.20 -0.24 -0.76 0.24 0.00 0.00 174.94 173.93 1a2v s LEU 84 N -3.57 2.16 -0.12 0.37 2.01 0.50 -1.54 118.68 118.49 1a2v s LEU 84 Ca 0.32 -0.55 0.02 0.00 0.01 0.00 0.00 54.13 53.93 1a2v s LEU 84 Cb 0.04 -1.15 0.01 0.00 0.01 0.00 0.00 46.19 45.10 1a2v s LEU 84 CO 0.15 0.22 -0.20 -0.70 1.01 0.00 0.00 176.35 176.83 1a2v s GLU 85 N -1.18 2.71 0.16 1.70 2.12 -1.26 0.10 118.70 123.05 1a2v s GLU 85 Ca 0.10 -0.75 -0.34 0.00 0.36 0.00 0.00 54.97 54.34 1a2v s GLU 85 Cb -0.09 -2.19 -0.16 0.00 0.26 0.00 0.00 34.13 31.95 1a2v s GLU 85 CO 0.02 0.01 1.24 0.00 -0.54 0.00 0.00 175.26 175.98 1a2v n ALA 86 N 4.00 -0.59 -0.92 6.30 0.00 -0.59 -0.77 120.51 127.95 1a2v n ALA 86 Ca -0.20 0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.71 1a2v n ALA 86 Cb 0.52 -2.07 0.00 0.00 0.00 0.00 0.00 19.45 17.90 1a2v n ALA 86 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1a2v n GLY 87 N 2.20 0.63 3.61 0.00 0.00 -1.26 -4.92 105.19 105.44 1a2v n GLY 87 Ca 0.16 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.84 1a2v n GLY 87 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a2v s LYS 88 N -0.33 2.70 0.33 1.61 -0.14 0.05 -5.11 119.74 118.86 1a2v s LYS 88 Ca 0.00 -0.60 -0.23 0.00 -1.36 0.00 0.00 55.97 53.78 1a2v s LYS 88 Cb 0.00 -2.58 -0.10 0.00 -1.68 0.00 0.00 37.83 33.47 1a2v s LYS 88 CO 0.00 0.64 0.89 -1.25 -0.76 0.00 0.00 175.35 174.88 1a2v s PRO 89 N -1.10 4.41 5.67 -1.68 0.04 -1.26 -4.67 135.00 136.40 1a2v s PRO 89 Ca 0.15 1.16 0.00 0.00 0.04 0.00 0.00 61.00 62.34 1a2v s PRO 89 Cb -0.11 -2.64 0.00 0.00 0.04 0.00 0.00 34.50 31.78 1a2v s PRO 89 CO 0.04 0.22 0.00 0.41 0.04 0.00 0.00 177.00 177.71 1a2v n GLY 90 N 0.25 1.28 2.73 0.56 0.00 -1.22 -4.27 105.19 104.52 1a2v n GLY 90 Ca 0.02 -0.63 -0.12 0.00 0.00 0.00 0.00 46.02 45.30 1a2v n GLY 90 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1a2v n VAL 91 N 0.00 0.00 -4.07 1.61 0.24 -0.62 -4.73 118.33 110.76 1a2v n VAL 91 Ca 0.00 -1.45 -0.15 0.00 -2.04 0.00 0.00 64.34 60.70 1a2v n VAL 91 Cb 0.00 0.89 -0.14 0.00 -1.47 0.00 0.00 33.84 33.12 1a2v n VAL 91 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 1a2v s LYS 92 N -2.65 0.30 0.23 7.34 1.02 -0.59 -0.95 119.74 124.44 1a2v s LYS 92 Ca 0.24 -0.12 0.00 0.00 0.02 0.00 0.00 55.97 56.11 1a2v s LYS 92 Cb -0.01 -0.30 -0.05 0.00 -0.52 0.00 0.00 37.83 36.95 1a2v s LYS 92 CO 0.17 0.06 0.11 -1.83 -0.92 0.00 0.00 175.35 172.94 1a2v s GLU 93 N -0.01 1.32 0.00 1.68 -1.05 0.27 -0.38 118.70 120.53 1a2v s GLU 93 Ca 0.01 -1.71 0.00 0.00 -0.15 0.00 0.00 54.97 53.12 1a2v s GLU 93 Cb -0.02 -0.06 0.00 0.00 -0.44 0.00 0.00 34.13 33.61 1a2v s GLU 93 CO -0.00 -0.33 0.00 0.41 0.95 0.00 0.00 175.26 176.29 1a2v n GLY 94 N -0.38 -1.63 3.32 -3.83 0.00 -0.93 -0.31 105.19 101.43 1a2v n GLY 94 Ca 0.01 -1.08 -0.28 0.00 0.00 0.00 0.00 46.02 44.67 1a2v n GLY 94 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1a2v s LEU 95 N 0.00 2.23 -0.11 0.99 1.43 0.14 -1.41 118.68 121.94 1a2v s LEU 95 Ca 0.00 -0.63 0.02 0.00 -1.03 0.00 0.00 54.13 52.50 1a2v s LEU 95 Cb 0.00 -1.12 -0.00 0.00 0.03 0.00 0.00 46.19 45.09 1a2v s LEU 95 CO 0.00 0.18 -0.20 -0.69 0.23 0.00 0.00 176.35 175.87 1a2v s VAL 96 N -0.92 2.41 -0.70 -1.59 1.01 0.04 -0.50 120.40 120.15 1a2v s VAL 96 Ca 0.10 -0.89 -0.21 0.00 0.00 0.00 0.00 61.98 60.98 1a2v s VAL 96 Cb -0.10 -1.96 0.09 0.00 0.00 0.00 0.00 36.38 34.42 1a2v s VAL 96 CO 0.03 0.55 0.95 -0.62 0.00 0.00 0.00 175.10 176.01 1a2v s ASP 97 N 0.37 6.27 0.36 3.32 2.15 -0.17 -1.54 116.67 127.44 1a2v s ASP 97 Ca -0.16 -1.30 0.11 0.00 0.43 0.00 0.00 52.55 51.64 1a2v s ASP 97 Cb -0.17 -2.39 0.90 0.00 -0.30 0.00 0.00 42.92 40.96 1a2v s ASP 97 CO 0.07 -1.30 1.82 -0.07 -0.17 0.00 0.00 175.17 175.52 1a2v h LEU 98 N 10.88 0.61 -0.67 -1.34 3.38 -1.75 0.11 115.31 126.54 1a2v h LEU 98 Ca -0.20 0.07 0.04 0.00 0.09 0.00 0.00 57.88 57.88 1a2v h LEU 98 Cb 1.06 -0.05 -0.05 0.00 0.09 0.00 0.00 40.66 41.72 1a2v h LEU 98 CO 1.15 0.24 0.40 0.00 0.09 0.00 0.00 178.44 180.32 1a2v h ALA 99 N 1.62 0.87 -0.60 1.53 0.00 -1.91 -1.97 119.26 118.81 1a2v h ALA 99 Ca 0.52 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.42 1a2v h ALA 99 Cb 1.01 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.62 1a2v h ALA 99 CO -0.27 0.14 0.00 -1.13 0.00 0.00 0.00 179.25 177.99 1a2v n SER 100 N -4.72 3.66 -4.01 0.00 3.41 -0.83 -4.89 113.62 106.24 1a2v n SER 100 Ca 0.07 -1.99 -0.41 0.00 -0.26 0.00 0.00 58.87 56.28 1a2v n SER 100 Cb 0.11 -0.39 0.01 0.00 -0.26 0.00 0.00 64.21 63.68 1a2v n SER 100 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1a2v n LEU 101 N 1.41 -0.55 -3.77 1.04 4.77 0.31 -4.95 117.00 115.26 1a2v n LEU 101 Ca 0.21 -1.22 -0.13 0.00 -0.03 0.00 0.00 56.01 54.85 1a2v n LEU 101 Cb 0.58 -1.57 -0.10 0.00 -2.33 0.00 0.00 43.42 40.00 1a2v n LEU 101 CO 0.15 0.72 -0.01 -0.94 -1.33 0.00 0.00 177.39 175.98 1a2v s SER 102 N -3.39 -0.28 -0.23 -1.43 1.04 -1.12 -4.92 113.70 103.37 1a2v s SER 102 Ca 0.36 0.46 -0.29 0.00 0.48 0.00 0.00 55.95 56.96 1a2v s SER 102 Cb -0.20 0.55 -0.02 0.00 0.10 0.00 0.00 66.02 66.45 1a2v s SER 102 CO 0.95 -0.21 1.49 -0.69 0.98 0.00 0.00 173.24 175.75 1a2v s VAL 103 N -0.30 3.88 -2.02 5.02 1.01 -1.26 -1.00 120.40 125.74 1a2v s VAL 103 Ca -0.04 1.01 0.19 0.00 0.00 0.00 0.00 61.98 63.14 1a2v s VAL 103 Cb -0.03 -3.85 0.06 0.00 0.00 0.00 0.00 36.38 32.55 1a2v s VAL 103 CO 0.02 -0.31 1.02 2.30 0.00 0.00 0.00 175.10 178.12 1a2v n ILE 104 N 6.17 0.00 -3.64 2.22 -5.35 0.35 -4.94 119.36 114.17 1a2v n ILE 104 Ca 0.17 -0.38 -0.05 0.00 -0.27 0.00 0.00 62.75 62.22 1a2v n ILE 104 Cb 0.45 1.30 -0.07 0.00 -1.74 0.00 0.00 39.64 39.58 1a2v n ILE 104 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 1a2v s GLU 105 N -1.96 0.57 -0.03 6.28 2.12 -1.15 -4.92 118.70 119.60 1a2v s GLU 105 Ca 0.18 0.94 -0.25 0.00 0.36 0.00 0.00 54.97 56.20 1a2v s GLU 105 Cb 0.16 0.13 0.05 0.00 0.26 0.00 0.00 34.13 34.73 1a2v s GLU 105 CO 0.39 -0.11 0.55 -0.08 -0.54 0.00 0.00 175.26 175.47 1a2v s THR 106 N 1.38 0.02 0.00 -1.70 -1.32 -1.26 0.25 115.64 113.01 1a2v s THR 106 Ca -0.08 -0.16 -0.28 0.00 -1.21 0.00 0.00 61.69 59.95 1a2v s THR 106 Cb -0.04 -0.88 0.09 0.00 -1.51 0.00 0.00 72.50 70.15 1a2v s THR 106 CO -0.16 -0.09 0.75 0.00 -2.21 0.00 0.00 174.62 172.91 1a2v s ARG 107 N -1.31 1.00 -0.13 7.08 1.70 0.58 -4.96 118.95 122.90 1a2v s ARG 107 Ca -0.11 -0.08 -0.04 0.00 -0.47 0.00 0.00 55.73 55.02 1a2v s ARG 107 Cb -0.02 0.46 -0.03 0.00 -0.57 0.00 0.00 34.95 34.79 1a2v s ARG 107 CO 0.07 -0.38 0.01 0.00 -1.08 0.00 0.00 175.30 173.93 1a2v s ALA 108 N -2.29 3.27 -0.48 7.88 0.00 -1.26 -0.56 121.76 128.32 1a2v s ALA 108 Ca -0.03 -0.78 0.03 0.00 0.00 0.00 0.00 51.96 51.18 1a2v s ALA 108 Cb -0.01 -1.65 0.12 0.00 0.00 0.00 0.00 23.12 21.59 1a2v s ALA 108 CO -0.02 0.38 0.22 -0.51 0.00 0.00 0.00 175.76 175.83 1a2v s LEU 109 N -0.21 4.57 0.22 0.00 1.02 -0.12 -4.97 118.68 119.20 1a2v s LEU 109 Ca 0.06 -2.73 0.25 0.00 0.02 0.00 0.00 54.13 51.73 1a2v s LEU 109 Cb -0.12 -1.67 0.88 0.00 0.02 0.00 0.00 46.19 45.29 1a2v s LEU 109 CO 0.02 -0.30 1.76 -0.62 0.02 0.00 0.00 176.35 177.23 1a2v n GLU 110 N 3.52 0.23 -1.54 1.70 1.02 -1.26 -1.59 120.64 122.72 1a2v n GLU 110 Ca 0.05 0.28 -0.17 0.00 -0.02 0.00 0.00 57.16 57.30 1a2v n GLU 110 Cb 0.36 -1.82 0.08 0.00 -0.02 0.00 0.00 31.44 30.04 1a2v n GLU 110 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1a2v n THR 111 N -2.23 2.56 -4.17 2.62 -2.24 -1.26 -3.41 114.28 106.15 1a2v n THR 111 Ca 0.04 -3.76 -0.11 0.00 -2.27 0.00 0.00 64.05 57.96 1a2v n THR 111 Cb 0.36 -0.87 -0.10 0.00 -2.10 0.00 0.00 70.33 67.62 1a2v n THR 111 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1a2v s VAL 112 N -4.19 0.63 -0.02 2.28 0.11 -1.24 -4.83 120.40 113.13 1a2v s VAL 112 Ca 0.49 -1.93 0.03 0.00 -2.93 0.00 0.00 61.98 57.64 1a2v s VAL 112 Cb 0.41 -1.74 -0.01 0.00 -1.53 0.00 0.00 36.38 33.51 1a2v s VAL 112 CO 0.01 -0.81 -0.11 -1.10 -3.33 0.00 0.00 175.10 169.75 1a2v s GLN 113 N -3.86 1.01 0.65 1.54 -1.52 -1.26 -4.27 119.66 111.95 1a2v s GLN 113 Ca 0.14 -0.40 0.01 0.00 -1.95 0.00 0.00 55.36 53.15 1a2v s GLN 113 Cb 0.06 -0.96 0.09 0.00 -0.22 0.00 0.00 33.01 31.98 1a2v s GLN 113 CO -0.04 0.22 0.90 -1.25 -0.25 0.00 0.00 175.29 174.88 1a2v s PRO 114 N -0.14 2.01 0.35 2.91 0.04 -1.26 -3.75 135.00 135.17 1a2v s PRO 114 Ca 0.02 -1.05 -0.27 0.00 0.04 0.00 0.00 61.00 59.74 1a2v s PRO 114 Cb -0.06 -2.41 -0.12 0.00 0.04 0.00 0.00 34.50 31.95 1a2v s PRO 114 CO -0.00 -1.16 1.14 1.51 0.04 0.00 0.00 177.00 178.53 1a2v n ILE 115 N -2.62 2.16 -2.94 0.56 3.06 -1.26 -4.64 119.36 113.68 1a2v n ILE 115 Ca 0.13 -0.50 -0.43 0.00 -2.50 0.00 0.00 62.75 59.45 1a2v n ILE 115 Cb 0.60 -1.30 -0.05 0.00 0.54 0.00 0.00 39.64 39.43 1a2v n ILE 115 CO 0.00 0.00 0.00 -0.76 -2.50 0.00 0.00 176.55 173.29 1a2v s LEU 116 N -0.52 4.21 0.74 9.51 1.43 -0.43 -4.97 118.68 128.64 1a2v s LEU 116 Ca 0.59 -0.06 -0.11 0.00 -1.03 0.00 0.00 54.13 53.52 1a2v s LEU 116 Cb -0.60 -3.00 0.03 0.00 0.03 0.00 0.00 46.19 42.65 1a2v s LEU 116 CO 0.60 -0.93 1.07 0.42 0.23 0.00 0.00 176.35 177.75 1a2v s THR 117 N 3.35 3.66 0.53 5.49 -4.23 -1.26 -4.56 115.64 118.62 1a2v s THR 117 Ca 0.31 0.54 0.37 0.00 -1.18 0.00 0.00 61.69 61.73 1a2v s THR 117 Cb -0.12 -3.23 0.39 0.00 1.34 0.00 0.00 72.50 70.88 1a2v s THR 117 CO 0.23 -0.70 2.25 -0.37 -0.54 0.00 0.00 174.62 175.48 1a2v h VAL 118 N -0.89 0.21 -0.14 2.29 -1.51 -1.91 -2.12 116.25 112.18 1a2v h VAL 118 Ca -0.45 -0.16 -0.12 0.00 -1.23 0.00 0.00 66.70 64.74 1a2v h VAL 118 Cb 1.23 1.13 0.00 0.00 -2.13 0.00 0.00 31.29 31.52 1a2v h VAL 118 CO 0.56 0.02 -0.40 -0.33 -1.23 0.00 0.00 177.57 176.20 1a2v h GLU 119 N 0.00 0.51 0.00 5.19 5.08 -1.99 0.65 114.58 124.02 1a2v h GLU 119 Ca -0.00 -0.37 0.00 0.00 -1.00 0.00 0.00 59.36 57.99 1a2v h GLU 119 Cb 0.13 0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.44 1a2v h GLU 119 CO 0.00 0.99 0.00 0.38 -1.00 0.00 0.00 179.01 179.38 1a2v h ASP 120 N 0.13 0.00 0.44 1.42 3.04 -1.81 -3.22 116.42 116.42 1a2v h ASP 120 Ca -0.01 0.00 -0.31 0.00 -3.24 0.00 0.00 57.03 53.47 1a2v h ASP 120 Cb 1.02 0.00 -0.03 0.00 -1.04 0.00 0.00 39.33 39.28 1a2v h ASP 120 CO 0.09 0.00 -1.66 -0.07 -2.04 0.00 0.00 179.24 175.56 1a2v h LEU 121 N 0.00 0.21 -1.35 0.15 3.38 -1.29 -3.39 115.31 113.01 1a2v h LEU 121 Ca 0.00 -0.38 -0.00 0.00 0.09 0.00 0.00 57.88 57.59 1a2v h LEU 121 Cb 0.68 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.36 1a2v h LEU 121 CO 0.00 1.33 -0.00 0.00 0.09 0.00 0.00 178.44 179.85 1a2v h SER 123 N 0.00 0.00 -0.91 0.00 4.64 -1.75 -3.37 113.55 112.15 1a2v h SER 123 Ca -0.00 0.00 0.20 0.00 -0.47 0.00 0.00 61.79 61.52 1a2v h SER 123 Cb 0.55 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 62.52 1a2v h SER 123 CO 0.00 0.69 0.46 0.74 -0.87 0.00 0.00 176.83 177.85 1a2v h THR 124 N 0.00 0.57 -0.88 2.95 2.02 -1.78 -2.37 112.91 113.42 1a2v h THR 124 Ca -0.01 -0.18 -0.02 0.00 0.77 0.00 0.00 66.41 66.98 1a2v h THR 124 Cb 1.50 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 67.87 1a2v h THR 124 CO 0.09 0.10 0.48 -0.08 0.37 0.00 0.00 175.52 176.48 1a2v h GLU 125 N 0.52 1.23 -0.23 6.66 4.81 -1.80 -2.55 114.58 123.22 1a2v h GLU 125 Ca 0.55 -0.15 -0.17 0.00 -0.13 0.00 0.00 59.36 59.47 1a2v h GLU 125 Cb 0.98 -0.24 -0.00 0.00 0.63 0.00 0.00 28.75 30.11 1a2v h GLU 125 CO -0.46 0.91 -0.54 1.49 -0.73 0.00 0.00 179.01 179.67 1a2v h GLU 126 N 1.24 0.70 -0.51 1.92 4.57 -1.70 -2.64 114.58 118.16 1a2v h GLU 126 Ca 0.31 -0.44 -0.08 0.00 -1.18 0.00 0.00 59.36 57.97 1a2v h GLU 126 Cb 0.03 0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 28.65 1a2v h GLU 126 CO -0.05 1.06 0.01 -0.39 -1.18 0.00 0.00 179.01 178.46 1a2v h VAL 127 N 0.54 1.25 0.00 0.32 -1.51 -1.20 -1.66 116.25 113.99 1a2v h VAL 127 Ca 0.01 -1.02 -0.12 0.00 -1.23 0.00 0.00 66.70 64.34 1a2v h VAL 127 Cb 1.12 0.85 -0.02 0.00 -2.13 0.00 0.00 31.29 31.11 1a2v h VAL 127 CO 0.11 0.36 -0.56 0.16 -1.23 0.00 0.00 177.57 176.42 1a2v h ILE 128 N 0.79 1.09 -0.21 7.19 3.07 -1.48 -2.15 117.51 125.81 1a2v h ILE 128 Ca 0.15 -2.17 -0.08 0.00 1.55 0.00 0.00 64.86 64.32 1a2v h ILE 128 Cb 0.46 2.28 -0.01 0.00 -0.27 0.00 0.00 36.82 39.28 1a2v h ILE 128 CO 0.02 0.55 -0.20 0.03 -1.05 0.00 0.00 178.15 177.50 1a2v h ARG 129 N 0.00 0.37 -0.05 0.16 3.08 -1.03 -2.70 114.38 114.21 1a2v h ARG 129 Ca -0.01 -0.12 0.00 0.00 0.07 0.00 0.00 59.98 59.93 1a2v h ARG 129 Cb 1.24 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.26 1a2v h ARG 129 CO 0.07 0.56 0.00 0.09 -1.07 0.00 0.00 179.97 179.63 1a2v n ASN 130 N -4.18 2.56 -4.68 7.04 3.02 -0.68 -4.81 115.26 113.53 1a2v n ASN 130 Ca -0.00 -1.85 -0.41 0.00 -0.03 0.00 0.00 54.58 52.29 1a2v n ASN 130 Cb 0.35 -0.02 -0.04 0.00 -0.61 0.00 0.00 39.78 39.46 1a2v n ASN 130 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1a2v s ASP 131 N -1.96 7.02 0.30 6.41 2.15 -0.82 -4.95 116.67 124.82 1a2v s ASP 131 Ca 0.32 1.24 0.04 0.00 0.43 0.00 0.00 52.55 54.58 1a2v s ASP 131 Cb 0.20 -2.46 0.64 0.00 -0.30 0.00 0.00 42.92 41.00 1a2v s ASP 131 CO 0.31 -0.33 1.85 -0.65 -0.17 0.00 0.00 175.17 176.18 1a2v h PRO 132 N 7.15 0.88 0.05 4.34 0.11 -1.91 0.13 132.00 142.74 1a2v h PRO 132 Ca -0.33 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 65.73 1a2v h PRO 132 Cb 1.15 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 32.07 1a2v h PRO 132 CO 0.81 0.58 -0.02 0.00 -0.21 0.00 0.00 178.00 179.16 1a2v h ALA 133 N 1.56 -0.06 -0.40 -0.75 0.00 -1.95 -1.21 119.26 116.45 1a2v h ALA 133 Ca 0.48 -0.12 0.05 0.00 0.00 0.00 0.00 54.91 55.32 1a2v h ALA 133 Cb 0.56 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 1a2v h ALA 133 CO -0.25 -0.43 0.15 0.28 0.00 0.00 0.00 179.25 179.01 1a2v h VAL 134 N -0.28 0.89 -0.70 0.00 2.07 -1.64 -1.72 116.25 114.87 1a2v h VAL 134 Ca -0.01 -0.11 0.02 0.00 0.82 0.00 0.00 66.70 67.43 1a2v h VAL 134 Cb 0.26 0.55 -0.04 0.00 -1.52 0.00 0.00 31.29 30.54 1a2v h VAL 134 CO 0.01 0.06 0.46 0.40 0.02 0.00 0.00 177.57 178.52 1a2v h ILE 135 N 0.32 1.13 -0.37 4.57 2.04 -0.57 -1.20 117.51 123.43 1a2v h ILE 135 Ca 0.18 -0.30 -0.08 0.00 1.00 0.00 0.00 64.86 65.66 1a2v h ILE 135 Cb 0.15 0.17 -0.02 0.00 -0.74 0.00 0.00 36.82 36.39 1a2v h ILE 135 CO -0.18 0.16 -0.12 -0.08 0.00 0.00 0.00 178.15 177.94 1a2v h GLU 136 N 0.88 0.65 -0.14 2.37 4.81 -0.36 -0.69 114.58 122.10 1a2v h GLU 136 Ca 0.27 -0.20 -0.12 0.00 -0.13 0.00 0.00 59.36 59.17 1a2v h GLU 136 Cb -0.01 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.30 1a2v h GLU 136 CO -0.07 0.75 -0.45 1.96 -0.73 0.00 0.00 179.01 180.47 1a2v h GLN 137 N 0.59 0.34 -0.24 1.92 1.08 -0.57 -0.53 115.11 117.70 1a2v h GLN 137 Ca 0.10 -0.18 -0.07 0.00 -1.45 0.00 0.00 58.65 57.05 1a2v h GLN 137 Cb 0.55 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.98 1a2v h GLN 137 CO 0.03 0.73 -0.13 0.00 -0.95 0.00 0.00 178.83 178.51 1a2v h VAL 139 N 0.23 1.12 -0.86 0.00 2.07 -0.62 0.22 116.25 118.41 1a2v h VAL 139 Ca 0.05 -0.29 -0.01 0.00 0.82 0.00 0.00 66.70 67.27 1a2v h VAL 139 Cb 0.64 0.18 -0.04 0.00 -1.52 0.00 0.00 31.29 30.55 1a2v h VAL 139 CO 0.04 0.16 0.50 -0.07 0.02 0.00 0.00 177.57 178.22 1a2v h LEU 140 N 0.86 1.04 0.00 2.57 4.07 -0.81 -1.24 115.31 121.80 1a2v h LEU 140 Ca 0.26 -0.08 0.00 0.00 0.08 0.00 0.00 57.88 58.15 1a2v h LEU 140 Cb -0.02 -0.26 0.00 0.00 1.08 0.00 0.00 40.66 41.45 1a2v h LEU 140 CO -0.09 0.82 0.00 -1.20 -1.08 0.00 0.00 178.44 176.89 1a2v n SER 141 N -4.41 0.00 0.00 -0.43 7.64 0.92 -4.84 113.62 112.50 1a2v n SER 141 Ca 0.09 -0.41 0.00 0.00 1.01 0.00 0.00 58.87 59.56 1a2v n SER 141 Cb 0.07 -0.10 0.00 0.00 -1.01 0.00 0.00 64.21 63.17 1a2v n SER 141 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1a2v n GLY 142 N 0.32 0.93 3.02 0.23 0.00 -0.47 -1.00 105.19 108.22 1a2v n GLY 142 Ca 0.13 -0.14 -0.31 0.00 0.00 0.00 0.00 46.02 45.70 1a2v n GLY 142 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1a2v s ILE 143 N -2.00 1.78 0.46 -0.61 1.01 0.67 -4.92 121.20 117.60 1a2v s ILE 143 Ca 0.00 -1.13 -0.23 0.00 0.00 0.00 0.00 60.65 59.30 1a2v s ILE 143 Cb 0.00 -1.84 -0.09 0.00 0.01 0.00 0.00 42.46 40.53 1a2v s ILE 143 CO 0.00 0.16 0.96 -2.65 0.00 0.00 0.00 174.94 173.41 1a2v n PRO 144 N 4.63 1.20 0.28 2.79 -0.02 -1.26 -2.15 135.00 140.46 1a2v n PRO 144 Ca -0.15 0.44 0.19 0.00 -2.02 0.00 0.00 63.50 61.96 1a2v n PRO 144 Cb 0.46 -2.03 1.00 0.00 -0.02 0.00 0.00 33.50 32.90 1a2v n PRO 144 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1a2v h ALA 145 N 1.25 1.00 -0.15 3.55 0.00 -1.93 -0.63 119.26 122.35 1a2v h ALA 145 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1a2v h ALA 145 Cb 1.35 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.14 1a2v h ALA 145 CO 0.55 0.00 0.00 0.27 0.00 0.00 0.00 179.25 180.07 1a2v n ASN 146 N -2.82 1.78 -0.40 0.00 2.04 -1.26 -3.87 115.26 110.73 1a2v n ASN 146 Ca -0.02 -1.70 0.08 0.00 -0.44 0.00 0.00 54.58 52.50 1a2v n ASN 146 Cb 0.08 -0.09 0.18 0.00 -2.53 0.00 0.00 39.78 37.41 1a2v n ASN 146 CO 0.00 0.00 0.00 -0.62 -0.44 0.00 0.00 177.26 176.20 1a2v n GLU 147 N 0.39 1.60 0.14 -3.83 1.02 -0.24 -4.70 120.64 115.02 1a2v n GLU 147 Ca 0.17 -2.86 0.10 0.00 -0.02 0.00 0.00 57.16 54.55 1a2v n GLU 147 Cb 0.36 -1.60 0.51 0.00 -0.02 0.00 0.00 31.44 30.69 1a2v n GLU 147 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 1a2v n MET 148 N -1.22 0.12 0.00 3.49 2.81 -1.25 -0.59 117.12 120.48 1a2v n MET 148 Ca 0.19 0.61 0.12 0.00 -1.81 0.00 0.00 57.70 56.81 1a2v n MET 148 Cb 0.72 -1.90 0.64 0.00 -0.71 0.00 0.00 33.22 31.96 1a2v n MET 148 CO 0.00 0.00 0.00 -2.39 1.51 0.00 0.00 175.97 175.09 1a2v n HIS 149 N -2.16 0.00 0.96 2.03 1.44 -1.26 -2.00 115.22 114.22 1a2v n HIS 149 Ca -0.01 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 55.80 1a2v n HIS 149 Cb 0.04 -0.26 -0.01 0.00 0.12 0.00 0.00 29.99 29.88 1a2v n HIS 149 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 1a2v n LYS 150 N -1.26 1.29 -3.47 -1.40 5.02 0.24 -4.89 118.16 113.68 1a2v n LYS 150 Ca 0.12 -0.97 -0.37 0.00 -2.02 0.00 0.00 58.31 55.07 1a2v n LYS 150 Cb 0.19 -1.45 -0.08 0.00 -0.02 0.00 0.00 35.03 33.68 1a2v n LYS 150 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1a2v s VAL 151 N -2.39 5.26 0.38 -0.18 1.01 -0.85 -0.90 120.40 122.73 1a2v s VAL 151 Ca 0.18 0.58 0.06 0.00 0.00 0.00 0.00 61.98 62.80 1a2v s VAL 151 Cb 0.17 -3.67 -0.07 0.00 0.00 0.00 0.00 36.38 32.82 1a2v s VAL 151 CO 0.55 0.31 0.03 -0.31 0.00 0.00 0.00 175.10 175.68 1a2v s TYR 152 N 0.97 2.28 -0.26 5.22 1.51 0.08 -4.98 117.35 122.17 1a2v s TYR 152 Ca 0.17 -0.80 -0.25 0.00 -1.01 0.00 0.00 57.07 55.17 1a2v s TYR 152 Cb -0.14 -1.58 0.08 0.00 -0.11 0.00 0.00 41.96 40.21 1a2v s TYR 152 CO 0.06 0.26 0.76 0.00 -1.11 0.00 0.00 175.55 175.52 1a2v s ASP 154 N 0.28 6.39 -0.25 0.00 1.01 -0.26 -4.79 116.67 119.06 1a2v s ASP 154 Ca -0.00 0.39 -0.27 0.00 0.71 0.00 0.00 52.55 53.37 1a2v s ASP 154 Cb -0.05 -2.27 0.01 0.00 1.01 0.00 0.00 42.92 41.62 1a2v s ASP 154 CO 0.00 -0.32 0.97 -2.16 0.21 0.00 0.00 175.17 173.88 1a2v s PRO 155 N 2.31 4.20 0.37 8.23 0.04 -1.26 -1.60 135.00 147.28 1a2v s PRO 155 Ca 0.20 1.16 0.08 0.00 0.04 0.00 0.00 61.00 62.48 1a2v s PRO 155 Cb -0.16 -3.66 -0.06 0.00 0.04 0.00 0.00 34.50 30.67 1a2v s PRO 155 CO 0.10 -0.63 0.05 -1.58 0.04 0.00 0.00 177.00 174.98 1a2v s TRP 156 N 3.14 2.55 0.74 0.56 0.52 -0.32 -4.97 118.94 121.17 1a2v s TRP 156 Ca 0.41 -0.52 -0.11 0.00 0.02 0.00 0.00 56.10 55.90 1a2v s TRP 156 Cb -0.15 -1.65 0.04 0.00 -1.15 0.00 0.00 33.47 30.56 1a2v s TRP 156 CO 0.08 0.40 1.09 0.99 0.02 0.00 0.00 176.95 179.53 1a2v s THR 157 N -2.58 3.46 -0.55 2.01 2.01 -1.26 -1.15 115.64 117.58 1a2v s THR 157 Ca 0.36 0.50 0.23 0.00 0.31 0.00 0.00 61.69 63.09 1a2v s THR 157 Cb 0.03 -3.03 0.24 0.00 0.01 0.00 0.00 72.50 69.75 1a2v s THR 157 CO 0.20 -0.59 1.70 0.00 -0.69 0.00 0.00 174.62 175.23 1a2v n ILE 158 N -3.31 0.81 0.00 1.82 0.13 -1.20 -4.12 119.36 113.49 1a2v n ILE 158 Ca 0.09 0.18 0.00 0.00 -1.10 0.00 0.00 62.75 61.92 1a2v n ILE 158 Cb 0.53 -1.09 0.00 0.00 -0.84 0.00 0.00 39.64 38.24 1a2v n ILE 158 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 1a2v n GLY 159 N 0.13 2.15 3.62 4.50 0.00 -1.26 -4.51 105.19 109.81 1a2v n GLY 159 Ca 0.03 -0.12 -0.04 0.00 0.00 0.00 0.00 46.02 45.88 1a2v n GLY 159 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1a2v s TYR 160 N 0.00 -1.00 -0.17 1.61 5.04 -1.26 -1.38 117.35 120.19 1a2v s TYR 160 Ca 0.00 1.90 -0.02 0.00 -2.44 0.00 0.00 57.07 56.51 1a2v s TYR 160 Cb 0.00 0.60 0.05 0.00 0.35 0.00 0.00 41.96 42.96 1a2v s TYR 160 CO 0.00 -0.50 0.02 0.34 -1.34 0.00 0.00 175.55 174.07 1a2v s ASP 161 N 1.94 2.70 0.02 4.32 -1.08 -1.26 -4.78 116.67 118.53 1a2v s ASP 161 Ca -0.08 -0.69 0.01 0.00 -0.52 0.00 0.00 52.55 51.27 1a2v s ASP 161 Cb -0.06 -0.62 0.08 0.00 -1.46 0.00 0.00 42.92 40.86 1a2v s ASP 161 CO -0.19 -0.27 1.02 -1.84 0.52 0.00 0.00 175.17 174.41 1a2v n GLU 162 N 5.04 0.01 0.15 4.34 0.00 -1.26 -1.43 120.64 127.49 1a2v n GLU 162 Ca -0.09 0.49 0.02 0.00 0.00 0.00 0.00 57.16 57.58 1a2v n GLU 162 Cb 0.48 -1.55 0.16 0.00 0.00 0.00 0.00 31.44 30.52 1a2v n GLU 162 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1a2v h ARG 163 N 0.00 0.00 0.00 3.44 3.08 -2.05 -3.38 114.38 115.47 1a2v h ARG 163 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1a2v h ARG 163 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.09 1a2v h ARG 163 CO 0.00 0.52 -0.74 0.91 -1.07 0.00 0.00 179.97 179.60 1a2v n TRP 164 N -3.43 0.00 -1.84 3.04 8.01 -0.59 -5.10 117.44 117.53 1a2v n TRP 164 Ca 0.00 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.19 1a2v n TRP 164 Cb 0.65 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.95 1a2v n TRP 164 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1a2v n GLY 165 N 1.87 3.34 1.01 6.99 0.00 -0.51 -1.90 105.19 115.99 1a2v n GLY 165 Ca 0.00 -0.21 0.08 0.00 0.00 0.00 0.00 46.02 45.89 1a2v n GLY 165 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1a2v n THR 166 N 0.00 2.07 0.28 2.61 -2.24 -1.26 -4.61 114.28 111.12 1a2v n THR 166 Ca 0.00 -1.61 0.16 0.00 -2.27 0.00 0.00 64.05 60.33 1a2v n THR 166 Cb 0.00 -0.09 0.75 0.00 -2.10 0.00 0.00 70.33 68.90 1a2v n THR 166 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1a2v h GLY 167 N 2.27 0.00 -5.09 3.38 0.00 -1.76 -3.43 103.07 98.44 1a2v h GLY 167 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 47.16 1a2v h GLY 167 CO 0.21 0.00 -0.58 0.54 0.00 0.00 0.00 176.54 176.71 1a2v s LYS 168 N -3.86 0.30 -0.52 4.80 1.02 -1.26 -5.00 119.74 115.23 1a2v s LYS 168 Ca -0.01 -0.24 -0.26 0.00 0.02 0.00 0.00 55.97 55.48 1a2v s LYS 168 Cb 0.11 0.12 0.03 0.00 -0.52 0.00 0.00 37.83 37.57 1a2v s LYS 168 CO 0.54 -0.06 1.03 0.50 -0.92 0.00 0.00 175.35 176.44 1a2v s ARG 169 N -0.83 3.51 0.25 1.68 3.52 -1.26 -4.96 118.95 120.85 1a2v s ARG 169 Ca -0.09 0.14 0.09 0.00 -0.13 0.00 0.00 55.73 55.73 1a2v s ARG 169 Cb -0.05 -3.98 -0.04 0.00 -1.56 0.00 0.00 34.95 29.32 1a2v s ARG 169 CO 0.00 -1.43 0.02 -0.51 -0.81 0.00 0.00 175.30 172.57 1a2v s LEU 170 N 4.22 3.28 0.04 -0.88 1.02 -1.26 -0.58 118.68 124.53 1a2v s LEU 170 Ca 0.39 -0.56 -0.00 0.00 0.02 0.00 0.00 54.13 53.97 1a2v s LEU 170 Cb -0.10 -1.82 -0.03 0.00 0.02 0.00 0.00 46.19 44.26 1a2v s LEU 170 CO 0.25 0.01 -0.04 -1.10 0.02 0.00 0.00 176.35 175.50 1a2v s GLN 171 N -3.55 0.52 -0.04 1.70 -0.21 -0.55 -3.24 119.66 114.29 1a2v s GLN 171 Ca 0.31 -0.99 0.05 0.00 0.02 0.00 0.00 55.36 54.74 1a2v s GLN 171 Cb -0.07 0.11 -0.01 0.00 1.00 0.00 0.00 33.01 34.04 1a2v s GLN 171 CO 0.20 -0.07 -0.19 1.14 -2.12 0.00 0.00 175.29 174.24 1a2v s GLN 172 N -2.94 1.88 -0.32 2.91 -2.07 -0.30 -0.61 119.66 118.22 1a2v s GLN 172 Ca -0.01 -0.70 -0.10 0.00 -1.82 0.00 0.00 55.36 52.73 1a2v s GLN 172 Cb 0.01 -1.67 -0.00 0.00 -1.09 0.00 0.00 33.01 30.25 1a2v s GLN 172 CO -0.06 0.32 0.16 0.00 -1.32 0.00 0.00 175.29 174.39 1a2v s ALA 173 N -0.15 3.27 -0.54 2.60 0.00 -0.50 -1.17 121.76 125.27 1a2v s ALA 173 Ca -0.00 -1.44 -0.27 0.00 0.00 0.00 0.00 51.96 50.25 1a2v s ALA 173 Cb -0.11 -2.41 0.03 0.00 0.00 0.00 0.00 23.12 20.64 1a2v s ALA 173 CO 0.02 -0.97 1.10 -0.51 0.00 0.00 0.00 175.76 175.39 1a2v s LEU 174 N 1.60 3.69 0.11 0.00 1.43 -0.63 -3.99 118.68 120.88 1a2v s LEU 174 Ca 0.04 0.09 -0.29 0.00 -1.03 0.00 0.00 54.13 52.95 1a2v s LEU 174 Cb -0.17 -3.18 -0.06 0.00 0.03 0.00 0.00 46.19 42.80 1a2v s LEU 174 CO 0.06 -1.33 0.91 -0.69 0.23 0.00 0.00 176.35 175.53 1a2v s VAL 175 N 4.51 4.52 0.29 -1.59 1.01 -1.26 -1.10 120.40 126.77 1a2v s VAL 175 Ca 0.41 1.96 0.03 0.00 0.00 0.00 0.00 61.98 64.37 1a2v s VAL 175 Cb -0.09 -4.27 -0.04 0.00 0.00 0.00 0.00 36.38 31.98 1a2v s VAL 175 CO 0.26 0.35 0.15 -0.31 0.00 0.00 0.00 175.10 175.54 1a2v s TYR 176 N -0.13 1.56 -0.02 5.22 2.02 0.11 -1.35 117.35 124.76 1a2v s TYR 176 Ca 0.44 -1.35 -0.00 0.00 -0.37 0.00 0.00 57.07 55.79 1a2v s TYR 176 Cb -0.23 -0.84 0.03 0.00 -0.40 0.00 0.00 41.96 40.52 1a2v s TYR 176 CO 0.28 -0.51 0.03 -0.47 -1.57 0.00 0.00 175.55 173.31 1a2v s TYR 177 N -3.67 0.02 -0.13 2.71 5.04 -0.35 -0.74 117.35 120.23 1a2v s TYR 177 Ca 0.36 0.13 0.00 0.00 -2.44 0.00 0.00 57.07 55.13 1a2v s TYR 177 Cb 0.06 -0.21 -0.01 0.00 0.35 0.00 0.00 41.96 42.14 1a2v s TYR 177 CO 0.17 -0.08 -0.15 1.03 -1.34 0.00 0.00 175.55 175.17 1a2v s ARG 178 N 0.98 3.33 0.19 4.97 0.52 -0.08 -4.57 118.95 124.30 1a2v s ARG 178 Ca -0.08 -0.72 0.25 0.00 -0.52 0.00 0.00 55.73 54.67 1a2v s ARG 178 Cb -0.12 -2.58 0.65 0.00 0.52 0.00 0.00 34.95 33.43 1a2v s ARG 178 CO -0.03 0.20 1.63 0.66 0.02 0.00 0.00 175.30 177.79 1a2v h SER 179 N 6.73 0.00 -3.73 0.23 4.64 -1.98 -3.44 113.55 116.01 1a2v h SER 179 Ca -0.25 -0.06 -0.15 0.00 -0.47 0.00 0.00 61.79 60.86 1a2v h SER 179 Cb 1.22 0.00 -0.26 0.00 -0.31 0.00 0.00 62.40 63.05 1a2v h SER 179 CO 0.54 0.03 -0.34 -0.62 -0.87 0.00 0.00 176.83 175.57 1a2v s ASP 180 N -4.51 -0.35 0.64 4.97 2.15 -1.26 -5.06 116.67 113.26 1a2v s ASP 180 Ca 0.09 0.67 0.31 0.00 0.43 0.00 0.00 52.55 54.05 1a2v s ASP 180 Cb 0.12 0.65 1.68 0.00 -0.30 0.00 0.00 42.92 45.08 1a2v s ASP 180 CO 0.64 -0.13 1.98 1.05 -0.17 0.00 0.00 175.17 178.54 1a2v h GLU 181 N 5.96 0.00 -0.16 4.34 4.11 -1.97 0.70 114.58 127.57 1a2v h GLU 181 Ca -0.29 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.14 1a2v h GLU 181 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 1a2v h GLU 181 CO 0.31 0.00 0.00 -0.25 0.07 0.00 0.00 179.01 179.14 1a2v n ASP 182 N -3.20 1.81 -4.80 3.06 8.00 -1.26 -4.92 116.55 115.25 1a2v n ASP 182 Ca 0.00 -1.71 -0.30 0.00 0.71 0.00 0.00 54.79 53.50 1a2v n ASP 182 Cb 0.40 -0.10 0.10 0.00 -0.02 0.00 0.00 41.12 41.49 1a2v n ASP 182 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1a2v s ASP 183 N -1.63 4.38 -0.36 -2.24 1.01 0.24 -4.96 116.67 113.11 1a2v s ASP 183 Ca 0.33 1.33 -0.11 0.00 0.71 0.00 0.00 52.55 54.81 1a2v s ASP 183 Cb 0.18 -2.05 0.02 0.00 1.01 0.00 0.00 42.92 42.08 1a2v s ASP 183 CO 0.28 -2.04 0.20 -0.55 0.21 0.00 0.00 175.17 173.26 1a2v s SER 184 N -3.85 5.71 0.59 0.27 0.15 -1.26 -4.97 113.70 110.34 1a2v s SER 184 Ca 0.61 -0.88 0.33 0.00 0.70 0.00 0.00 55.95 56.72 1a2v s SER 184 Cb -0.15 -2.03 1.86 0.00 -1.71 0.00 0.00 66.02 64.00 1a2v s SER 184 CO 0.54 -0.34 2.22 0.06 1.20 0.00 0.00 173.24 176.93 1a2v h GLN 185 N 8.43 0.00 0.00 5.44 3.07 -1.93 -3.31 115.11 126.81 1a2v h GLN 185 Ca -0.27 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.47 1a2v h GLN 185 Cb 1.11 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.67 1a2v h GLN 185 CO 0.66 0.03 0.04 0.66 0.09 0.00 0.00 178.83 180.31 1a2v n TYR 186 N -3.56 0.00 1.11 0.06 4.01 -1.26 -0.05 117.16 117.47 1a2v n TYR 186 Ca -0.02 0.00 0.13 0.00 -0.16 0.00 0.00 57.90 57.84 1a2v n TYR 186 Cb 0.13 -0.43 0.33 0.00 -0.31 0.00 0.00 39.34 39.07 1a2v n TYR 186 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 1a2v n SER 187 N -1.42 0.65 -3.23 7.72 3.41 -1.25 -4.45 113.62 115.05 1a2v n SER 187 Ca 0.00 -0.45 -0.25 0.00 -0.26 0.00 0.00 58.87 57.91 1a2v n SER 187 Cb 0.04 0.16 -0.06 0.00 -0.26 0.00 0.00 64.21 64.08 1a2v n SER 187 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1a2v n HIS 188 N -1.18 2.40 -2.27 7.33 8.25 0.93 -4.77 115.22 125.91 1a2v n HIS 188 Ca 0.08 -3.94 -0.32 0.00 -0.26 0.00 0.00 57.72 53.28 1a2v n HIS 188 Cb 0.34 -0.48 -0.02 0.00 1.12 0.00 0.00 29.99 30.94 1a2v n HIS 188 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 1a2v s PRO 189 N -2.41 3.84 0.30 -0.41 0.04 -1.26 -1.21 135.00 133.89 1a2v s PRO 189 Ca 0.41 0.92 0.05 0.00 0.04 0.00 0.00 61.00 62.43 1a2v s PRO 189 Cb 0.21 -2.12 -0.02 0.00 0.04 0.00 0.00 34.50 32.61 1a2v s PRO 189 CO -0.07 -0.36 0.43 -0.51 0.04 0.00 0.00 177.00 176.53 1a2v s LEU 190 N -4.33 4.11 0.03 -3.56 1.43 -0.46 -4.53 118.68 111.37 1a2v s LEU 190 Ca 0.58 -0.03 0.27 0.00 -1.03 0.00 0.00 54.13 53.92 1a2v s LEU 190 Cb -0.10 -2.84 0.89 0.00 0.03 0.00 0.00 46.19 44.17 1a2v s LEU 190 CO 0.36 -0.28 1.70 -0.90 0.23 0.00 0.00 176.35 177.46 1a2v n ASP 191 N -1.56 0.29 -4.81 2.29 5.68 -1.26 -4.50 116.55 112.68 1a2v n ASP 191 Ca -0.04 0.22 -0.22 0.00 -0.50 0.00 0.00 54.79 54.25 1a2v n ASP 191 Cb 0.57 -0.22 -0.05 0.00 -1.14 0.00 0.00 41.12 40.29 1a2v n ASP 191 CO 0.00 0.00 0.00 0.72 -1.33 0.00 0.00 177.20 176.59 1a2v s PHE 192 N -3.02 2.81 -0.27 2.11 -0.71 -1.26 -4.38 117.98 113.26 1a2v s PHE 192 Ca 0.12 -0.36 -0.02 0.00 -1.04 0.00 0.00 56.93 55.63 1a2v s PHE 192 Cb 0.18 -1.78 0.09 0.00 -1.21 0.00 0.00 43.02 40.29 1a2v s PHE 192 CO 0.61 0.21 0.09 0.00 -1.34 0.00 0.00 175.22 174.79 1a2v s PRO 194 N 1.85 4.42 -0.19 0.00 0.02 -1.26 -0.39 135.00 139.46 1a2v s PRO 194 Ca 0.07 1.95 -0.06 0.00 0.02 0.00 0.00 61.00 62.98 1a2v s PRO 194 Cb -0.17 -3.04 -0.03 0.00 0.02 0.00 0.00 34.50 31.28 1a2v s PRO 194 CO -0.24 -0.03 0.02 0.42 -0.33 0.00 0.00 177.00 176.83 1a2v s ILE 195 N -1.21 4.24 -0.06 2.83 -1.09 0.23 -1.41 121.20 124.72 1a2v s ILE 195 Ca 0.49 -0.22 0.06 0.00 -2.23 0.00 0.00 60.65 58.74 1a2v s ILE 195 Cb -0.34 -2.91 -0.01 0.00 -1.58 0.00 0.00 42.46 37.62 1a2v s ILE 195 CO 0.44 0.45 -0.24 -0.69 -1.23 0.00 0.00 174.94 173.67 1a2v s VAL 196 N 0.69 2.16 -0.47 2.92 1.01 0.22 -0.85 120.40 126.07 1a2v s VAL 196 Ca 0.01 -1.04 -0.27 0.00 0.00 0.00 0.00 61.98 60.68 1a2v s VAL 196 Cb -0.14 -1.78 0.03 0.00 0.00 0.00 0.00 36.38 34.49 1a2v s VAL 196 CO 0.02 0.57 1.02 -0.62 0.00 0.00 0.00 175.10 176.09 1a2v s ASP 197 N -0.23 6.55 0.11 3.32 -1.08 0.23 -1.48 116.67 124.09 1a2v s ASP 197 Ca -0.01 0.25 -0.32 0.00 -0.52 0.00 0.00 52.55 51.94 1a2v s ASP 197 Cb -0.13 -2.49 -0.11 0.00 -1.46 0.00 0.00 42.92 38.72 1a2v s ASP 197 CO 0.03 -1.15 1.58 0.74 0.52 0.00 0.00 175.17 176.89 1a2v h THR 198 N 6.15 0.13 0.26 1.71 2.02 -1.16 0.79 112.91 122.81 1a2v h THR 198 Ca -0.24 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 66.93 1a2v h THR 198 Cb 1.07 0.13 0.00 0.00 -1.74 0.00 0.00 68.15 67.61 1a2v h THR 198 CO 1.07 0.00 -0.13 -0.08 0.37 0.00 0.00 175.52 176.76 1a2v h GLU 199 N -0.70 -0.34 0.00 6.66 4.81 -1.92 -2.78 114.58 120.32 1a2v h GLU 199 Ca 0.01 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.26 1a2v h GLU 199 Cb 0.71 0.08 -0.00 0.00 0.63 0.00 0.00 28.75 30.16 1a2v h GLU 199 CO -0.23 -0.19 -0.03 0.93 -0.73 0.00 0.00 179.01 178.76 1a2v h GLU 200 N -0.39 0.00 -5.75 1.92 4.39 -1.90 -3.47 114.58 109.38 1a2v h GLU 200 Ca -0.04 0.00 -0.30 0.00 0.34 0.00 0.00 59.36 59.37 1a2v h GLU 200 Cb 0.30 0.00 0.14 0.00 -0.10 0.00 0.00 28.75 29.09 1a2v h GLU 200 CO 0.06 0.03 -0.82 1.63 -1.16 0.00 0.00 179.01 178.74 1a2v n LYS 201 N -3.15 -1.78 -3.59 2.33 5.02 0.27 -5.01 118.16 112.25 1a2v n LYS 201 Ca -0.00 0.77 -0.13 0.00 -2.02 0.00 0.00 58.31 56.93 1a2v n LYS 201 Cb 0.27 -5.14 -0.06 0.00 -0.02 0.00 0.00 35.03 30.08 1a2v n LYS 201 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 1a2v s LYS 202 N -4.85 0.77 -0.08 1.97 -2.85 -1.09 -4.97 119.74 108.64 1a2v s LYS 202 Ca 0.42 0.55 -0.30 0.00 -1.00 0.00 0.00 55.97 55.65 1a2v s LYS 202 Cb -0.09 0.37 -0.04 0.00 -2.06 0.00 0.00 37.83 36.01 1a2v s LYS 202 CO 0.79 -0.17 1.49 0.08 0.10 0.00 0.00 175.35 177.64 1a2v s VAL 203 N -0.34 3.83 -0.84 1.79 1.01 -1.26 -0.60 120.40 124.00 1a2v s VAL 203 Ca -0.02 1.04 0.17 0.00 0.00 0.00 0.00 61.98 63.17 1a2v s VAL 203 Cb -0.03 -3.67 -0.19 0.00 0.00 0.00 0.00 36.38 32.49 1a2v s VAL 203 CO 0.02 -0.08 0.75 2.30 0.00 0.00 0.00 175.10 178.09 1a2v n ILE 204 N 5.33 0.00 -3.58 2.22 -5.35 -0.03 -4.93 119.36 113.01 1a2v n ILE 204 Ca 0.16 -0.09 -0.08 0.00 -0.27 0.00 0.00 62.75 62.47 1a2v n ILE 204 Cb 0.44 1.00 -0.04 0.00 -1.74 0.00 0.00 39.64 39.30 1a2v n ILE 204 CO 0.00 0.00 0.00 0.12 -1.76 0.00 0.00 176.55 174.91 1a2v s PHE 205 N -2.66 -0.27 -0.07 4.28 2.19 -1.20 -5.01 117.98 115.23 1a2v s PHE 205 Ca 0.07 0.39 0.01 0.00 0.33 0.00 0.00 56.93 57.73 1a2v s PHE 205 Cb 0.13 0.48 0.02 0.00 -1.31 0.00 0.00 43.02 42.34 1a2v s PHE 205 CO 0.72 -0.30 -0.07 0.42 1.83 0.00 0.00 175.22 177.82 1a2v s ILE 206 N -1.59 0.86 -0.21 3.12 1.01 -1.26 0.74 121.20 123.86 1a2v s ILE 206 Ca 0.03 -0.26 -0.23 0.00 0.00 0.00 0.00 60.65 60.19 1a2v s ILE 206 Cb -0.01 -0.86 -0.02 0.00 0.01 0.00 0.00 42.46 41.59 1a2v s ILE 206 CO -0.02 0.31 0.73 -1.81 0.00 0.00 0.00 174.94 174.15 1a2v s ASP 207 N 1.18 6.76 -0.08 3.58 1.01 0.48 -4.91 116.67 124.69 1a2v s ASP 207 Ca -0.06 0.94 0.05 0.00 0.71 0.00 0.00 52.55 54.19 1a2v s ASP 207 Cb -0.14 -2.39 -0.00 0.00 1.01 0.00 0.00 42.92 41.39 1a2v s ASP 207 CO -0.02 -0.39 -0.24 -0.63 0.21 0.00 0.00 175.17 174.11 1a2v s ILE 208 N 2.34 2.00 0.69 0.77 1.01 -1.26 -0.66 121.20 126.09 1a2v s ILE 208 Ca 0.32 -1.01 -0.13 0.00 0.00 0.00 0.00 60.65 59.83 1a2v s ILE 208 Cb -0.16 -1.72 0.01 0.00 0.01 0.00 0.00 42.46 40.61 1a2v s ILE 208 CO 0.10 0.55 1.09 -2.16 0.00 0.00 0.00 174.94 174.52 1a2v s PRO 209 N 0.16 2.70 0.28 2.79 0.04 -1.26 -4.94 135.00 134.78 1a2v s PRO 209 Ca -0.13 1.26 0.07 0.00 0.04 0.00 0.00 61.00 62.25 1a2v s PRO 209 Cb -0.16 -1.95 0.42 0.00 0.04 0.00 0.00 34.50 32.85 1a2v s PRO 209 CO 0.07 -1.31 1.66 -0.91 0.04 0.00 0.00 177.00 176.55 1a2v h ASN 210 N -0.34 0.19 -3.67 6.66 2.35 -1.98 -3.39 115.58 115.41 1a2v h ASN 210 Ca -0.46 -0.09 -0.67 0.00 -0.55 0.00 0.00 56.30 54.53 1a2v h ASN 210 Cb 1.24 -0.05 -0.22 0.00 0.05 0.00 0.00 38.32 39.33 1a2v h ASN 210 CO 0.54 0.65 -0.55 -0.60 -1.65 0.00 0.00 177.43 175.82 1a2v s ARG 211 N -3.97 3.38 0.16 0.81 3.52 -1.26 -5.07 118.95 116.51 1a2v s ARG 211 Ca -0.04 -0.69 -0.25 0.00 -0.13 0.00 0.00 55.73 54.62 1a2v s ARG 211 Cb 0.13 -3.58 -0.08 0.00 -1.56 0.00 0.00 34.95 29.86 1a2v s ARG 211 CO 0.77 -0.40 0.78 1.03 -0.81 0.00 0.00 175.30 176.66 1a2v s ARG 212 N 1.63 4.57 -0.14 5.12 1.81 -1.26 -5.05 118.95 125.62 1a2v s ARG 212 Ca 0.05 1.15 -0.01 0.00 -1.72 0.00 0.00 55.73 55.20 1a2v s ARG 212 Cb -0.17 -3.27 0.04 0.00 -0.45 0.00 0.00 34.95 31.10 1a2v s ARG 212 CO 0.07 0.56 -0.02 1.03 -0.68 0.00 0.00 175.30 176.25 1a2v s ARG 213 N -1.08 1.09 0.78 3.54 3.00 -1.26 -5.07 118.95 119.94 1a2v s ARG 213 Ca 0.36 -0.33 -0.12 0.00 0.00 0.00 0.00 55.73 55.64 1a2v s ARG 213 Cb -0.23 -1.75 0.06 0.00 0.00 0.00 0.00 34.95 33.03 1a2v s ARG 213 CO 0.26 -0.43 1.14 0.15 0.00 0.00 0.00 175.30 176.42 1a2v s LYS 214 N 1.77 2.22 0.25 3.54 1.02 -1.26 -4.13 119.74 123.14 1a2v s LYS 214 Ca 0.02 0.29 -0.30 0.00 0.02 0.00 0.00 55.97 56.00 1a2v s LYS 214 Cb -0.15 -1.96 -0.15 0.00 -0.52 0.00 0.00 37.83 35.05 1a2v s LYS 214 CO -0.07 -1.45 1.06 0.28 -0.92 0.00 0.00 175.35 174.25 1a2v n VAL 215 N -3.25 1.60 -1.94 3.17 0.31 -0.17 -4.90 118.33 113.16 1a2v n VAL 215 Ca 0.07 -0.40 -0.40 0.00 -0.01 0.00 0.00 64.34 63.61 1a2v n VAL 215 Cb 0.59 -0.94 0.00 0.00 -0.91 0.00 0.00 33.84 32.59 1a2v n VAL 215 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1a2v s SER 216 N -0.36 6.14 -0.09 4.52 0.15 -1.26 -4.92 113.70 117.88 1a2v s SER 216 Ca 0.64 2.79 0.18 0.00 0.70 0.00 0.00 55.95 60.26 1a2v s SER 216 Cb -0.75 -2.65 0.65 0.00 -1.71 0.00 0.00 66.02 61.56 1a2v s SER 216 CO 0.57 -0.98 1.56 0.29 1.20 0.00 0.00 173.24 175.88 1a2v n LYS 217 N 0.03 3.43 -2.45 5.44 5.02 -1.26 -4.98 118.16 123.40 1a2v n LYS 217 Ca 0.04 -2.76 -0.24 0.00 -2.02 0.00 0.00 58.31 53.33 1a2v n LYS 217 Cb 0.43 -1.77 0.05 0.00 -0.02 0.00 0.00 35.03 33.71 1a2v n LYS 217 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1a2v s HIS 218 N -1.69 3.00 0.63 2.13 3.76 -1.26 -5.05 115.29 116.81 1a2v s HIS 218 Ca 0.47 0.33 -0.17 0.00 -0.15 0.00 0.00 55.06 55.55 1a2v s HIS 218 Cb 0.30 -2.88 -0.02 0.00 1.11 0.00 0.00 32.58 31.09 1a2v s HIS 218 CO 0.24 -1.02 1.14 0.15 -0.85 0.00 0.00 174.74 174.40 1a2v s LYS 219 N -4.98 2.89 0.62 1.40 1.02 -1.26 -4.98 119.74 114.45 1a2v s LYS 219 Ca 0.57 1.56 -0.16 0.00 0.02 0.00 0.00 55.97 57.95 1a2v s LYS 219 Cb -0.10 -1.95 -0.02 0.00 -0.52 0.00 0.00 37.83 35.24 1a2v s LYS 219 CO 0.42 -1.21 1.11 -1.01 -0.92 0.00 0.00 175.35 173.74 1a2v s HIS 220 N -2.04 2.67 -0.75 3.18 3.76 -1.26 -4.96 115.29 115.89 1a2v s HIS 220 Ca 0.71 1.55 -0.17 0.00 -0.15 0.00 0.00 55.06 56.99 1a2v s HIS 220 Cb -0.24 -3.18 0.15 0.00 1.11 0.00 0.00 32.58 30.42 1a2v s HIS 220 CO 0.37 -1.60 0.83 0.00 -0.85 0.00 0.00 174.74 173.49 1a2v s ALA 221 N -2.22 3.62 0.35 -1.40 0.00 -1.26 -5.04 121.76 115.81 1a2v s ALA 221 Ca 0.68 -2.72 0.07 0.00 0.00 0.00 0.00 51.96 49.98 1a2v s ALA 221 Cb -0.21 -3.66 -0.01 0.00 0.00 0.00 0.00 23.12 19.25 1a2v s ALA 221 CO 0.38 -2.49 0.47 -0.80 0.00 0.00 0.00 175.76 173.32 1a2v s ASN 222 N 3.18 5.82 0.00 0.00 0.01 -1.26 -4.63 114.94 118.05 1a2v s ASN 222 Ca 0.19 -0.28 0.00 0.00 -0.71 0.00 0.00 52.86 52.06 1a2v s ASN 222 Cb -0.15 -1.08 0.00 0.00 0.41 0.00 0.00 41.25 40.43 1a2v s ASN 222 CO -0.03 -0.49 0.26 2.22 -1.51 0.00 0.00 177.10 177.55 1a2v n PHE 223 N -1.65 0.00 -2.36 2.20 1.16 -1.26 -4.73 117.46 110.82 1a2v n PHE 223 Ca 0.01 -0.03 -0.33 0.00 -1.87 0.00 0.00 57.45 55.23 1a2v n PHE 223 Cb 0.59 -0.00 -0.02 0.00 -1.61 0.00 0.00 39.48 38.43 1a2v n PHE 223 CO 0.00 0.00 0.00 0.71 -1.87 0.00 0.00 176.76 175.60 1a2v s TYR 224 N -0.07 3.19 0.32 2.97 1.51 -1.26 -4.73 117.35 119.28 1a2v s TYR 224 Ca 0.00 1.52 0.08 0.00 -1.01 0.00 0.00 57.07 57.66 1a2v s TYR 224 Cb 0.00 -2.92 0.91 0.00 -0.11 0.00 0.00 41.96 39.84 1a2v s TYR 224 CO 0.00 -0.68 1.63 -1.35 -1.11 0.00 0.00 175.55 174.04 1a2v h PRO 225 N 0.99 0.18 -0.33 -1.71 0.11 -1.98 0.47 132.00 129.73 1a2v h PRO 225 Ca -0.48 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.58 1a2v h PRO 225 Cb 1.20 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 32.25 1a2v h PRO 225 CO 0.60 0.12 0.00 1.57 -0.21 0.00 0.00 178.00 180.08 1a2v h LYS 226 N 0.18 0.52 -0.07 1.05 2.10 -1.99 0.27 116.57 118.63 1a2v h LYS 226 Ca 0.65 -0.11 -0.05 0.00 -2.00 0.00 0.00 60.65 59.15 1a2v h LYS 226 Cb 1.45 -0.08 0.00 0.00 -0.90 0.00 0.00 32.23 32.70 1a2v h LYS 226 CO -0.70 0.54 -0.15 0.45 -2.00 0.00 0.00 179.45 177.60 1a2v h HIS 227 N 0.50 0.28 -0.59 0.07 3.86 -0.55 -3.05 115.15 115.66 1a2v h HIS 227 Ca 0.11 -0.10 -0.01 0.00 -1.16 0.00 0.00 60.37 59.21 1a2v h HIS 227 Cb 0.32 -0.05 -0.03 0.00 1.06 0.00 0.00 27.41 28.71 1a2v h HIS 227 CO 0.01 0.75 0.34 0.52 0.86 0.00 0.00 177.93 180.41 1a2v h MET 228 N -0.28 0.81 -0.89 2.45 2.86 -0.37 0.13 114.93 119.65 1a2v h MET 228 Ca -0.00 -0.09 0.15 0.00 -2.06 0.00 0.00 59.70 57.70 1a2v h MET 228 Cb 0.75 -0.16 -0.07 0.00 0.06 0.00 0.00 31.60 32.17 1a2v h MET 228 CO 0.03 0.61 0.57 0.82 1.06 0.00 0.00 176.91 180.00 1a2v h ILE 229 N 0.80 0.82 -0.06 -1.22 2.04 -0.53 0.37 117.51 119.74 1a2v h ILE 229 Ca 0.21 -0.23 -0.14 0.00 1.00 0.00 0.00 64.86 65.69 1a2v h ILE 229 Cb 0.02 0.09 0.01 0.00 -0.74 0.00 0.00 36.82 36.20 1a2v h ILE 229 CO -0.04 0.12 -0.53 -0.33 0.00 0.00 0.00 178.15 177.38 1a2v h GLU 230 N 0.67 0.46 0.75 2.37 5.08 -1.21 -3.35 114.58 119.35 1a2v h GLU 230 Ca 0.45 -0.42 -0.04 0.00 -1.00 0.00 0.00 59.36 58.36 1a2v h GLU 230 Cb 0.75 0.10 0.01 0.00 0.50 0.00 0.00 28.75 30.10 1a2v h GLU 230 CO -0.21 1.06 -0.36 -0.22 -1.00 0.00 0.00 179.01 178.28 1a2v h LYS 231 N 0.00 -0.97 -6.32 2.33 3.64 0.92 -3.43 116.57 112.74 1a2v h LYS 