#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 3.44 0.68 0.55 0.00 -1.26 -4.95 121.76 120.22 1a2v s ALA 19 Ca 0.00 -0.75 -0.17 0.00 0.00 0.00 0.00 51.96 51.04 1a2v s ALA 19 Cb 0.00 -1.77 0.01 0.00 0.00 0.00 0.00 23.12 21.36 1a2v s ALA 19 CO 0.00 0.40 1.27 0.54 0.00 0.00 0.00 175.76 177.97 1a2v n ARG 20 N 2.78 0.93 -2.13 0.00 1.74 -1.26 -4.96 116.66 113.76 1a2v n ARG 20 Ca -0.18 0.38 -0.27 0.00 -0.77 0.00 0.00 57.85 57.01 1a2v n ARG 20 Cb 0.53 -2.51 0.06 0.00 -1.02 0.00 0.00 32.46 29.52 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 -3.50 2.46 0.23 5.56 0.04 -1.26 -4.97 135.00 133.56 1a2v s PRO 21 Ca 0.81 0.02 -0.07 0.00 0.04 0.00 0.00 61.00 61.79 1a2v s PRO 21 Cb -0.36 -2.12 0.20 0.00 0.04 0.00 0.00 34.50 32.25 1a2v s PRO 21 CO 0.42 -1.13 1.86 0.00 0.04 0.00 0.00 177.00 178.19 1a2v h ALA 22 N -0.59 1.13 -3.95 8.56 0.00 -1.98 -3.43 119.26 119.00 1a2v h ALA 22 Ca -0.45 -0.12 -0.52 0.00 0.00 0.00 0.00 54.91 53.83 1a2v h ALA 22 Cb 1.29 -0.35 -0.31 0.00 0.00 0.00 0.00 17.79 18.42 1a2v h ALA 22 CO 0.62 0.62 -0.82 -1.58 0.00 0.00 0.00 179.25 178.09 1a2v s HIS 23 N -5.90 1.45 0.64 0.00 5.65 -1.26 -5.04 115.29 110.83 1a2v s HIS 23 Ca -0.13 -0.38 0.31 0.00 0.25 0.00 0.00 55.06 55.11 1a2v s HIS 23 Cb 0.17 -0.98 1.66 0.00 -1.18 0.00 0.00 32.58 32.25 1a2v s HIS 23 CO 0.82 -0.12 1.98 -1.35 -0.65 0.00 0.00 174.74 175.42 1a2v h PRO 24 N 6.19 0.00 -0.02 2.88 0.11 -1.97 -0.05 132.00 139.14 1a2v h PRO 24 Ca -0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.78 1a2v h PRO 24 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1a2v h PRO 24 CO 0.48 0.00 -0.23 1.28 -0.21 0.00 0.00 178.00 179.33 1a2v n LEU 25 N -3.22 1.96 -4.76 2.35 4.77 -1.26 -4.68 117.00 112.16 1a2v n LEU 25 Ca 0.01 -0.66 -0.41 0.00 -0.03 0.00 0.00 56.01 54.91 1a2v n LEU 25 Cb 0.41 -0.03 -0.01 0.00 -2.33 0.00 0.00 43.42 41.46 1a2v n LEU 25 CO 0.19 0.35 1.20 -1.81 -1.33 0.00 0.00 177.39 175.98 1a2v s ASP 26 N -2.28 6.37 0.84 -1.43 1.01 -0.04 -4.86 116.67 116.29 1a2v s ASP 26 Ca 0.26 2.98 -0.12 0.00 0.71 0.00 0.00 52.55 56.38 1a2v s ASP 26 Cb 0.19 -2.65 0.11 0.00 1.01 0.00 0.00 42.92 41.58 1a2v s ASP 26 CO 0.45 -0.89 1.17 -2.84 0.21 0.00 0.00 175.17 173.27 1a2v s PRO 27 N -1.15 1.46 0.52 8.23 0.02 -1.26 -4.90 135.00 137.91 1a2v s PRO 27 Ca 0.59 1.61 -0.23 0.00 0.02 0.00 0.00 61.00 62.99 1a2v s PRO 27 Cb -0.47 -1.77 -0.06 0.00 0.02 0.00 0.00 34.50 32.22 1a2v s PRO 27 CO 0.54 -2.32 1.37 1.28 -0.33 0.00 0.00 177.00 177.54 1a2v n LEU 28 N -3.69 5.39 -4.93 -5.54 4.77 -1.26 -5.00 117.00 106.74 1a2v n LEU 28 Ca 0.12 1.01 -0.27 0.00 -0.03 0.00 0.00 56.01 56.85 1a2v n LEU 28 Cb 0.51 -1.58 0.09 0.00 -2.33 0.00 0.00 43.42 40.11 1a2v n LEU 28 CO 0.49 -0.49 0.68 -0.94 -1.33 0.00 0.00 177.39 175.80 1a2v s SER 29 N -0.80 4.53 0.52 -1.43 1.04 -1.26 -4.84 113.70 111.46 1a2v s SER 29 Ca 0.69 0.46 0.27 0.00 0.48 0.00 0.00 55.95 57.85 1a2v s SER 29 Cb -0.43 -0.99 1.43 0.00 0.10 0.00 0.00 66.02 66.13 1a2v s SER 29 CO 0.51 -1.81 2.06 0.71 0.98 0.00 0.00 173.24 175.70 1a2v h THR 30 N -0.81 0.57 -0.01 2.02 1.35 -1.95 -0.78 112.91 113.30 1a2v h THR 30 Ca -0.44 -0.55 -0.21 0.00 -0.55 0.00 0.00 66.41 64.66 1a2v h THR 30 Cb 1.31 1.36 0.02 0.00 -1.73 0.00 0.00 68.15 69.10 1a2v h THR 30 CO 0.58 0.12 -0.81 0.00 -0.25 0.00 0.00 175.52 175.15 1a2v h ALA 31 N 1.88 0.11 -0.57 6.62 0.00 -1.99 -2.51 119.26 122.80 1a2v h ALA 31 Ca -0.00 -0.63 -0.09 0.00 0.00 0.00 0.00 54.91 54.19 1a2v h ALA 31 Cb 0.35 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1a2v h ALA 31 CO 0.02 0.52 -0.02 0.93 0.00 0.00 0.00 179.25 180.70 1a2v h GLU 32 N 0.17 1.00 -0.37 0.00 5.08 -1.79 0.11 114.58 118.78 1a2v h GLU 32 Ca -0.10 -0.31 0.01 0.00 -1.00 0.00 0.00 59.36 57.96 1a2v h GLU 32 Cb 1.49 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 30.63 1a2v h GLU 32 CO 0.16 0.99 0.22 0.82 -1.00 0.00 0.00 179.01 180.21 1a2v h ILE 33 N 0.91 1.05 -0.29 3.13 2.04 -1.19 -0.27 117.51 122.89 1a2v h ILE 33 Ca 0.16 -0.16 -0.04 0.00 1.00 0.00 0.00 64.86 65.82 1a2v h ILE 33 Cb 0.55 0.55 -0.01 0.00 -0.74 0.00 0.00 36.82 37.18 1a2v h ILE 33 CO 0.03 0.08 0.02 0.50 0.00 0.00 0.00 178.15 178.78 1a2v h LYS 34 N 0.46 0.51 -0.36 2.37 1.63 -1.09 -0.73 116.57 119.35 1a2v h LYS 34 Ca 0.15 -0.15 0.03 0.00 -0.85 0.00 0.00 60.65 59.83 1a2v h LYS 34 Cb -0.01 -0.05 -0.02 0.00 -0.60 0.00 0.00 32.23 31.55 1a2v h LYS 34 CO -0.06 0.64 0.24 0.00 -3.45 0.00 0.00 179.45 176.82 1a2v h ALA 35 N 0.85 1.90 0.13 5.00 0.00 -0.49 0.11 119.26 126.76 1a2v h ALA 35 Ca 0.09 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1a2v h ALA 35 Cb 0.40 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1a2v h ALA 35 CO 0.01 0.05 -0.06 0.00 0.00 0.00 0.00 179.25 179.25 1a2v h ALA 36 N 1.80 -0.17 -0.79 0.00 0.00 -0.67 -1.56 119.26 117.87 1a2v h ALA 36 Ca 0.15 -0.24 0.03 0.00 0.00 0.00 0.00 54.91 54.84 1a2v h ALA 36 Cb 0.16 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 1a2v h ALA 36 CO -0.03 -0.29 0.52 1.79 0.00 0.00 0.00 179.25 181.24 1a2v h THR 37 N -0.78 1.14 -0.30 0.00 1.35 -0.65 0.25 112.91 113.92 1a2v h THR 37 Ca -0.02 -0.34 -0.02 0.00 -0.55 0.00 0.00 66.41 65.48 1a2v h THR 37 Cb 0.55 0.06 -0.01 0.00 -1.73 0.00 0.00 68.15 67.01 1a2v h THR 37 CO 0.03 0.18 0.10 0.78 -0.25 0.00 0.00 175.52 176.36 1a2v h ASN 38 N 1.00 0.44 -0.91 5.36 2.35 -0.82 0.63 115.58 123.63 1a2v h ASN 38 Ca 0.31 -0.20 0.03 0.00 -0.55 0.00 0.00 56.30 55.90 1a2v h ASN 38 Cb 0.00 -0.11 -0.05 0.00 0.05 0.00 0.00 38.32 38.20 1a2v h ASN 38 CO -0.08 0.52 0.59 0.74 -1.65 0.00 0.00 177.43 177.54 1a2v h THR 39 N 0.33 1.15 -0.15 2.81 2.02 -0.15 -1.81 112.91 117.12 1a2v h THR 39 Ca 0.10 -0.39 -0.08 0.00 0.77 0.00 0.00 66.41 66.80 1a2v h THR 39 Cb 0.23 -0.09 -0.00 0.00 -1.74 0.00 0.00 68.15 66.55 1a2v h THR 39 CO -0.00 0.21 -0.24 0.58 0.37 0.00 0.00 175.52 176.43 1a2v h VAL 40 N 1.14 1.36 -0.95 3.16 2.07 -0.68 -1.98 116.25 120.37 1a2v h VAL 40 Ca 0.36 -1.48 0.12 0.00 0.82 0.00 0.00 66.70 66.52 1a2v h VAL 40 Cb 0.00 1.97 -0.08 0.00 -1.52 0.00 0.00 31.29 31.66 1a2v h VAL 40 CO -0.12 0.44 0.60 0.11 0.02 0.00 0.00 177.57 178.62 1a2v h LYS 41 N 0.04 0.87 -0.23 1.57 1.57 -0.63 -0.42 116.57 119.33 1a2v h LYS 41 Ca 0.01 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 58.69 1a2v h LYS 41 Cb 0.82 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.92 1a2v h LYS 41 CO 0.05 0.58 -0.03 0.77 -0.57 0.00 0.00 179.45 180.25 1a2v h SER 42 N 0.90 0.43 -0.84 0.86 0.02 -1.23 -2.29 113.55 111.40 1a2v h SER 42 Ca 0.46 -0.34 0.08 0.00 -0.84 0.00 0.00 61.79 61.15 1a2v h SER 42 Cb 0.52 -0.12 -0.07 0.00 0.14 0.00 0.00 62.40 62.88 1a2v h SER 42 CO -0.23 0.66 0.51 0.22 -1.14 0.00 0.00 176.83 176.85 1a2v h TYR 43 N 0.18 0.93 -1.19 3.45 3.20 -0.43 -2.02 116.97 121.10 1a2v h TYR 43 Ca 0.06 0.03 -0.69 0.00 3.14 0.00 0.00 58.73 61.27 1a2v h TYR 43 Cb 0.46 -0.29 -0.30 0.00 1.54 0.00 0.00 36.73 38.14 1a2v h TYR 43 CO 0.04 0.44 0.80 1.19 -1.64 0.00 0.00 178.16 178.99 1a2v n PHE 44 N -4.67 3.16 -1.70 -3.82 3.72 -0.29 -5.01 117.46 108.84 1a2v n PHE 44 Ca 0.13 -2.85 -0.43 0.00 -0.05 0.00 0.00 57.45 54.24 1a2v n PHE 44 Cb 0.22 -1.32 -0.03 0.00 -0.94 0.00 0.00 39.48 37.41 1a2v n PHE 44 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1a2v n ALA 45 N -0.83 2.15 0.00 4.37 0.00 -0.76 -1.09 120.51 124.35 1a2v n ALA 45 Ca 0.60 0.41 0.00 0.00 0.00 0.00 0.00 53.44 54.45 1a2v n ALA 45 Cb 0.59 -2.43 0.00 0.00 0.00 0.00 0.00 19.45 17.61 1a2v n ALA 45 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1a2v n GLY 46 N 3.17 1.80 3.87 0.00 0.00 -1.26 -5.02 105.19 107.76 1a2v n GLY 46 Ca 0.14 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.41 3.56 -1.09 1.61 -0.14 -0.25 -5.02 119.74 118.00 1a2v s LYS 47 Ca 0.00 -0.01 -0.18 0.00 -1.36 0.00 0.00 55.97 54.42 1a2v s LYS 47 Cb 0.00 -3.18 0.11 0.00 -1.68 0.00 0.00 37.83 33.08 1a2v s LYS 47 CO 0.00 0.74 1.39 0.21 -0.76 0.00 0.00 175.35 176.93 1a2v s LYS 48 N -1.14 3.80 0.19 1.68 2.20 -1.26 -5.00 119.74 120.21 1a2v s LYS 48 Ca 0.18 -1.89 0.04 0.00 -0.36 0.00 0.00 55.97 53.94 1a2v s LYS 48 Cb -0.13 -5.16 -0.03 0.00 -1.51 0.00 0.00 37.83 30.99 1a2v s LYS 48 CO 0.08 -1.95 0.30 0.96 -0.36 0.00 0.00 175.35 174.38 1a2v s ILE 49 N 3.14 5.20 0.02 5.43 -4.36 -1.26 -1.40 121.20 127.97 1a2v s ILE 49 Ca 0.42 -0.86 0.03 0.00 -0.26 0.00 0.00 60.65 59.98 1a2v s ILE 49 Cb -0.02 -3.74 -0.01 0.00 1.25 0.00 0.00 42.46 39.94 1a2v s ILE 49 CO -0.04 -0.19 -0.10 -0.55 0.24 0.00 0.00 174.94 174.30 1a2v s SER 50 N -3.53 1.13 -0.19 4.36 0.15 0.92 -4.96 113.70 111.57 1a2v s SER 50 Ca 0.34 -0.32 -0.16 0.00 0.70 0.00 0.00 55.95 56.51 1a2v s SER 50 Cb -0.10 -0.07 -0.04 0.00 -1.71 0.00 0.00 66.02 64.10 1a2v s SER 50 CO 0.28 0.02 0.42 -0.36 1.20 0.00 0.00 173.24 174.80 1a2v s PHE 51 N -0.63 3.39 -0.26 3.44 0.08 0.23 -0.99 117.98 123.24 1a2v s PHE 51 Ca -0.00 0.66 0.01 0.00 0.12 0.00 0.00 56.93 57.72 1a2v s PHE 51 Cb -0.06 -2.54 -0.16 0.00 -0.57 0.00 0.00 43.02 39.69 1a2v s PHE 51 CO 0.00 0.00 -0.23 -1.71 -0.10 0.00 0.00 175.22 173.18 1a2v n ASN 52 N 4.42 2.02 -3.71 1.36 2.85 0.72 -3.89 115.26 119.03 1a2v n ASN 52 Ca -0.08 -0.10 -0.12 0.00 -0.11 0.00 0.00 54.58 54.17 1a2v n ASN 52 Cb 0.51 -0.43 -0.10 0.00 1.24 0.00 0.00 39.78 41.00 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 -2.51 -0.01 -0.20 -0.44 2.01 -0.84 -4.88 115.64 108.77 1a2v s THR 53 Ca -0.34 0.04 -0.05 0.00 0.31 0.00 0.00 61.69 61.65 1a2v s THR 53 Cb 0.09 -0.63 0.07 0.00 0.01 0.00 0.00 72.50 72.04 1a2v s THR 53 CO 0.58 0.02 0.10 -0.69 -0.69 0.00 0.00 174.62 173.94 1a2v s VAL 54 N 0.84 -0.09 0.15 3.82 1.01 -1.26 -0.70 120.40 124.18 1a2v s VAL 54 Ca -0.05 -0.30 -0.08 0.00 0.00 0.00 0.00 61.98 61.55 1a2v s VAL 54 Cb -0.06 -0.67 -0.01 0.00 0.00 0.00 0.00 36.38 35.64 1a2v s VAL 54 CO -0.07 -0.38 0.25 0.28 0.00 0.00 0.00 175.10 175.18 1a2v s THR 55 N 2.14 0.08 0.35 3.92 -1.32 -0.20 -4.50 115.64 116.10 1a2v s THR 55 Ca 0.04 -1.43 -0.28 0.00 -1.21 0.00 0.00 61.69 58.81 1a2v s THR 55 Cb -0.16 -1.82 -0.10 0.00 -1.51 0.00 0.00 72.50 68.91 1a2v s THR 55 CO -0.16 -0.34 1.35 -0.22 -2.21 0.00 0.00 174.62 173.03 1a2v s LEU 56 N -2.97 4.39 -0.57 9.08 2.96 -1.26 0.43 118.68 130.74 1a2v s LEU 56 Ca 0.17 2.77 -0.08 0.00 -0.22 0.00 0.00 54.13 56.76 1a2v s LEU 56 Cb 0.04 -3.68 0.15 0.00 0.50 0.00 0.00 46.19 43.20 1a2v s LEU 56 CO -0.01 -0.64 0.43 -0.60 -1.32 0.00 0.00 176.35 174.22 1a2v s ARG 57 N -1.90 2.67 0.53 1.98 6.06 -0.91 -4.65 118.95 122.73 1a2v s ARG 57 Ca 0.50 -2.07 -0.20 0.00 -2.50 0.00 0.00 55.73 51.46 1a2v s ARG 57 Cb -0.41 -3.95 -0.08 0.00 0.06 0.00 0.00 34.95 30.57 1a2v s ARG 57 CO 0.55 -1.20 0.85 0.39 -2.50 0.00 0.00 175.30 173.39 1a2v n GLU 58 N 4.40 0.94 -0.90 5.12 1.02 -1.26 -4.41 120.64 125.54 1a2v n GLU 58 Ca -0.00 0.35 -0.30 0.00 -0.02 0.00 0.00 57.16 57.18 1a2v n GLU 58 Cb 0.41 -1.98 0.16 0.00 -0.02 0.00 0.00 31.44 30.01 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 -2.29 0.98 0.44 3.49 0.04 -1.26 -4.95 135.00 131.44 1a2v s PRO 59 Ca 0.69 1.18 -0.26 0.00 0.04 0.00 0.00 61.00 62.66 1a2v s PRO 59 Cb -0.48 -1.75 -0.09 0.00 0.04 0.00 0.00 34.50 32.23 1a2v s PRO 59 CO 0.52 -2.53 1.41 0.00 0.04 0.00 0.00 177.00 176.44 1a2v s ALA 60 N -2.74 3.27 0.20 8.56 0.00 -1.26 -4.78 121.76 125.01 1a2v s ALA 60 Ca 0.65 1.43 -0.12 0.00 0.00 0.00 0.00 51.96 