231 Ca -0.05 0.07 -0.60 0.00 -1.27 0.00 0.00 60.65 58.80 1a2v h LYS 231 Cb 1.20 0.22 -0.11 0.00 -0.41 0.00 0.00 32.23 33.13 1a2v h LYS 231 CO 0.11 -0.63 -0.65 0.14 -2.27 0.00 0.00 179.45 176.15 1a2v s VAL 232 N -5.40 3.74 0.31 2.00 -7.23 0.12 -5.03 120.40 108.92 1a2v s VAL 232 Ca -0.17 -1.44 0.03 0.00 -1.81 0.00 0.00 61.98 58.59 1a2v s VAL 232 Cb 0.02 -2.89 0.42 0.00 0.56 0.00 0.00 36.38 34.49 1a2v s VAL 232 CO 0.54 -0.13 1.57 1.23 -0.31 0.00 0.00 175.10 177.99 1a2v h GLY 233 N 2.62 1.29 -1.22 2.32 0.00 -1.80 -3.34 103.07 102.95 1a2v h GLY 233 Ca -0.47 0.15 0.06 0.00 0.00 0.00 0.00 47.33 47.07 1a2v h GLY 233 CO 0.58 -0.53 0.42 0.00 0.00 0.00 0.00 176.54 177.01 1a2v s ALA 234 N -5.99 -1.10 0.52 3.60 0.00 -1.26 -4.68 121.76 112.86 1a2v s ALA 234 Ca -0.13 -0.61 -0.06 0.00 0.00 0.00 0.00 51.96 51.16 1a2v s ALA 234 Cb 0.29 0.71 -0.03 0.00 0.00 0.00 0.00 23.12 24.10 1a2v s ALA 234 CO 0.78 -1.02 0.84 -1.64 0.00 0.00 0.00 175.76 174.72 1a2v s MET 235 N -2.11 3.39 0.52 0.00 1.00 -1.26 -4.73 119.30 116.10 1a2v s MET 235 Ca 0.19 0.20 -0.20 0.00 0.00 0.00 0.00 55.69 55.88 1a2v s MET 235 Cb -0.04 -2.32 -0.07 0.00 0.00 0.00 0.00 34.83 32.40 1a2v s MET 235 CO 0.09 -0.37 1.07 1.03 0.00 0.00 0.00 175.02 176.85 1a2v s ARG 236 N -4.85 3.60 0.41 2.03 0.52 -1.26 -4.97 118.95 114.43 1a2v s ARG 236 Ca 0.50 1.44 -0.26 0.00 -0.52 0.00 0.00 55.73 56.89 1a2v s ARG 236 Cb -0.10 -2.06 -0.08 0.00 0.52 0.00 0.00 34.95 33.22 1a2v s ARG 236 CO 0.46 -0.62 1.29 -2.14 0.02 0.00 0.00 175.30 174.31 1a2v s PRO 237 N -3.32 3.93 0.33 3.54 0.02 -1.26 -4.91 135.00 133.33 1a2v s PRO 237 Ca 0.69 2.12 -0.26 0.00 0.02 0.00 0.00 61.00 63.57 1a2v s PRO 237 Cb -0.19 -2.71 -0.13 0.00 0.02 0.00 0.00 34.50 31.48 1a2v s PRO 237 CO 0.24 -0.51 0.92 -1.91 -0.33 0.00 0.00 177.00 175.40 1a2v n GLU 238 N 0.05 1.16 -3.47 5.54 4.07 -1.26 -4.94 120.64 121.79 1a2v n GLU 238 Ca 0.04 0.41 -0.30 0.00 -0.06 0.00 0.00 57.16 57.25 1a2v n GLU 238 Cb 0.44 -1.79 -0.04 0.00 -0.06 0.00 0.00 31.44 29.99 1a2v n GLU 238 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1a2v s ALA 239 N -1.16 3.67 0.23 4.31 0.00 -1.26 -5.02 121.76 122.53 1a2v s ALA 239 Ca 0.61 -0.53 -0.31 0.00 0.00 0.00 0.00 51.96 51.72 1a2v s ALA 239 Cb -0.67 -2.26 -0.14 0.00 0.00 0.00 0.00 23.12 20.06 1a2v s ALA 239 CO 0.59 0.42 1.36 -2.30 0.00 0.00 0.00 175.76 175.84 1a2v n PRO 240 N -0.49 1.88 -1.67 0.00 -0.02 -1.26 -4.89 135.00 128.55 1a2v n PRO 240 Ca -0.02 0.67 -0.33 0.00 -2.02 0.00 0.00 63.50 61.80 1a2v n PRO 240 Cb 0.53 -2.30 0.06 0.00 -0.02 0.00 0.00 33.50 31.77 1a2v n PRO 240 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1a2v s PRO 241 N -0.40 2.68 -0.31 0.52 0.04 -1.26 -5.03 135.00 131.25 1a2v s PRO 241 Ca 0.69 1.38 0.02 0.00 0.04 0.00 0.00 61.00 63.13 1a2v s PRO 241 Cb -0.69 -1.94 0.09 0.00 0.04 0.00 0.00 34.50 32.01 1a2v s PRO 241 CO 0.50 -1.34 0.04 0.42 0.04 0.00 0.00 177.00 176.66 1a2v s ILE 242 N -2.40 1.75 -0.08 0.56 1.01 -1.26 -5.10 121.20 115.68 1a2v s ILE 242 Ca 0.67 -1.85 -0.15 0.00 0.00 0.00 0.00 60.65 59.32 1a2v s ILE 242 Cb -0.20 -2.23 -0.05 0.00 0.01 0.00 0.00 42.46 39.99 1a2v s ILE 242 CO 0.44 -0.51 0.37 0.20 0.00 0.00 0.00 174.94 175.44 1a2v s ASN 243 N 1.20 6.65 -0.22 3.58 0.01 -1.26 -5.06 114.94 119.84 1a2v s ASN 243 Ca 0.07 0.77 -0.05 0.00 -0.71 0.00 0.00 52.86 52.94 1a2v s ASN 243 Cb -0.19 -2.22 -0.02 0.00 0.41 0.00 0.00 41.25 39.23 1a2v s ASN 243 CO -0.12 0.21 0.00 -0.69 -1.51 0.00 0.00 177.10 174.98 1a2v s VAL 244 N -0.32 3.84 0.00 1.60 1.01 -1.26 -5.09 120.40 120.19 1a2v s VAL 244 Ca 0.21 -0.34 0.03 0.00 0.00 0.00 0.00 61.98 61.88 1a2v s VAL 244 Cb -0.15 -2.76 -0.01 0.00 0.00 0.00 0.00 36.38 33.46 1a2v s VAL 244 CO 0.09 0.41 -0.09 0.42 0.00 0.00 0.00 175.10 175.93 1a2v s THR 245 N 1.30 0.66 -0.60 3.92 -4.23 -1.26 -4.75 115.64 110.68 1a2v s THR 245 Ca 0.04 -0.50 0.05 0.00 -1.18 0.00 0.00 61.69 60.11 1a2v s THR 245 Cb -0.15 -0.58 0.20 0.00 1.34 0.00 0.00 72.50 73.31 1a2v s THR 245 CO 0.01 0.09 0.54 0.00 -0.54 0.00 0.00 174.62 174.72 1a2v n GLN 246 N 2.61 1.62 -0.31 3.99 6.02 -1.26 -4.98 117.38 125.07 1a2v n GLN 246 Ca -0.15 -4.18 0.13 0.00 -0.01 0.00 0.00 57.00 52.79 1a2v n GLN 246 Cb 0.57 -2.06 0.30 0.00 1.02 0.00 0.00 30.24 30.07 1a2v n GLN 246 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 1a2v h PRO 247 N 4.95 0.47 -0.63 -1.09 0.13 -2.04 -1.57 132.00 132.21 1a2v h PRO 247 Ca 0.18 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 1a2v h PRO 247 Cb 0.77 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 31.79 1a2v h PRO 247 CO 0.66 0.31 0.00 0.39 -0.23 0.00 0.00 178.00 179.13 1a2v n GLU 248 N -4.98 3.27 0.00 0.86 1.02 -1.26 -5.05 120.64 114.50 1a2v n GLU 248 Ca 0.22 -2.31 0.00 0.00 -0.02 0.00 0.00 57.16 55.04 1a2v n GLU 248 Cb 0.62 -1.80 0.00 0.00 -0.02 0.00 0.00 31.44 30.24 1a2v n GLU 248 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1a2v n GLY 249 N 0.95 -1.72 3.85 0.62 0.00 -0.59 -5.00 105.19 103.29 1a2v n GLY 249 Ca 0.21 -1.99 -0.21 0.00 0.00 0.00 0.00 46.02 44.02 1a2v n GLY 249 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1a2v s VAL 250 N 0.00 3.65 -1.37 1.61 -7.23 -1.26 -4.83 120.40 110.97 1a2v s VAL 250 Ca 0.00 -1.38 0.25 0.00 -1.81 0.00 0.00 61.98 59.04 1a2v s VAL 250 Cb 0.00 -3.21 0.09 0.00 0.56 0.00 0.00 36.38 33.82 1a2v s VAL 250 CO 0.00 -0.20 1.41 -1.54 -0.31 0.00 0.00 175.10 174.46 1a2v n SER 251 N -1.34 0.85 -4.92 4.85 3.41 -1.26 -4.93 113.62 110.27 1a2v n SER 251 Ca -0.03 -0.65 -0.27 0.00 -0.26 0.00 0.00 58.87 57.67 1a2v n SER 251 Cb 0.59 0.28 -0.03 0.00 -0.26 0.00 0.00 64.21 64.80 1a2v n SER 251 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1a2v s PHE 252 N -2.77 3.48 -0.11 7.33 -0.12 -1.26 -4.81 117.98 119.72 1a2v s PHE 252 Ca 0.17 0.46 -0.01 0.00 -0.05 0.00 0.00 56.93 57.50 1a2v s PHE 252 Cb 0.18 -1.96 0.03 0.00 -0.63 0.00 0.00 43.02 40.64 1a2v s PHE 252 CO 0.63 0.24 -0.07 0.21 -0.05 0.00 0.00 175.22 176.18 1a2v s LYS 253 N -3.65 1.44 -0.24 1.99 2.20 -0.05 -4.99 119.74 116.42 1a2v s LYS 253 Ca 0.41 -0.23 -0.08 0.00 -0.36 0.00 0.00 55.97 55.72 1a2v s LYS 253 Cb -0.11 -1.54 -0.03 0.00 -1.51 0.00 0.00 37.83 34.64 1a2v s LYS 253 CO 0.31 -0.28 0.08 -1.64 -0.36 0.00 0.00 175.35 173.46 1a2v s MET 254 N 1.73 3.71 -0.68 4.03 -1.94 -1.26 -1.10 119.30 123.79 1a2v s MET 254 Ca 0.05 -0.45 -0.04 0.00 -1.71 0.00 0.00 55.69 53.54 1a2v s MET 254 Cb -0.13 -3.34 0.17 0.00 2.01 0.00 0.00 34.83 33.55 1a2v s MET 254 CO -0.08 -0.14 0.51 0.99 -0.01 0.00 0.00 175.02 176.29 1a2v s THR 255 N 1.50 3.97 0.00 2.05 2.01 0.12 -4.94 115.64 120.35 1a2v s THR 255 Ca 0.06 -3.03 0.00 0.00 0.31 0.00 0.00 61.69 59.03 1a2v s THR 255 Cb -0.15 -3.56 0.00 0.00 0.01 0.00 0.00 72.50 68.80 1a2v s THR 255 CO 0.04 -0.92 0.00 0.61 -0.69 0.00 0.00 174.62 173.66 1a2v n GLY 256 N 3.38 1.62 0.41 4.40 0.00 -1.26 -2.21 105.19 111.53 1a2v n GLY 256 Ca 0.10 -0.55 0.11 0.00 0.00 0.00 0.00 46.02 45.69 1a2v n GLY 256 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1a2v n ASN 257 N 8.30 1.74 -4.67 1.61 3.02 -1.26 -4.89 115.26 119.11 1a2v n ASN 257 Ca 0.00 -1.34 -0.42 0.00 -0.03 0.00 0.00 54.58 52.79 1a2v n ASN 257 Cb 0.00 0.43 -0.03 0.00 -0.61 0.00 0.00 39.78 39.57 1a2v n ASN 257 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1a2v s VAL 258 N -2.52 4.80 0.04 2.41 1.01 -0.94 -1.10 120.40 124.11 1a2v s VAL 258 Ca 0.19 1.86 0.02 0.00 0.00 0.00 0.00 61.98 64.05 1a2v s VAL 258 Cb 0.18 -4.24 -0.04 0.00 0.00 0.00 0.00 36.38 32.29 1a2v s VAL 258 CO 0.58 -0.03 0.07 -0.32 0.00 0.00 0.00 175.10 175.40 1a2v s MET 259 N 2.37 2.93 -0.04 2.72 0.00 0.75 0.10 119.30 128.13 1a2v s MET 259 Ca 0.43 -0.61 -0.01 0.00 0.00 0.00 0.00 55.69 55.49 1a2v s MET 259 Cb -0.17 -2.76 0.03 0.00 0.00 0.00 0.00 34.83 31.93 1a2v s MET 259 CO 0.13 0.60 0.03 -1.21 0.00 0.00 0.00 175.02 174.56 1a2v s GLU 260 N -2.07 0.19 -0.28 4.11 2.02 -0.26 -1.87 118.70 120.54 1a2v s GLU 260 Ca 0.26 0.22 -0.16 0.00 0.02 0.00 0.00 54.97 55.31 1a2v s GLU 260 Cb -0.12 -0.61 0.11 0.00 0.10 0.00 0.00 34.13 33.61 1a2v s GLU 260 CO 0.18 -0.27 0.82 -0.46 0.02 0.00 0.00 175.26 175.56 1a2v s TRP 261 N 1.78 -0.83 -1.66 1.61 -0.00 -0.59 -0.87 118.94 118.37 1a2v s TRP 261 Ca 0.01 1.67 -0.17 0.00 -0.00 0.00 0.00 56.10 57.61 1a2v s TRP 261 Cb -0.12 0.49 0.14 0.00 -0.00 0.00 0.00 33.47 33.98 1a2v s TRP 261 CO -0.03 -0.41 0.80 0.43 -0.00 0.00 0.00 176.95 177.74 1a2v n SER 262 N 3.96 -3.38 0.00 5.86 7.64 -1.26 0.36 113.62 126.79 1a2v n SER 262 Ca -0.19 -0.97 0.00 0.00 1.01 0.00 0.00 58.87 58.72 1a2v n SER 262 Cb 0.58 -2.97 0.00 0.00 -1.01 0.00 0.00 64.21 60.81 1a2v n SER 262 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1a2v n ASN 263 N -2.71 0.00 -4.84 6.43 3.02 -1.26 -4.89 115.26 111.02 1a2v n ASN 263 Ca 0.05 0.00 -0.32 0.00 -0.03 0.00 0.00 54.58 54.27 1a2v n ASN 263 Cb 0.51 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.62 1a2v n ASN 263 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1a2v s PHE 264 N -3.02 3.38 -0.16 3.10 0.08 0.16 0.35 117.98 121.87 1a2v s PHE 264 Ca 0.00 1.38 -0.09 0.00 0.12 0.00 0.00 56.93 58.35 1a2v s PHE 264 Cb 0.00 -2.68 0.06 0.00 -0.57 0.00 0.00 43.02 39.82 1a2v s PHE 264 CO 0.00 -0.09 0.39 0.21 -0.10 0.00 0.00 175.22 175.63 1a2v s LYS 265 N -3.36 0.37 0.18 0.44 2.20 -0.63 -1.55 119.74 117.39 1a2v s LYS 265 Ca 0.58 0.76 -0.24 0.00 -0.36 0.00 0.00 55.97 56.70 1a2v s LYS 265 Cb -0.10 -0.04 0.05 0.00 -1.51 0.00 0.00 37.83 36.24 1a2v s LYS 265 CO 0.20 -0.16 0.79 -0.59 -0.36 0.00 0.00 175.35 175.24 1a2v s PHE 266 N 1.39 -0.26 -0.17 4.03 -0.71 -0.78 -1.22 117.98 120.26 1a2v s PHE 266 Ca -0.10 -0.07 -0.07 0.00 -1.04 0.00 0.00 56.93 55.66 1a2v s PHE 266 Cb -0.09 0.64 -0.04 0.00 -1.21 0.00 0.00 43.02 42.32 1a2v s PHE 266 CO -0.12 -0.95 0.05 -1.58 -1.34 0.00 0.00 175.22 171.28 1a2v s HIS 267 N -3.59 3.24 -0.51 3.49 5.65 -0.16 -0.18 115.29 123.24 1a2v s HIS 267 Ca 0.09 0.08 -0.17 0.00 0.25 0.00 0.00 55.06 55.31 1a2v s HIS 267 Cb -0.03 -2.04 0.09 0.00 -1.18 0.00 0.00 32.58 29.42 1a2v s HIS 267 CO -0.00 0.20 0.50 0.42 -0.65 0.00 0.00 174.74 175.20 1a2v s ILE 268 N 0.19 5.12 0.57 0.89 1.01 -0.26 -1.16 121.20 127.56 1a2v s ILE 268 Ca 0.04 -1.08 0.09 0.00 0.00 0.00 0.00 60.65 59.69 1a2v s ILE 268 Cb -0.12 -4.26 0.08 0.00 0.01 0.00 0.00 42.46 38.17 1a2v s ILE 268 CO 0.01 -0.76 0.72 -0.83 0.00 0.00 0.00 174.94 174.07 1a2v s GLY 269 N 3.02 1.86 -0.22 6.18 0.00 0.14 -4.84 107.32 113.45 1a2v s GLY 269 Ca 0.06 -1.97 -0.27 0.00 0.00 0.00 0.00 44.72 42.55 1a2v s GLY 269 CO 0.06 -1.75 0.84 -0.12 0.00 0.00 0.00 173.10 172.14 1a2v s PHE 270 N -2.70 -0.63 0.16 1.90 2.19 -1.26 -1.19 117.98 116.45 1a2v s PHE 270 Ca 0.56 1.42 -0.12 0.00 0.33 0.00 0.00 56.93 59.12 1a2v s PHE 270 Cb -0.05 0.34 0.01 0.00 -1.31 0.00 0.00 43.02 42.01 1a2v s PHE 270 CO 0.35 -0.37 0.34 0.54 1.83 0.00 0.00 175.22 177.92 1a2v s ASN 271 N -0.09 -0.05 0.38 6.13 2.20 -0.62 -4.78 114.94 118.11 1a2v s ASN 271 Ca -0.01 -0.70 0.18 0.00 -0.94 0.00 0.00 52.86 51.39 1a2v s ASN 271 Cb -0.04 0.46 1.10 0.00 -2.00 0.00 0.00 41.25 40.78 1a2v s ASN 271 CO 0.00 -0.91 1.74 0.10 -2.94 0.00 0.00 177.10 175.09 1a2v h TYR 272 N 2.47 0.73 0.00 1.54 -0.00 -1.90 -1.89 116.97 117.91 1a2v h TYR 272 Ca -0.31 0.03 0.00 0.00 -0.00 0.00 0.00 58.73 58.44 1a2v h TYR 272 Cb 1.24 -0.21 0.00 0.00 -0.00 0.00 0.00 36.73 37.76 1a2v h TYR 272 CO 0.38 0.01 -0.10 -0.09 -0.00 0.00 0.00 178.16 178.36 1a2v h ARG 273 N 0.38 0.00 0.00 0.10 2.43 -1.88 0.54 114.38 115.96 1a2v h ARG 273 Ca 0.64 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.80 1a2v h ARG 273 Cb 1.60 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 31.15 1a2v h ARG 273 CO -0.37 0.00 -0.07 0.93 -1.51 0.00 0.00 179.97 178.95 1a2v h GLU 274 N -0.25 0.00 0.00 0.20 5.08 -1.81 0.78 114.58 118.58 1a2v h GLU 274 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1a2v h GLU 274 Cb 0.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.35 1a2v h GLU 274 CO 0.00 0.07 0.00 0.41 -1.00 0.00 0.00 179.01 178.49 1a2v n GLY 275 N 0.85 0.34 3.78 -3.84 0.00 -0.71 -4.62 105.19 100.98 1a2v n GLY 275 Ca 0.03 -0.83 -0.41 0.00 0.00 0.00 0.00 46.02 44.81 1a2v n GLY 275 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1a2v s ILE 276 N 0.00 2.11 -0.12 -0.61 1.01 -1.26 -1.59 121.20 120.74 1a2v s ILE 276 Ca 0.00 0.11 -0.03 0.00 0.00 0.00 0.00 60.65 60.73 1a2v s ILE 276 Cb 0.00 -3.07 0.04 0.00 0.01 0.00 0.00 42.46 39.44 1a2v s ILE 276 CO 0.00 0.03 0.05 -0.69 0.00 0.00 0.00 174.94 174.32 1a2v s VAL 277 N -1.07 0.16 -0.12 2.92 1.01 -0.34 -4.59 120.40 118.37 1a2v s VAL 277 Ca 0.53 -0.02 -0.15 0.00 0.00 0.00 0.00 61.98 62.34 1a2v s VAL 277 Cb -0.46 -0.55 -0.05 0.00 0.00 0.00 0.00 36.38 35.33 1a2v s VAL 277 CO 0.62 -0.00 0.36 -0.76 0.00 0.00 0.00 175.10 175.31 1a2v s LEU 278 N 2.04 4.30 0.14 3.92 1.43 -0.90 0.27 118.68 129.88 1a2v s LEU 278 Ca 0.03 0.67 0.03 0.00 -1.03 0.00 0.00 54.13 53.82 1a2v s LEU 278 Cb -0.14 -2.49 -0.04 0.00 0.03 0.00 0.00 46.19 43.55 1a2v s LEU 278 CO -0.06 0.12 -0.05 -0.44 0.23 0.00 0.00 176.35 176.15 1a2v s SER 279 N 0.20 1.37 -1.30 2.29 0.01 -0.31 -0.97 113.70 114.99 1a2v s SER 279 Ca 0.20 -1.07 -0.10 0.00 1.31 0.00 0.00 55.95 56.29 1a2v s SER 279 Cb -0.14 0.07 0.00 0.00 0.21 0.00 0.00 66.02 66.16 1a2v s SER 279 CO 0.07 -0.47 0.56 -0.67 0.41 0.00 0.00 173.24 173.14 1a2v n ASP 280 N -0.17 -2.23 -4.69 2.44 2.03 0.14 -0.99 116.55 113.09 1a2v n ASP 280 Ca -0.09 -1.03 -0.41 0.00 0.52 0.00 0.00 54.79 53.77 1a2v n ASP 280 Cb 0.62 -3.05 -0.04 0.00 -0.72 0.00 0.00 41.12 37.93 1a2v n ASP 280 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1a2v s VAL 281 N -3.77 4.92 0.17 5.18 1.01 -0.03 -4.11 120.40 123.78 1a2v s VAL 281 Ca 0.19 1.69 -0.05 0.00 0.00 0.00 0.00 61.98 63.82 1a2v s VAL 281 Cb -0.08 -4.16 -0.03 0.00 0.00 0.00 0.00 36.38 32.12 1a2v s VAL 281 CO 0.89 0.12 0.20 -0.94 0.00 0.00 0.00 175.10 175.37 1a2v s SER 282 N 1.01 0.14 -0.05 3.32 1.04 -0.36 -0.65 113.70 118.14 1a2v s SER 282 Ca 0.42 -1.12 0.02 0.00 0.48 0.00 0.00 55.95 55.75 1a2v s SER 282 Cb -0.18 0.40 0.02 0.00 0.10 0.00 0.00 66.02 66.35 1a2v s SER 282 CO 0.18 -0.86 -0.09 -0.47 0.98 0.00 0.00 173.24 172.98 1a2v s TYR 283 N -4.05 1.15 -0.89 5.02 6.14 0.35 -1.61 117.35 123.46 1a2v s TYR 283 Ca 0.26 -0.39 -0.24 0.00 0.64 0.00 0.00 57.07 57.34 1a2v s TYR 283 Cb 0.05 -0.89 0.06 0.00 0.42 0.00 0.00 41.96 41.60 1a2v s TYR 283 CO 0.05 -0.23 1.32 1.21 0.64 0.00 0.00 175.55 178.53 1a2v s ASN 284 N 0.74 6.38 -1.26 4.32 3.84 0.16 -0.80 114.94 128.31 1a2v s ASN 284 Ca -0.13 -1.17 -0.19 0.00 0.21 0.00 0.00 52.86 51.58 1a2v s ASN 284 Cb -0.15 -2.53 0.05 0.00 -0.55 0.00 0.00 41.25 38.07 1a2v s ASN 284 CO 0.02 -1.55 1.73 -0.62 -2.79 0.00 0.00 177.10 173.89 1a2v s ASP 285 N 4.33 6.65 -1.32 -4.21 2.15 0.47 -4.39 116.67 120.35 1a2v s ASP 285 Ca 0.39 -2.29 -0.13 0.00 0.43 0.00 0.00 52.55 50.95 1a2v s ASP 285 Cb -0.05 -2.58 0.01 0.00 -0.30 0.00 0.00 42.92 40.00 1a2v s ASP 285 CO -0.00 -1.37 0.50 1.41 -0.17 0.00 0.00 175.17 175.54 1a2v n HIS 286 N 8.98 -1.60 0.00 -5.34 8.25 -1.26 -1.16 115.22 123.10 1a2v n HIS 286 Ca 0.47 0.50 0.00 0.00 -0.26 0.00 0.00 57.72 58.43 1a2v n HIS 286 Cb 0.46 -3.31 0.00 0.00 1.12 0.00 0.00 29.99 28.27 1a2v n HIS 286 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1a2v n GLY 287 N -2.03 3.04 3.49 -1.41 0.00 -1.26 -5.00 105.19 102.01 1a2v n GLY 287 Ca -0.22 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.37 1a2v n GLY 287 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1a2v s ASN 288 N 0.31 6.24 -0.41 1.61 3.04 -0.31 -5.01 114.94 120.41 1a2v s ASN 288 Ca 0.00 -0.60 -0.24 0.00 0.04 0.00 0.00 52.86 52.06 1a2v s ASN 288 Cb 0.00 -2.27 0.02 0.00 -1.54 0.00 0.00 41.25 37.46 1a2v s ASN 288 CO 0.00 -0.69 0.83 -0.69 -3.04 0.00 0.00 177.10 173.50 1a2v s VAL 289 N 2.44 4.64 -0.17 -5.21 1.01 -1.26 0.18 120.40 122.02 1a2v s VAL 289 Ca 0.16 0.76 -0.04 0.00 0.00 0.00 0.00 61.98 62.85 1a2v s VAL 289 Cb -0.16 -4.30 -0.03 0.00 0.00 0.00 0.00 36.38 31.89 1a2v s VAL 289 CO 0.15 -0.61 -0.02 -0.13 0.00 0.00 0.00 175.10 174.49 1a2v s ARG 290 N 3.33 3.69 0.58 2.72 0.52 0.02 -4.91 118.95 124.90 1a2v s ARG 290 Ca 0.33 -0.50 -0.17 0.00 -0.52 0.00 0.00 55.73 54.86 1a2v s ARG 290 Cb -0.12 -2.98 -0.04 0.00 0.52 0.00 0.00 34.95 32.32 1a2v s ARG 290 CO 0.21 0.19 1.09 -2.14 0.02 0.00 0.00 175.30 174.67 1a2v s PRO 291 N 0.51 3.27 0.14 3.54 0.02 -1.26 -0.49 135.00 140.72 1a2v s PRO 291 Ca -0.02 1.41 0.00 0.00 0.02 0.00 0.00 61.00 62.41 1a2v s PRO 291 Cb -0.14 -2.01 0.00 0.00 0.02 0.00 0.00 34.50 32.37 1a2v s PRO 291 CO 0.02 -0.88 0.00 -0.89 -0.33 0.00 0.00 177.00 174.92 1a2v n ILE 292 N -1.73 0.69 -4.75 2.83 5.41 0.18 -0.18 119.36 121.81 1a2v n ILE 292 Ca 0.10 0.23 -0.24 0.00 1.00 0.00 0.00 62.75 63.84 1a2v n ILE 292 Cb 0.52 -1.13 -0.15 0.00 -0.71 0.00 0.00 39.64 38.16 1a2v n ILE 292 CO 0.00 0.00 0.00 -0.36 0.00 0.00 0.00 176.55 176.19 1a2v s PHE 293 N -1.85 1.46 0.04 1.39 0.08 -1.11 -0.43 117.98 117.56 1a2v s PHE 293 Ca 0.00 -0.32 0.03 0.00 0.12 0.00 0.00 56.93 56.76 1a2v s PHE 293 Cb 0.00 -0.96 -0.25 0.00 -0.57 0.00 0.00 43.02 41.24 1a2v s PHE 293 CO 0.00 -0.06 0.98 1.25 -0.10 0.00 0.00 175.22 177.29 1a2v h HIS 294 N 5.91 0.23 -1.90 0.36 -0.00 -0.27 -0.04 115.15 119.45 1a2v h HIS 294 Ca -0.35 -0.17 -0.02 0.00 -0.00 0.00 0.00 60.37 59.83 1a2v h HIS 294 Cb 1.16 -0.01 -0.21 0.00 -0.00 0.00 0.00 27.41 28.35 1a2v h HIS 294 CO 0.41 1.18 0.25 0.50 -0.00 0.00 0.00 177.93 180.27 1a2v s ARG 295 N -2.65 0.88 -0.20 5.26 3.52 -0.87 -0.68 118.95 124.21 1a2v s ARG 295 Ca -0.05 0.48 -0.17 0.00 -0.13 0.00 0.00 55.73 55.86 1a2v s ARG 295 Cb 0.08 0.42 0.05 0.00 -1.56 0.00 0.00 34.95 33.94 1a2v s ARG 295 CO 0.84 -0.22 0.53 -1.50 -0.81 0.00 0.00 175.30 174.14 1a2v s ILE 296 N -0.61 -0.00 0.01 4.11 2.07 -0.14 -0.21 121.20 126.43 1a2v s ILE 296 Ca -0.05 0.01 -0.22 0.00 -1.41 0.00 0.00 60.65 58.97 1a2v s ILE 296 Cb -0.02 -0.74 0.07 0.00 0.13 0.00 0.00 42.46 41.90 1a2v s ILE 296 CO 0.05 0.00 1.02 -1.54 -1.91 0.00 0.00 174.94 172.56 1a2v n SER 297 N 3.05 -1.04 -4.62 4.50 3.41 -0.82 -2.13 113.62 115.97 1a2v n SER 297 Ca -0.15 -1.28 -0.38 0.00 -0.26 0.00 0.00 58.87 56.80 1a2v n SER 297 Cb 0.56 1.62 -0.10 0.00 -0.26 0.00 0.00 64.21 66.04 1a2v n SER 297 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1a2v s LEU 298 N 0.00 4.06 0.02 1.04 1.43 -1.26 -0.61 118.68 123.36 1a2v s LEU 298 Ca 0.24 0.19 0.22 0.00 -1.03 0.00 0.00 54.13 53.75 1a2v s LEU 298 Cb -0.01 -2.28 -0.14 0.00 0.03 0.00 0.00 46.19 43.79 1a2v s LEU 298 CO 0.00 -0.08 0.84 -1.54 0.23 0.00 0.00 176.35 175.79 1a2v n SER 299 N 4.96 0.54 -3.62 2.29 3.41 0.12 -4.58 113.62 116.74 1a2v n SER 299 Ca -0.11 -0.33 0.00 0.00 -0.26 0.00 0.00 58.87 58.17 1a2v n SER 299 Cb 0.51 1.19 -0.01 0.00 -0.26 0.00 0.00 64.21 65.64 1a2v n SER 299 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 1a2v s GLU 300 N -3.25 0.41 0.24 4.33 2.56 -1.24 -4.59 118.70 117.16 1a2v s GLU 300 Ca 0.01 -0.22 -0.10 0.00 0.00 0.00 0.00 54.97 54.67 1a2v s GLU 300 Cb 0.15 0.15 -0.01 0.00 2.00 0.00 0.00 34.13 36.41 1a2v s GLU 300 CO 0.85 -0.19 0.40 -1.64 -0.56 0.00 0.00 175.26 174.12 1a2v s MET 301 N -2.46 1.48 -0.26 4.30 -1.94 -1.26 -1.30 119.30 117.86 1a2v s MET 301 Ca 0.13 -1.35 -0.17 0.00 -1.71 0.00 0.00 55.69 52.59 1a2v s MET 301 Cb 0.03 0.43 0.07 0.00 2.01 0.00 0.00 34.83 37.37 1a2v s MET 301 CO -0.04 -0.59 0.65 -1.50 -0.01 0.00 0.00 175.02 173.52 1a2v s ILE 302 N -4.02 -0.00 -0.61 2.53 2.07 -0.87 -4.08 121.20 116.21 1a2v s ILE 302 Ca 0.26 0.01 0.06 0.00 -1.41 0.00 0.00 60.65 59.57 1a2v s ILE 302 Cb 0.01 -0.92 0.22 0.00 0.13 0.00 0.00 42.46 41.90 1a2v s ILE 302 CO 0.10 0.00 0.62 0.52 -1.91 0.00 0.00 174.94 174.27 1a2v n VAL 303 N 3.80 1.53 -2.24 4.00 0.31 0.19 -1.02 118.33 124.90 1a2v n VAL 303 Ca -0.18 -4.84 -0.42 0.00 -0.01 0.00 0.00 64.34 58.88 1a2v n VAL 303 Cb 0.57 -2.08 -0.03 0.00 -0.91 0.00 0.00 33.84 31.40 1a2v n VAL 303 