53.93 1a2v s ALA 60 Cb -0.21 -3.57 0.23 0.00 0.00 0.00 0.00 23.12 19.57 1a2v s ALA 60 CO 0.58 -1.11 1.71 -0.09 0.00 0.00 0.00 175.76 176.85 1a2v h ARG 61 N 2.45 0.23 -0.10 0.00 2.43 -1.99 0.24 114.38 117.63 1a2v h ARG 61 Ca -0.51 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 58.64 1a2v h ARG 61 Cb 1.26 -0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 30.75 1a2v h ARG 61 CO 0.62 0.15 0.04 -0.22 -1.51 0.00 0.00 179.97 179.05 1a2v h LYS 62 N 0.23 0.15 -0.05 0.20 3.11 -1.99 -1.55 116.57 116.68 1a2v h LYS 62 Ca 0.28 -0.03 0.02 0.00 -2.81 0.00 0.00 60.65 58.11 1a2v h LYS 62 Cb 0.39 -0.02 -0.02 0.00 -1.00 0.00 0.00 32.23 31.57 1a2v h LYS 62 CO -0.37 0.26 -0.08 0.00 -2.81 0.00 0.00 179.45 176.46 1a2v h ALA 63 N 0.89 -0.04 -0.12 5.00 0.00 -1.78 -0.41 119.26 122.79 1a2v h ALA 63 Ca 0.03 0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.01 1a2v h ALA 63 Cb 0.16 0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 1a2v h ALA 63 CO -0.00 -0.55 -0.15 -0.92 0.00 0.00 0.00 179.25 177.62 1a2v h TYR 64 N -0.11 -0.38 -0.62 0.00 3.20 -0.45 -0.98 116.97 117.63 1a2v h TYR 64 Ca 0.05 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.90 1a2v h TYR 64 Cb 0.17 0.19 -0.03 0.00 1.54 0.00 0.00 36.73 38.60 1a2v h TYR 64 CO -0.17 -0.22 0.25 0.82 -1.64 0.00 0.00 178.16 177.21 1a2v h ILE 65 N -0.19 1.22 -0.40 1.81 2.04 -1.03 0.13 117.51 121.09 1a2v h ILE 65 Ca 0.09 -0.68 -0.03 0.00 1.00 0.00 0.00 64.86 65.24 1a2v h ILE 65 Cb 0.32 0.48 -0.02 0.00 -0.74 0.00 0.00 36.82 36.86 1a2v h ILE 65 CO -0.23 0.27 0.14 1.56 0.00 0.00 0.00 178.15 179.90 1a2v h GLN 66 N 0.89 0.60 -0.42 2.37 4.20 -0.70 0.15 115.11 122.20 1a2v h GLN 66 Ca 0.21 -0.12 -0.01 0.00 0.06 0.00 0.00 58.65 58.79 1a2v h GLN 66 Cb 0.17 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 27.84 1a2v h GLN 66 CO -0.02 0.58 0.22 2.35 -0.67 0.00 0.00 178.83 181.29 1a2v h TRP 67 N 0.50 0.60 -0.10 2.96 7.01 -0.67 0.62 115.95 126.86 1a2v h TRP 67 Ca 0.13 -0.02 -0.13 0.00 2.11 0.00 0.00 58.89 60.98 1a2v h TRP 67 Cb 0.22 -0.19 -0.01 0.00 -2.10 0.00 0.00 29.16 27.08 1a2v h TRP 67 CO 0.00 0.47 -0.52 -0.22 -2.79 0.00 0.00 178.44 175.39 1a2v h LYS 68 N 0.55 0.29 0.00 2.65 3.64 -0.54 -3.34 116.57 119.82 1a2v h LYS 68 Ca 0.15 -0.17 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1a2v h LYS 68 Cb 0.08 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 1a2v h LYS 68 CO -0.02 0.74 -0.08 0.39 -2.27 0.00 0.00 179.45 178.21 1a2v n GLU 69 N -3.94 4.40 -0.63 1.90 1.02 0.51 -4.77 120.64 119.12 1a2v n GLU 69 Ca -0.02 0.00 0.06 0.00 -0.02 0.00 0.00 57.16 57.18 1a2v n GLU 69 Cb 0.56 -0.40 0.18 0.00 -0.02 0.00 0.00 31.44 31.76 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 -0.72 1.34 -1.73 3.49 6.02 0.20 -4.95 117.38 121.03 1a2v n GLN 70 Ca 0.00 -3.03 -0.18 0.00 -0.01 0.00 0.00 57.00 53.78 1a2v n GLN 70 Cb 0.00 -1.40 -0.06 0.00 1.02 0.00 0.00 30.24 29.79 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 -0.96 1.24 3.63 1.08 0.00 -0.99 -4.86 105.19 104.33 1a2v n GLY 71 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 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 -2.44 1.59 0.71 -0.02 0.00 -0.16 -4.91 107.32 102.10 1a2v s GLY 72 Ca 0.00 -0.05 -0.13 0.00 0.00 0.00 0.00 44.72 44.54 1a2v s GLY 72 CO 0.00 0.52 1.10 2.56 0.00 0.00 0.00 173.10 177.29 1a2v s PRO 73 N -4.75 2.57 0.02 2.90 0.04 -1.26 -4.29 135.00 130.23 1a2v s PRO 73 Ca 0.66 1.29 -0.30 0.00 0.04 0.00 0.00 61.00 62.69 1a2v s PRO 73 Cb -0.21 -1.93 -0.07 0.00 0.04 0.00 0.00 34.50 32.34 1a2v s PRO 73 CO 0.60 -1.42 1.57 -1.17 0.04 0.00 0.00 177.00 176.61 1a2v s LEU 74 N -5.32 4.34 0.68 -3.56 2.96 -1.26 -4.55 118.68 111.97 1a2v s LEU 74 Ca 0.64 2.32 -0.16 0.00 -0.22 0.00 0.00 54.13 56.71 1a2v s LEU 74 Cb -0.19 -3.56 0.01 0.00 0.50 0.00 0.00 46.19 42.96 1a2v s LEU 74 CO 0.48 -0.84 1.21 -2.84 -1.32 0.00 0.00 176.35 173.04 1a2v s PRO 75 N 2.80 2.44 0.46 0.98 0.02 -1.26 -4.94 135.00 135.50 1a2v s PRO 75 Ca 0.70 1.77 -0.25 0.00 0.02 0.00 0.00 61.00 63.25 1a2v s PRO 75 Cb -0.36 -1.87 -0.08 0.00 0.02 0.00 0.00 34.50 32.22 1a2v s PRO 75 CO 0.30 -1.61 1.42 -2.14 -0.33 0.00 0.00 177.00 174.63 1a2v s PRO 76 N -3.74 3.63 -0.53 5.54 0.02 -1.26 -4.93 135.00 133.74 1a2v s PRO 76 Ca 0.75 2.39 -0.23 0.00 0.02 0.00 0.00 61.00 63.93 1a2v s PRO 76 Cb -0.30 -2.61 0.04 0.00 0.02 0.00 0.00 34.50 31.65 1a2v s PRO 76 CO 0.41 -0.85 0.88 0.50 -0.33 0.00 0.00 177.00 177.61 1a2v s ARG 77 N -2.50 3.32 0.14 5.54 6.06 -1.26 -4.85 118.95 125.40 1a2v s ARG 77 Ca 0.62 -0.30 0.07 0.00 -2.50 0.00 0.00 55.73 53.62 1a2v s ARG 77 Cb -0.43 -4.04 -0.04 0.00 0.06 0.00 0.00 34.95 30.50 1a2v s ARG 77 CO 0.55 -1.39 -0.05 -0.51 -2.50 0.00 0.00 175.30 171.40 1a2v s LEU 78 N 3.68 3.19 -0.05 -0.88 1.43 -1.26 -2.46 118.68 122.32 1a2v s LEU 78 Ca 0.29 -0.38 0.05 0.00 -1.03 0.00 0.00 54.13 53.05 1a2v s LEU 78 Cb -0.13 -1.91 -0.01 0.00 0.03 0.00 0.00 46.19 44.17 1a2v s LEU 78 CO 0.19 0.14 -0.21 0.00 0.23 0.00 0.00 176.35 176.70 1a2v s ALA 79 N -1.47 1.85 -0.17 4.21 0.00 -0.67 -2.13 121.76 123.38 1a2v s ALA 79 Ca 0.25 -0.86 -0.07 0.00 0.00 0.00 0.00 51.96 51.27 1a2v s ALA 79 Cb -0.10 -0.60 -0.04 0.00 0.00 0.00 0.00 23.12 22.38 1a2v s ALA 79 CO 0.16 0.34 0.06 -0.47 0.00 0.00 0.00 175.76 175.85 1a2v s TYR 80 N -0.03 3.26 0.16 0.00 5.04 0.17 -0.90 117.35 125.05 1a2v s TYR 80 Ca -0.05 0.10 0.07 0.00 -2.44 0.00 0.00 57.07 54.76 1a2v s TYR 80 Cb -0.13 -2.05 -0.04 0.00 0.35 0.00 0.00 41.96 40.09 1a2v s TYR 80 CO 0.03 0.21 -0.16 1.52 -1.34 0.00 0.00 175.55 175.81 1a2v s TYR 81 N 0.20 1.63 -0.09 4.97 1.13 -0.48 -1.04 117.35 123.68 1a2v s TYR 81 Ca 0.04 -0.54 -0.02 0.00 -1.41 0.00 0.00 57.07 55.15 1a2v s TYR 81 Cb -0.12 -0.81 0.04 0.00 -1.10 0.00 0.00 41.96 39.96 1a2v s TYR 81 CO 0.00 0.26 0.03 0.08 -2.51 0.00 0.00 175.55 173.41 1a2v s VAL 82 N -2.35 0.24 0.30 -3.49 1.01 0.12 -2.21 120.40 114.03 1a2v s VAL 82 Ca 0.15 0.08 0.08 0.00 0.00 0.00 0.00 61.98 62.29 1a2v s VAL 82 Cb -0.04 -0.51 -0.06 0.00 0.00 0.00 0.00 36.38 35.77 1a2v s VAL 82 CO 0.05 0.13 -0.09 0.27 0.00 0.00 0.00 175.10 175.47 1a2v s ILE 83 N 2.02 1.92 -0.00 2.22 -4.36 0.03 -0.20 121.20 122.82 1a2v s ILE 83 Ca 0.04 -2.18 0.07 0.00 -0.26 0.00 0.00 60.65 58.32 1a2v s ILE 83 Cb -0.13 -2.48 -0.02 0.00 1.25 0.00 0.00 42.46 41.08 1a2v s ILE 83 CO -0.05 -0.29 -0.22 -0.76 0.24 0.00 0.00 174.94 173.85 1a2v s LEU 84 N -3.50 2.07 -0.14 0.37 2.01 -0.17 -1.54 118.68 117.78 1a2v s LEU 84 Ca 0.30 -0.43 0.01 0.00 0.01 0.00 0.00 54.13 54.01 1a2v s LEU 84 Cb 0.02 -1.13 -0.00 0.00 0.01 0.00 0.00 46.19 45.09 1a2v s LEU 84 CO 0.13 0.26 -0.16 -0.70 1.01 0.00 0.00 176.35 176.89 1a2v s GLU 85 N -0.67 3.23 0.23 1.70 2.12 -1.26 -0.05 118.70 124.00 1a2v s GLU 85 Ca 0.09 -0.75 -0.31 0.00 0.36 0.00 0.00 54.97 54.35 1a2v s GLU 85 Cb -0.09 -2.59 -0.14 0.00 0.26 0.00 0.00 34.13 31.57 1a2v s GLU 85 CO -0.00 0.08 1.32 0.00 -0.54 0.00 0.00 175.26 176.11 1a2v n ALA 86 N 3.89 0.55 -0.86 6.30 0.00 -0.49 -1.08 120.51 128.81 1a2v n ALA 86 Ca -0.19 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.67 1a2v n ALA 86 Cb 0.52 -2.20 0.00 0.00 0.00 0.00 0.00 19.45 17.78 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 2.03 1.20 3.62 0.00 0.00 -1.26 -4.91 105.19 105.87 1a2v n GLY 87 Ca 0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.03 2.69 0.33 1.61 -0.14 -0.24 -5.11 119.74 118.86 1a2v s LYS 88 Ca 0.00 -0.63 -0.20 0.00 -1.36 0.00 0.00 55.97 53.78 1a2v s LYS 88 Cb 0.00 -2.59 -0.10 0.00 -1.68 0.00 0.00 37.83 33.47 1a2v s LYS 88 CO 0.00 0.63 0.84 -1.25 -0.76 0.00 0.00 175.35 174.82 1a2v s PRO 89 N -1.24 4.25 4.51 -1.68 0.04 -1.26 -4.70 135.00 134.92 1a2v s PRO 89 Ca 0.16 1.00 0.00 0.00 0.04 0.00 0.00 61.00 62.20 1a2v s PRO 89 Cb -0.11 -2.53 0.00 0.00 0.04 0.00 0.00 34.50 31.89 1a2v s PRO 89 CO 0.06 0.18 0.00 0.41 0.04 0.00 0.00 177.00 177.69 1a2v n GLY 90 N -0.01 0.90 2.92 0.56 0.00 -1.21 -4.27 105.19 104.08 1a2v n GLY 90 Ca 0.03 -0.81 -0.15 0.00 0.00 0.00 0.00 46.02 45.10 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 -3.90 1.61 0.24 -0.32 -4.76 118.33 111.19 1a2v n VAL 91 Ca 0.00 -1.81 -0.13 0.00 -2.04 0.00 0.00 64.34 60.36 1a2v n VAL 91 Cb 0.00 1.01 -0.14 0.00 -1.47 0.00 0.00 33.84 33.24 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 -2.91 0.07 0.16 7.34 1.02 -0.59 -1.19 119.74 123.64 1a2v s LYS 92 Ca 0.30 0.00 -0.00 0.00 0.02 0.00 0.00 55.97 56.28 1a2v s LYS 92 Cb 0.00 -0.11 -0.04 0.00 -0.52 0.00 0.00 37.83 37.16 1a2v s LYS 92 CO 0.21 -0.01 0.05 -1.83 -0.92 0.00 0.00 175.35 172.85 1a2v s GLU 93 N 0.16 1.03 0.00 1.68 -1.05 0.74 -0.79 118.70 120.48 1a2v s GLU 93 Ca -0.01 -1.51 0.00 0.00 -0.15 0.00 0.00 54.97 53.30 1a2v s GLU 93 Cb -0.02 0.09 0.00 0.00 -0.44 0.00 0.00 34.13 33.75 1a2v s GLU 93 CO -0.00 -0.25 0.00 0.41 0.95 0.00 0.00 175.26 176.37 1a2v n GLY 94 N -0.18 -1.47 3.33 -3.83 0.00 -0.94 0.12 105.19 102.23 1a2v n GLY 94 Ca -0.04 -1.03 -0.27 0.00 0.00 0.00 0.00 46.02 44.68 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 2.26 -0.09 0.99 1.43 0.15 -1.38 118.68 122.05 1a2v s LEU 95 Ca 0.00 -0.67 0.04 0.00 -1.03 0.00 0.00 54.13 52.47 1a2v s LEU 95 Cb 0.00 -1.09 -0.01 0.00 0.03 0.00 0.00 46.19 45.13 1a2v s LEU 95 CO 0.00 0.15 -0.23 -0.69 0.23 0.00 0.00 176.35 175.81 1a2v s VAL 96 N -1.01 2.20 -0.70 -1.59 1.01 -0.08 -0.82 120.40 119.41 1a2v s VAL 96 Ca 0.10 -0.99 -0.20 0.00 0.00 0.00 0.00 61.98 60.89 1a2v s VAL 96 Cb -0.10 -1.83 0.10 0.00 0.00 0.00 0.00 36.38 34.55 1a2v s VAL 96 CO 0.04 0.56 0.90 -0.62 0.00 0.00 0.00 175.10 175.98 1a2v s ASP 97 N 0.14 6.29 0.32 3.32 2.15 0.93 -1.67 116.67 128.15 1a2v s ASP 97 Ca -0.12 -1.42 0.10 0.00 0.43 0.00 0.00 52.55 51.54 1a2v s ASP 97 Cb -0.16 -2.37 0.90 0.00 -0.30 0.00 0.00 42.92 41.00 1a2v s ASP 97 CO 0.07 -1.22 1.73 -0.07 -0.17 0.00 0.00 175.17 175.50 1a2v h LEU 98 N 10.55 0.66 -1.05 -1.34 3.38 -1.77 0.11 115.31 125.85 1a2v h LEU 98 Ca -0.19 0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 1a2v h LEU 98 Cb 1.07 0.04 -0.04 0.00 0.09 0.00 0.00 40.66 41.81 1a2v h LEU 98 CO 1.12 0.09 0.44 0.00 0.09 0.00 0.00 178.44 180.19 1a2v h ALA 99 N 1.74 1.28 -0.42 1.53 0.00 -1.91 -2.46 119.26 119.01 1a2v h ALA 99 Ca 0.65 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.45 1a2v h ALA 99 Cb 1.26 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.73 1a2v h ALA 99 CO -0.48 0.59 0.00 -1.13 0.00 0.00 0.00 179.25 178.23 1a2v n SER 100 N -4.35 3.29 -4.04 0.00 3.41 -0.65 -4.89 113.62 106.39 1a2v n SER 100 Ca 0.08 -1.94 -0.33 0.00 -0.26 0.00 0.00 58.87 56.43 1a2v n SER 100 Cb 0.09 -0.28 -0.02 0.00 -0.26 0.00 0.00 64.21 63.74 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 1.19 -1.55 -3.99 1.04 4.77 0.30 -4.96 117.00 113.80 1a2v n LEU 101 Ca 0.17 -1.15 -0.10 0.00 -0.03 0.00 0.00 56.01 54.91 1a2v n LEU 101 Cb 0.53 -1.95 -0.11 0.00 -2.33 0.00 0.00 43.42 39.56 1a2v n LEU 101 CO 0.13 0.53 -0.37 -0.94 -1.33 0.00 0.00 177.39 175.42 1a2v s SER 102 N -4.05 0.33 -0.35 -1.43 1.04 -1.13 -4.88 113.70 103.23 1a2v s SER 102 Ca 0.18 -0.51 -0.29 0.00 0.48 0.00 0.00 55.95 55.82 1a2v s SER 102 Cb -0.09 0.09 0.01 0.00 0.10 0.00 0.00 66.02 66.14 1a2v s SER 102 CO 0.93 -0.28 1.17 -0.69 0.98 0.00 0.00 173.24 175.35 1a2v s VAL 103 N -1.44 4.31 -2.40 5.02 1.01 -1.26 -0.05 120.40 125.59 1a2v s VAL 103 Ca -0.15 1.47 0.21 0.00 0.00 0.00 0.00 61.98 63.51 1a2v s VAL 103 Cb -0.10 -4.37 0.12 0.00 0.00 0.00 0.00 36.38 32.03 1a2v s VAL 103 CO -0.01 -0.60 1.12 2.30 0.00 0.00 0.00 175.10 177.91 1a2v n ILE 104 N 6.21 0.00 -3.64 2.22 -5.35 -0.00 -4.94 119.36 113.87 1a2v n ILE 104 Ca 0.13 -0.44 -0.06 0.00 -0.27 0.00 0.00 62.75 62.10 1a2v n ILE 104 Cb 0.47 1.38 -0.07 0.00 -1.74 0.00 0.00 39.64 39.69 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 -1.88 0.58 -0.07 6.28 2.12 -1.17 -4.93 118.70 119.63 1a2v s GLU 105 Ca 0.22 0.90 -0.28 0.00 0.36 0.00 0.00 54.97 56.18 1a2v s GLU 105 Cb 0.17 0.16 0.06 0.00 0.26 0.00 0.00 34.13 34.79 1a2v s GLU 105 CO 0.33 -0.11 0.63 -0.08 -0.54 0.00 0.00 175.26 175.49 1a2v s THR 106 N 1.17 0.01 0.02 -1.70 -1.32 -1.26 0.30 115.64 112.86 1a2v s THR 106 Ca -0.06 -0.07 -0.28 0.00 -1.21 0.00 0.00 61.69 60.07 1a2v s THR 106 Cb -0.05 -0.93 0.08 0.00 -1.51 0.00 0.00 72.50 70.10 1a2v s THR 106 CO -0.14 -0.04 0.74 0.00 -2.21 0.00 0.00 174.62 172.98 1a2v s ARG 107 N -0.99 1.02 -0.16 7.08 1.70 0.12 -4.96 118.95 122.77 1a2v s ARG 107 Ca -0.10 -0.13 -0.04 0.00 -0.47 0.00 0.00 55.73 54.99 1a2v s ARG 107 Cb -0.01 0.47 -0.03 0.00 -0.57 0.00 0.00 34.95 34.81 1a2v s ARG 107 CO 0.08 -0.40 -0.03 0.00 -1.08 0.00 0.00 175.30 173.88 1a2v s ALA 108 N -2.49 3.05 -0.54 7.88 0.00 -1.26 -0.18 121.76 128.21 1a2v s ALA 108 Ca -0.02 -0.81 0.00 0.00 0.00 0.00 0.00 51.96 51.13 1a2v s ALA 108 Cb -0.01 -1.59 0.14 0.00 0.00 0.00 0.00 23.12 21.66 1a2v s ALA 108 CO -0.03 0.21 0.32 -0.51 0.00 0.00 0.00 175.76 175.75 1a2v s LEU 109 N 0.35 4.87 0.33 0.00 1.02 -0.33 -4.95 118.68 119.96 1a2v s LEU 109 Ca -0.03 -2.77 0.26 0.00 0.02 0.00 0.00 54.13 51.61 1a2v s LEU 109 Cb -0.14 -1.75 0.92 0.00 0.02 0.00 0.00 46.19 45.24 1a2v s LEU 109 CO 0.03 -0.34 1.77 -0.33 0.02 0.00 0.00 176.35 177.50 1a2v h GLU 110 N 6.99 0.00 -0.63 1.70 5.08 -1.77 -0.84 114.58 125.11 1a2v h GLU 110 Ca -0.05 0.00 -0.44 0.00 -1.00 0.00 0.00 59.36 57.87 1a2v h GLU 110 Cb 0.95 0.00 -0.29 0.00 0.50 0.00 0.00 28.75 29.90 1a2v h GLU 110 CO 0.69 0.00 -0.31 0.25 -1.00 0.00 0.00 179.01 178.63 1a2v n THR 111 N -2.53 2.71 -4.15 1.13 -2.24 -1.26 -3.30 114.28 104.64 1a2v n THR 111 Ca 0.03 -3.56 -0.10 0.00 -2.27 0.00 0.00 64.05 58.16 1a2v n THR 111 Cb 0.34 -0.87 -0.10 0.00 -2.10 0.00 0.00 70.33 67.60 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 -4.20 0.51 0.00 2.28 0.11 -1.24 -4.84 120.40 113.02 1a2v s VAL 112 Ca 0.51 -1.90 0.04 0.00 -2.93 0.00 0.00 61.98 57.70 1a2v s VAL 112 Cb 0.42 -1.67 -0.01 0.00 -1.53 0.00 0.00 36.38 33.59 1a2v s VAL 112 CO 0.01 -0.88 -0.13 -1.10 -3.33 0.00 0.00 175.10 169.67 1a2v s GLN 113 N -3.88 1.01 0.60 1.54 -1.52 -1.26 -4.29 119.66 111.87 1a2v s GLN 113 Ca 0.11 -0.52 0.04 0.00 -1.95 0.00 0.00 55.36 53.04 1a2v s GLN 113 Cb 0.06 -0.98 0.08 0.00 -0.22 0.00 0.00 33.01 31.95 1a2v s GLN 113 CO -0.06 0.26 0.82 -1.25 -0.25 0.00 0.00 175.29 174.82 1a2v s PRO 114 N -0.48 2.22 0.37 2.91 0.04 -1.26 -3.81 135.00 134.99 1a2v s PRO 114 Ca 0.04 -1.20 -0.26 0.00 0.04 0.00 0.00 61.00 59.62 1a2v s PRO 114 Cb -0.06 -2.52 -0.12 0.00 0.04 0.00 0.00 34.50 31.85 1a2v s PRO 114 CO -0.00 -0.94 1.09 1.51 0.04 0.00 0.00 177.00 178.70 1a2v n ILE 115 N -2.41 2.22 -2.96 0.56 3.06 -1.26 -4.67 119.36 113.90 1a2v n ILE 115 Ca 0.12 -0.50 -0.43 0.00 -2.50 0.00 0.00 62.75 59.44 1a2v n ILE 115 Cb 0.60 -1.23 -0.05 0.00 0.54 0.00 0.00 39.64 39.50 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 -0.43 4.28 0.84 9.51 1.43 -0.26 -4.97 118.68 129.09 1a2v s LEU 116 Ca 0.60 -0.21 -0.12 0.00 -1.03 0.00 0.00 54.13 53.37 1a2v s LEU 116 Cb -0.60 -2.90 0.10 0.00 0.03 0.00 0.00 46.19 42.82 1a2v s LEU 116 CO 0.59 -0.96 1.10 0.42 0.23 0.00 0.00 176.35 177.73 1a2v s THR 117 N 3.34 2.75 0.02 5.49 -4.23 -1.26 -4.56 115.64 117.19 1a2v s THR 117 Ca 0.29 0.24 0.32 0.00 -1.18 0.00 0.00 61.69 61.36 1a2v s THR 117 Cb -0.13 -2.94 0.34 0.00 1.34 0.00 0.00 72.50 71.12 1a2v s THR 117 CO 0.21 -0.32 1.95 -0.37 -0.54 0.00 0.00 174.62 175.56 1a2v h VAL 118 N -1.28 0.00 -0.02 2.29 -1.51 -1.91 -2.34 116.25 111.49 1a2v h VAL 118 Ca -0.48 -0.25 -0.15 0.00 -1.23 0.00 0.00 66.70 64.59 1a2v h VAL 118 Cb 1.29 1.11 0.01 0.00 -2.13 0.00 0.00 31.29 31.56 1a2v h VAL 118 CO 0.59 0.00 -0.56 -0.33 -1.23 0.00 0.00 177.57 176.04 1a2v h GLU 119 N 0.00 0.41 0.00 5.19 5.08 -2.00 -0.63 114.58 122.64 1a2v h GLU 119 Ca 0.00 -0.42 0.00 0.00 -1.00 0.00 0.00 59.36 57.94 1a2v h GLU 119 Cb 0.29 0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.65 1a2v h GLU 119 CO 0.00 1.08 0.00 0.38 -1.00 0.00 0.00 179.01 179.47 1a2v h ASP 120 N -0.10 0.00 0.20 1.42 3.04 -1.84 -3.21 116.42 115.93 1a2v h ASP 120 Ca -0.07 0.00 -0.35 0.00 -3.24 0.00 0.00 57.03 53.37 1a2v h ASP 120 Cb 1.26 0.00 0.01 0.00 -1.04 0.00 0.00 39.33 39.56 1a2v h ASP 120 CO 0.11 0.00 -1.77 -0.07 -2.04 0.00 0.00 179.24 175.47 1a2v h LEU 121 N 0.00 0.59 -1.89 0.15 3.38 -1.40 -3.39 115.31 112.74 1a2v h LEU 121 Ca 0.00 -0.91 -0.03 0.00 0.09 0.00 0.00 57.88 57.03 1a2v h LEU 121 Cb 0.64 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 1a2v h LEU 121 CO 0.00 1.78 -0.12 0.00 0.09 0.00 0.00 178.44 180.18 1a2v h SER 123 N 0.00 0.00 -0.86 0.00 4.64 -1.76 -3.36 113.55 112.21 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 0.34 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 62.31 1a2v h SER 123 CO 0.02 0.57 0.35 0.74 -0.87 0.00 0.00 176.83 177.63 1a2v h THR 124 N 0.00 0.49 -0.85 2.95 2.02 -1.76 -2.36 112.91 113.40 1a2v h THR 124 Ca -0.01 -0.13 0.00 0.00 0.77 0.00 0.00 66.41 67.05 1a2v h THR 124 Cb 1.21 0.08 -0.04 0.00 -1.74 0.00 0.00 68.15 67.65 1a2v h THR 124 CO 0.07 0.07 