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1a2v s PRO 304 N -1.85 4.29 0.37 5.55 0.04 -1.15 -3.81 135.00 138.44 1a2v s PRO 304 Ca 0.34 1.95 -0.09 0.00 0.04 0.00 0.00 61.00 63.24 1a2v s PRO 304 Cb 0.09 -3.56 -0.06 0.00 0.04 0.00 0.00 34.50 31.01 1a2v s PRO 304 CO -0.08 -0.56 0.70 0.71 0.04 0.00 0.00 177.00 177.81 1a2v s TYR 305 N 2.34 3.47 -0.21 0.56 1.51 -0.96 -1.14 117.35 122.91 1a2v s TYR 305 Ca 0.63 0.93 0.15 0.00 -1.01 0.00 0.00 57.07 57.77 1a2v s TYR 305 Cb -0.31 -2.34 0.63 0.00 -0.11 0.00 0.00 41.96 39.83 1a2v s TYR 305 CO 0.26 -0.01 1.55 0.41 -1.11 0.00 0.00 175.55 176.65 1a2v n GLY 306 N -1.15 3.75 3.72 0.71 0.00 -0.42 -4.92 105.19 106.89 1a2v n GLY 306 Ca 0.01 -1.02 -0.37 0.00 0.00 0.00 0.00 46.02 44.64 1a2v n GLY 306 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1a2v s SER 307 N -1.56 6.56 0.00 1.61 0.15 -1.26 -4.80 113.70 114.39 1a2v s SER 307 Ca 0.47 0.66 0.29 0.00 0.70 0.00 0.00 55.95 58.07 1a2v s SER 307 Cb 0.38 -2.24 1.24 0.00 -1.71 0.00 0.00 66.02 63.68 1a2v s SER 307 CO 0.11 0.04 1.88 -0.81 1.20 0.00 0.00 173.24 175.66 1a2v n PRO 308 N 3.69 0.38 -2.39 5.44 -0.04 -1.26 -4.45 135.00 136.36 1a2v n PRO 308 Ca -0.09 -0.09 -0.41 0.00 -0.04 0.00 0.00 63.50 62.87 1a2v n PRO 308 Cb 0.52 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.44 1a2v n PRO 308 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1a2v s GLU 309 N -2.68 4.50 0.31 0.54 2.02 -1.26 -4.79 118.70 117.34 1a2v s GLU 309 Ca 0.23 1.85 -0.29 0.00 0.02 0.00 0.00 54.97 56.78 1a2v s GLU 309 Cb 0.20 -3.25 -0.11 0.00 0.10 0.00 0.00 34.13 31.06 1a2v s GLU 309 CO 0.51 -0.08 1.51 0.12 0.02 0.00 0.00 175.26 177.34 1a2v s PHE 310 N 0.00 2.79 -0.40 1.61 5.36 -1.26 0.27 117.98 126.35 1a2v s PHE 310 Ca 0.53 0.99 0.05 0.00 -0.96 0.00 0.00 56.93 57.54 1a2v s PHE 310 Cb -0.32 -3.97 0.65 0.00 -0.34 0.00 0.00 43.02 39.04 1a2v s PHE 310 CO 0.36 -3.09 1.83 -0.35 -1.46 0.00 0.00 175.22 172.51 1a2v n PRO 311 N 1.62 2.60 0.00 10.12 -0.04 -1.26 -4.98 135.00 143.05 1a2v n PRO 311 Ca 0.05 -2.84 0.08 0.00 -0.04 0.00 0.00 63.50 60.75 1a2v n PRO 311 Cb 0.39 -2.12 0.49 0.00 -0.04 0.00 0.00 33.50 32.21 1a2v n PRO 311 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1a2v n HIS 312 N -0.77 0.00 0.20 0.54 8.25 0.14 -1.55 115.22 122.03 1a2v n HIS 312 Ca 0.51 0.00 0.09 0.00 -0.26 0.00 0.00 57.72 58.06 1a2v n HIS 312 Cb 1.53 0.00 0.31 0.00 1.12 0.00 0.00 29.99 32.95 1a2v n HIS 312 CO 0.00 0.00 0.00 1.96 0.64 0.00 0.00 176.34 178.94 1a2v h GLN 313 N 0.00 0.00 0.00 -0.41 7.50 -1.78 -2.92 115.11 117.50 1a2v h GLN 313 Ca 0.00 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 1a2v h GLN 313 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.53 1a2v h GLN 313 CO 0.00 0.25 0.00 0.54 -1.50 0.00 0.00 178.83 178.12 1a2v n ARG 314 N -3.28 0.85 -3.43 1.46 1.74 -0.60 -4.39 116.66 109.02 1a2v n ARG 314 Ca 0.01 0.00 -0.44 0.00 -0.77 0.00 0.00 57.85 56.65 1a2v n ARG 314 Cb 0.52 -1.35 -0.04 0.00 -1.02 0.00 0.00 32.46 30.58 1a2v n ARG 314 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1a2v s LYS 315 N -2.00 3.30 -0.46 5.56 1.02 -1.10 -4.52 119.74 121.54 1a2v s LYS 315 Ca 0.28 -2.42 0.06 0.00 0.02 0.00 0.00 55.97 53.91 1a2v s LYS 315 Cb 0.13 -4.25 0.31 0.00 -0.52 0.00 0.00 37.83 33.51 1a2v s LYS 315 CO 0.22 -1.26 1.11 -2.39 -0.92 0.00 0.00 175.35 172.11 1a2v n HIS 316 N 3.95 -2.81 -1.79 3.18 1.44 -1.26 -2.27 115.22 115.65 1a2v n HIS 316 Ca 0.10 -2.03 -0.41 0.00 -2.01 0.00 0.00 57.72 53.37 1a2v n HIS 316 Cb 0.44 1.61 -0.01 0.00 0.12 0.00 0.00 29.99 32.15 1a2v n HIS 316 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1a2v s ALA 317 N 0.30 3.71 -0.88 1.59 0.00 -1.25 -4.48 121.76 120.74 1a2v s ALA 317 Ca 0.23 1.56 -0.01 0.00 0.00 0.00 0.00 51.96 53.74 1a2v s ALA 317 Cb 0.28 -3.64 0.24 0.00 0.00 0.00 0.00 23.12 20.01 1a2v s ALA 317 CO -0.07 -0.99 0.88 1.28 0.00 0.00 0.00 175.76 176.85 1a2v n LEU 318 N 1.81 4.45 -0.27 0.00 4.32 -1.26 -0.64 117.00 125.41 1a2v n LEU 318 Ca 0.07 -5.20 0.09 0.00 -0.02 0.00 0.00 56.01 50.95 1a2v n LEU 318 Cb 0.38 -1.05 0.22 0.00 -1.62 0.00 0.00 43.42 41.35 1a2v n LEU 318 CO 0.64 1.66 0.92 0.44 -1.22 0.00 0.00 177.39 179.82 1a2v h ASP 319 N 5.61 -0.06 -0.60 -1.43 3.32 -1.93 0.23 116.42 121.57 1a2v h ASP 319 Ca 0.17 0.18 -0.05 0.00 0.02 0.00 0.00 57.03 57.35 1a2v h ASP 319 Cb 0.76 0.25 -0.03 0.00 0.22 0.00 0.00 39.33 40.54 1a2v h ASP 319 CO 0.92 -0.11 0.17 0.40 -1.72 0.00 0.00 179.24 178.90 1a2v h ILE 320 N 0.22 1.25 0.00 0.35 2.04 -1.86 0.67 117.51 120.17 1a2v h ILE 320 Ca 0.47 -0.86 0.00 0.00 1.00 0.00 0.00 64.86 65.48 1a2v h ILE 320 Cb 0.88 0.66 0.00 0.00 -0.74 0.00 0.00 36.82 37.62 1a2v h ILE 320 CO -0.60 0.32 -0.73 1.23 0.00 0.00 0.00 178.15 178.37 1a2v h GLY 321 N 0.86 0.00 0.00 5.37 0.00 -1.67 -2.87 103.07 104.76 1a2v h GLY 321 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.52 1a2v h GLY 321 CO -0.00 0.00 -1.23 1.18 0.00 0.00 0.00 176.54 176.49 1a2v n GLU 322 N -2.17 1.25 0.00 4.80 1.02 0.75 -4.33 120.64 121.97 1a2v n GLU 322 Ca 0.03 -0.07 0.00 0.00 -0.02 0.00 0.00 57.16 57.09 1a2v n GLU 322 Cb 0.45 -1.28 0.00 0.00 -0.02 0.00 0.00 31.44 30.59 1a2v n GLU 322 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1a2v n TYR 323 N -1.71 0.00 -0.05 -0.32 4.01 -0.32 -1.31 117.16 117.46 1a2v n TYR 323 Ca -0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 1a2v n TYR 323 Cb 0.32 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.35 1a2v n TYR 323 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1a2v n GLY 324 N 1.56 0.75 0.24 2.72 0.00 0.08 -4.54 105.19 105.99 1a2v n GLY 324 Ca 0.00 -1.20 0.16 0.00 0.00 0.00 0.00 46.02 44.98 1a2v n GLY 324 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a2v h ALA 325 N 0.00 1.00 0.00 4.61 0.00 0.76 -1.54 119.26 124.09 1a2v h ALA 325 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 1a2v h ALA 325 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1a2v h ALA 325 CO 0.00 0.00 -0.41 0.78 0.00 0.00 0.00 179.25 179.62 1a2v h GLY 326 N 2.27 0.00 0.83 0.00 0.00 -0.01 -3.20 103.07 102.96 1a2v h GLY 326 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 47.33 47.45 1a2v h GLY 326 CO 0.00 0.00 0.47 -0.97 0.00 0.00 0.00 176.54 176.04 1a2v h TYR 327 N -1.00 0.50 -0.02 5.60 0.05 -0.93 -1.93 116.97 119.24 1a2v h TYR 327 Ca -0.10 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.70 1a2v h TYR 327 Cb 0.83 -0.16 0.00 0.00 1.01 0.00 0.00 36.73 38.41 1a2v h TYR 327 CO 0.11 0.21 -0.10 -1.33 -1.05 0.00 0.00 178.16 176.00 1a2v n MET 328 N -4.48 1.66 -1.89 4.88 2.81 -0.59 -4.90 117.12 114.61 1a2v n MET 328 Ca 0.13 -1.17 -0.40 0.00 -1.81 0.00 0.00 57.70 54.44 1a2v n MET 328 Cb 0.45 -1.48 0.00 0.00 -0.71 0.00 0.00 33.22 31.48 1a2v n MET 328 CO 0.00 0.00 0.00 -0.08 1.51 0.00 0.00 175.97 177.40 1a2v s THR 329 N -2.14 2.25 0.02 2.03 -1.32 -0.73 -1.31 115.64 114.44 1a2v s THR 329 Ca 0.30 0.24 -0.19 0.00 -1.21 0.00 0.00 61.69 60.84 1a2v s THR 329 Cb 0.20 -3.15 -0.06 0.00 -1.51 0.00 0.00 72.50 67.98 1a2v s THR 329 CO 0.39 0.05 0.53 0.20 -2.21 0.00 0.00 174.62 173.58 1a2v s ASN 330 N -0.40 6.95 -0.06 8.08 0.01 0.11 -4.88 114.94 124.75 1a2v s ASN 330 Ca 0.55 1.13 -0.30 0.00 -0.71 0.00 0.00 52.86 53.54 1a2v s ASN 330 Cb -0.43 -2.33 -0.05 0.00 0.41 0.00 0.00 41.25 38.85 1a2v s ASN 330 CO 0.57 0.21 1.57 -2.84 -1.51 0.00 0.00 177.10 175.11 1a2v s PRO 331 N -0.69 4.20 0.29 -0.60 0.02 -1.26 -4.54 135.00 132.41 1a2v s PRO 331 Ca 0.28 2.09 0.08 0.00 0.02 0.00 0.00 61.00 63.48 1a2v s PRO 331 Cb -0.18 -3.90 0.43 0.00 0.02 0.00 0.00 34.50 30.87 1a2v s PRO 331 CO 0.17 -0.80 1.67 -0.07 -0.33 0.00 0.00 177.00 177.64 1a2v h LEU 332 N 9.91 0.13 0.00 -5.54 -0.00 0.17 -3.41 115.31 116.57 1a2v h LEU 332 Ca -0.37 -0.06 0.00 0.00 -0.00 0.00 0.00 57.88 57.44 1a2v h LEU 332 Cb 1.17 -0.04 0.00 0.00 -0.00 0.00 0.00 40.66 41.79 1a2v h LEU 332 CO 0.95 0.62 0.00 -0.24 -0.00 0.00 0.00 178.44 179.77 1a2v n SER 333 N -3.94 0.00 -0.33 -0.43 2.88 -1.26 -3.91 113.62 106.63 1a2v n SER 333 Ca -0.02 0.64 -0.06 0.00 -1.33 0.00 0.00 58.87 58.10 1a2v n SER 333 Cb 0.53 -0.14 -0.04 0.00 -0.75 0.00 0.00 64.21 63.82 1a2v n SER 333 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 1a2v n LEU 334 N -1.44 -0.75 0.25 2.46 0.00 -1.26 -2.61 117.00 113.65 1a2v n LEU 334 Ca 0.00 1.45 0.15 0.00 0.00 0.00 0.00 56.01 57.61 1a2v n LEU 334 Cb 0.00 -0.24 0.81 0.00 0.00 0.00 0.00 43.42 43.99 1a2v n LEU 334 CO 0.00 -1.22 0.99 1.23 0.00 0.00 0.00 177.39 178.39 1a2v h GLY 335 N 0.00 0.00 -0.52 -3.96 0.00 -1.85 -3.45 103.07 93.30 1a2v h GLY 335 Ca 0.19 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.48 1a2v h GLY 335 CO -0.79 0.00 -0.05 0.00 0.00 0.00 0.00 176.54 175.71 1a2v h ASP 337 N -0.05 -0.17 -3.59 0.00 5.19 -1.78 -3.40 116.42 112.62 1a2v h ASP 337 Ca -0.04 -0.15 -0.70 0.00 -0.62 0.00 0.00 57.03 55.52 1a2v h ASP 337 Cb 1.03 0.04 -0.23 0.00 0.18 0.00 0.00 39.33 40.36 1a2v h ASP 337 CO 0.05 0.05 -0.49 0.00 -3.12 0.00 0.00 179.24 175.72 1a2v s LYS 339 N 1.61 4.35 0.00 0.00 2.20 -1.26 -4.88 119.74 121.76 1a2v s LYS 339 Ca 0.04 0.69 0.00 0.00 -0.36 0.00 0.00 55.97 56.34 1a2v s LYS 339 Cb -0.19 -3.39 0.00 0.00 -1.51 0.00 0.00 37.83 32.74 1a2v s LYS 339 CO 0.08 0.24 0.00 0.41 -0.36 0.00 0.00 175.35 175.72 1a2v n GLY 340 N 2.82 -0.32 3.55 5.54 0.00 -1.26 -4.89 105.19 110.63 1a2v n GLY 340 Ca -0.06 -2.20 -0.41 0.00 0.00 0.00 0.00 46.02 43.36 1a2v n GLY 340 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1a2v s VAL 341 N 0.00 3.83 0.21 1.61 1.01 -1.26 -5.00 120.40 120.80 1a2v s VAL 341 Ca 0.00 -0.11 -0.02 0.00 0.00 0.00 0.00 61.98 61.85 1a2v s VAL 341 Cb 0.00 -4.97 -0.05 0.00 0.00 0.00 0.00 36.38 31.36 1a2v s VAL 341 CO 0.00 -1.88 0.42 -0.63 0.00 0.00 0.00 175.10 173.01 1a2v s ILE 342 N 5.36 5.17 -0.16 2.22 -1.09 -1.26 -4.69 121.20 126.74 1a2v s ILE 342 Ca 0.39 -0.23 -0.01 0.00 -2.23 0.00 0.00 60.65 58.57 1a2v s ILE 342 Cb -0.05 -3.71 0.04 0.00 -1.58 0.00 0.00 42.46 37.16 1a2v s ILE 342 CO 0.04 -0.16 -0.03 -2.28 -1.23 0.00 0.00 174.94 171.28 1a2v s HIS 343 N -1.87 1.47 0.47 3.97 5.65 -0.49 -4.97 115.29 119.51 1a2v s HIS 343 Ca 0.40 -0.95 0.03 0.00 0.25 0.00 0.00 55.06 54.79 1a2v s HIS 343 Cb -0.11 -1.20 0.01 0.00 -1.18 0.00 0.00 32.58 30.10 1a2v s HIS 343 CO 0.28 -0.59 0.67 0.71 -0.65 0.00 0.00 174.74 175.16 1a2v s TYR 344 N 1.71 2.98 0.02 3.88 2.02 -1.26 -0.61 117.35 126.10 1a2v s TYR 344 Ca 0.01 -0.05 0.00 0.00 -0.37 0.00 0.00 57.07 56.66 1a2v s TYR 344 Cb -0.15 -2.46 -0.02 0.00 -0.40 0.00 0.00 41.96 38.93 1a2v s TYR 344 CO -0.07 -0.53 -0.03 -0.51 -1.57 0.00 0.00 175.55 172.84 1a2v s LEU 345 N -4.55 2.22 0.28 -1.29 1.43 -0.44 -4.96 118.68 111.37 1a2v s LEU 345 Ca 0.53 -0.46 0.07 0.00 -1.03 0.00 0.00 54.13 53.24 1a2v s LEU 345 Cb -0.10 0.08 -0.03 0.00 0.03 0.00 0.00 46.19 46.16 1a2v s LEU 345 CO 0.36 -0.27 0.22 -1.81 0.23 0.00 0.00 176.35 175.09 1a2v s ASP 346 N -1.33 5.44 0.01 2.29 1.01 -1.26 -0.18 116.67 122.64 1a2v s ASP 346 Ca -0.14 -0.33 0.08 0.00 0.71 0.00 0.00 52.55 52.86 1a2v s ASP 346 Cb -0.09 -1.27 -0.02 0.00 1.01 0.00 0.00 42.92 42.55 1a2v s ASP 346 CO -0.01 -0.13 -0.23 0.00 0.21 0.00 0.00 175.17 175.01 1a2v s ALA 347 N -2.19 1.96 -0.10 5.23 0.00 -0.20 -4.85 121.76 121.61 1a2v s ALA 347 Ca 0.35 -1.07 0.02 0.00 0.00 0.00 0.00 51.96 51.26 1a2v s ALA 347 Cb -0.07 -0.45 0.01 0.00 0.00 0.00 0.00 23.12 22.61 1a2v s ALA 347 CO 0.25 0.47 -0.16 -1.01 0.00 0.00 0.00 175.76 175.31 1a2v s HIS 348 N -0.67 1.92 0.00 0.00 3.76 -1.26 -0.99 115.29 118.05 1a2v s HIS 348 Ca 0.09 -0.84 0.00 0.00 -0.15 0.00 0.00 55.06 54.16 1a2v s HIS 348 Cb -0.09 -1.37 0.00 0.00 1.11 0.00 0.00 32.58 32.23 1a2v s HIS 348 CO 0.00 -0.42 0.00 1.19 -0.85 0.00 0.00 174.74 174.67 1a2v n PHE 349 N 4.02 0.00 -4.56 1.40 3.72 -0.10 -4.92 117.46 117.02 1a2v n PHE 349 Ca -0.20 0.00 -0.25 0.00 -0.05 0.00 0.00 57.45 56.95 1a2v n PHE 349 Cb 0.52 0.00 -0.14 0.00 -0.94 0.00 0.00 39.48 38.92 1a2v n PHE 349 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1a2v s SER 350 N -0.31 2.44 0.63 4.37 0.15 -1.26 -0.52 113.70 119.20 1a2v s SER 350 Ca 0.00 -0.55 0.04 0.00 0.70 0.00 0.00 55.95 56.14 1a2v s SER 350 Cb 0.00 -0.19 0.10 0.00 -1.71 0.00 0.00 66.02 64.22 1a2v s SER 350 CO 0.00 0.13 0.87 1.51 1.20 0.00 0.00 173.24 176.96 1a2v s ASP 351 N -1.31 4.79 0.45 5.45 1.47 0.07 -4.81 116.67 122.77 1a2v s ASP 351 Ca 0.07 -0.53 0.24 0.00 1.18 0.00 0.00 52.55 53.51 1a2v s ASP 351 Cb -0.09 0.01 1.26 0.00 -0.34 0.00 0.00 42.92 43.75 1a2v s ASP 351 CO 0.02 -1.54 1.80 -0.09 0.68 0.00 0.00 175.17 176.04 1a2v h ARG 352 N -0.13 0.24 -0.00 2.11 2.43 -1.89 -0.30 114.38 116.84 1a2v h ARG 352 Ca -0.34 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.81 1a2v h ARG 352 Cb 1.28 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.77 1a2v h ARG 352 CO 0.41 0.16 -0.06 0.00 -1.51 0.00 0.00 179.97 178.97 1a2v n ALA 353 N -2.58 2.57 -0.27 2.80 0.00 -1.26 -0.82 120.51 120.96 1a2v n ALA 353 Ca 0.24 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.51 1a2v n ALA 353 Cb 0.97 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.99 1a2v n ALA 353 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1a2v n GLY 354 N 1.38 0.81 3.79 0.00 0.00 -0.12 -4.93 105.19 106.12 1a2v n GLY 354 Ca 0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.75 1a2v n GLY 354 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1a2v s ASP 355 N -2.25 6.63 0.51 1.61 1.01 -1.26 -4.50 116.67 118.42 1a2v s ASP 355 Ca 0.00 0.74 -0.23 0.00 0.71 0.00 0.00 52.55 53.78 1a2v s ASP 355 Cb 0.00 -2.22 -0.07 0.00 1.01 0.00 0.00 42.92 41.65 1a2v s ASP 355 CO 0.00 0.21 1.26 -2.65 0.21 0.00 0.00 175.17 174.20 1a2v n PRO 356 N 2.70 1.64 -4.45 8.23 -0.02 -1.26 -0.75 135.00 141.09 1a2v n PRO 356 Ca -0.13 0.60 -0.22 0.00 -2.02 0.00 0.00 63.50 61.73 1a2v n PRO 356 Cb 0.52 -2.44 -0.14 0.00 -0.02 0.00 0.00 33.50 31.43 1a2v n PRO 356 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 1a2v s ILE 357 N -1.29 1.30 -0.01 4.25 -4.36 0.32 -4.76 121.20 116.66 1a2v s ILE 357 Ca 0.68 -1.07 0.06 0.00 -0.26 0.00 0.00 60.65 60.07 1a2v s ILE 357 Cb -0.45 -1.16 -0.02 0.00 1.25 0.00 0.00 42.46 42.08 1a2v s ILE 357 CO 0.52 0.07 -0.20 -0.89 0.24 0.00 0.00 174.94 174.68 1a2v s THR 358 N -0.83 1.56 -0.24 8.37 2.01 -1.26 -0.92 115.64 124.32 1a2v s THR 358 Ca 0.04 -0.88 0.01 0.00 0.31 0.00 0.00 61.69 61.17 1a2v s THR 358 Cb -0.08 -1.30 0.06 0.00 0.01 0.00 0.00 72.50 71.19 1a2v s THR 358 CO 0.01 0.41 -0.07 0.54 -0.69 0.00 0.00 174.62 174.82 1a2v s VAL 359 N -0.50 1.72 0.36 3.82 0.11 -0.16 -4.98 120.40 120.77 1a2v s VAL 359 Ca 0.07 -1.31 -0.26 0.00 -2.93 0.00 0.00 61.98 57.56 1a2v s VAL 359 Cb -0.08 -1.92 -0.09 0.00 -1.53 0.00 0.00 36.38 32.77 1a2v s VAL 359 CO -0.00 -0.05 1.08 -0.54 -3.33 0.00 0.00 175.10 172.26 1a2v s LYS 360 N 1.32 4.30 -1.18 1.54 1.02 -1.26 -1.04 119.74 124.43 1a2v s LYS 360 Ca -0.06 1.64 -0.13 0.00 0.02 0.00 0.00 55.97 57.45 1a2v s LYS 360 Cb -0.19 -2.76 -0.02 0.00 -0.52 0.00 0.00 37.83 34.34 1a2v s LYS 360 CO -0.06 -0.05 0.76 0.09 -0.92 0.00 0.00 175.35 175.16 1a2v n ASN 361 N 0.34 -4.19 0.04 2.83 5.03 -1.10 -4.05 115.26 114.17 1a2v n ASN 361 Ca 0.03 -0.94 -0.08 0.00 0.87 0.00 0.00 54.58 54.46 1a2v n ASN 361 Cb 0.48 -3.74 -0.13 0.00 -1.02 0.00 0.00 39.78 35.37 1a2v n ASN 361 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1a2v h ALA 362 N 0.70 0.44 -4.37 5.41 0.00 -0.68 1.37 119.26 122.13 1a2v h ALA 362 Ca -0.64 -1.05 -0.62 0.00 0.00 0.00 0.00 54.91 52.59 1a2v h ALA 362 Cb 1.35 0.03 -0.29 0.00 0.00 0.00 0.00 17.79 18.88 1a2v h ALA 362 CO 0.51 1.31 -0.86 0.08 0.00 0.00 0.00 179.25 180.29 1a2v s VAL 363 N -2.68 1.75 -0.08 0.00 1.01 -1.06 -4.51 120.40 114.84 1a2v s VAL 363 Ca -0.01 -1.03 0.02 0.00 0.00 0.00 0.00 61.98 60.96 1a2v s VAL 363 Cb 0.09 -1.47 0.01 0.00 0.00 0.00 0.00 36.38 35.02 1a2v s VAL 363 CO 0.83 0.42 -0.13 0.00 0.00 0.00 0.00 175.10 176.21 1a2v s ILE 365 N 0.80 2.94 -0.12 0.00 1.01 0.22 -1.01 121.20 125.05 1a2v s ILE 365 Ca -0.12 -0.76 -0.33 0.00 0.00 0.00 0.00 60.65 59.45 1a2v s ILE 365 Cb -0.15 -2.15 0.13 0.00 0.01 0.00 0.00 42.46 40.29 1a2v s ILE 365 CO 0.02 0.58 1.25 -1.38 0.00 0.00 0.00 174.94 175.41 1a2v s HIS 366 N -0.50 -0.09 -0.02 3.97 -3.43 -0.86 -1.40 115.29 112.97 1a2v s HIS 366 Ca 0.07 0.01 0.06 0.00 -0.80 0.00 0.00 55.06 54.40 1a2v s HIS 366 Cb -0.12 0.53 -0.03 0.00 -1.43 0.00 0.00 32.58 31.54 1a2v s HIS 366 CO 0.01 -0.23 -0.19 -1.83 -2.00 0.00 0.00 174.74 170.50 1a2v s GLU 367 N -2.41 2.25 0.30 -0.38 -1.05 -1.26 -0.37 118.70 115.79 1a2v s GLU 367 Ca 0.12 -0.85 0.03 0.00 -0.15 0.00 0.00 54.97 54.12 1a2v s GLU 367 Cb 0.02 -2.21 -0.06 0.00 -0.44 0.00 0.00 34.13 31.44 1a2v s GLU 367 CO -0.04 0.58 0.06 -1.21 0.95 0.00 0.00 175.26 175.60 1a2v s GLU 368 N -0.86 1.58 0.34 -4.83 2.02 -0.25 -4.94 118.70 111.75 1a2v s GLU 368 Ca 0.12 -1.87 -0.26 0.00 0.02 0.00 0.00 54.97 52.98 1a2v s GLU 368 Cb -0.10 -0.72 -0.09 0.00 0.10 0.00 0.00 34.13 33.31 1a2v s GLU 368 CO 0.01 -0.20 1.03 -0.51 0.02 0.00 0.00 175.26 175.61 1a2v s ASP 369 N -3.44 7.08 -0.25 -0.19 1.01 -1.26 -0.70 116.67 118.92 1a2v s ASP 369 Ca 0.36 2.05 0.19 0.00 0.71 0.00 0.00 52.55 55.86 1a2v s ASP 369 Cb 0.08 -2.60 0.49 0.00 1.01 0.00 0.00 42.92 41.91 1a2v s ASP 369 CO 0.15 -0.26 1.14 -0.67 0.21 0.00 0.00 175.17 175.73 1a2v n ASP 370 N 0.51 2.36 0.00 0.27 2.03 0.13 -4.77 116.55 117.09 1a2v n ASP 370 Ca 0.02 -2.48 0.00 0.00 0.52 0.00 0.00 54.79 52.85 1a2v n ASP 370 Cb 0.48 -0.44 0.00 0.00 -0.72 0.00 0.00 41.12 40.45 1a2v n ASP 370 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1a2v n GLY 371 N -0.57 1.12 3.80 0.27 0.00 -1.25 -4.57 105.19 103.98 1a2v n GLY 371 Ca 0.16 -0.71 -0.37 0.00 0.00 0.00 0.00 46.02 45.10 1a2v n GLY 371 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1a2v s LEU 372 N 0.00 4.39 -0.18 0.99 1.43 -1.26 0.68 118.68 124.73 1a2v s LEU 372 Ca 0.00 1.60 0.05 0.00 -1.03 0.00 0.00 54.13 54.75 1a2v s LEU 372 Cb 0.00 -3.68 -0.22 0.00 0.03 0.00 0.00 46.19 42.32 1a2v s LEU 372 CO 0.00 0.03 0.11 -0.11 0.23 0.00 0.00 176.35 176.61 1a2v n LEU 373 N 0.82 1.98 -3.63 1.79 7.94 0.67 -4.48 117.00 122.09 1a2v n LEU 373 Ca -0.01 0.06 -0.03 0.00 -1.11 0.00 0.00 56.01 54.92 1a2v n LEU 373 Cb 0.50 -0.52 -0.02 0.00 0.53 0.00 0.00 43.42 43.91 1a2v n LEU 373 CO 0.44 0.75 1.13 0.72 -1.11 0.00 0.00 177.39 179.33 1a2v s PHE 374 N -2.53 -0.05 -0.07 1.96 -0.12 -1.08 -5.00 117.98 111.09 1a2v s PHE 374 Ca -0.22 0.03 -0.30 0.00 -0.05 0.00 0.00 56.93 56.39 1a2v s PHE 374 Cb 0.08 0.50 0.08 0.00 -0.63 0.00 0.00 43.02 43.05 1a2v s PHE 374 CO 0.72 -0.07 0.76 0.21 -0.05 0.00 0.00 175.22 176.80 1a2v s LYS 375 N -2.02 0.95 -0.28 1.99 2.20 -1.26 -1.92 119.74 119.39 1a2v s LYS 375 Ca 0.11 0.19 -0.17 0.00 -0.36 0.00 0.00 55.97 55.74 1a2v s LYS 375 Cb -0.01 0.45 0.09 0.00 -1.51 0.00 0.00 37.83 36.84 1a2v s LYS 375 CO -0.03 -0.30 0.73 -1.58 -0.36 0.00 0.00 175.35 173.80 1a2v s HIS 376 N -1.32 -0.98 0.08 4.03 2.46 -0.91 -5.02 115.29 113.64 1a2v s HIS 376 Ca -0.08 1.99 0.07 0.00 0.47 0.00 0.00 55.06 57.51 1a2v s HIS 376 Cb -0.00 0.57 -0.03 0.00 -0.13 0.00 0.00 32.58 32.99 1a2v s HIS 376 CO 0.07 -0.48 -0.19 -1.12 -2.47 0.00 0.00 174.74 170.54 1a2v s SER 377 N 1.49 2.25 -0.13 9.88 0.01 -1.26 -2.20 113.70 123.74 1a2v s SER 377 Ca -0.09 -0.61 -0.19 0.00 1.31 0.00 0.00 55.95 56.37 1a2v s SER 377 Cb -0.05 -0.13 -0.04 0.00 0.21 0.00 0.00 66.02 66.01 1a2v s SER 377 CO -0.18 0.05 0.50 -0.62 0.41 0.00 0.00 173.24 173.41 1a2v s ASP 378 N -1.63 6.68 0.31 2.44 -1.08 -0.39 -4.90 116.67 118.10 1a2v s ASP 378 Ca 0.04 0.82 0.26 0.00 -0.52 0.00 0.00 52.55 53.15 1a2v s ASP 378 Cb -0.09 -2.30 0.92 0.00 -1.46 0.00 0.00 42.92 39.99 1a2v s ASP 378 CO 0.03 -0.05 1.77 2.19 0.52 0.00 0.00 175.17 179.63 1a2v h PHE 379 N 6.88 0.00 -0.98 -5.34 -5.15 -1.95 0.57 116.94 110.98 1a2v h PHE 379 Ca -0.39 0.00 0.01 0.00 -0.20 0.00 0.00 57.97 57.38 1a2v h PHE 379 Cb 1.17 0.00 -0.05 0.00 0.22 0.00 0.00 35.95 37.30 1a2v h PHE 379 CO 0.64 0.00 0.64 0.00 -2.00 0.00 0.00 178.31 177.58 1a2v h ARG 380 N 0.00 1.30 -0.80 6.09 3.08 -1.97 -2.58 114.38 119.49 1a2v h ARG 380 Ca 0.00 -0.09 -0.56 0.00 0.07 0.00 0.00 59.98 59.40 1a2v h ARG 380 Cb 0.58 -0.29 -0.35 0.00 0.08 0.00 0.00 29.97 30.00 1a2v h ARG 380 CO 0.00 0.87 -0.14 -0.40 -1.07 0.00 0.00 179.97 179.23 1a2v n ASP 381 N -4.38 5.66 -3.99 7.04 5.68 -1.24 -4.92 116.55 120.42 1a2v n ASP 381 Ca 0.11 -3.77 -0.30 0.00 -0.50 0.00 0.00 54.79 50.34 1a2v n ASP 381 Cb 0.02 -0.60 -0.00 0.00 -1.14 0.00 0.00 41.12 39.40 1a2v n ASP 381 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 1a2v n ASN 382 N -0.83 -2.72 0.00 -1.12 4.05 -0.97 -1.50 115.26 112.16 1a2v n ASN 382 Ca 0.50 -0.91 0.00 0.00 0.45 0.00 0.00 54.58 54.62 1a2v n ASN 382 Cb 0.87 -3.36 0.00 0.00 1.23 0.00 0.00 39.78 38.52 1a2v n ASN 382 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 177.26 174.70 1a2v n PHE 383 N -4.47 0.00 -0.21 1.20 3.72 0.19 -4.88 117.46 113.01 1a2v n PHE 383 Ca -0.08 0.00 -0.06 0.00 -0.05 0.00 0.00 57.45 57.25 1a2v n PHE 383 Cb 0.58 -0.77 0.03 0.00 -0.94 0.00 0.00 39.48 38.38 1a2v n PHE 383 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1a2v h ALA 384 N 0.00 0.76 -1.93 4.37 0.00 -1.46 -3.35 119.26 117.65 1a2v h ALA 384 Ca 0.00 -0.08 -0.57 0.00 0.00 0.00 0.00 54.91 54.27 1a2v h ALA 384 Cb 0.38 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 1a2v h ALA 384 CO 0.00 0.25 1.07 0.99 0.00 0.00 0.00 179.25 181.56 1a2v s THR 385 N -5.97 3.89 0.01 0.00 2.01 -1.26 -4.59 115.64 109.72 1a2v s THR 385 Ca -0.13 0.97 -0.28 0.00 0.31 0.00 0.00 61.69 62.56 1a2v s THR 385 Cb 0.13 -3.99 0.08 0.00 0.01 0.00 0.00 72.50 68.73 1a2v s THR 385 CO 0.77 -0.49 0.69 -0.55 -0.69 0.00 0.00 174.62 174.35 1a2v s SER 386 N 3.80 -0.59 -0.06 3.53 0.15 -0.32 -1.27 113.70 118.94 1a2v s SER 386 Ca 0.64 0.44 -0.02 0.00 0.70 0.00 0.00 55.95 57.70 1a2v s SER 386 Cb -0.19 0.53 0.04 0.00 -1.71 0.00 0.00 66.02 64.69 1a2v s SER 386 CO 0.28 -0.70 0.13 -0.22 1.20 0.00 0.00 173.24 173.93 1a2v s LEU 387 N -1.73 0.62 -0.06 3.45 0.20 -0.94 0.23 118.68 120.46 1a2v s LEU 387 Ca -0.06 0.26 0.01 0.00 0.69 0.00 0.00 54.13 55.03 1a2v s LEU 387 Cb -0.00 0.26 0.02 0.00 -0.43 0.00 0.00 46.19 46.04 1a2v s LEU 387 CO 0.01 -0.16 -0.07 -0.69 -0.29 0.00 0.00 176.35 175.15 1a2v s VAL 388 N 1.37 0.78 -0.11 1.68 1.01 -0.25 -2.13 120.40 122.75 1a2v s VAL 388 Ca -0.07 -0.23 0.01 0.00 0.00 0.00 0.00 61.98 61.69 1a2v s VAL 388 Cb -0.12 -0.78 0.02 0.00 0.00 0.00 0.00 36.38 35.50 1a2v s VAL 388 CO -0.05 0.29 -0.14 -0.89 0.00 0.00 0.00 175.10 174.31 1a2v s THR 389 N 1.07 1.43 0.52 3.92 2.01 -0.81 0.15 115.64 123.93 1a2v s THR 389 Ca -0.08 -0.59 -0.08 0.00 0.31 0.00 0.00 61.69 61.25 1a2v s THR 389 Cb -0.14 -1.33 -0.04 0.00 0.01 0.00 0.00 72.50 71.00 1a2v s THR 389 CO -0.01 0.43 0.86 -0.13 -0.69 0.00 0.00 174.62 175.08 1a2v s ARG 390 N 1.12 3.59 0.04 4.92 0.52 -1.26 -0.24 118.95 127.64 1a2v s ARG 390 Ca -0.04 0.40 0.04 0.00 -0.52 0.00 0.00 55.73 55.61 1a2v s ARG 390 Cb -0.14 -2.29 -0.04 0.00 0.52 0.00 0.00 34.95 33.01 1a2v s ARG 390 CO -0.03 -0.30 -0.05 0.00 0.02 0.00 0.00 175.30 174.93 1a2v s ALA 391 N -2.84 3.09 0.01 2.13 0.00 0.21 -4.44 121.76 119.92 1a2v s ALA 391 Ca 0.50 -1.07 0.03 0.00 0.00 0.00 0.00 51.96 51.42 1a2v s ALA 391 Cb -0.10 -1.13 -0.01 0.00 0.00 0.00 0.00 23.12 21.88 1a2v s ALA 391 CO 0.46 0.64 -0.10 -0.08 0.00 0.00 0.00 175.76 176.68 1a2v s THR 392 N -1.10 0.76 0.12 0.00 -1.32 -1.26 0.22 115.64 113.05 1a2v s THR 392 Ca 0.20 -0.55 0.11 0.00 -1.21 0.00 0.00 61.69 60.23 1a2v s THR 392 Cb -0.11 -0.66 -0.04 0.00 -1.51 0.00 0.00 72.50 70.18 1a2v s THR 392 CO 0.11 0.11 -0.27 -1.59 -2.21 0.00 0.00 174.62 170.78 1a2v s LYS 393 N -0.49 1.41 -0.19 7.08 -2.85 0.12 -4.16 119.74 120.66 1a2v s LYS 393 Ca 0.02 -1.32 -0.12 0.00 -1.00 0.00 0.00 55.97 53.55 1a2v s LYS 393 Cb -0.05 -1.87 -0.05 0.00 -2.06 0.00 0.00 37.83 33.80 1a2v s LYS 393 CO -0.00 0.45 0.22 -1.17 0.10 0.00 0.00 175.35 174.95 1a2v s LEU 394 N -1.99 4.21 -0.16 2.77 0.20 -0.48 -1.09 118.68 122.13 1a2v s LEU 394 Ca 0.13 0.35 0.01 0.00 0.69 0.00 0.00 54.13 55.31 1a2v s LEU 394 Cb -0.10 -2.25 0.02 0.00 -0.43 0.00 0.00 46.19 43.43 1a2v s LEU 394 CO 0.06 0.11 -0.17 -0.69 -0.29 0.00 0.00 176.35 175.37 1a2v s VAL 395 N 0.58 1.80 -0.32 1.68 1.01 0.50 -0.62 120.40 125.03 1a2v s VAL 395 Ca 0.12 -0.77 -0.05 0.00 0.00 0.00 0.00 61.98 61.28 1a2v s VAL 395 Cb -0.12 -1.65 0.04 0.00 0.00 0.00 0.00 36.38 34.64 1a2v s VAL 395 CO 0.02 0.50 0.07 -0.69 0.00 0.00 0.00 175.10 175.00 1a2v s VAL 396 N 1.39 3.56 0.30 2.92 1.01 -0.09 -2.02 120.40 127.47 1a2v s VAL 396 Ca 0.05 -1.17 0.08 0.00 0.00 0.00 0.00 61.98 60.94 1a2v s VAL 396 Cb -0.13 -3.00 -0.06 0.00 0.00 0.00 0.00 36.38 33.19 1a2v s VAL 396 CO -0.12 -0.13 -0.07 -0.55 0.00 0.00 0.00 175.10 174.23 1a2v s SER 397 N 1.37 3.13 0.02 3.32 0.15 -0.18 -0.91 113.70 120.60 1a2v s SER 397 Ca -0.02 -1.19 -0.21 0.00 0.70 0.00 0.00 55.95 55.23 1a2v s SER 397 Cb -0.19 -0.24 0.04 0.00 -1.71 0.00 0.00 66.02 63.92 1a2v s SER 397 CO 0.02 -0.29 0.47 0.00 1.20 0.00 0.00 173.24 174.64 1a2v s GLN 398 N -3.68 0.93 -0.09 5.44 -2.07 -0.86 -1.33 119.66 118.00 1a2v s GLN 398 Ca 0.31 -0.20 -0.02 0.00 -1.82 0.00 0.00 55.36 53.63 1a2v s GLN 398 Cb 0.03 0.42 0.04 0.00 -1.09 0.00 0.00 33.01 32.41 1a2v s GLN 398 CO 0.14 -0.31 0.04 0.42 -1.32 0.00 0.00 175.29 174.25 1a2v s ILE 399 N -2.07 0.18 0.18 3.63 1.01 -1.26 -0.62 121.20 122.24 1a2v s ILE 399 Ca -0.08 0.10 0.09 0.00 0.00 0.00 0.00 60.65 60.76 1a2v s ILE 399 Cb -0.01 -0.48 -0.04 0.00 0.01 0.00 0.00 42.46 41.94 1a2v s ILE 399 CO 0.01 0.10 -0.11 0.72 0.00 0.00 0.00 174.94 175.67 1a2v s PHE 400 N 2.04 2.61 -0.18 3.97 -0.12 -0.67 0.05 117.98 125.69 1a2v s PHE 400 Ca 0.04 -0.23 -0.02 0.00 -0.05 0.00 0.00 56.93 56.67 1a2v s PHE 400 Cb -0.13 -1.29 -0.01 0.00 -0.63 0.00 0.00 43.02 40.96 1a2v s PHE 400 CO -0.05 0.50 -0.08 0.99 -0.05 0.00 0.00 175.22 176.53 1a2v s THR 401 N -1.66 3.24 -0.75 -4.49 2.01 -0.42 -1.36 115.64 112.21 1a2v s THR 401 Ca 0.24 -0.56 0.01 0.00 0.31 0.00 0.00 61.69 61.69 1a2v s THR 401 Cb -0.09 -2.43 0.18 0.00 0.01 0.00 0.00 72.50 70.18 1a2v s THR 401 CO 0.15 0.47 0.57 0.00 -0.69 0.00 0.00 174.62 175.12 1a2v s ALA 402 N 1.00 3.90 0.00 7.40 0.00 -1.26 -4.79 121.76 128.01 1a2v s ALA 402 Ca -0.00 -3.68 0.00 0.00 0.00 0.00 0.00 51.96 48.27 1a2v s ALA 402 Cb -0.15 -2.52 0.00 0.00 0.00 0.00 0.00 23.12 20.45 1a2v s ALA 402 CO -0.01 -2.11 0.00 0.00 0.00 0.00 0.00 175.76 173.64 1a2v n ALA 403 N 2.50 0.00 0.99 0.00 0.00 -1.26 -4.83 120.51 117.91 1a2v n ALA 403 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.61 1a2v n ALA 403 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.81 1a2v n ALA 403 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1a2v n ASN 404 N 9.06 0.43 -3.66 0.00 6.94 -1.26 -4.97 115.26 121.80 1a2v n ASN 404 Ca 0.00 -1.42 -0.14 0.00 -0.02 0.00 0.00 54.58 53.00 1a2v n ASN 404 Cb 0.00 -0.22 -0.08 0.00 -2.36 0.00 0.00 39.78 37.12 1a2v n ASN 404 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 1a2v s GLU 406 N -1.39 0.72 -0.23 -3.83 0.41 -0.43 -0.01 118.70 113.94 1a2v s GLU 406 Ca 0.00 0.79 0.00 0.00 -0.41 0.00 0.00 54.97 55.35 1a2v s GLU 406 Cb 0.00 0.35 0.03 0.00 -1.78 0.00 0.00 34.13 32.73 1a2v s GLU 406 CO 0.00 -0.10 -0.11 0.71 -0.49 0.00 0.00 175.26 175.27 1a2v s TYR 407 N 0.21 3.04 -0.25 1.61 1.51 -0.46 -1.99 117.35 121.02 1a2v s TYR 407 Ca -0.01 -1.77 -0.13 0.00 -1.01 0.00 0.00 57.07 54.16 1a2v s TYR 407 Cb -0.04 -1.99 -0.05 0.00 -0.11 0.00 0.00 41.96 39.78 1a2v s TYR 407 CO 0.01 -0.79 0.25 0.00 -1.11 0.00 0.00 175.55 173.92 1a2v s LEU 409 N 1.47 3.06 -0.26 0.00 1.43 0.21 -1.37 118.68 123.21 1a2v s LEU 409 Ca 0.11 -0.15 -0.02 0.00 -1.03 0.00 0.00 54.13 53.04 1a2v s LEU 409 Cb -0.15 -1.70 0.08 0.00 0.03 0.00 0.00 46.19 44.46 1a2v s LEU 409 CO 0.08 0.23 0.07 -0.31 0.23 0.00 0.00 176.35 176.65 1a2v s TYR 410 N -0.04 1.42 -0.22 0.29 1.51 0.05 -2.04 117.35 118.33 1a2v s TYR 410 Ca -0.00 -1.37 -0.26 0.00 -1.01 0.00 0.00 57.07 54.42 1a2v s TYR 410 Cb -0.14 -1.41 -0.00 0.00 -0.11 0.00 0.00 41.96 40.30 1a2v s TYR 410 CO 0.03 -0.77 0.90 -1.58 -1.11 0.00 0.00 175.55 173.01 1a2v s TRP 411 N 1.72 3.35 -0.14 2.71 0.52 -0.09 -1.70 118.94 125.31 1a2v s TRP 411 Ca 0.05 1.27 0.00 0.00 0.02 0.00 0.00 56.10 57.45 1a2v s TRP 411 Cb -0.17 -3.11 -0.01 0.00 -1.15 0.00 0.00 33.47 29.03 1a2v s TRP 411 CO -0.19 -0.38 -0.15 0.08 0.02 0.00 0.00 176.95 176.33 1a2v s VAL 412 N 2.75 2.74 -0.09 4.03 1.01 0.32 -0.92 120.40 130.25 1a2v s VAL 412 Ca 0.39 -0.76 -0.01 0.00 0.00 0.00 0.00 61.98 61.60 1a2v s VAL 412 Cb -0.16 -2.15 -0.03 0.00 0.00 0.00 0.00 36.38 34.05 1a2v s VAL 412 CO 0.09 0.52 -0.02 -0.36 0.00 0.00 0.00 175.10 175.33 1a2v s PHE 413 N 0.65 3.09 0.18 5.22 0.40 0.21 -0.51 117.98 127.22 1a2v s PHE 413 Ca -0.08 0.11 0.09 0.00 -0.60 0.00 0.00 56.93 56.44 1a2v s PHE 413 Cb -0.16 -1.79 -0.04 0.00 0.51 0.00 0.00 43.02 41.54 1a2v s PHE 413 CO 0.02 0.39 -0.17 -1.64 0.70 0.00 0.00 175.22 174.52 1a2v s MET 414 N -0.74 1.32 0.00 0.44 -1.94 -0.36 -1.39 119.30 116.63 1a2v s MET 414 Ca 0.11 -1.48 0.11 0.00 -1.71 0.00 0.00 55.69 52.72 1a2v s MET 414 Cb -0.11 -1.31 0.67 0.00 2.01 0.00 0.00 34.83 36.09 1a2v s MET 414 CO 0.02 0.25 1.11 1.04 -0.01 0.00 0.00 175.02 177.43 1a2v n GLN 415 N 0.04 0.51 -0.14 2.03 6.02 -1.26 -1.78 117.38 122.80 1a2v n GLN 415 Ca -0.11 0.00 0.08 0.00 -0.01 0.00 0.00 57.00 56.96 1a2v n GLN 415 Cb 0.58 -1.35 0.15 0.00 1.02 0.00 0.00 30.24 30.65 1a2v n GLN 415 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.06 175.65 1a2v n ASP 416 N -0.85 2.91 0.00 1.08 5.75 -1.26 -4.14 116.55 120.04 1a2v n ASP 416 Ca 0.08 -1.85 0.00 0.00 -0.01 0.00 0.00 54.79 53.01 1a2v n ASP 416 Cb 0.04 -0.18 0.00 0.00 -1.03 0.00 0.00 41.12 39.95 1a2v n ASP 416 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1a2v n GLY 417 N 0.99 0.66 3.87 6.12 0.00 -0.74 -4.77 105.19 111.32 1a2v n GLY 417 Ca 0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 1a2v n GLY 417 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a2v s ALA 418 N -2.42 3.33 -0.05 4.61 0.00 -1.24 -4.47 121.76 121.52 1a2v s ALA 418 Ca 0.00 -0.17 0.04 0.00 0.00 0.00 0.00 51.96 51.83 1a2v s ALA 418 Cb 0.00 -2.72 -0.00 0.00 0.00 0.00 0.00 23.12 20.39 1a2v s ALA 418 CO 0.00 -0.00 -0.18 0.42 0.00 0.00 0.00 175.76 175.99 1a2v s ILE 419 N -2.36 1.53 0.05 0.00 1.01 -1.01 -1.22 121.20 119.20 1a2v s ILE 419 Ca 0.52 -0.76 0.04 0.00 0.00 0.00 0.00 60.65 60.45 1a2v s ILE 419 Cb -0.10 -1.32 -0.03 0.00 0.01 0.00 0.00 42.46 41.02 1a2v s ILE 419 CO 0.31 0.44 -0.13 -0.60 0.00 0.00 0.00 174.94 174.96 1a2v s ARG 420 N 0.09 0.80 -0.25 2.79 3.52 0.33 -0.44 118.95 125.79 1a2v s ARG 420 Ca -0.06 -0.84 0.02 0.00 -0.13 0.00 0.00 55.73 54.72 1a2v s ARG 420 Cb -0.13 -0.77 0.05 0.00 -1.56 0.00 0.00 34.95 32.54 1a2v s ARG 420 CO 0.03 0.18 -0.11 -1.17 -0.81 0.00 0.00 175.30 173.42 1a2v s LEU 421 N -1.47 3.26 -0.09 -0.88 0.20 -0.61 -0.52 118.68 118.57 1a2v s LEU 421 Ca -0.02 -1.21 -0.02 0.00 0.69 0.00 0.00 54.13 53.58 1a2v s LEU 421 Cb -0.09 -1.57 -0.03 0.00 -0.43 0.00 0.00 46.19 44.07 1a2v s LEU 421 CO 0.02 -0.16 -0.02 -1.81 -0.29 0.00 0.00 176.35 174.09 1a2v s ASP 422 N 1.17 5.05 0.05 3.68 1.01 -0.69 -2.54 116.67 124.41 1a2v s ASP 422 Ca -0.05 0.07 0.06 0.00 0.71 0.00 0.00 52.55 53.33 1a2v s ASP 422 Cb -0.18 -1.45 -0.02 0.00 1.01 0.00 0.00 42.92 42.28 1a2v s ASP 422 CO -0.06 0.35 -0.16 -0.63 0.21 0.00 0.00 175.17 174.88 1a2v s ILE 423 N -0.69 1.25 -0.05 0.77 1.01 0.51 -0.77 121.20 123.23 1a2v s ILE 423 Ca 0.11 -1.10 0.00 0.00 0.00 0.00 0.00 60.65 59.66 1a2v s ILE 423 Cb -0.12 -1.13 0.02 0.00 0.01 0.00 0.00 42.46 41.25 1a2v s ILE 423 CO 0.02 0.01 -0.03 -0.13 0.00 0.00 0.00 174.94 174.82 1a2v s ARG 424 N -1.26 0.73 -0.18 2.79 0.52 -0.47 -0.72 118.95 120.36 1a2v s ARG 424 Ca 0.03 -0.02 -0.09 0.00 -0.52 0.00 0.00 55.73 55.12 1a2v s ARG 424 Cb -0.08 -0.87 -0.05 0.00 0.52 0.00 0.00 34.95 34.47 1a2v s ARG 424 CO 0.02 -0.16 0.11 -0.51 0.02 0.00 0.00 175.30 174.77 1a2v s LEU 425 N 1.28 4.09 0.00 2.53 1.43 0.15 -1.28 118.68 126.89 1a2v s LEU 425 Ca -0.05 0.20 0.00 0.00 -1.03 0.00 0.00 54.13 53.25 1a2v s LEU 425 Cb -0.14 -2.04 0.00 0.00 0.03 0.00 0.00 46.19 44.04 1a2v s LEU 425 CO -0.02 0.20 0.00 1.07 0.23 0.00 0.00 176.35 177.83 1a2v n THR 426 N 3.36 0.00 0.00 5.49 5.66 -0.84 -0.30 114.28 127.64 1a2v n THR 426 Ca -0.17 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.83 1a2v n THR 426 Cb 0.52 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.30 1a2v n THR 426 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1a2v n GLY 427 N 0.00 0.13 3.25 1.09 0.00 -1.25 -1.31 105.19 107.10 1a2v n GLY 427 Ca 0.00 -1.84 -0.27 0.00 0.00 0.00 0.00 46.02 43.91 1a2v n GLY 427 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1a2v s ILE 428 N 0.00 1.73 0.44 -0.61 1.01 0.99 -1.06 121.20 123.70 1a2v s ILE 428 Ca 0.00 -1.10 -0.26 0.00 0.00 0.00 0.00 60.65 59.29 1a2v s ILE 428 Cb 0.00 -1.47 -0.09 0.00 0.01 0.00 0.00 42.46 40.91 1a2v s ILE 428 CO 0.00 0.34 1.45 -0.76 0.00 0.00 0.00 174.94 175.97 1a2v s LEU 429 N -0.91 4.14 0.10 2.97 1.43 -1.26 -4.71 118.68 120.44 1a2v s LEU 429 Ca 0.08 2.97 -0.30 0.00 -1.03 0.00 0.00 54.13 55.85 1a2v s LEU 429 Cb -0.09 -3.89 -0.06 0.00 0.03 0.00 0.00 46.19 42.18 1a2v s LEU 429 CO 0.01 -1.16 1.09 0.21 0.23 0.00 0.00 176.35 176.73 1a2v s ASN 430 N -0.42 7.26 0.09 2.29 3.84 -1.26 -5.01 114.94 121.73 1a2v s ASN 430 Ca 0.60 1.94 0.06 0.00 0.21 0.00 0.00 52.86 55.67 1a2v s ASN 430 Cb -0.45 -2.59 -0.03 0.00 -0.55 0.00 0.00 41.25 37.63 1a2v s ASN 430 CO 0.58 -0.28 -0.15 0.42 -2.79 0.00 0.00 177.10 174.88 1a2v s THR 431 N 0.45 1.25 0.19 -5.21 -4.23 -1.26 -4.21 115.64 102.61 1a2v s THR 431 Ca 0.52 -1.44 0.07 0.00 -1.18 0.00 0.00 61.69 59.66 1a2v s THR 431 Cb -0.27 -1.25 -0.05 0.00 1.34 0.00 0.00 72.50 72.27 1a2v s THR 431 CO 0.31 -0.25 -0.14 -0.47 -0.54 0.00 0.00 174.62 173.53 1a2v s TYR 432 N -1.48 1.62 0.48 3.99 5.04 -0.18 -4.85 117.35 121.97 1a2v s TYR 432 Ca 0.02 -0.61 -0.22 0.00 -2.44 0.00 0.00 57.07 53.82 1a2v s TYR 432 Cb -0.09 -0.76 -0.07 0.00 0.35 0.00 0.00 41.96 41.39 1a2v s TYR 432 CO 0.03 0.30 1.18 -1.50 -1.34 0.00 0.00 175.55 174.22 1a2v s ILE 433 N -3.01 3.00 -0.06 3.14 2.07 -1.26 -0.91 121.20 124.16 1a2v s ILE 433 Ca 0.21 0.73 0.02 0.00 -1.41 0.00 0.00 60.65 60.20 1a2v s ILE 433 Cb -0.00 -3.36 0.01 0.00 0.13 0.00 0.00 42.46 39.24 1a2v s ILE 433 CO 0.06 -0.03 -0.11 -0.22 -1.91 0.00 0.00 174.94 172.73 1a2v s LEU 434 N -3.18 1.60 0.79 8.50 2.96 -0.34 -4.68 118.68 124.32 1a2v s LEU 434 Ca 0.66 -0.27 -0.13 0.00 -0.22 0.00 0.00 54.13 54.16 1a2v s LEU 434 Cb -0.29 -0.77 0.07 0.00 0.50 0.00 0.00 46.19 45.70 1a2v s LEU 434 CO 0.35 0.02 1.18 -0.83 -1.32 0.00 0.00 176.35 175.75 1a2v s GLY 435 N 0.71 2.11 0.27 7.98 0.00 -1.26 -4.31 107.32 112.82 1a2v s GLY 435 Ca -0.14 0.76 -0.01 0.00 0.00 0.00 0.00 44.72 45.33 1a2v s GLY 435 CO 0.03 1.16 1.85 -0.55 0.00 0.00 0.00 173.10 175.59 1a2v h ASP 436 N -0.82 0.93 -0.17 1.64 5.19 -1.99 -1.39 116.42 119.81 1a2v h ASP 436 Ca -0.46 0.03 -0.07 0.00 -0.62 0.00 0.00 57.03 55.91 1a2v h ASP 436 Cb 1.28 -0.16 -0.04 0.00 0.18 0.00 0.00 39.33 40.60 1a2v h ASP 436 CO 0.47 0.54 -0.20 0.47 -3.12 0.00 0.00 179.24 177.40 1a2v n ASP 437 N -4.60 2.35 -4.83 6.45 8.00 -1.26 -5.00 116.55 117.66 1a2v n ASP 437 Ca 0.17 -3.63 -0.37 0.00 0.71 0.00 0.00 54.79 51.66 1a2v n ASP 437 Cb 0.28 -0.56 -0.06 0.00 -0.02 0.00 0.00 41.12 40.76 1a2v n ASP 437 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1a2v s GLU 438 N -3.14 3.80 -0.12 -1.24 2.12 -0.53 -5.07 118.70 114.53 1a2v s GLU 438 Ca 0.40 0.16 -0.18 0.00 0.36 0.00 0.00 54.97 55.70 1a2v s GLU 438 Cb 0.37 -3.25 -0.04 0.00 0.26 0.00 0.00 34.13 31.47 1a2v s GLU 438 CO -0.01 0.64 0.48 -2.00 -0.54 0.00 0.00 175.26 173.84 1a2v s GLU 439 N -0.78 4.34 0.00 4.30 2.56 -1.26 -4.63 118.70 123.22 1a2v s GLU 439 Ca 0.19 0.46 0.02 0.00 0.00 0.00 0.00 54.97 55.65 1a2v s GLU 439 Cb -0.14 -3.43 0.15 0.00 2.00 0.00 0.00 34.13 32.70 1a2v s GLU 439 CO 0.08 0.16 0.45 0.00 -0.56 0.00 0.00 175.26 175.40 1a2v n ALA 440 N 3.65 1.69 -0.20 6.30 0.00 -1.26 -4.87 120.51 125.82 1a2v n ALA 440 Ca -0.07 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1a2v n ALA 440 Cb 0.52 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.93 1a2v n ALA 440 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1a2v n GLY 441 N -0.47 0.68 0.05 0.00 0.00 -1.26 -1.57 105.19 102.62 1a2v n GLY 441 Ca 0.02 -0.79 0.13 0.00 0.00 0.00 0.00 46.02 45.37 1a2v n GLY 441 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1a2v n PRO 442 N 0.00 0.16 0.06 1.61 -0.04 -1.26 -3.98 135.00 131.55 1a2v n PRO 442 Ca 0.00 0.09 0.12 0.00 -0.04 0.00 0.00 63.50 63.67 1a2v n PRO 442 Cb 0.00 -1.65 0.24 0.00 -0.04 0.00 0.00 33.50 32.06 1a2v n PRO 442 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 1a2v n TRP 443 N -1.90 0.55 -3.88 0.54 7.02 -1.23 -4.94 117.44 113.59 1a2v n TRP 443 Ca 0.05 0.16 -0.11 0.00 -1.02 0.00 0.00 57.50 56.58 1a2v n TRP 443 Cb 0.39 -0.66 0.01 0.00 -2.42 0.00 0.00 31.31 28.63 1a2v n TRP 443 CO 0.00 0.00 0.00 0.20 -2.02 0.00 0.00 177.69 175.87 1a2v s GLY 444 N -3.54 0.76 -0.04 6.99 0.00 -0.61 0.04 107.32 110.92 1a2v s GLY 444 Ca 0.08 -1.02 0.05 0.00 0.00 0.00 0.00 44.72 43.83 1a2v s GLY 444 CO 0.69 -0.53 -0.19 -1.59 0.00 0.00 0.00 173.10 171.48 1a2v s THR 445 N -2.32 1.55 -0.83 0.90 2.01 0.80 -4.44 115.64 113.32 1a2v s THR 445 Ca 0.20 -0.80 -0.24 0.00 0.31 0.00 0.00 61.69 61.16 1a2v s THR 445 Cb -0.04 -1.31 0.05 0.00 0.01 0.00 0.00 72.50 71.21 1a2v s THR 445 CO 0.15 0.44 1.26 -0.60 -0.69 0.00 0.00 174.62 175.18 1a2v s ARG 446 N -0.13 3.33 0.00 4.92 3.52 -1.26 -0.67 118.95 128.66 1a2v s ARG 446 Ca -0.01 -0.73 0.27 0.00 -0.13 0.00 0.00 55.73 55.14 1a2v s ARG 446 Cb -0.11 -4.60 0.91 0.00 -1.56 0.00 0.00 34.95 29.59 1a2v s ARG 446 CO 0.02 -2.08 1.66 1.33 -0.81 0.00 0.00 175.30 175.42 1a2v n VAL 447 N 6.38 0.00 -3.63 7.11 0.24 -1.18 -4.83 118.33 122.42 1a2v n VAL 447 Ca 0.13 -0.18 -0.04 0.00 -2.04 0.00 0.00 64.34 62.21 1a2v n VAL 447 Cb 0.49 0.42 -0.05 0.00 -1.47 0.00 0.00 33.84 33.23 1a2v n VAL 447 CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 1a2v s TYR 448 N -2.28 -0.12 -0.03 6.34 5.04 -1.26 -4.74 117.35 120.30 1a2v s TYR 448 Ca 0.31 0.23 -0.39 0.00 -2.44 0.00 0.00 57.07 54.77 1a2v s TYR 448 Cb 0.20 0.48 -0.18 0.00 0.35 0.00 0.00 41.96 42.81 1a2v s TYR 448 CO 0.44 -0.10 1.31 -2.30 -1.34 0.00 0.00 175.55 173.55 1a2v n PRO 449 N 0.80 0.65 -1.20 4.97 -0.02 -1.26 0.07 135.00 139.01 1a2v n PRO 449 Ca -0.04 0.23 -0.07 0.00 -2.02 0.00 0.00 63.50 61.60 1a2v n PRO 449 Cb 0.58 -1.82 -0.03 0.00 -0.02 0.00 0.00 33.50 32.21 1a2v n PRO 449 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1a2v n ASN 450 N 2.57 -4.96 -4.37 2.55 3.02 -1.26 -4.97 115.26 107.83 1a2v n ASN 450 Ca 0.21 0.17 -0.33 0.00 -0.03 0.00 0.00 54.58 54.60 1a2v n ASN 450 Cb 0.13 -3.07 -0.14 0.00 -0.61 0.00 0.00 39.78 36.08 1a2v n ASN 450 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1a2v s VAL 451 N -1.88 2.95 -0.17 2.41 1.01 0.11 -1.20 120.40 123.63 1a2v s VAL 451 Ca 0.00 -0.71 0.01 0.00 0.00 0.00 0.00 61.98 61.28 1a2v s VAL 451 Cb 0.00 -2.22 0.03 0.00 0.00 0.00 0.00 36.38 34.19 1a2v s VAL 451 CO 0.00 0.54 -0.16 0.21 0.00 0.00 0.00 175.10 175.69 1a2v s ASN 452 N 0.20 3.07 -0.37 3.32 3.04 -0.09 -3.09 114.94 121.02 1a2v s ASN 452 Ca -0.09 -0.67 -0.12 0.00 0.04 0.00 0.00 52.86 52.03 1a2v s ASN 452 Cb -0.15 -1.32 0.02 0.00 -1.54 0.00 0.00 41.25 38.25 1a2v s ASN 452 CO 0.05 -0.06 0.22 0.00 -3.04 0.00 0.00 177.10 174.27 1a2v s ALA 453 N 1.37 3.33 0.55 1.71 0.00 0.15 -1.01 121.76 127.87 1a2v s ALA 453 Ca 0.03 -1.62 -0.18 0.00 0.00 0.00 0.00 51.96 50.19 1a2v s ALA 453 Cb -0.14 -2.61 -0.05 0.00 0.00 0.00 0.00 23.12 20.32 1a2v s ALA 453 CO -0.11 -1.27 1.07 -1.01 0.00 0.00 0.00 175.76 174.44 1a2v s HIS 454 N 1.60 