0.54 -0.08 0.37 0.00 0.00 175.52 176.50 1a2v h GLU 125 N 0.38 1.14 -0.30 6.66 4.81 -1.80 -1.77 114.58 123.71 1a2v h GLU 125 Ca 0.52 -0.08 -0.15 0.00 -0.13 0.00 0.00 59.36 59.52 1a2v h GLU 125 Cb 0.97 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 30.09 1a2v h GLU 125 CO -0.52 0.78 -0.42 1.49 -0.73 0.00 0.00 179.01 179.61 1a2v h GLU 126 N 1.16 0.75 -0.62 1.92 4.57 -1.69 -2.13 114.58 118.54 1a2v h GLU 126 Ca 0.31 -0.40 -0.09 0.00 -1.18 0.00 0.00 59.36 58.00 1a2v h GLU 126 Cb -0.09 0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.49 1a2v h GLU 126 CO -0.06 1.02 0.04 -0.39 -1.18 0.00 0.00 179.01 178.44 1a2v h VAL 127 N 0.61 1.26 0.00 0.32 -1.51 -1.05 -1.31 116.25 114.57 1a2v h VAL 127 Ca 0.05 -1.11 -0.12 0.00 -1.23 0.00 0.00 66.70 64.29 1a2v h VAL 127 Cb 0.97 0.74 -0.02 0.00 -2.13 0.00 0.00 31.29 30.86 1a2v h VAL 127 CO 0.09 0.41 -0.57 0.16 -1.23 0.00 0.00 177.57 176.43 1a2v h ILE 128 N 0.98 1.33 -0.38 7.19 3.07 -1.31 -2.35 117.51 126.04 1a2v h ILE 128 Ca 0.18 -1.99 -0.06 0.00 1.55 0.00 0.00 64.86 64.55 1a2v h ILE 128 Cb 0.51 2.09 -0.02 0.00 -0.27 0.00 0.00 36.82 39.14 1a2v h ILE 128 CO 0.02 0.55 -0.00 0.03 -1.05 0.00 0.00 178.15 177.71 1a2v h ARG 129 N 0.00 0.59 -0.22 0.16 3.08 -0.79 -2.76 114.38 114.45 1a2v h ARG 129 Ca -0.01 -0.13 0.00 0.00 0.07 0.00 0.00 59.98 59.91 1a2v h ARG 129 Cb 1.05 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 31.02 1a2v h ARG 129 CO 0.07 0.61 0.00 0.09 -1.07 0.00 0.00 179.97 179.68 1a2v n ASN 130 N -4.26 2.43 -4.67 7.04 3.02 -0.55 -4.79 115.26 113.48 1a2v n ASN 130 Ca 0.02 -1.83 -0.41 0.00 -0.03 0.00 0.00 54.58 52.34 1a2v n ASN 130 Cb 0.26 -0.14 -0.05 0.00 -0.61 0.00 0.00 39.78 39.24 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 -1.62 6.83 0.26 6.41 -1.08 -0.91 -4.96 116.67 121.60 1a2v s ASP 131 Ca 0.35 1.02 -0.01 0.00 -0.52 0.00 0.00 52.55 53.38 1a2v s ASP 131 Cb 0.20 -2.40 0.52 0.00 -1.46 0.00 0.00 42.92 39.78 1a2v s ASP 131 CO 0.29 -0.32 1.77 -0.65 0.52 0.00 0.00 175.17 176.78 1a2v h PRO 132 N 7.36 0.66 0.09 4.34 0.11 -1.91 0.19 132.00 142.84 1a2v h PRO 132 Ca -0.31 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.76 1a2v h PRO 132 Cb 1.14 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.10 1a2v h PRO 132 CO 0.80 0.43 -0.04 0.00 -0.21 0.00 0.00 178.00 178.98 1a2v h ALA 133 N 1.54 -0.12 -0.92 -0.75 0.00 -1.95 -0.95 119.26 116.11 1a2v h ALA 133 Ca 0.46 -0.11 0.05 0.00 0.00 0.00 0.00 54.91 55.31 1a2v h ALA 133 Cb 0.61 0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.39 1a2v h ALA 133 CO -0.34 -0.48 0.59 0.28 0.00 0.00 0.00 179.25 179.31 1a2v h VAL 134 N -0.31 1.12 -0.94 0.00 2.07 -1.67 -1.90 116.25 114.62 1a2v h VAL 134 Ca -0.01 -0.39 -0.01 0.00 0.82 0.00 0.00 66.70 67.11 1a2v h VAL 134 Cb 0.26 -0.10 -0.04 0.00 -1.52 0.00 0.00 31.29 29.88 1a2v h VAL 134 CO 0.02 0.20 0.55 0.40 0.02 0.00 0.00 177.57 178.77 1a2v h ILE 135 N 1.12 1.26 -0.54 4.57 2.04 -0.29 -1.34 117.51 124.33 1a2v h ILE 135 Ca 0.38 -0.59 -0.07 0.00 1.00 0.00 0.00 64.86 65.59 1a2v h ILE 135 Cb 0.07 -0.05 -0.02 0.00 -0.74 0.00 0.00 36.82 36.08 1a2v h ILE 135 CO -0.14 0.28 0.07 -0.08 0.00 0.00 0.00 178.15 178.28 1a2v h GLU 136 N 1.30 0.86 -0.24 2.37 4.81 -0.48 -1.60 114.58 121.60 1a2v h GLU 136 Ca 0.33 -0.21 -0.12 0.00 -0.13 0.00 0.00 59.36 59.23 1a2v h GLU 136 Cb -0.03 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.22 1a2v h GLU 136 CO -0.06 0.82 -0.37 1.96 -0.73 0.00 0.00 179.01 180.63 1a2v h GLN 137 N 0.82 0.54 -0.26 1.92 1.08 -0.76 0.58 115.11 119.03 1a2v h GLN 137 Ca 0.17 -0.26 -0.04 0.00 -1.45 0.00 0.00 58.65 57.07 1a2v h GLN 137 Cb 0.39 -0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.81 1a2v h GLN 137 CO 0.01 0.83 0.00 0.00 -0.95 0.00 0.00 178.83 178.72 1a2v h VAL 139 N 0.24 1.06 -1.00 0.00 2.07 -0.82 0.18 116.25 117.99 1a2v h VAL 139 Ca 0.07 -0.19 0.06 0.00 0.82 0.00 0.00 66.70 67.46 1a2v h VAL 139 Cb 0.42 0.46 -0.06 0.00 -1.52 0.00 0.00 31.29 30.58 1a2v h VAL 139 CO 0.01 0.10 0.65 -0.07 0.02 0.00 0.00 177.57 178.28 1a2v h LEU 140 N 0.55 1.05 0.00 2.57 4.07 -0.68 -1.20 115.31 121.68 1a2v h LEU 140 Ca 0.18 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.14 1a2v h LEU 140 Cb -0.00 -0.23 0.00 0.00 1.08 0.00 0.00 40.66 41.51 1a2v h LEU 140 CO -0.07 0.69 0.00 -1.20 -1.08 0.00 0.00 178.44 176.78 1a2v n SER 141 N -4.48 0.00 0.00 -0.43 7.64 0.61 -4.87 113.62 112.10 1a2v n SER 141 Ca 0.15 -0.43 0.00 0.00 1.01 0.00 0.00 58.87 59.60 1a2v n SER 141 Cb 0.15 -0.13 0.00 0.00 -1.01 0.00 0.00 64.21 63.23 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 0.56 0.93 3.08 0.23 0.00 -0.45 -1.52 105.19 108.02 1a2v n GLY 142 Ca 0.15 -0.09 -0.32 0.00 0.00 0.00 0.00 46.02 45.76 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 2.18 0.36 -0.61 1.01 0.47 -4.94 121.20 117.66 1a2v s ILE 143 Ca 0.00 -1.53 -0.26 0.00 0.00 0.00 0.00 60.65 58.86 1a2v s ILE 143 Cb 0.00 -2.23 -0.12 0.00 0.01 0.00 0.00 42.46 40.12 1a2v s ILE 143 CO 0.00 0.05 0.99 -2.65 0.00 0.00 0.00 174.94 173.34 1a2v n PRO 144 N 4.46 1.34 0.34 2.79 -0.02 -1.26 -2.21 135.00 140.44 1a2v n PRO 144 Ca -0.15 0.48 0.21 0.00 -2.02 0.00 0.00 63.50 62.02 1a2v n PRO 144 Cb 0.43 -1.93 1.15 0.00 -0.02 0.00 0.00 33.50 33.13 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 1.75 1.06 -0.16 3.55 0.00 -1.94 -0.01 119.26 123.51 1a2v h ALA 145 Ca -0.42 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1a2v h ALA 145 Cb 1.34 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1a2v h ALA 145 CO 0.58 -0.06 0.00 0.27 0.00 0.00 0.00 179.25 180.05 1a2v n ASN 146 N -3.03 1.55 -0.25 0.00 2.04 -1.26 -3.81 115.26 110.50 1a2v n ASN 