2.91 0.81 0.00 0.09 -1.26 -0.14 115.29 119.31 1a2v s HIS 454 Ca 0.03 1.54 -0.11 0.00 -0.00 0.00 0.00 55.06 56.53 1a2v s HIS 454 Cb -0.19 -3.09 0.08 0.00 -0.00 0.00 0.00 32.58 29.39 1a2v s HIS 454 CO 0.08 -1.12 1.11 -0.80 -0.00 0.00 0.00 174.74 174.00 1a2v s ASN 455 N -2.32 4.01 -0.11 1.40 0.01 0.11 -4.74 114.94 113.31 1a2v s ASN 455 Ca 0.67 1.97 -0.33 0.00 -0.71 0.00 0.00 52.86 54.45 1a2v s ASN 455 Cb -0.18 -2.54 0.13 0.00 0.41 0.00 0.00 41.25 39.07 1a2v s ASN 455 CO 0.29 -2.37 1.19 -1.38 -1.51 0.00 0.00 177.10 173.33 1a2v s HIS 456 N -2.77 -0.12 0.16 2.20 -3.43 -0.88 -1.29 115.29 109.15 1a2v s HIS 456 Ca 0.64 0.04 0.10 0.00 -0.80 0.00 0.00 55.06 55.04 1a2v s HIS 456 Cb -0.19 0.53 -0.04 0.00 -1.43 0.00 0.00 32.58 31.44 1a2v s HIS 456 CO 0.56 -0.28 -0.21 -0.65 -2.00 0.00 0.00 174.74 172.15 1a2v s GLN 457 N -2.52 1.63 -0.26 -0.38 -0.21 -0.29 0.11 119.66 117.74 1a2v s GLN 457 Ca 0.10 -1.36 0.01 0.00 0.02 0.00 0.00 55.36 54.13 1a2v s GLN 457 Cb 0.01 -1.97 0.05 0.00 1.00 0.00 0.00 33.01 32.10 1a2v s GLN 457 CO -0.04 0.44 -0.09 -1.01 -2.12 0.00 0.00 175.29 172.46 1a2v s HIS 458 N -1.40 3.19 0.05 0.91 3.76 -0.23 -2.94 115.29 118.63 1a2v s HIS 458 Ca 0.19 -2.05 0.09 0.00 -0.15 0.00 0.00 55.06 53.14 1a2v s HIS 458 Cb -0.09 -1.98 -0.03 0.00 1.11 0.00 0.00 32.58 31.59 1a2v s HIS 458 CO 0.10 -0.84 -0.26 -0.51 -0.85 0.00 0.00 174.74 172.39 1a2v s LEU 459 N 1.18 2.17 0.10 0.89 1.43 -0.19 -1.03 118.68 123.24 1a2v s LEU 459 Ca -0.05 -0.59 0.06 0.00 -1.03 0.00 0.00 54.13 52.52 1a2v s LEU 459 Cb -0.19 -1.24 -0.03 0.00 0.03 0.00 0.00 46.19 44.76 1a2v s LEU 459 CO -0.05 0.24 -0.16 -0.36 0.23 0.00 0.00 176.35 176.25 1a2v s PHE 460 N -0.82 1.46 -0.37 0.29 0.40 0.17 -2.05 117.98 117.05 1a2v s PHE 460 Ca 0.11 -0.48 0.02 0.00 -0.60 0.00 0.00 56.93 55.99 1a2v s PHE 460 Cb -0.10 -0.79 0.11 0.00 0.51 0.00 0.00 43.02 42.75 1a2v s PHE 460 CO 0.02 0.14 0.10 0.45 0.70 0.00 0.00 175.22 176.63 1a2v s SER 461 N -2.05 4.85 -0.16 1.36 0.15 -0.42 -1.86 113.70 115.56 1a2v s SER 461 Ca 0.04 -2.20 -0.29 0.00 0.70 0.00 0.00 55.95 54.20 1a2v s SER 461 Cb -0.08 -1.68 -0.01 0.00 -1.71 0.00 0.00 66.02 62.54 1a2v s SER 461 CO 0.03 -0.40 1.16 -0.22 1.20 0.00 0.00 173.24 175.01 1a2v s LEU 462 N 0.85 4.18 -0.27 3.45 0.20 0.30 -0.71 118.68 126.69 1a2v s LEU 462 Ca 0.11 1.60 -0.08 0.00 0.69 0.00 0.00 54.13 56.44 1a2v s LEU 462 Cb -0.20 -3.54 -0.03 0.00 -0.43 0.00 0.00 46.19 41.98 1a2v s LEU 462 CO -0.07 -0.67 0.11 -0.60 -0.29 0.00 0.00 176.35 174.83 1a2v s ARG 463 N 3.04 3.68 -0.20 1.98 3.52 0.22 -0.51 118.95 130.68 1a2v s ARG 463 Ca 0.51 -0.47 -0.01 0.00 -0.13 0.00 0.00 55.73 55.62 1a2v s ARG 463 Cb -0.20 -3.44 0.01 0.00 -1.56 0.00 0.00 34.95 29.77 1a2v s ARG 463 CO 0.13 -0.22 -0.13 0.42 -0.81 0.00 0.00 175.30 174.70 1a2v s ILE 464 N 1.65 2.63 -0.54 4.11 1.01 -0.11 -1.94 121.20 128.00 1a2v s ILE 464 Ca 0.06 -0.80 -0.09 0.00 0.00 0.00 0.00 60.65 59.82 1a2v s ILE 464 Cb -0.16 -2.18 0.14 0.00 0.01 0.00 0.00 42.46 40.27 1a2v s ILE 464 CO 0.06 0.45 0.42 -0.62 0.00 0.00 0.00 174.94 175.24 1a2v s ASP 465 N 1.36 5.81 0.58 3.58 -1.08 0.71 -1.55 116.67 126.08 1a2v s ASP 465 Ca 0.04 -2.11 -0.08 0.00 -0.52 0.00 0.00 52.55 49.89 1a2v s ASP 465 Cb -0.14 -2.03 -0.01 0.00 -1.46 0.00 0.00 42.92 39.28 1a2v s ASP 465 CO -0.08 -0.65 0.92 -2.16 0.52 0.00 0.00 175.17 173.72 1a2v s PRO 466 N 1.06 3.23 -0.35 4.34 0.04 -1.26 0.42 135.00 142.48 1a2v s PRO 466 Ca 0.08 0.28 0.14 0.00 0.04 0.00 0.00 61.00 61.53 1a2v s PRO 466 Cb -0.24 -2.23 0.42 0.00 0.04 0.00 0.00 34.50 32.50 1a2v s PRO 466 CO -0.02 -0.58 1.28 -2.13 0.04 0.00 0.00 177.00 175.60 1a2v n ARG 467 N -2.59 1.29 -1.50 4.56 0.63 0.42 -4.51 116.66 114.96 1a2v n ARG 467 Ca 0.04 -2.19 -0.41 0.00 -0.92 0.00 0.00 57.85 54.37 1a2v n ARG 467 Cb 0.56 -0.38 -0.10 0.00 0.45 0.00 0.00 32.46 32.99 1a2v n ARG 467 CO 0.00 0.00 0.00 -0.89 -2.51 0.00 0.00 177.63 174.23 1a2v n ILE 468 N -0.70 -0.02 -2.90 5.15 2.08 -0.87 -0.48 119.36 121.62 1a2v n ILE 468 Ca -0.03 -0.30 -0.21 0.00 0.56 0.00 0.00 62.75 62.77 1a2v n ILE 468 Cb 0.84 -1.39 0.01 0.00 -0.75 0.00 0.00 39.64 38.36 1a2v n ILE 468 CO 0.00 0.00 0.00 -0.67 0.56 0.00 0.00 176.55 176.44 1a2v n ASP 469 N 12.26 -5.35 0.00 4.38 2.03 0.75 -4.40 116.55 126.22 1a2v n ASP 469 Ca 0.54 -0.20 0.00 0.00 0.52 0.00 0.00 54.79 55.65 1a2v n ASP 469 Cb 0.22 -4.38 0.00 0.00 -0.72 0.00 0.00 41.12 36.24 1a2v n ASP 469 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1a2v n GLY 470 N -1.27 0.37 3.89 0.27 0.00 0.36 -4.87 105.19 103.95 1a2v n GLY 470 Ca -0.12 -2.24 -0.32 0.00 0.00 0.00 0.00 46.02 43.33 1a2v n GLY 470 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1a2v s ASP 471 N -4.00 6.50 0.00 1.61 1.01 -1.26 -4.43 116.67 116.09 1a2v s ASP 471 Ca 0.00 0.57 0.00 0.00 0.71 0.00 0.00 52.55 53.83 1a2v s ASP 471 Cb 0.00 -2.09 0.00 0.00 1.01 0.00 0.00 42.92 41.84 1a2v s ASP 471 CO 0.00 0.12 0.00 0.61 0.21 0.00 0.00 175.17 176.11 1a2v n GLY 472 N 0.42 0.04 3.69 0.21 0.00 -1.26 -4.95 105.19 103.34 1a2v n GLY 472 Ca -0.05 -0.63 -0.26 0.00 0.00 0.00 0.00 46.02 45.08 1a2v n GLY 472 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1a2v s ASN 473 N -0.07 4.19 0.20 1.61 -0.87 -0.65 -4.01 114.94 115.35 1a2v s ASN 473 Ca 0.00 -1.19 -0.08 0.00 -1.57 0.00 0.00 52.86 50.01 1a2v s ASN 473 Cb 0.00 -0.45 -0.02 0.00 -0.02 0.00 0.00 41.25 40.77 1a2v s ASN 473 CO 0.00 -0.49 0.32 -0.44 -2.57 0.00 0.00 177.10 173.91 1a2v s SER 474 N -3.82 0.02 0.11 -1.22 0.01 0.28 -0.26 113.70 108.83 1a2v s SER 474 Ca 0.38 -1.03 0.04 0.00 1.31 0.00 0.00 55.95 56.66 1a2v s SER 474 Cb 0.06 0.48 -0.04 0.00 0.21 0.00 0.00 66.02 66.73 1a2v s SER 474 CO 0.21 -0.97 -0.10 0.00 0.41 0.00 0.00 173.24 172.78 1a2v s ALA 475 N -4.04 1.25 0.15 1.44 0.00 -1.26 -0.98 121.76 118.33 1a2v s ALA 475 Ca 0.25 -1.29 -0.12 0.00 0.00 0.00 0.00 51.96 50.79 1a2v s ALA 475 Cb 0.03 0.02 0.01 0.00 0.00 0.00 0.00 23.12 23.18 1a2v s ALA 475 CO 0.06 -0.04 0.35 0.00 0.00 0.00 0.00 175.76 176.13 1a2v s ALA 476 N -2.68 -0.45 -0.10 0.00 0.00 -0.01 -1.29 121.76 117.22 1a2v s ALA 476 Ca 0.09 -0.52 -0.01 0.00 0.00 0.00 0.00 51.96 51.53 1a2v s ALA 476 Cb -0.01 0.76 -0.03 0.00 0.00 0.00 0.00 23.12 23.84 1a2v s ALA 476 CO 0.00 -0.66 -0.07 0.00 0.00 0.00 0.00 175.76 175.03 1a2v s ALA 477 N -3.90 2.94 -0.23 0.00 0.00 -0.49 -1.58 121.76 118.51 1a2v s ALA 477 Ca 0.10 -0.87 -0.00 0.00 0.00 0.00 0.00 51.96 51.19 1a2v s ALA 477 Cb 0.02 -1.33 0.03 0.00 0.00 0.00 0.00 23.12 21.84 1a2v s ALA 477 CO -0.05 0.42 -0.10 0.00 0.00 0.00 0.00 175.76 176.03 1a2v s ASP 479 N 1.29 2.83 0.09 0.00 1.01 -0.36 -2.21 116.67 119.31 1a2v s ASP 479 Ca 0.00 -0.49 -0.30 0.00 0.71 0.00 0.00 52.55 52.47 1a2v s ASP 479 Cb -0.16 -1.01 -0.06 0.00 1.01 0.00 0.00 42.92 42.70 1a2v s ASP 479 CO -0.07 0.18 1.08 0.00 0.21 0.00 0.00 175.17 176.58 1a2v s ALA 480 N 0.12 3.31 -0.01 5.23 0.00 -0.29 0.12 121.76 130.24 1a2v s ALA 480 Ca -0.10 0.73 -0.02 0.00 0.00 0.00 0.00 51.96 52.57 1a2v s ALA 480 Cb -0.15 -3.37 0.00 0.00 0.00 0.00 0.00 23.12 19.60 1a2v s ALA 480 CO 0.05 -0.26 0.04 0.15 0.00 0.00 0.00 175.76 175.74 1a2v s LYS 481 N 0.50 0.09 0.65 0.00 1.02 0.14 -4.64 119.74 117.49 1a2v s LYS 481 Ca 0.53 0.00 -0.15 0.00 0.02 0.00 0.00 55.97 56.37 1a2v s LYS 481 Cb -0.27 0.04 -0.01 0.00 -0.52 0.00 0.00 37.83 37.08 1a2v s LYS 481 CO 0.31 -0.01 1.10 -1.12 -0.92 0.00 0.00 175.35 174.70 1a2v s SER 482 N -0.13 5.21 0.61 2.83 0.01 -1.26 -0.72 113.70 120.25 1a2v s SER 482 Ca -0.02 1.96 -0.19 0.00 1.31 0.00 0.00 55.95 59.01 1a2v s SER 482 Cb -0.01 -2.55 -0.03 0.00 0.21 0.00 0.00 66.02 63.64 1a2v s SER 482 CO 0.00 -1.56 1.29 -0.55 0.41 0.00 0.00 173.24 172.83 1a2v s SER 483 N -2.66 4.92 0.51 2.44 0.15 -0.14 -4.80 113.70 114.11 1a2v s SER 483 Ca 0.66 2.61 0.29 0.00 0.70 0.00 0.00 55.95 60.22 1a2v s SER 483 Cb -0.20 -2.62 1.22 0.00 -1.71 0.00 0.00 66.02 62.71 1a2v s SER 483 CO 0.41 -1.79 1.94 1.55 1.20 0.00 0.00 173.24 176.55 1a2v h PRO 484 N 0.88 0.00 -6.86 5.44 0.13 -1.92 -3.43 132.00 126.24 1a2v h PRO 484 Ca -0.51 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.13 1a2v h PRO 484 Cb 1.32 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.46 1a2v h PRO 484 CO 0.55 0.10 0.42 0.71 -0.23 0.00 0.00 178.00 179.55 1a2v s TYR 485 N -3.72 3.55 0.69 1.56 1.51 -1.26 -5.03 117.35 114.64 1a2v s TYR 485 Ca 0.00 1.72 -0.09 0.00 -1.01 0.00 0.00 57.07 57.70 1a2v s TYR 485 Cb 0.10 -3.15 0.03 0.00 -0.11 0.00 0.00 41.96 38.83 1a2v s TYR 485 CO 0.58 -0.35 1.04 -1.25 -1.11 0.00 0.00 175.55 174.46 1a2v s PRO 486 N -1.81 2.61 0.38 -1.71 0.04 -1.26 -4.81 135.00 128.44 1a2v s PRO 486 Ca 0.49 0.14 -0.26 0.00 0.04 0.00 0.00 61.00 61.41 1a2v s PRO 486 Cb -0.27 -2.11 -0.12 0.00 0.04 0.00 0.00 34.50 32.05 1a2v s PRO 486 CO 0.34 -1.06 1.04 -0.11 0.04 0.00 0.00 177.00 177.25 1a2v n LEU 487 N -2.92 2.53 0.00 -3.56 0.00 -1.26 -1.86 117.00 109.93 1a2v n LEU 487 Ca 0.07 1.09 0.00 0.00 0.00 0.00 0.00 56.01 57.17 1a2v n LEU 487 Cb 0.58 -1.36 0.00 0.00 0.00 0.00 0.00 43.42 42.65 1a2v n LEU 487 CO 0.55 -1.33 0.00 0.61 0.00 0.00 0.00 177.39 177.22 1a2v n GLY 488 N 1.14 1.54 3.87 -3.96 0.00 -0.62 -4.95 105.19 102.22 1a2v n GLY 488 Ca 0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.80 1a2v n GLY 488 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1a2v s SER 489 N -3.23 6.62 0.53 1.61 1.04 -0.78 -4.79 113.70 114.70 1a2v s SER 489 Ca 0.00 1.08 0.32 0.00 0.48 0.00 0.00 55.95 57.83 1a2v s SER 489 Cb 0.00 -2.29 1.48 0.00 0.10 0.00 0.00 66.02 65.30 1a2v s SER 489 CO 0.00 -0.24 1.87 -0.65 0.98 0.00 0.00 173.24 175.20 1a2v h PRO 490 N 1.92 0.02 0.00 4.02 0.11 -1.95 0.14 132.00 136.26 1a2v h PRO 490 Ca -0.47 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1a2v h PRO 490 Cb 1.18 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1a2v h PRO 490 CO 0.66 0.01 -0.27 0.93 -0.21 0.00 0.00 178.00 179.12 1a2v h GLU 491 N 0.02 0.00 -0.32 1.05 3.07 -1.92 -3.38 114.58 113.11 1a2v h GLU 491 Ca 0.46 0.00 -0.26 0.00 -0.50 0.00 0.00 59.36 59.05 1a2v h GLU 491 Cb 1.79 0.00 -0.23 0.00 -0.84 0.00 0.00 28.75 29.47 1a2v h GLU 491 CO -0.02 0.00 -0.62 -1.71 -1.40 0.00 0.00 179.01 175.26 1a2v n ASN 492 N -2.35 -0.81 -0.33 1.42 5.15 -0.23 -4.99 115.26 113.13 1a2v n ASN 492 Ca 0.04 -2.53 0.18 0.00 -0.60 0.00 0.00 54.58 51.68 1a2v n ASN 492 Cb 0.45 0.51 0.35 0.00 -0.53 0.00 0.00 39.78 40.57 1a2v n ASN 492 CO 0.00 0.00 0.00 -0.03 1.40 0.00 0.00 177.26 178.63 1a2v h MET 493 N 2.29 0.03 -0.37 1.20 1.85 -0.99 0.18 114.93 119.11 1a2v h MET 493 Ca -0.23 -0.00 0.00 0.00 -0.61 0.00 0.00 59.70 58.86 1a2v h MET 493 Cb 1.26 -0.01 0.00 0.00 0.43 0.00 0.00 31.60 33.29 1a2v h MET 493 CO 0.11 0.02 0.00 0.66 -0.40 0.00 0.00 176.91 177.30 1a2v n TYR 494 N -5.41 0.48 -2.49 1.39 4.02 -1.26 -1.59 117.16 112.30 1a2v n TYR 494 Ca 0.26 -0.29 -0.20 0.00 -0.01 0.00 0.00 57.90 57.66 1a2v n TYR 494 Cb 0.86 -0.01 -0.00 0.00 -0.02 0.00 0.00 39.34 40.18 1a2v n TYR 494 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1a2v n GLY 495 N 1.23 -0.45 0.12 2.72 0.00 0.61 -4.90 105.19 104.51 1a2v n GLY 495 Ca 0.17 -0.02 0.09 0.00 0.00 0.00 0.00 46.02 46.25 1a2v n GLY 495 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1a2v n ASN 496 N -1.89 1.09 -4.75 1.61 6.94 -1.26 -4.97 115.26 112.03 1a2v n ASN 496 Ca -0.21 -1.05 -0.41 0.00 -0.02 0.00 0.00 54.58 52.89 1a2v n ASN 496 Cb 0.67 0.85 -0.02 0.00 -2.36 0.00 0.00 39.78 38.92 1a2v n ASN 496 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1a2v s ALA 497 N -2.51 3.66 0.06 -2.53 0.00 -1.26 -4.96 121.76 114.22 1a2v s ALA 497 Ca 0.09 1.43 -0.26 0.00 0.00 0.00 0.00 51.96 53.22 1a2v s ALA 497 Cb 0.14 -3.59 0.07 0.00 0.00 0.00 0.00 23.12 19.74 1a2v s ALA 497 CO 0.65 -0.84 0.62 -0.59 0.00 0.00 0.00 175.76 175.59 1a2v s PHE 498 N -0.15 -0.56 0.14 0.00 -0.12 -1.26 -0.97 117.98 115.05 1a2v s PHE 498 Ca 0.60 0.67 0.01 0.00 -0.05 0.00 0.00 56.93 58.15 1a2v s PHE 498 Cb -0.44 0.46 -0.00 0.00 -0.63 0.00 0.00 43.02 42.41 1a2v s PHE 498 CO 0.47 -0.72 0.17 2.48 -0.05 0.00 0.00 175.22 177.57 1a2v n TYR 499 N 0.28 -0.67 -4.35 3.49 4.11 0.10 -4.91 117.16 115.21 1a2v n TYR 499 Ca -0.18 -1.00 -0.34 0.00 -0.00 0.00 0.00 57.90 56.38 1a2v n TYR 499 Cb 0.61 0.19 -0.15 0.00 -0.00 0.00 0.00 39.34 39.99 1a2v n TYR 499 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.86 177.31 1a2v s SER 500 N -1.89 3.84 -0.30 9.48 0.15 -1.26 -0.69 113.70 123.03 1a2v s SER 500 Ca 0.13 -0.44 -0.21 0.00 0.70 0.00 0.00 55.95 56.13 1a2v s SER 500 Cb -0.00 -1.61 -0.01 0.00 -1.71 0.00 0.00 66.02 62.69 1a2v s SER 500 CO 0.09 0.06 0.67 -0.70 1.20 0.00 0.00 173.24 174.57 1a2v s GLU 501 N 0.97 3.94 -0.27 5.44 2.12 0.33 -4.87 118.70 126.36 1a2v s GLU 501 Ca -0.02 0.41 -0.11 0.00 0.36 0.00 0.00 54.97 55.61 1a2v s GLU 501 Cb -0.15 -3.72 -0.05 0.00 0.26 0.00 0.00 34.13 30.47 1a2v s GLU 501 CO -0.02 -0.58 0.19 0.21 -0.54 0.00 0.00 175.26 174.52 1a2v s LYS 502 N 2.69 3.99 -0.46 4.30 2.20 -1.26 -1.23 119.74 129.97 1a2v s LYS 502 Ca 0.27 -0.29 0.00 0.00 -0.36 0.00 0.00 55.97 55.60 1a2v s LYS 502 Cb -0.15 -3.63 0.12 0.00 -1.51 0.00 0.00 37.83 32.67 1a2v s LYS 502 CO 0.12 -0.12 0.23 0.99 -0.36 0.00 0.00 175.35 176.21 1a2v s THR 503 N 1.58 2.98 0.04 3.43 2.01 -0.31 -4.97 115.64 120.40 1a2v s THR 503 Ca 0.08 -2.61 -0.28 0.00 0.31 0.00 0.00 61.69 59.19 1a2v s THR 503 Cb -0.15 -3.05 -0.05 0.00 0.01 0.00 0.00 72.50 69.26 1a2v s THR 503 CO 0.09 -0.73 0.88 0.42 -0.69 0.00 0.00 174.62 174.59 1a2v s THR 504 N 0.50 4.75 0.05 -0.82 -4.23 -1.26 -1.39 115.64 113.23 1a2v s THR 504 Ca 0.13 1.87 -0.31 0.00 -1.18 0.00 0.00 61.69 62.21 1a2v s THR 504 Cb -0.22 -4.23 -0.07 0.00 1.34 0.00 0.00 72.50 69.32 1a2v s THR 504 CO -0.04 0.27 1.40 -0.36 -0.54 0.00 0.00 174.62 175.35 1a2v s PHE 505 N 0.41 3.01 -0.26 3.99 0.08 -0.42 -4.90 117.98 119.90 1a2v s PHE 505 Ca 0.45 0.87 0.02 0.00 0.12 0.00 0.00 56.93 58.40 1a2v s PHE 505 Cb -0.21 -3.67 -0.17 0.00 -0.57 0.00 0.00 43.02 38.40 1a2v s PHE 505 CO 0.26 -2.42 -0.21 1.63 -0.10 0.00 0.00 175.22 174.38 1a2v n LYS 506 N 4.77 0.65 -4.37 0.44 5.02 -1.26 -4.11 118.16 119.30 1a2v n LYS 506 Ca 0.12 0.15 -0.27 0.00 -2.02 0.00 0.00 58.31 56.29 1a2v n LYS 506 Cb 0.43 -1.52 -0.13 0.00 -0.02 0.00 0.00 35.03 33.79 1a2v n LYS 506 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1a2v s THR 507 N -2.52 2.14 0.27 -0.18 2.01 -1.26 -1.42 115.64 114.68 1a2v s THR 507 Ca -0.34 -1.78 -0.04 0.00 0.31 0.00 0.00 61.69 59.84 1a2v s THR 507 Cb 0.09 -1.92 0.32 0.00 0.01 0.00 0.00 72.50 70.99 1a2v s THR 507 CO 0.61 -0.00 1.62 0.58 -0.69 0.00 0.00 174.62 176.74 1a2v h VAL 508 N 3.76 0.25 -0.93 3.82 2.07 -1.09 0.34 116.25 124.47 1a2v h VAL 508 Ca -0.49 -0.03 0.18 0.00 0.82 0.00 0.00 66.70 67.18 1a2v h VAL 508 Cb 1.18 0.15 -0.08 0.00 -1.52 0.00 0.00 31.29 31.03 1a2v h VAL 508 CO 0.41 0.02 0.60 0.50 0.02 0.00 0.00 177.57 179.12 1a2v h LYS 509 N 0.09 0.57 0.00 1.57 3.64 -1.36 -0.58 116.57 120.50 1a2v h LYS 509 Ca 0.47 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.78 1a2v h LYS 509 Cb 0.88 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.56 1a2v h LYS 509 CO -0.74 0.38 -0.19 -0.44 -2.27 0.00 0.00 179.45 176.19 1a2v h ASP 510 N 0.59 0.00 1.04 4.20 3.32 -0.59 -3.03 116.42 121.95 1a2v h ASP 510 Ca 0.49 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 57.40 1a2v h ASP 510 Cb 0.96 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.49 1a2v h ASP 510 CO -0.23 0.19 -0.66 0.77 -1.72 0.00 0.00 179.24 177.59 1a2v h SER 511 N 0.00 0.00 -0.20 6.45 4.64 -1.06 -3.43 113.55 119.95 1a2v h SER 511 Ca -0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 1a2v h SER 511 Cb 0.37 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.46 1a2v h SER 511 CO 0.03 0.66 0.06 0.18 -0.87 0.00 0.00 176.83 176.89 1a2v n LEU 512 N -3.43 1.43 -4.43 5.97 4.77 -1.15 -4.47 117.00 115.69 1a2v n LEU 512 Ca 0.00 -1.95 -0.21 0.00 -0.03 0.00 0.00 56.01 53.82 1a2v n LEU 512 Cb 0.74 -1.66 -0.10 0.00 -2.33 0.00 0.00 43.42 40.06 1a2v n LEU 512 CO 0.42 -3.11 -0.35 0.42 -1.33 0.00 0.00 177.39 173.44 1a2v s THR 513 N 15.59 1.55 0.18 -5.08 -4.23 -1.11 -4.99 115.64 117.55 1a2v s THR 513 Ca 0.87 -2.10 0.09 0.00 -1.18 0.00 0.00 61.69 59.36 1a2v s THR 513 Cb -0.10 -2.49 -0.04 0.00 1.34 0.00 0.00 72.50 71.21 1a2v s THR 513 CO 0.14 -0.27 -0.18 0.20 -0.54 0.00 0.00 174.62 173.97 1a2v s ASN 514 N -3.44 2.78 0.33 3.99 0.01 -1.26 -0.84 114.94 116.50 1a2v s ASN 514 Ca 0.30 -0.89 -0.29 0.00 -0.71 0.00 0.00 52.86 51.27 1a2v s ASN 514 Cb 0.05 -0.17 -0.10 0.00 0.41 0.00 0.00 41.25 41.43 1a2v s ASN 514 CO 0.12 -0.04 1.29 -0.47 -1.51 0.00 0.00 177.10 176.49 1a2v s TYR 515 N -2.17 3.10 -0.14 2.20 5.04 -1.26 -4.94 117.35 119.18 1a2v s TYR 515 Ca 0.18 1.44 0.00 0.00 -2.44 0.00 0.00 57.07 56.25 1a2v s TYR 515 Cb -0.05 -3.64 0.02 0.00 0.35 0.00 0.00 41.96 38.64 1a2v s TYR 515 CO 0.07 -1.73 -0.12 -1.21 -1.34 0.00 0.00 175.55 171.21 1a2v s GLU 516 N -1.75 2.11 0.34 4.97 0.41 -1.26 -5.01 118.70 118.51 1a2v s GLU 516 Ca 0.49 -0.50 0.09 0.00 -0.41 0.00 0.00 54.97 54.63 1a2v s GLU 516 Cb -0.39 -2.01 0.63 0.00 -1.78 0.00 0.00 34.13 30.58 1a2v s GLU 516 CO 0.52 -0.25 1.80 0.66 -0.49 0.00 0.00 175.26 177.49 1a2v h SER 517 N 8.08 0.17 -0.15 -0.19 4.64 -1.96 -2.31 113.55 121.83 1a2v h SER 517 Ca -0.36 -0.06 0.04 0.00 -0.47 0.00 0.00 61.79 60.95 1a2v h SER 517 Cb 1.13 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 63.17 1a2v h SER 517 CO 0.50 0.49 0.15 0.00 -0.87 0.00 0.00 176.83 177.10 1a2v h ALA 518 N 1.53 1.84 -0.00 5.18 0.00 -1.99 -2.10 119.26 123.71 1a2v h ALA 518 Ca 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1a2v h ALA 518 Cb 0.64 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1a2v h ALA 518 CO 0.05 -0.23 0.00 0.25 0.00 0.00 0.00 179.25 179.31 1a2v n THR 519 N -3.95 0.63 -3.86 0.00 -2.24 -1.16 -4.92 114.28 98.78 1a2v n THR 519 Ca 0.01 -0.82 -0.26 0.00 -2.27 0.00 0.00 64.05 60.71 1a2v n THR 519 Cb 0.27 0.69 -0.00 0.00 -2.10 0.00 0.00 70.33 69.19 1a2v n THR 519 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1a2v n GLY 520 N -0.31 -0.38 3.77 3.38 0.00 -0.79 -1.13 105.19 109.73 1a2v n GLY 520 Ca 0.00 0.20 -0.40 0.00 0.00 0.00 0.00 46.02 45.82 1a2v n GLY 520 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1a2v s ARG 521 N -6.36 4.20 0.10 1.61 3.52 -0.97 -4.66 118.95 116.38 1a2v s ARG 521 Ca 0.09 2.23 -0.00 0.00 -0.13 0.00 0.00 55.73 57.92 1a2v s ARG 521 Cb -0.03 -2.96 -0.04 0.00 -1.56 0.00 0.00 34.95 30.36 1a2v s ARG 521 CO 0.87 -0.32 -0.01 -1.54 -0.81 0.00 0.00 175.30 173.49 1a2v s SER 522 N -0.54 0.67 0.06 -2.12 1.04 -0.94 -4.75 113.70 107.13 1a2v s SER 522 Ca 0.52 -1.08 0.09 0.00 0.48 0.00 0.00 55.95 55.96 1a2v s SER 522 Cb -0.40 0.19 -0.03 0.00 0.10 0.00 0.00 66.02 65.89 1a2v s SER 522 CO 0.53 -0.60 -0.25 0.26 0.98 0.00 0.00 173.24 174.15 1a2v s TRP 523 N -3.86 2.22 -0.09 5.02 0.51 -1.09 0.18 118.94 121.83 1a2v s TRP 523 Ca 0.15 -0.40 0.01 0.00 -2.12 0.00 0.00 56.10 53.74 1a2v s TRP 523 Cb 0.07 -1.30 -0.02 0.00 -0.81 0.00 0.00 33.47 31.40 1a2v s TRP 523 CO -0.04 0.15 -0.10 -0.51 -0.51 0.00 0.00 176.95 175.94 1a2v s ASP 524 N -1.37 4.31 -0.22 2.95 1.11 -0.61 0.33 116.67 123.17 1a2v s ASP 524 Ca 0.11 -0.16 -0.01 0.00 0.18 0.00 0.00 52.55 52.67 1a2v s ASP 524 Cb -0.10 -1.24 0.01 0.00 1.07 0.00 0.00 42.92 42.67 1a2v s ASP 524 CO 0.03 0.29 -0.11 -0.63 1.18 0.00 0.00 175.17 175.93 1a2v s ILE 525 N -0.37 2.70 0.19 0.77 1.01 -0.81 -0.83 121.20 123.86 1a2v s ILE 525 Ca 0.05 -0.86 -0.01 0.00 0.00 0.00 0.00 60.65 59.83 1a2v s ILE 525 Cb -0.12 -2.26 -0.04 0.00 0.01 0.00 0.00 42.46 40.04 1a2v s ILE 525 CO 0.02 0.38 0.11 0.72 0.00 0.00 0.00 174.94 176.17 1a2v s PHE 526 N 1.35 1.12 -0.47 3.97 -0.71 -0.15 -1.89 117.98 121.20 1a2v s PHE 526 Ca 0.03 -1.33 -0.11 0.00 -1.04 0.00 0.00 56.93 54.48 1a2v s PHE 526 Cb -0.15 -0.57 0.11 0.00 -1.21 0.00 0.00 43.02 41.20 1a2v s PHE 526 CO -0.07 -0.59 0.36 1.21 -1.34 0.00 0.00 175.22 174.79 1a2v s ASN 527 N -3.15 5.82 0.00 1.98 3.04 -1.00 -0.55 114.94 121.08 1a2v s ASN 527 Ca 0.35 -1.74 0.10 0.00 0.04 0.00 0.00 52.86 51.62 1a2v s ASN 527 Cb 0.07 -2.06 0.53 0.00 -1.54 0.00 0.00 41.25 38.25 1a2v s ASN 527 CO 0.10 -0.68 1.22 -0.81 -3.04 0.00 0.00 177.10 173.88 1a2v n PRO 528 N 5.00 0.16 0.00 0.43 -0.04 -1.26 -2.48 135.00 136.81 1a2v n PRO 528 Ca -0.10 0.18 0.13 0.00 -0.04 0.00 0.00 63.50 63.67 1a2v n PRO 528 Cb 0.41 -1.50 0.35 0.00 -0.04 0.00 0.00 33.50 32.73 1a2v n PRO 528 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1a2v n ASN 529 N -1.27 1.81 -4.32 3.54 3.02 -1.26 -4.93 115.26 111.85 1a2v n ASN 529 Ca 0.05 -1.51 -0.17 0.00 -0.03 0.00 0.00 54.58 52.93 1a2v n ASN 529 Cb 0.08 0.07 -0.10 0.00 -0.61 0.00 0.00 39.78 39.21 1a2v n ASN 529 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1a2v s LYS 530 N -2.13 1.35 0.01 3.52 1.02 -1.04 -5.13 119.74 117.34 1a2v s LYS 530 Ca 0.31 -1.70 0.01 0.00 0.02 0.00 0.00 55.97 54.62 1a2v s LYS 530 Cb 0.20 -0.47 -0.01 0.00 -0.52 0.00 0.00 37.83 37.03 1a2v s LYS 530 CO 0.38 -0.17 -0.04 0.08 -0.92 0.00 0.00 175.35 174.69 1a2v s VAL 531 N -3.55 0.24 -0.05 3.17 1.01 -1.26 -4.10 120.40 115.86 1a2v s VAL 531 Ca 0.31 -0.49 -0.30 0.00 0.00 0.00 0.00 61.98 61.50 1a2v s VAL 531 Cb 0.07 -0.28 -0.03 0.00 0.00 0.00 0.00 36.38 36.14 1a2v s VAL 531 CO 0.10 -0.16 1.09 0.21 0.00 0.00 0.00 175.10 176.34 1a2v s ASN 532 N -0.69 7.18 0.65 3.32 3.84 0.38 -4.85 114.94 124.77 1a2v s ASN 532 Ca -0.05 1.72 0.42 0.00 0.21 0.00 0.00 52.86 55.15 1a2v s ASN 532 Cb -0.05 -2.56 2.28 0.00 -0.55 0.00 0.00 41.25 40.36 1a2v s ASN 532 CO -0.00 -0.46 2.33 1.55 -2.79 0.00 0.00 177.10 177.73 1a2v h PRO 533 N 7.12 0.00 0.00 0.43 0.13 -1.93 0.13 132.00 137.88 1a2v h PRO 533 Ca -0.35 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 1a2v h PRO 533 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1a2v h PRO 533 CO 0.84 0.00 -0.45 0.66 -0.23 0.00 0.00 178.00 178.82 1a2v n TYR 534 N -3.19 0.26 0.22 1.56 4.01 -1.26 -4.64 117.16 114.13 1a2v n TYR 534 Ca -0.03 0.11 0.11 0.00 -0.16 0.00 0.00 57.90 57.94 1a2v n TYR 534 Cb 0.09 -0.42 0.38 0.00 -0.31 0.00 0.00 39.34 39.08 1a2v n TYR 534 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1a2v h SER 535 N -0.59 0.00 0.00 7.72 4.64 -1.97 -3.47 113.55 119.88 1a2v h SER 535 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1a2v h SER 535 Cb 0.45 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.54 1a2v h SER 535 CO 0.00 0.15 0.00 0.61 -0.87 0.00 0.00 176.83 176.72 1a2v n GLY 536 N 0.52 0.66 3.96 -0.77 0.00 0.03 -4.98 105.19 104.61 1a2v n GLY 536 Ca 0.02 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.80 1a2v n GLY 536 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a2v s LYS 537 N -0.04 3.45 0.68 1.61 -0.14 -1.26 -4.65 119.74 119.39 1a2v s LYS 537 Ca 0.00 -0.65 -0.12 0.00 -1.36 0.00 0.00 55.97 53.84 1a2v s LYS 537 Cb 0.00 -2.88 0.00 0.00 -1.68 0.00 0.00 37.83 33.27 1a2v s LYS 537 CO 0.00 0.42 1.07 -1.25 -0.76 0.00 0.00 175.35 174.83 1a2v s PRO 538 N -3.78 2.92 0.46 -1.68 0.04 -1.26 0.14 135.00 131.85 1a2v s PRO 538 Ca 0.35 1.09 -0.24 0.00 0.04 0.00 0.00 61.00 62.24 1a2v s PRO 538 Cb -0.10 -1.98 -0.07 0.00 0.04 0.00 0.00 34.50 32.39 1a2v s PRO 538 CO 0.30 -1.12 1.25 -1.25 0.04 0.00 0.00 177.00 176.22 1a2v s PRO 539 N -4.69 3.69 0.18 0.56 0.04 -1.26 -4.72 135.00 128.81 1a2v s PRO 539 Ca 0.61 2.00 -0.23 0.00 0.04 0.00 0.00 61.00 63.41 1a2v s PRO 539 Cb -0.15 -2.49 0.05 0.00 0.04 0.00 0.00 34.50 31.95 1a2v s PRO 539 CO 0.49 -0.67 0.75 -1.54 0.04 0.00 0.00 177.00 176.08 1a2v s SER 540 N -1.07 -0.35 -0.11 6.66 1.04 -1.00 -2.38 113.70 116.48 1a2v s SER 540 Ca 0.63 -0.31 0.03 0.00 0.48 0.00 0.00 55.95 56.77 1a2v s SER 540 Cb -0.34 0.60 0.01 0.00 0.10 0.00 0.00 66.02 66.39 1a2v s SER 540 CO 0.42 -1.06 -0.20 -0.31 0.98 0.00 0.00 173.24 173.08 1a2v s TYR 541 N -3.64 2.32 -0.19 5.02 1.51 -0.79 -0.56 117.35 121.02 1a2v s TYR 541 Ca 0.08 -1.07 -0.09 0.00 -1.01 0.00 0.00 57.07 54.97 1a2v s TYR 541 Cb -0.03 -1.60 -0.05 0.00 -0.11 0.00 0.00 41.96 40.17 1a2v s TYR 541 CO -0.02 -0.49 0.11 0.21 -1.11 0.00 0.00 175.55 174.25 1a2v s LYS 542 N 0.72 4.12 -0.42 -0.62 2.20 0.25 -1.91 119.74 124.08 1a2v s LYS 542 Ca -0.11 -0.26 -0.25 0.00 -0.36 0.00 0.00 55.97 55.00 1a2v s LYS 542 Cb -0.16 -3.36 0.02 0.00 -1.51 0.00 0.00 37.83 32.82 1a2v s LYS 542 CO 0.02 0.30 0.89 -1.17 -0.36 0.00 0.00 175.35 175.02 1a2v s LEU 543 N 0.35 4.05 -0.54 5.43 2.96 0.15 -1.21 118.68 129.87 1a2v s LEU 543 Ca 0.07 0.28 -0.06 0.00 -0.22 0.00 0.00 54.13 54.19 1a2v s LEU 543 Cb -0.11 -3.16 0.14 0.00 0.50 0.00 0.00 46.19 43.55 1a2v s LEU 543 CO -0.01 -0.93 0.38 -0.69 -1.32 0.00 0.00 176.35 173.78 1a2v s VAL 544 N 3.51 3.97 -0.02 1.68 1.01 0.43 -2.68 120.40 128.30 1a2v s VAL 544 Ca 0.36 -2.29 0.03 0.00 0.00 0.00 0.00 61.98 60.07 1a2v s VAL 544 Cb -0.11 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.66 1a2v s VAL 544 CO 0.22 -0.81 -0.10 -0.55 0.00 0.00 0.00 175.10 173.86 1a2v s SER 545 N 1.79 1.27 0.00 3.32 0.15 -1.26 -1.65 113.70 117.32 1a2v s SER 545 Ca 0.11 -0.20 0.00 0.00 0.70 0.00 0.00 55.95 56.56 1a2v s SER 545 Cb -0.22 -0.31 0.00 0.00 -1.71 0.00 0.00 66.02 63.79 1a2v s SER 545 CO -0.03 0.08 0.00 1.07 1.20 0.00 0.00 173.24 175.56 1a2v n THR 546 N 3.20 0.00 -2.46 6.45 5.66 -1.26 -4.83 114.28 121.04 1a2v n THR 546 Ca -0.17 -0.03 -0.43 0.00 -3.05 0.00 0.00 64.05 60.37 1a2v n THR 546 Cb 0.55 0.32 0.00 0.00 -1.55 0.00 0.00 70.33 69.65 1a2v n THR 546 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1a2v n GLN 547 N -0.60 3.67 -3.83 1.09 6.02 -1.26 -4.83 117.38 117.63 1a2v n GLN 547 Ca 0.00 -3.65 -0.31 0.00 -0.01 0.00 0.00 57.00 53.03 1a2v n GLN 547 Cb 0.00 -2.90 -0.11 0.00 1.02 0.00 0.00 30.24 28.25 1a2v n GLN 547 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1a2v s PRO 549 N -1.16 4.20 0.59 0.00 0.02 -1.26 -4.82 135.00 132.57 1a2v s PRO 549 Ca 0.24 1.96 -0.16 0.00 0.02 0.00 0.00 61.00 63.06 1a2v s PRO 549 Cb -0.09 -2.86 -0.04 0.00 0.02 0.00 0.00 34.50 31.53 1a2v s PRO 549 CO -0.12 -0.23 1.06 -1.25 -0.33 0.00 0.00 177.00 176.13 1a2v s PRO 550 N -2.04 3.33 -0.25 5.54 0.04 -1.26 -4.93 135.00 135.43 1a2v s PRO 550 Ca 0.53 1.23 -0.29 0.00 0.04 0.00 0.00 61.00 62.51 1a2v s PRO 550 Cb -0.34 -2.03 -0.01 0.00 0.04 0.00 0.00 34.50 32.16 1a2v s PRO 550 CO 0.44 -0.80 1.42 -1.17 0.04 0.00 0.00 177.00 176.93 1a2v s LEU 551 N -4.43 3.93 0.44 -3.56 2.96 -1.26 -4.88 118.68 111.89 1a2v s LEU 551 Ca 0.64 1.43 0.25 0.00 -0.22 0.00 0.00 54.13 56.23 1a2v s LEU 551 Cb -0.16 -3.54 0.78 0.00 0.50 0.00 0.00 46.19 43.77 1a2v s LEU 551 CO 0.36 -1.11 1.76 -0.07 -1.32 0.00 0.00 176.35 175.97 1a2v h LEU 552 N 11.05 0.00 -9.78 -0.68 3.38 -1.95 -3.44 115.31 113.88 1a2v h LEU 552 Ca -0.29 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.16 1a2v h LEU 552 Cb 1.12 0.00 0.05 0.00 0.09 0.00 0.00 40.66 41.92 1a2v h LEU 552 CO 1.01 0.16 0.63 0.00 0.09 0.00 0.00 178.44 180.34 1a2v s ALA 553 N -3.46 3.51 0.87 1.53 0.00 -1.26 -4.98 121.76 117.97 1a2v s ALA 553 Ca 0.03 1.16 -0.12 0.00 0.00 0.00 0.00 51.96 53.03 1a2v s ALA 553 Cb 0.08 -3.46 0.12 0.00 0.00 0.00 0.00 23.12 19.86 1a2v s ALA 553 CO 0.64 -0.54 1.17 1.63 0.00 0.00 0.00 175.76 178.66 1a2v n LYS 554 N 1.68 -0.17 -2.30 0.00 4.01 -1.26 -4.79 118.16 115.33 1a2v n LYS 554 Ca 0.03 0.03 -0.37 0.00 -0.51 0.00 0.00 58.31 57.48 1a2v n LYS 554 Cb 0.42 -2.41 -0.02 0.00 -0.51 0.00 0.00 35.03 32.52 1a2v n LYS 554 CO 0.00 0.00 0.00 -1.21 -1.11 0.00 0.00 177.40 175.08 1a2v s GLU 555 N -4.40 3.92 0.00 1.97 2.02 -1.26 -2.21 118.70 118.74 1a2v s GLU 555 Ca 0.70 1.77 0.00 0.00 0.02 0.00 0.00 54.97 57.46 1a2v s GLU 555 Cb -0.26 -2.53 0.00 0.00 0.10 0.00 0.00 34.13 31.44 1a2v s GLU 555 CO 0.55 -0.41 0.00 0.41 0.02 0.00 0.00 175.26 175.82 1a2v n GLY 556 N 0.51 1.49 3.85 -1.39 0.00 -1.26 -5.02 105.19 103.36 1a2v n GLY 556 Ca 0.06 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.78 1a2v n GLY 556 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1a2v s SER 557 N -3.22 5.20 0.16 1.61 1.04 -0.94 -4.85 113.70 112.69 1a2v s SER 557 Ca 0.00 1.25 -0.16 0.00 0.48 0.00 0.00 55.95 57.52 1a2v s SER 557 Cb 0.00 -2.05 0.07 0.00 0.10 0.00 0.00 66.02 64.14 1a2v s SER 557 CO 0.00 -1.51 1.74 -0.07 0.98 0.00 0.00 173.24 174.38 1a2v h LEU 558 N -0.77 0.09 0.54 2.42 3.38 -1.91 0.32 115.31 119.38 1a2v h LEU 558 Ca -0.45 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 57.54 1a2v h LEU 558 Cb 1.25 0.05 0.00 0.00 0.09 0.00 0.00 40.66 42.05 1a2v h LEU 558 CO 0.62 0.09 -0.28 0.58 0.09 0.00 0.00 178.44 179.53 1a2v h VAL 559 N 0.25 0.42 -0.24 1.22 2.07 -1.92 -0.67 116.25 117.38 1a2v h VAL 559 Ca 0.17 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.71 1a2v h VAL 559 Cb 0.17 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.35 1a2v h VAL 559 CO -0.19 0.00 0.16 0.00 0.02 0.00 0.00 177.57 177.56 1a2v h ALA 560 N -0.31 1.90 -0.02 1.67 0.00 -1.73 -1.35 119.26 119.42 1a2v h ALA 560 Ca -0.07 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.68 1a2v h ALA 560 Cb 0.60 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.32 1a2v h ALA 560 CO 0.11 0.08 -0.57 0.87 0.00 0.00 0.00 179.25 179.73 1a2v h LYS 561 N 0.27 0.42 0.00 0.00 1.57 -0.64 -3.27 116.57 114.92 1a2v h LYS 561 Ca 0.09 -0.43 0.00 0.00 -1.87 0.00 0.00 60.65 58.45 1a2v h LYS 561 Cb 0.05 0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.48 1a2v h LYS 561 CO -0.02 1.09 0.00 0.00 -0.57 0.00 0.00 179.45 179.95 1a2v h ARG 562 N -0.09 0.00 -2.17 3.15 3.08 -0.97 -3.34 114.38 114.04 1a2v h ARG 562 Ca -0.07 0.00 -0.59 0.00 0.07 0.00 0.00 59.98 59.39 1a2v h ARG 562 Cb 1.28 0.00 -0.41 0.00 0.08 0.00 0.00 29.97 30.91 1a2v h ARG 562 CO 0.11 0.00 -0.70 0.00 -1.07 0.00 0.00 179.97 178.32 1a2v n ALA 563 N -1.91 3.86 -0.13 0.04 0.00 -0.52 -4.72 120.51 117.13 1a2v n ALA 563 Ca 0.04 -4.51 0.18 0.00 0.00 0.00 0.00 53.44 49.15 1a2v n ALA 563 Cb 0.39 -0.86 0.58 0.00 0.00 0.00 0.00 19.45 19.56 1a2v n ALA 563 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1a2v h PRO 564 N 3.91 0.26 0.00 0.00 0.13 -1.68 -1.72 132.00 132.89 1a2v h PRO 564 Ca 0.17 -0.02 -0.05 0.00 -0.87 0.00 0.00 66.00 65.23 1a2v h PRO 564 Cb 0.68 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 31.74 1a2v h PRO 564 CO 0.77 0.17 -0.24 0.11 -0.23 0.00 0.00 178.00 178.58 1a2v h TRP 565 N 0.26 0.00 0.00 1.56 5.08 -1.89 -3.30 115.95 117.66 1a2v h TRP 565 Ca 0.36 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.33 1a2v h TRP 565 Cb 1.02 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.18 1a2v h TRP 565 CO -0.00 0.24 0.00 0.00 -1.28 0.00 0.00 178.44 177.40 1a2v n ALA 566 N -2.22 1.88 0.98 0.11 0.00 -0.65 -3.18 120.51 117.44 1a2v n ALA 566 Ca 0.00 0.01 0.13 0.00 0.00 0.00 0.00 53.44 53.58 1a2v n ALA 566 Cb 0.46 -1.38 0.58 0.00 0.00 0.00 0.00 19.45 19.11 1a2v n ALA 566 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1a2v n SER 567 N -1.98 0.00 -4.04 0.00 3.41 -1.24 -4.21 113.62 105.56 1a2v n SER 567 Ca 0.04 0.35 -0.17 0.00 -0.26 0.00 0.00 58.87 58.83 1a2v n SER 567 Cb 0.27 -0.45 -0.13 0.00 -0.26 0.00 0.00 64.21 63.64 1a2v n SER 567 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1a2v s HIS 568 N -2.89 0.77 0.31 7.33 3.76 -1.19 -4.77 115.29 118.60 1a2v s HIS 568 Ca 0.16 -0.28 0.07 0.00 -0.15 0.00 0.00 55.06 54.86 1a2v s HIS 568 Cb 0.17 -0.47 0.50 0.00 1.11 0.00 0.00 32.58 33.89 1a2v s HIS 568 CO 0.45 -0.02 1.73 0.77 -0.85 0.00 0.00 174.74 176.82 1a2v h SER 569 N 5.33 0.24 -4.00 1.40 0.02 -1.26 -3.36 113.55 111.91 1a2v h SER 569 Ca -0.33 -0.09 -0.39 0.00 -0.84 0.00 0.00 61.79 60.14 1a2v h SER 569 Cb 1.19 -0.07 -0.29 0.00 0.14 0.00 0.00 62.40 63.37 1a2v h SER 569 CO 0.46 0.60 -0.78 -0.69 -1.14 0.00 0.00 176.83 175.28 1a2v s VAL 570 N -4.21 0.68 -0.10 2.27 1.01 -0.02 -0.42 120.40 119.61 1a2v s VAL 570 Ca -0.05 -0.36 -0.03 0.00 0.00 0.00 0.00 61.98 61.54 1a2v s VAL 570 Cb 0.14 -0.58 0.04 0.00 0.00 0.00 0.00 36.38 35.98 1a2v s VAL 570 CO 0.77 0.20 0.05 0.20 0.00 0.00 0.00 175.10 176.32 1a2v s ASN 571 N -0.16 1.79 -0.20 3.32 0.01 -0.53 -2.74 114.94 116.44 1a2v s ASN 571 Ca 0.03 -0.26 -0.02 0.00 -0.71 0.00 0.00 52.86 51.90 1a2v s ASN 571 Cb -0.04 -0.29 0.00 0.00 0.41 0.00 0.00 41.25 41.34 1a2v s ASN 571 CO -0.00 -0.27 -0.12 -0.69 -1.51 0.00 0.00 177.10 174.51 1a2v s VAL 572 N 2.08 2.76 0.23 1.60 1.01 -1.26 -0.93 120.40 125.90 1a2v s VAL 572 Ca 0.03 -0.70 0.07 0.00 0.00 0.00 0.00 61.98 61.38 1a2v s VAL 572 Cb -0.14 -2.22 -0.05 0.00 0.00 0.00 0.00 36.38 33.97 1a2v s VAL 572 CO -0.06 0.48 -0.09 0.68 0.00 0.00 0.00 175.10 176.11 1a2v s VAL 573 N 1.35 1.57 0.48 2.92 -7.23 -0.20 -4.57 120.40 114.73 1a2v s VAL 573 Ca 0.05 -2.15 -0.23 0.00 -1.81 0.00 0.00 61.98 57.84 1a2v s VAL 573 Cb -0.14 -2.22 -0.07 0.00 0.56 0.00 0.00 36.38 34.52 1a2v s VAL 573 CO -0.07 -0.46 1.26 -2.84 -0.31 0.00 0.00 175.10 172.67 1a2v s PRO 574 N -3.71 3.60 0.37 4.82 0.02 -1.26 -0.03 135.00 138.81 1a2v s PRO 574 Ca 0.25 2.01 -0.25 0.00 0.02 0.00 0.00 61.00 63.04 1a2v s PRO 574 Cb 0.02 -2.43 -0.09 0.00 0.02 0.00 0.00 34.50 32.02 1a2v s PRO 574 CO 0.08 -0.75 1.06 -0.47 -0.33 0.00 0.00 177.00 176.59 1a2v s TYR 575 N -1.40 3.33 -0.13 6.54 6.14 -0.02 -4.63 117.35 127.17 1a2v s TYR 575 Ca 0.65 1.65 -0.18 0.00 0.64 0.00 0.00 57.07 59.84 1a2v s TYR 575 Cb -0.35 -3.17 0.04 0.00 0.42 0.00 0.00 41.96 38.91 1a2v s TYR 575 CO 0.42 -0.63 0.46 0.21 0.64 0.00 0.00 175.55 176.65 1a2v s LYS 576 N -2.26 0.63 0.34 4.97 2.47 -1.26 -4.96 119.74 119.67 1a2v s LYS 576 Ca 0.55 0.42 -0.29 0.00 -1.56 0.00 0.00 55.97 55.09 1a2v s LYS 576 Cb -0.25 0.30 -0.11 0.00 -1.46 0.00 0.00 37.83 36.31 1a2v s LYS 576 CO 0.31 -0.12 1.56 -0.51 0.16 0.00 0.00 175.35 176.74 1a2v s ASP 577 N -0.26 6.33 -0.78 1.43 1.01 -1.26 -2.78 116.67 120.37 1a2v s ASP 577 Ca -0.04 3.02 0.00 0.00 0.71 0.00 0.00 52.55 56.24 1a2v s ASP 577 Cb -0.03 -2.65 0.00 0.00 1.01 0.00 0.00 42.92 41.25 1a2v s ASP 577 CO 0.03 -0.92 0.00 0.59 0.21 0.00 0.00 175.17 175.08 1a2v n ASN 578 N 1.36 -3.20 -4.33 0.27 3.02 -1.26 -4.97 115.26 106.15 1a2v n ASN 578 Ca 0.05 0.02 -0.45 0.00 -0.03 0.00 0.00 54.58 54.17 1a2v n ASN 578 Cb 0.38 -2.36 -0.00 0.00 -0.61 0.00 0.00 39.78 37.19 1a2v n ASN 578 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1a2v s ARG 579 N -4.22 4.12 -0.15 3.52 0.52 -1.12 -4.76 118.95 116.87 1a2v s ARG 579 Ca 0.00 -3.14 -0.09 0.00 -0.52 0.00 0.00 55.73 51.98 1a2v s ARG 579 Cb 0.00 -4.53 -0.06 0.00 0.52 0.00 0.00 34.95 30.87 1a2v s ARG 579 CO 0.00 -1.25 -0.22 1.28 0.02 0.00 0.00 175.30 175.14 1a2v n LEU 580 N 2.83 1.28 -4.46 2.53 4.77 -1.26 -4.97 117.00 117.73 1a2v n LEU 580 Ca 0.23 0.22 -0.43 0.00 -0.03 0.00 0.00 56.01 55.99 1a2v n LEU 580 Cb 0.40 -0.52 -0.10 0.00 -2.33 0.00 0.00 43.42 40.88 1a2v n LEU 580 CO 0.45 0.17 -0.07 -0.31 -1.33 0.00 0.00 177.39 176.30 1a2v s TYR 581 N -2.36 3.24 0.67 -1.77 2.02 -1.26 -4.80 117.35 113.08 1a2v s TYR 581 Ca -0.22 -0.61 0.44 0.00 -0.37 0.00 0.00 57.07 56.31 1a2v s TYR 581 Cb 0.08 -2.62 2.42 0.00 -0.40 0.00 0.00 41.96 41.44 1a2v s TYR 581 CO 0.29 -0.60 2.37 -1.00 -1.57 0.00 0.00 175.55 175.04 1a2v h PRO 582 N 8.63 0.00 -0.56 -1.71 0.13 -1.94 -1.77 132.00 134.80 1a2v h PRO 582 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 1a2v h PRO 582 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1a2v h PRO 582 CO 0.74 0.00 0.00 0.43 -0.23 0.00 0.00 178.00 178.94 1a2v n SER 583 N -3.10 4.11 0.00 1.44 7.64 -1.26 -0.98 113.62 121.47 1a2v n SER 583 Ca -0.03 -2.32 0.00 0.00 1.01 0.00 0.00 58.87 57.53 1a2v n SER 583 Cb 0.07 -0.48 0.00 0.00 -1.01 0.00 0.00 64.21 62.79 1a2v n SER 583 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1a2v n GLY 584 N 0.92 1.65 0.18 0.23 0.00 -0.66 -4.65 105.19 102.85 1a2v n GLY 584 Ca 0.22 -1.95 -0.13 0.00 0.00 0.00 0.00 46.02 44.16 1a2v n GLY 584 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1a2v h ASP 585 N 0.00 0.62 -3.69 1.61 3.32 -1.98 -3.40 116.42 112.90 1a2v h ASP 585 Ca 0.00 -0.44 -0.65 0.00 0.02 0.00 0.00 57.03 55.96 1a2v h ASP 585 Cb 0.00 -0.19 -0.40 0.00 0.22 0.00 0.00 39.33 38.96 1a2v h ASP 585 CO 0.00 1.21 -0.72 -1.00 -1.72 0.00 0.00 179.24 177.02 1a2v s HIS 586 N -3.51 3.55 -0.02 4.55 3.76 -1.26 -4.89 115.29 117.46 1a2v s HIS 586 Ca -0.07 -2.91 -0.19 0.00 -0.15 0.00 0.00 55.06 51.74 1a2v s HIS 586 Cb 0.09 -2.82 -0.33 0.00 1.11 0.00 0.00 32.58 30.64 1a2v s HIS 586 CO 0.87 -0.93 0.91 0.28 -0.85 0.00 0.00 174.74 175.02 1a2v h VAL 587 N 6.52 1.38 -2.34 -0.90 2.07 -1.75 -3.43 116.25 117.79 1a2v h VAL 587 Ca -0.05 -2.60 -0.61 0.00 0.82 0.00 0.00 66.70 64.27 1a2v h VAL 587 Cb 1.01 3.11 0.07 0.00 -1.52 0.00 0.00 31.29 33.96 1a2v h VAL 587 CO 0.53 0.76 0.55 -2.65 0.02 0.00 0.00 177.57 176.77 1a2v n PRO 588 N -3.94 1.76 -1.25 1.57 -0.02 -1.25 -2.47 135.00 129.41 1a2v n PRO 588 Ca -0.16 0.63 -0.09 0.00 -2.02 0.00 0.00 63.50 61.86 1a2v n PRO 588 Cb 0.95 -2.27 -0.04 0.00 -0.02 0.00 0.00 33.50 32.12 1a2v n PRO 588 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1a2v n GLN 589 N 2.25 -1.28 -2.73 -0.52 6.02 -0.48 -3.99 117.38 116.65 1a2v n GLN 589 Ca 0.14 0.75 -0.42 0.00 -0.01 0.00 0.00 57.00 57.47 1a2v n GLN 589 Cb 0.28 -4.90 -0.04 0.00 1.02 0.00 0.00 30.24 26.60 1a2v n GLN 589 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 177.06 175.59 1a2v s TRP 590 N -1.99 3.72 0.18 1.08 -0.00 -1.03 -4.31 118.94 116.59 1a2v s TRP 590 Ca 0.00 1.73 0.24 0.00 -0.00 0.00 0.00 56.10 58.07 1a2v s TRP 590 Cb 0.00 -3.08 0.96 0.00 -0.00 0.00 0.00 33.47 31.35 1a2v s TRP 590 CO 0.00 0.08 1.85 0.66 -0.00 0.00 0.00 176.95 179.54 1a2v h SER 591 N 6.29 0.00 0.00 5.86 4.64 -1.93 -3.47 113.55 124.94 1a2v h SER 591 Ca -0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.90 1a2v h SER 591 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1a2v h SER 591 CO 0.74 0.23 0.00 0.61 -0.87 0.00 0.00 176.83 177.54 1a2v n GLY 592 N 0.03 0.62 3.71 -0.77 0.00 -1.26 -4.55 105.19 102.97 1a2v n GLY 592 Ca -0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.64 1a2v n GLY 592 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1a2v s ASP 593 N -2.42 6.52 0.00 1.61 1.01 -1.26 -4.67 116.67 117.47 1a2v s ASP 593 Ca 0.00 0.61 0.00 0.00 0.71 0.00 0.00 52.55 53.87 1a2v s ASP 593 Cb 0.00 -2.23 0.00 0.00 1.01 0.00 0.00 42.92 41.70 1a2v s ASP 593 CO 0.00 0.01 0.00 0.61 0.21 0.00 0.00 175.17 176.00 1a2v n GLY 594 N 3.52 3.93 3.42 0.21 0.00 -1.26 -4.99 105.19 110.02 1a2v n GLY 594 Ca -0.09 -1.60 -0.44 0.00 0.00 0.00 0.00 46.02 43.89 1a2v n GLY 594 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1a2v s VAL 595 N -2.22 4.73 0.17 1.61 1.01 -1.26 -4.87 120.40 119.57 1a2v s VAL 595 Ca 0.00 -1.19 -0.16 0.00 0.00 0.00 0.00 61.98 60.63 1a2v s VAL 595 Cb 0.00 -4.65 0.03 0.00 0.00 0.00 0.00 36.38 31.76 1a2v s VAL 595 CO 0.00 -1.35 0.45 0.00 0.00 0.00 0.00 175.10 174.21 1a2v s ARG 596 N 2.80 1.24 4.63 2.72 1.70 -1.26 -4.70 118.95 126.09 1a2v s ARG 596 Ca 0.23 -0.84 0.00 0.00 -0.47 0.00 0.00 55.73 54.65 1a2v s ARG 596 Cb -0.14 0.49 0.00 0.00 -0.57 0.00 0.00 34.95 34.73 1a2v s ARG 596 CO -0.00 -0.50 0.00 0.41 -1.08 0.00 0.00 175.30 174.12 1a2v n GLY 597 N -0.28 1.61 0.26 3.88 0.00 -1.26 -2.96 105.19 106.42 1a2v n GLY 597 Ca -0.12 -0.56 0.02 0.00 0.00 0.00 0.00 46.02 45.36 1a2v n GLY 597 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1a2v h MET 598 N 0.00 0.46 -0.93 1.61 1.85 -1.32 0.24 114.93 116.85 1a2v h MET 598 Ca 0.00 -0.03 0.17 0.00 -0.61 0.00 0.00 59.70 59.23 1a2v h MET 598 Cb 0.00 -0.10 -0.08 0.00 0.43 0.00 0.00 31.60 31.85 1a2v h MET 598 CO 0.00 0.30 0.59 -0.09 -0.40 0.00 0.00 176.91 177.32 1a2v h ARG 599 N 0.47 0.64 -0.09 0.39 2.43 -1.79 0.24 114.38 116.67 1a2v h ARG 599 Ca 0.35 -0.04 -0.13 0.00 -0.81 0.00 0.00 59.98 59.36 1a2v h ARG 599 Cb 0.46 -0.14 0.01 0.00 -0.42 0.00 0.00 29.97 29.87 1a2v h ARG 599 CO -0.33 0.42 -0.43 1.49 -1.51 0.00 0.00 179.97 179.61 1a2v h GLU 600 N 0.66 0.46 -0.39 0.20 4.81 -0.91 -2.48 114.58 116.93 1a2v h GLU 600 Ca 0.48 -0.37 -0.06 0.00 -0.13 0.00 0.00 59.36 59.29 1a2v h GLU 600 Cb 0.85 0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.29 1a2v h GLU 600 CO -0.24 1.00 -0.00 -1.49 -0.73 0.00 0.00 179.01 177.55 1a2v h TRP 601 N 0.02 0.64 -0.32 0.92 6.55 0.18 -2.70 115.95 121.24 1a2v h TRP 601 Ca -0.03 -0.07 -0.07 0.00 0.95 0.00 0.00 58.89 59.67 1a2v h TRP 601 Cb 1.08 -0.18 -0.01 0.00 -0.86 0.00 0.00 29.16 29.19 1a2v h TRP 601 CO 0.12 0.62 -0.08 0.82 -1.05 0.00 0.00 178.44 178.86 1a2v h ILE 602 N 0.58 1.28 0.00 1.49 2.04 -0.62 -3.44 117.51 118.84 1a2v h ILE 602 Ca 0.12 -1.14 0.00 0.00 1.00 0.00 0.00 64.86 64.84 1a2v h ILE 602 Cb 0.37 1.35 0.00 0.00 -0.74 0.00 0.00 36.82 37.81 1a2v h ILE 602 CO 0.01 0.37 0.00 0.61 0.00 0.00 0.00 178.15 179.14 1a2v n GLY 603 N -0.16 3.23 1.13 5.37 0.00 -0.94 -0.18 105.19 113.65 1a2v n GLY 603 Ca -0.03 -0.15 0.08 0.00 0.00 0.00 0.00 46.02 45.92 1a2v n GLY 603 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1a2v n ASP 604 N 6.35 3.29 -0.31 1.61 5.68 -1.26 -4.91 116.55 127.01 1a2v n ASP 604 Ca 0.00 -2.15 -0.04 0.00 -0.50 0.00 0.00 54.79 52.10 1a2v n ASP 604 Cb 0.00 -0.43 -0.02 0.00 -1.14 0.00 0.00 41.12 39.54 1a2v n ASP 604 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1a2v n GLY 605 N 1.17 0.52 0.18 6.12 0.00 0.75 -4.87 105.19 109.06 1a2v n GLY 605 Ca 0.19 -0.09 0.11 0.00 0.00 0.00 0.00 46.02 46.23 1a2v n GLY 605 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1a2v n SER 606 N -0.61 1.14 -4.77 1.61 3.41 -1.26 -0.98 113.62 112.16 1a2v n SER 606 Ca -0.04 -0.92 -0.39 0.00 -0.26 0.00 0.00 58.87 57.26 1a2v n SER 606 Cb 0.39 0.48 -0.03 0.00 -0.26 0.00 0.00 64.21 64.79 1a2v n SER 606 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1a2v s GLU 607 N -2.75 4.22 0.40 4.33 2.02 -1.26 -4.71 118.70 120.96 1a2v s GLU 607 Ca 0.15 1.87 -0.26 0.00 0.02 0.00 0.00 54.97 56.75 1a2v s GLU 607 Cb 0.18 -2.83 -0.09 0.00 0.10 0.00 0.00 34.13 31.49 1a2v s GLU 607 CO 0.67 -0.18 1.31 1.21 0.02 0.00 0.00 175.26 178.29 1a2v s ASN 608 N -1.01 6.31 -0.00 -0.19 2.47 -1.26 -1.10 114.94 120.16 1a2v s ASN 608 Ca 0.53 2.67 0.00 0.00 0.42 0.00 0.00 52.86 56.48 1a2v s ASN 608 Cb -0.32 -2.64 0.01 0.00 -1.45 0.00 0.00 41.25 36.85 1a2v s ASN 608 CO 0.41 -0.85 0.85 2.30 -3.72 0.00 0.00 177.10 176.09 1a2v n ILE 609 N 0.14 0.05 -3.61 -5.21 -5.35 -0.51 -4.65 119.36 100.22 1a2v n ILE 609 Ca 0.04 -0.06 -0.39 0.00 -0.27 0.00 0.00 62.75 62.08 1a2v n ILE 609 Cb 0.43 0.64 -0.11 0.00 -1.74 0.00 0.00 39.64 38.86 1a2v n ILE 609 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1a2v s ASP 610 N -0.74 5.81 -1.00 7.28 2.15 -1.24 -4.45 116.67 124.49 1a2v s ASP 610 Ca 0.01 -0.26 -0.07 0.00 0.43 0.00 0.00 52.55 52.66 1a2v s ASP 610 Cb 0.01 -2.07 -0.05 0.00 -0.30 0.00 0.00 42.92 40.51 1a2v s ASP 610 CO 0.00 -0.13 0.85 -3.20 -0.17 0.00 0.00 175.17 172.52 1a2v n ASN 611 N 5.04 -6.65 -1.12 -0.34 5.15 0.65 -4.98 115.26 113.00 1a2v n ASN 611 Ca -0.14 -0.64 -0.01 0.00 -0.60 0.00 0.00 54.58 53.20 1a2v n ASN 611 Cb 0.51 -4.89 0.00 0.00 -0.53 0.00 0.00 39.78 34.87 1a2v n ASN 611 CO 0.00 0.00 0.00 1.07 1.40 0.00 0.00 177.26 179.73 1a2v n THR 612 N -3.07 0.00 -2.89 -0.44 5.66 -0.59 -4.65 114.28 108.29 1a2v n THR 612 Ca -0.06 -0.07 -0.42 0.00 -3.05 0.00 0.00 64.05 60.44 1a2v n THR 612 Cb 0.59 0.07 -0.04 0.00 -1.55 0.00 0.00 70.33 69.40 1a2v n THR 612 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 1a2v s ASP 613 N -1.14 6.80 0.41 1.09 1.01 -1.26 -1.63 116.67 121.95 1a2v s ASP 613 Ca 0.01 0.96 0.05 0.00 0.71 0.00 0.00 52.55 54.29 1a2v s ASP 613 Cb -0.00 -2.43 -0.06 0.00 1.01 0.00 0.00 42.92 41.43 1a2v s ASP 613 CO 0.01 -0.55 0.02 0.27 0.21 0.00 0.00 175.17 175.13 1a2v s ILE 614 N 2.90 1.65 -0.05 0.77 -4.36 -1.26 -0.84 121.20 120.01 1a2v s ILE 614 Ca 0.35 -2.00 -0.00 0.00 -0.26 0.00 0.00 60.65 58.74 1a2v s ILE 614 Cb -0.15 -2.80 0.03 0.00 1.25 0.00 0.00 42.46 40.79 1a2v s ILE 614 CO 0.09 0.00 -0.01 -0.76 0.24 0.00 0.00 174.94 174.49 1a2v s LEU 615 N -3.69 0.98 -0.28 0.37 1.43 0.96 -4.36 118.68 114.08 1a2v s LEU 615 Ca 0.30 -0.07 -0.05 0.00 -1.03 0.00 0.00 54.13 53.28 1a2v s LEU 615 Cb 0.08 -0.37 0.02 0.00 0.03 0.00 0.00 46.19 45.95 1a2v s LEU 615 CO 0.15 -0.12 0.04 0.12 0.23 0.00 0.00 176.35 176.77 1a2v s PHE 616 N 1.36 3.14 -0.22 0.29 2.19 -0.59 -1.03 117.98 123.12 1a2v s PHE 616 Ca -0.05 -1.18 -0.04 0.00 0.33 0.00 0.00 56.93 55.99 1a2v s PHE 616 Cb -0.13 -2.20 -0.01 0.00 -1.31 0.00 0.00 43.02 39.37 1a2v s PHE 616 CO -0.02 -0.63 -0.03 -0.06 1.83 0.00 0.00 175.22 176.30 1a2v s PHE 617 N 1.44 2.97 -0.15 10.12 0.40 -0.11 -0.93 117.98 131.72 1a2v s PHE 617 Ca 0.01 -0.85 -0.03 0.00 -0.60 0.00 0.00 56.93 55.47 1a2v s PHE 617 Cb -0.17 -2.11 -0.02 0.00 0.51 0.00 0.00 43.02 41.22 1a2v s PHE 617 CO 0.01 -0.50 -0.06 -1.58 0.70 0.00 0.00 175.22 173.78 1a2v s HIS 618 N 1.44 2.97 -0.27 0.36 2.46 0.33 -1.46 115.29 121.11 1a2v s HIS 618 Ca 0.05 -0.41 -0.11 0.00 0.47 0.00 0.00 55.06 55.06 1a2v s HIS 618 Cb -0.14 -1.93 -0.05 0.00 -0.13 0.00 0.00 32.58 30.32 1a2v s HIS 618 CO -0.02 -0.10 0.19 0.99 -2.47 0.00 0.00 174.74 173.33 1a2v s THR 619 N 0.40 5.32 0.17 0.89 2.01 0.44 -0.54 115.64 124.33 1a2v s THR 619 Ca -0.06 0.17 -0.06 0.00 0.31 0.00 0.00 61.69 62.05 1a2v s THR 619 Cb -0.15 -3.53 -0.02 0.00 0.01 0.00 0.00 72.50 68.82 1a2v s THR 619 CO 0.04 0.26 0.23 0.72 -0.69 0.00 0.00 174.62 175.17 1a2v s PHE 620 N 1.67 0.60 -5.00 4.92 -0.71 -0.78 -4.61 117.98 114.07 1a2v s PHE 620 Ca 0.07 -0.95 0.00 0.00 -1.04 0.00 0.00 56.93 55.01 1a2v s PHE 620 Cb -0.16 -0.20 0.00 0.00 -1.21 0.00 0.00 43.02 41.45 1a2v s PHE 620 CO 0.10 -0.68 0.00 0.41 -1.34 0.00 0.00 175.22 173.71 1a2v n GLY 621 N -0.21 -0.44 3.17 1.99 0.00 0.07 0.42 105.19 110.18 1a2v n GLY 621 Ca -0.05 -1.04 -0.10 0.00 0.00 0.00 0.00 46.02 44.82 1a2v n GLY 621 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1a2v s ILE 622 N -3.30 0.11 -0.26 -0.61 -4.36 -0.20 -4.32 121.20 108.26 1a2v s ILE 622 Ca 0.00 -1.93 -0.02 0.00 -0.26 0.00 0.00 60.65 58.44 1a2v s ILE 622 Cb 0.00 -2.15 0.03 0.00 1.25 0.00 0.00 42.46 41.59 1a2v s ILE 622 CO 0.00 -0.36 -0.05 -0.89 0.24 0.00 0.00 174.94 173.88 1a2v s THR 623 N -4.05 2.92 -0.40 8.37 2.01 -1.26 -1.06 115.64 122.16 1a2v s THR 623 Ca 0.27 -1.09 -0.16 0.00 0.31 0.00 0.00 61.69 61.02 1a2v s THR 623 Cb 0.07 -2.52 0.01 0.00 0.01 0.00 0.00 72.50 70.07 1a2v s THR 623 CO 0.04 0.14 0.38 -2.28 -0.69 0.00 0.00 174.62 172.21 1a2v s HIS 624 N 1.31 3.20 -0.58 4.92 2.46 0.12 -5.00 115.29 121.72 1a2v s HIS 624 Ca -0.01 -0.33 -0.07 0.00 0.47 0.00 0.00 55.06 55.12 1a2v s HIS 624 Cb -0.17 -2.75 0.15 0.00 -0.13 0.00 0.00 32.58 29.67 1a2v s HIS 624 CO -0.04 -0.60 0.43 -0.06 -2.47 0.00 0.00 174.74 172.01 1a2v s PHE 625 N 1.99 3.50 0.39 3.88 0.08 -1.26 -2.07 117.98 124.48 1a2v s PHE 625 Ca 0.10 -2.26 -0.24 0.00 0.12 0.00 0.00 56.93 54.66 1a2v s PHE 625 Cb -0.17 -3.42 -0.12 0.00 -0.57 0.00 0.00 43.02 38.74 1a2v s PHE 625 CO 0.12 -0.94 0.74 -2.30 -0.10 0.00 0.00 175.22 172.74 1a2v n PRO 626 N 4.21 0.85 -4.09 0.24 -0.02 -1.26 -5.05 135.00 129.88 1a2v n PRO 626 Ca 0.02 0.31 -0.11 0.00 -2.02 0.00 0.00 63.50 61.70 1a2v n PRO 626 Cb 0.41 -1.67 -0.11 0.00 -0.02 0.00 0.00 33.50 32.11 1a2v n PRO 626 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1a2v s ALA 627 N -1.33 0.65 0.51 3.55 0.00 -1.26 -4.70 121.76 119.17 1a2v s ALA 627 Ca 0.63 -1.02 0.32 0.00 0.00 0.00 0.00 51.96 51.89 1a2v s ALA 627 Cb -0.62 0.14 1.45 0.00 0.00 0.00 0.00 23.12 24.08 1a2v s ALA 627 CO 0.58 -0.17 1.80 -1.35 0.00 0.00 0.00 175.76 176.61 1a2v h PRO 628 N 3.75 0.09 -0.11 0.00 0.11 -1.88 0.62 132.00 134.59 1a2v h PRO 628 Ca -0.35 -0.01 0.03 0.00 0.11 0.00 0.00 66.00 65.79 1a2v h PRO 628 Cb 1.18 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 1a2v h PRO 628 CO 0.53 0.06 0.19 0.93 -0.21 0.00 0.00 178.00 179.50 1a2v h GLU 629 N 0.09 0.00 -0.01 1.05 3.07 -1.96 0.91 114.58 117.73 1a2v h GLU 629 Ca 0.57 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.43 1a2v h GLU 629 Cb 2.07 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.98 1a2v h GLU 629 CO -0.08 0.00 -0.07 -0.25 -1.40 0.00 0.00 179.01 177.21 1a2v n ASP 630 N -3.43 0.78 -4.40 1.42 8.00 0.21 -4.50 116.55 114.63 1a2v n ASP 630 Ca -0.00 -0.98 -0.30 0.00 0.71 0.00 0.00 54.79 54.22 1a2v n ASP 630 Cb 0.29 -0.01 -0.13 0.00 -0.02 0.00 0.00 41.12 41.25 1a2v n ASP 630 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1a2v s PHE 631 N -2.24 2.37 -1.31 1.24 5.36 0.31 -2.43 117.98 121.28 1a2v s PHE 631 Ca 0.35 -0.36 0.29 0.00 -0.96 0.00 0.00 56.93 56.24 1a2v s PHE 631 Cb 0.21 -1.32 1.18 0.00 -0.34 0.00 0.00 43.02 42.75 1a2v s PHE 631 CO 0.42 0.28 1.85 -0.35 -1.46 0.00 0.00 175.22 175.97 1a2v n PRO 632 N 1.18 0.33 -3.91 10.12 -0.04 -1.26 -4.91 135.00 136.50 1a2v n PRO 632 Ca -0.17 -0.08 -0.21 0.00 -0.04 0.00 0.00 63.50 63.00 1a2v n PRO 632 Cb 0.53 -1.50 -0.17 0.00 -0.04 0.00 0.00 33.50 32.32 1a2v n PRO 632 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1a2v s LEU 633 N -2.73 0.90 -0.02 1.53 0.20 -1.25 -4.70 118.68 112.61 1a2v s LEU 633 Ca 0.22 -0.08 -0.18 0.00 0.69 0.00 0.00 54.13 54.79 1a2v s LEU 633 Cb 0.19 -0.38 -0.05 0.00 -0.43 0.00 0.00 46.19 45.52 1a2v s LEU 633 CO 0.52 -0.14 0.49 0.00 -0.29 0.00 0.00 176.35 176.93 1a2v s MET 634 N 1.48 4.16 0.43 1.98 0.23 -0.22 -4.79 119.30 122.57 1a2v s MET 634 Ca -0.03 0.54 -0.25 0.00 -1.03 0.00 0.00 55.69 54.92 1a2v s MET 634 Cb -0.13 -3.30 -0.08 0.00 -1.53 0.00 0.00 34.83 29.79 1a2v s MET 634 CO -0.03 0.48 1.27 -2.14 -2.03 0.00 0.00 175.02 172.57 1a2v s PRO 635 N -0.46 3.82 0.25 3.16 0.02 -1.26 -3.90 135.00 136.63 1a2v s PRO 635 Ca 0.26 2.06 -0.30 0.00 0.02 0.00 0.00 61.00 63.04 1a2v s PRO 635 Cb -0.17 -2.61 -0.14 0.00 0.02 0.00 0.00 34.50 31.60 1a2v s PRO 635 CO 0.14 -0.58 1.19 0.00 -0.33 0.00 0.00 177.00 177.43 1a2v n ALA 636 N -0.15 0.19 -3.14 -1.55 0.00 -1.25 -4.78 120.51 109.82 1a2v n ALA 636 Ca 0.05 0.41 -0.33 0.00 0.00 0.00 0.00 53.44 53.57 1a2v n ALA 636 Cb 0.45 -2.12 -0.14 0.00 0.00 0.00 0.00 19.45 17.64 1a2v n ALA 636 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1a2v s GLU 637 N -0.98 3.42 0.25 0.00 2.12 0.58 -4.86 118.70 119.24 1a2v s GLU 637 Ca 0.65 -0.65 -0.11 0.00 0.36 0.00 0.00 54.97 55.21 1a2v s GLU 637 Cb -0.71 -2.73 -0.08 0.00 0.26 0.00 0.00 34.13 30.88 1a2v s GLU 637 CO 0.55 0.15 0.59 -1.25 -0.54 0.00 0.00 175.26 174.77 1a2v s PRO 638 N 0.54 3.85 -0.05 4.30 0.04 -1.26 0.29 135.00 142.71 1a2v s PRO 638 Ca -0.07 0.37 -0.03 0.00 0.04 0.00 0.00 61.00 61.31 1a2v s PRO 638 Cb -0.15 -2.60 0.02 0.00 0.04 0.00 0.00 34.50 31.81 1a2v s PRO 638 CO 0.04 0.28 0.12 0.42 0.04 0.00 0.00 177.00 177.90 1a2v s ILE 639 N -1.85 -0.02 0.11 0.56 1.01 0.10 -4.98 121.20 116.13 1a2v s ILE 639 Ca 0.49 0.09 -0.04 0.00 0.00 0.00 0.00 60.65 61.19 1a2v s ILE 639 Cb -0.11 -0.20 -0.03 0.00 0.01 0.00 0.00 42.46 42.14 1a2v s ILE 639 CO 0.20 0.04 0.12 0.28 0.00 0.00 0.00 174.94 175.58 1a2v s THR 640 N 0.60 0.13 -0.08 2.92 -1.32 -1.26 -0.37 115.64 116.25 1a2v s THR 640 Ca -0.04 -1.64 -0.30 0.00 -1.21 0.00 0.00 61.69 58.50 1a2v s THR 640 Cb -0.06 -1.76 0.07 0.00 -1.51 0.00 0.00 72.50 69.24 1a2v s THR 640 CO -0.03 -0.57 0.70 -1.48 -2.21 0.00 0.00 174.62 171.03 1a2v s LEU 641 N -2.97 -0.66 0.05 9.08 2.34 -1.05 -4.58 118.68 120.90 1a2v s LEU 641 Ca 0.15 0.79 -0.00 0.00 0.06 0.00 0.00 54.13 55.13 1a2v s LEU 641 Cb 0.06 2.50 -0.04 0.00 -0.56 0.00 0.00 46.19 48.16 1a2v s LEU 641 CO -0.03 -0.56 -0.04 -0.32 -1.06 0.00 0.00 176.35 174.34 1a2v s MET 642 N -1.01 0.60 -0.38 1.48 1.75 -0.66 -1.58 119.30 119.50 1a2v s MET 642 Ca -0.09 -1.13 0.01 0.00 -1.25 0.00 0.00 55.69 53.23 1a2v s MET 642 Cb -0.01 0.11 0.12 0.00 2.84 0.00 0.00 34.83 37.89 1a2v s MET 642 CO 0.09 -0.08 0.17 -0.51 -0.65 0.00 0.00 175.02 174.03 1a2v s LEU 643 N -2.67 2.74 0.08 4.11 1.43 0.41 -0.42 118.68 124.37 1a2v s LEU 643 Ca 0.04 -2.21 -0.10 0.00 -1.03 0.00 0.00 54.13 50.82 1a2v s LEU 643 Cb 0.04 -1.04 -0.06 0.00 0.03 0.00 0.00 46.19 45.17 1a2v s LEU 643 CO -0.07 -0.33 0.41 -0.13 0.23 0.00 0.00 176.35 176.46 1a2v s ARG 644 N 0.88 3.79 -0.05 1.70 0.52 -0.35 -2.40 118.95 123.04 1a2v s ARG 644 Ca 0.14 0.21 -0.30 0.00 -0.52 0.00 0.00 55.73 55.27 1a2v s ARG 644 Cb -0.21 -3.00 -0.03 0.00 0.52 0.00 0.00 34.95 32.23 1a2v s ARG 644 CO -0.10 0.56 1.08 -1.25 0.02 0.00 0.00 175.30 175.61 1a2v s PRO 645 N -1.88 4.43 -0.15 3.54 0.04 -1.26 0.85 135.00 140.57 1a2v s PRO 645 Ca 0.33 1.53 -0.01 0.00 0.04 0.00 0.00 61.00 62.89 1a2v s PRO 645 Cb -0.14 -3.51 0.04 0.00 0.04 0.00 0.00 34.50 30.93 1a2v s PRO 645 CO 0.18 -0.30 -0.02 1.03 0.04 0.00 0.00 177.00 177.93 1a2v s ARG 646 N 1.77 1.04 0.00 4.56 1.81 0.28 -4.67 118.95 123.74 1a2v s ARG 646 Ca 0.53 -0.35 0.00 0.00 -1.72 0.00 0.00 55.73 54.19 1a2v s ARG 646 Cb -0.22 -1.79 0.00 0.00 -0.45 0.00 0.00 34.95 32.49 1a2v s ARG 646 CO 0.22 -0.46 0.00 0.72 -0.68 0.00 0.00 175.30 175.11 1a2v n HIS 647 N 4.98 0.00 -0.05 -0.53 8.25 -1.26 -2.38 115.22 124.23 1a2v n HIS 647 Ca -0.10 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.23 1a2v n HIS 647 Cb 0.48 -0.40 -0.12 0.00 1.12 0.00 0.00 29.99 31.07 1a2v n HIS 647 CO 0.00 0.00 0.00 0.35 0.64 0.00 0.00 176.34 177.33 1a2v h PHE 648 N 0.00 -0.00 -1.53 4.41 3.57 -1.83 -3.35 116.94 118.21 1a2v h PHE 648 Ca 0.00 -0.00 -0.43 0.00 3.53 0.00 0.00 57.97 61.07 1a2v h PHE 648 Cb 0.19 0.00 0.01 0.00 2.79 0.00 0.00 35.95 38.95 1a2v h PHE 648 CO 0.12 0.79 -0.28 -0.06 -2.23 0.00 0.00 178.31 176.64 1a2v s PHE 649 N -2.99 2.87 -2.41 0.41 0.08 -1.26 -4.92 117.98 109.77 1a2v s PHE 649 Ca -0.18 -0.36 0.22 0.00 0.12 0.00 0.00 56.93 56.73 1a2v s PHE 649 Cb -0.01 -2.28 0.09 0.00 -0.57 0.00 0.00 43.02 40.24 1a2v s PHE 649 CO 0.67 -0.31 1.14 0.25 -0.10 0.00 0.00 175.22 176.87 1a2v n THR 650 N -1.79 0.00 -3.58 0.64 -2.24 -1.26 -4.99 114.28 101.06 1a2v n THR 650 Ca 0.06 -0.39 -0.05 0.00 -2.27 0.00 0.00 64.05 61.40 1a2v n THR 650 Cb 0.59 1.36 -0.02 0.00 -2.10 0.00 0.00 70.33 70.17 1a2v n THR 650 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1a2v s GLU 651 N -2.14 0.63 -0.25 -0.78 -1.05 -1.26 -5.00 118.70 108.85 1a2v s GLU 651 Ca 0.22 -0.27 -0.40 0.00 -0.15 0.00 0.00 54.97 54.37 1a2v s GLU 651 Cb 0.18 0.27 -0.16 0.00 -0.44 0.00 0.00 34.13 33.98 1a2v s GLU 651 CO 0.41 -0.28 1.69 -1.71 0.95 0.00 0.00 175.26 176.32 1a2v n ASN 652 N -0.25 2.22 0.00 0.83 2.85 -1.26 -4.84 115.26 114.81 1a2v n ASN 652 Ca -0.05 1.09 0.12 0.00 -0.11 0.00 0.00 54.58 55.63 1a2v n ASN 652 Cb 0.60 -1.13 0.59 0.00 1.24 0.00 0.00 39.78 41.08 1a2v n ASN 652 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 1a2v n PRO 653 N 4.95 0.16 -0.54 1.20 -0.04 -1.26 -3.56 135.00 135.91 1a2v n PRO 653 Ca 0.26 0.06 0.08 0.00 -0.04 0.00 0.00 63.50 63.86 1a2v n PRO 653 Cb 0.12 -1.50 0.31 0.00 -0.04 0.00 0.00 33.50 32.39 1a2v n PRO 653 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1a2v n GLY 654 N 1.02 3.11 0.28 0.55 0.00 -1.26 -4.49 105.19 104.40 1a2v n GLY 654 Ca 0.09 -0.83 0.16 0.00 0.00 0.00 0.00 46.02 45.44 1a2v n GLY 654 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1a2v h LEU 655 N 3.17 0.00 -1.90 0.99 3.38 -1.93 -1.95 115.31 117.07 1a2v h LEU 655 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1a2v h LEU 655 Cb 1.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.15 1a2v h LEU 655 CO 0.22 0.07 0.00 -0.90 0.09 0.00 0.00 178.44 177.92 1a2v n ASP 656 N -3.26 2.81 -4.77 -0.43 5.75 -1.26 -4.82 116.55 110.57 1a2v n ASP 656 Ca -0.01 -2.24 -0.39 0.00 -0.01 0.00 0.00 54.79 52.15 1a2v n ASP 656 Cb 0.28 -0.43 -0.06 0.00 -1.03 0.00 0.00 41.12 39.88 1a2v n ASP 656 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 1a2v s ILE 657 N -1.70 4.88 -0.03 2.12 1.01 -0.73 -4.98 121.20 121.77 1a2v s ILE 657 Ca 0.28 1.22 -0.30 0.00 0.00 0.00 0.00 60.65 61.85 1a2v s ILE 657 Cb 0.18 -3.92 -0.09 0.00 0.01 0.00 0.00 42.46 38.65 1a2v s ILE 657 CO 0.13 0.45 2.02 0.00 0.00 0.00 0.00 174.94 177.55 1a2v n GLN 658 N 2.50 2.61 -1.31 2.79 1.13 -1.26 -4.94 117.38 118.90 1a2v n GLN 658 Ca -0.08 0.92 -0.34 0.00 -1.94 0.00 0.00 57.00 55.56 1a2v n GLN 658 Cb 0.51 -3.01 0.11 0.00 0.11 0.00 0.00 30.24 27.95 1a2v n GLN 658 CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 1a2v s PRO 659 N 4.82 1.95 0.13 -1.09 0.04 -1.26 -4.81 135.00 134.78 1a2v s PRO 659 Ca 0.92 1.77 -0.04 0.00 0.04 0.00 0.00 61.00 63.69 1a2v s PRO 659 Cb -0.45 -1.81 -0.11 0.00 0.04 0.00 0.00 34.50 32.18 1a2v s PRO 659 CO 0.42 -1.98 1.29 0.77 0.04 0.00 0.00 177.00 177.54 1a2v h SER 660 N -0.51 0.51 -4.75 6.66 0.02 0.10 -3.46 113.55 112.12 1a2v h SER 660 Ca -0.47 -0.42 -0.14 0.00 -0.84 0.00 0.00 61.79 59.92 1a2v h SER 660 Cb 1.30 -0.16 -0.21 0.00 0.14 0.00 0.00 62.40 63.47 1a2v h SER 660 CO 0.48 1.23 -0.40 -0.47 -1.14 0.00 0.00 176.83 176.53 1a2v s TYR 661 N -3.21 -0.10 -0.30 3.45 5.04 -0.88 -4.99 117.35 116.36 1a2v s TYR 661 Ca -0.05 0.17 -0.12 0.00 -2.44 0.00 0.00 57.07 54.62 1a2v s TYR 661 Cb 0.09 0.03 0.14 0.00 0.35 0.00 0.00 41.96 42.56 1a2v s TYR 661 CO 0.87 -0.29 0.75 0.00 -1.34 0.00 0.00 175.55 175.53 1a2v s ALA 662 N -1.06 -2.21 -0.09 3.97 0.00 -1.26 -1.09 121.76 120.02 1a2v s ALA 662 Ca -0.11 2.28 0.00 0.00 0.00 0.00 0.00 51.96 54.13 1a2v s ALA 662 Cb -0.06 -1.82 0.02 0.00 0.00 0.00 0.00 23.12 21.26 1a2v s ALA 662 CO 0.02 -0.88 -0.08 1.41 0.00 0.00 0.00 175.76 176.23 1a2v s MET 663 N 2.65 1.48 0.62 0.00 0.00 0.14 -4.98 119.30 119.20 1a2v s MET 663 Ca -0.05 -0.27 -0.10 0.00 0.00 0.00 0.00 55.69 55.26 1a2v s MET 663 Cb -0.10 -1.46 -0.03 0.00 0.00 0.00 0.00 34.83 33.24 1a2v s MET 663 CO -0.19 -0.18 1.01 0.99 0.00 0.00 0.00 175.02 176.65 1a2v s THR 664 N 1.39 4.49 0.13 10.11 2.01 -1.26 -1.18 115.64 131.34 1a2v s THR 664 Ca -0.01 0.70 -0.16 0.00 0.31 0.00 0.00 61.69 62.53 1a2v s THR 664 Cb -0.14 -3.79 -0.01 0.00 0.01 0.00 0.00 72.50 68.57 1a2v s THR 664 CO -0.04 -1.00 1.67 0.74 -0.69 0.00 0.00 174.62 175.30 1a2v h THR 665 N -0.31 1.20 -0.57 -0.82 2.02 -1.95 0.06 112.91 112.54 1a2v h THR 665 Ca -0.45 -0.61 -0.04 0.00 0.77 0.00 0.00 66.41 66.08 1a2v h THR 665 Cb 1.20 0.88 -0.02 0.00 -1.74 0.00 0.00 68.15 68.47 1a2v h THR 665 CO 0.62 0.22 0.20 0.77 0.37 0.00 0.00 175.52 177.70 1a2v h SER 666 N 0.48 0.82 -0.27 4.18 4.64 -2.00 -2.42 113.55 118.98 1a2v h SER 666 Ca 0.13 -0.19 -0.03 0.00 -0.47 0.00 0.00 61.79 61.23 1a2v h SER 666 Cb 0.20 -0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 62.06 1a2v h SER 666 CO -0.01 0.79 0.10 -0.33 -0.87 0.00 0.00 176.83 176.50 1a2v h GLU 667 N 0.80 0.48 0.00 4.77 5.08 -1.87 -1.20 114.58 122.64 1a2v h GLU 667 Ca 0.19 -0.07 -0.06 0.00 -1.00 0.00 0.00 59.36 58.42 1a2v h GLU 667 Cb 0.25 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 1a2v h GLU 667 CO -0.01 0.44 -0.29 0.00 -1.00 0.00 0.00 179.01 178.15 1a2v h ALA 668 N 1.63 1.06 -0.01 3.43 0.00 -0.52 -2.02 119.26 122.84 1a2v h ALA 668 Ca 0.12 -0.26 -0.11 0.00 0.00 0.00 0.00 54.91 54.66 1a2v h ALA 668 Cb 0.16 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 17.92 1a2v h ALA 668 CO -0.01 0.36 -0.42 0.87 0.00 0.00 0.00 179.25 180.05 1a2v h LYS 669 N 0.00 0.31 -0.44 0.00 1.57 -0.85 -3.18 116.57 113.98 1a2v h LYS 669 Ca -0.00 -0.31 0.06 0.00 -1.87 0.00 0.00 60.65 58.52 1a2v h LYS 669 Cb 0.75 0.09 -0.05 0.00 0.08 0.00 0.00 32.23 33.10 1a2v h LYS 669 CO 0.04 1.00 0.16 0.00 -0.57 0.00 0.00 179.45 180.08 1a2v h ARG 670 N -0.26 0.32 0.00 3.15 3.08 -1.09 0.66 114.38 120.23 1a2v h ARG 670 Ca -0.05 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.98 1a2v h ARG 670 Cb 1.14 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.12 1a2v h ARG 670 CO 0.08 0.21 0.06 0.00 -1.07 0.00 0.00 179.97 179.26 1a2v n ALA 671 N -2.39 0.92 -0.75 0.04 0.00 -0.78 -5.12 120.51 112.44 1a2v n ALA 671 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1a2v n ALA 671 Cb 0.17 -0.85 0.00 0.00 0.00 0.00 0.00 19.45 18.77 1a2v n ALA 671 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78