146 Ca -0.03 -1.70 0.08 0.00 -0.44 0.00 0.00 54.58 52.49 1a2v n ASN 146 Cb 0.12 -0.10 0.15 0.00 -2.53 0.00 0.00 39.78 37.42 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 0.25 1.87 0.00 -3.83 1.02 -0.02 -4.71 120.64 115.23 1a2v n GLU 147 Ca 0.16 -2.50 0.00 0.00 -0.02 0.00 0.00 57.16 54.80 1a2v n GLU 147 Cb 0.31 -1.51 0.00 0.00 -0.02 0.00 0.00 31.44 30.22 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 -1.07 0.00 0.06 3.49 2.81 -1.25 -0.07 117.12 121.08 1a2v n MET 148 Ca 0.15 0.44 0.13 0.00 -1.81 0.00 0.00 57.70 56.61 1a2v n MET 148 Cb 0.64 -1.55 0.48 0.00 -0.71 0.00 0.00 33.22 32.09 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 -1.44 0.49 1.19 2.03 1.44 -1.26 -2.30 115.22 115.37 1a2v n HIS 149 Ca 0.00 0.15 0.13 0.00 -2.01 0.00 0.00 57.72 55.99 1a2v n HIS 149 Cb 0.05 -0.75 0.26 0.00 0.12 0.00 0.00 29.99 29.66 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 -1.91 1.92 -3.45 -1.40 5.02 0.89 -4.86 118.16 114.37 1a2v n LYS 150 Ca 0.05 -1.43 -0.38 0.00 -2.02 0.00 0.00 58.31 54.53 1a2v n LYS 150 Cb 0.35 -1.47 -0.08 0.00 -0.02 0.00 0.00 35.03 33.81 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 -2.07 5.23 0.44 -0.18 1.01 -0.97 -0.82 120.40 123.04 1a2v s VAL 151 Ca 0.31 0.58 0.04 0.00 0.00 0.00 0.00 61.98 62.90 1a2v s VAL 151 Cb 0.20 -3.67 -0.05 0.00 0.00 0.00 0.00 36.38 32.86 1a2v s VAL 151 CO 0.35 0.27 0.02 -0.31 0.00 0.00 0.00 175.10 175.42 1a2v s TYR 152 N 1.30 2.17 -0.22 5.22 1.51 0.01 -4.96 117.35 122.38 1a2v s TYR 152 Ca 0.16 -0.85 -0.27 0.00 -1.01 0.00 0.00 57.07 55.10 1a2v s TYR 152 Cb -0.14 -1.62 0.09 0.00 -0.11 0.00 0.00 41.96 40.17 1a2v s TYR 152 CO 0.07 0.27 0.83 0.00 -1.11 0.00 0.00 175.55 175.61 1a2v s ASP 154 N -0.16 6.30 -0.11 0.00 1.01 -0.52 -4.81 116.67 118.38 1a2v s ASP 154 Ca -0.02 0.35 -0.28 0.00 0.71 0.00 0.00 52.55 53.31 1a2v s ASP 154 Cb -0.03 -2.22 -0.02 0.00 1.01 0.00 0.00 42.92 41.66 1a2v s ASP 154 CO 0.01 -0.16 0.94 -2.16 0.21 0.00 0.00 175.17 174.01 1a2v s PRO 155 N 1.90 4.40 0.26 8.23 0.04 -1.26 -1.80 135.00 146.77 1a2v s PRO 155 Ca 0.16 1.27 0.09 0.00 0.04 0.00 0.00 61.00 62.55 1a2v s PRO 155 Cb -0.15 -3.54 -0.05 0.00 0.04 0.00 0.00 34.50 30.79 1a2v s PRO 155 CO 0.09 -0.27 -0.13 -1.58 0.04 0.00 0.00 177.00 175.15 1a2v s TRP 156 N 1.90 2.02 0.79 0.56 0.52 0.03 -4.97 118.94 119.79 1a2v s TRP 156 Ca 0.45 -0.53 -0.11 0.00 0.02 0.00 0.00 56.10 55.93 1a2v s TRP 156 Cb -0.18 -1.01 0.07 0.00 -1.15 0.00 0.00 33.47 31.20 1a2v s TRP 156 CO 0.17 0.47 1.11 0.99 0.02 0.00 0.00 176.95 179.71 1a2v s THR 157 N -2.81 2.99 -0.49 2.01 2.01 -1.26 -0.01 115.64 118.08 1a2v s THR 157 Ca 0.28 0.34 0.24 0.00 0.31 0.00 0.00 61.69 62.86 1a2v s THR 157 Cb -0.00 -2.73 0.26 0.00 0.01 0.00 0.00 72.50 70.04 1a2v s THR 157 CO 0.12 -0.40 1.73 0.00 -0.69 0.00 0.00 174.62 175.38 1a2v n ILE 158 N -3.55 0.79 0.00 1.82 3.06 -1.20 -4.07 119.36 116.21 1a2v n ILE 158 Ca 0.10 0.15 0.00 0.00 -2.50 0.00 0.00 62.75 60.50 1a2v n ILE 158 Cb 0.53 -1.08 0.00 0.00 0.54 0.00 0.00 39.64 39.62 1a2v n ILE 158 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 1a2v n GLY 159 N 0.20 2.24 3.63 4.50 0.00 -1.26 -4.54 105.19 109.96 1a2v n GLY 159 Ca 0.03 -0.11 -0.05 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.91 -0.13 1.61 5.04 -1.26 -1.53 117.35 120.17 1a2v s TYR 160 Ca 0.00 1.79 -0.03 0.00 -2.44 0.00 0.00 57.07 56.39 1a2v s TYR 160 Cb 0.00 0.55 0.05 0.00 0.35 0.00 0.00 41.96 42.90 1a2v s TYR 160 CO 0.00 -0.45 0.06 0.34 -1.34 0.00 0.00 175.55 174.16 1a2v s ASP 161 N 1.65 2.07 0.25 4.32 -1.08 -1.26 -4.79 116.67 117.83 1a2v s ASP 161 Ca -0.09 -0.42 0.17 0.00 -0.52 0.00 0.00 52.55 51.69 1a2v s ASP 161 Cb -0.05 -0.32 0.92 0.00 -1.46 0.00 0.00 42.92 42.01 1a2v s ASP 161 CO -0.18 -0.30 1.52 -1.84 0.52 0.00 0.00 175.17 174.89 1a2v n GLU 162 N 5.22 0.11 0.20 4.34 0.00 -1.26 -1.54 120.64 127.71 1a2v n GLU 162 Ca -0.06 0.60 0.07 0.00 0.00 0.00 0.00 57.16 57.77 1a2v n GLU 162 Cb 0.49 -1.86 0.37 0.00 0.00 0.00 0.00 31.44 30.44 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 -3.36 114.38 115.49 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 0.01 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.06 1a2v h ARG 163 CO 0.00 0.32 -0.29 0.91 -1.07 0.00 0.00 179.97 179.84 1a2v n TRP 164 N -3.47 0.00 -0.74 3.04 8.01 -0.59 -5.10 117.44 118.59 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 0.48 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.78 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 1.08 3.21 0.76 6.99 0.00 -0.68 -1.68 105.19 114.87 1a2v n GLY 165 Ca 0.00 -0.12 0.07 0.00 0.00 0.00 0.00 46.02 45.96 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 1.53 0.29 2.61 -2.24 -1.26 -4.63 114.28 110.59 1a2v n THR 166 Ca 0.00 -1.35 0.17 0.00 -2.27 0.00 0.00 64.05 60.59 1a2v n THR 166 Cb 0.00 0.19 0.88 0.00 -2.10 0.00 0.00 70.33 69.30 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 1.98 0.00 -5.53 3.38 0.00 -1.70 -3.42 103.07 97.78 1a2v h GLY 167 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 47.12 1a2v h GLY 167 CO 0.10 0.00 -0.63 0.54 0.00 0.00 0.00 176.54 176.55 1a2v s LYS 168 N -4.14 0.09 -0.38 4.80 1.02 -1.26 -4.99 119.74 114.88 1a2v s LYS 168 Ca -0.03 0.12 -0.29 0.00 0.02 0.00 0.00 55.97 55.79 1a2v s LYS 168 Cb 0.13 0.03 0.02 0.00 -0.52 0.00 0.00 37.83 37.49 1a2v s LYS 168 CO 0.52 -0.02 1.12 0.50 -0.92 0.00 0.00 175.35 176.56 1a2v s ARG 169 N 0.09 3.91 0.30 1.68 3.52 -1.26 -4.96 118.95 122.23 1a2v s ARG 169 Ca -0.00 0.89 0.11 0.00 -0.13 0.00 0.00 55.73 56.59 1a2v s ARG 169 Cb -0.01 -3.82 -0.05 0.00 -1.56 0.00 0.00 34.95 29.51 1a2v s ARG 169 CO -0.00 -1.12 -0.14 -0.51 -0.81 0.00 0.00 175.30 172.72 1a2v s LEU 170 N 4.06 2.70 0.05 -0.88 1.02 -1.26 -1.05 118.68 123.32 1a2v s LEU 170 Ca 0.48 -1.05 -0.00 0.00 0.02 0.00 0.00 54.13 53.58 1a2v s LEU 170 Cb -0.11 -1.14 -0.03 0.00 0.02 0.00 0.00 46.19 44.93 1a2v s LEU 170 CO 0.23 -0.05 -0.04 -1.10 0.02 0.00 0.00 176.35 175.41 1a2v s GLN 171 N -3.57 0.56 -0.01 1.70 -0.21 -0.73 -3.27 119.66 114.14 1a2v s GLN 171 Ca 0.31 -1.06 0.07 0.00 0.02 0.00 0.00 55.36 54.70 1a2v s GLN 171 Cb -0.03 0.10 -0.02 0.00 1.00 0.00 0.00 33.01 34.07 1a2v s GLN 171 CO 0.16 -0.07 -0.22 1.14 -2.12 0.00 0.00 175.29 174.17 1a2v s GLN 172 N -3.19 1.77 -0.32 2.91 -2.07 0.99 -0.94 119.66 118.82 1a2v s GLN 172 Ca 0.01 -0.83 -0.07 0.00 -1.82 0.00 0.00 55.36 52.65 1a2v s GLN 172 Cb 0.02 -1.74 0.02 0.00 -1.09 0.00 0.00 33.01 30.23 1a2v s GLN 172 CO -0.07 0.47 0.09 0.00 -1.32 0.00 0.00 175.29 174.47 1a2v s ALA 173 N -0.57 3.06 -0.49 2.60 0.00 -0.56 -0.79 121.76 125.01 1a2v s ALA 173 Ca 0.09 -1.59 -0.27 0.00 0.00 0.00 0.00 51.96 50.18 1a2v s ALA 173 Cb -0.09 -2.21 0.03 0.00 0.00 0.00 0.00 23.12 20.85 1a2v s ALA 173 CO -0.00 -1.12 1.05 -0.51 0.00 0.00 0.00 175.76 175.18 1a2v s LEU 174 N 1.46 3.78 0.09 0.00 1.43 -0.75 -3.99 118.68 120.70 1a2v s LEU 174 Ca 0.01 0.26 -0.25 0.00 -1.03 0.00 0.00 54.13 53.11 1a2v s LEU 174 Cb -0.18 -3.35 -0.06 0.00 0.03 0.00 0.00 46.19 42.63 1a2v s LEU 174 CO 0.03 -1.20 0.78 -0.69 0.23 0.00 0.00 176.35 175.50 1a2v s VAL 175 N 4.22 4.59 0.25 -1.59 1.01 -1.26 -1.44 120.40 126.18 1a2v s VAL 175 Ca 0.43 1.69 0.01 0.00 0.00 0.00 0.00 61.98 64.10 1a2v s VAL 175 Cb -0.08 -4.14 -0.04 0.00 0.00 0.00 0.00 36.38 32.11 1a2v s VAL 175 CO 0.29 0.42 0.12 -0.31 0.00 0.00 0.00 175.10 175.61 1a2v s TYR 176 N -0.43 1.44 -0.02 5.22 2.02 0.40 -0.85 117.35 125.14 1a2v s TYR 176 Ca 0.38 -1.28 0.01 0.00 -0.37 0.00 0.00 57.07 55.81 1a2v s TYR 176 Cb -0.22 -0.79 0.01 0.00 -0.40 0.00 0.00 41.96 40.56 1a2v s TYR 176 CO 0.25 -0.47 -0.04 -0.47 -1.57 0.00 0.00 175.55 173.25 1a2v s TYR 177 N -3.84 0.48 -0.10 2.71 5.04 -0.25 -0.81 117.35 120.58 1a2v s TYR 177 Ca 0.38 -0.09 0.02 0.00 -2.44 0.00 0.00 57.07 54.94 1a2v s TYR 177 Cb 0.07 -0.40 -0.01 0.00 0.35 0.00 0.00 41.96 41.97 1a2v s TYR 177 CO 0.14 -0.08 -0.18 1.03 -1.34 0.00 0.00 175.55 175.12 1a2v s ARG 178 N 0.40 3.05 0.05 4.97 0.52 -0.00 -4.56 118.95 123.37 1a2v s ARG 178 Ca -0.04 -0.77 0.26 0.00 -0.52 0.00 0.00 55.73 54.65 1a2v s ARG 178 Cb -0.08 -2.44 0.68 0.00 0.52 0.00 0.00 34.95 33.64 1a2v s ARG 178 CO -0.00 0.29 1.56 -1.13 0.02 0.00 0.00 175.30 176.03 1a2v n SER 179 N 3.27 0.45 -3.70 0.23 3.41 -1.26 -4.70 113.62 111.32 1a2v n SER 179 Ca -0.18 0.11 -0.12 0.00 -0.26 0.00 0.00 58.87 58.42 1a2v n SER 179 Cb 0.53 -0.06 -0.10 0.00 -0.26 0.00 0.00 64.21 64.32 1a2v n SER 179 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1a2v s ASP 180 N -3.44 -0.55 0.59 4.04 2.15 -1.26 -5.06 116.67 113.15 1a2v s ASP 180 Ca 0.11 0.99 0.29 0.00 0.43 0.00 0.00 52.55 54.36 1a2v s ASP 180 Cb 0.16 0.93 1.40 0.00 -0.30 0.00 0.00 42.92 45.12 1a2v s ASP 180 CO 0.65 -0.18 1.80 1.05 -0.17 0.00 0.00 175.17 178.32 1a2v h GLU 181 N 6.24 0.00 -0.00 4.34 4.11 -1.98 0.22 114.58 127.51 1a2v h GLU 181 Ca -0.31 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.12 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 0.24 0.00 -0.16 -0.25 0.07 0.00 0.00 179.01 178.90 1a2v n ASP 182 N -3.64 0.58 -4.67 3.06 8.00 -1.26 -4.90 116.55 113.72 1a2v n ASP 182 Ca 0.11 -0.58 -0.30 0.00 0.71 0.00 0.00 54.79 54.74 1a2v n ASP 182 Cb 0.82 -0.03 0.16 0.00 -0.02 0.00 0.00 41.12 42.06 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 -2.54 3.03 -0.32 -2.24 1.01 0.79 -4.98 116.67 111.42 1a2v s ASP 183 Ca 0.26 1.73 -0.11 0.00 0.71 0.00 0.00 52.55 55.14 1a2v s ASP 183 Cb 0.20 -2.35 -0.02 0.00 1.01 0.00 0.00 42.92 41.76 1a2v s ASP 183 CO 0.50 -2.95 0.19 -0.55 0.21 0.00 0.00 175.17 172.57 1a2v s SER 184 N -3.06 5.81 0.55 0.27 0.15 -1.26 -4.97 113.70 111.19 1a2v s SER 184 Ca 0.65 -0.41 0.33 0.00 0.70 0.00 0.00 55.95 57.23 1a2v s SER 184 Cb -0.20 -2.07 1.46 0.00 -1.71 0.00 0.00 66.02 63.50 1a2v s SER 184 CO 0.58 -0.19 2.03 0.06 1.20 0.00 0.00 173.24 176.92 1a2v h GLN 185 N 8.41 0.00 0.00 5.44 3.07 -1.93 -3.33 115.11 126.77 1a2v h GLN 185 Ca -0.32 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.42 1a2v h GLN 185 Cb 1.16 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.72 1a2v h GLN 185 CO 0.61 0.04 0.03 0.66 0.09 0.00 0.00 178.83 180.26 1a2v n TYR 186 N -3.18 0.00 0.52 0.06 4.01 -1.26 -0.74 117.16 116.56 1a2v n TYR 186 Ca -0.00 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.86 1a2v n TYR 186 Cb 0.28 -0.47 0.18 0.00 -0.31 0.00 0.00 39.34 39.03 1a2v n TYR 186 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1a2v h SER 187 N 0.00 0.00 -2.22 7.72 4.64 -1.90 -3.40 113.55 118.40 1a2v h SER 187 Ca 0.00 -0.17 -0.59 0.00 -0.47 0.00 0.00 61.79 60.56 1a2v h SER 187 Cb 0.05 0.00 -0.42 0.00 -0.31 0.00 0.00 62.40 61.72 1a2v h SER 187 CO 0.00 0.08 -0.65 1.41 -0.87 0.00 0.00 176.83 176.80 1a2v n HIS 188 N -2.21 3.56 -1.67 4.77 8.25 0.08 -4.73 115.22 123.26 1a2v n HIS 188 Ca 0.03 -4.06 -0.31 0.00 -0.26 0.00 0.00 57.72 53.12 1a2v n HIS 188 Cb 0.45 -0.52 0.04 0.00 1.12 0.00 0.00 29.99 31.08 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 -2.85 3.13 0.37 -0.41 0.04 -1.26 -1.09 135.00 132.92 1a2v s PRO 189 Ca 0.44 0.92 0.07 0.00 0.04 0.00 0.00 61.00 62.47 1a2v s PRO 189 Cb 0.21 -2.02 -0.01 0.00 0.04 0.00 0.00 34.50 32.72 1a2v s PRO 189 CO -0.07 -0.95 0.42 -0.51 0.04 0.00 0.00 177.00 175.93 1a2v s LEU 190 N -5.39 3.68 0.00 -3.56 1.43 -0.03 -4.58 118.68 110.23 1a2v s LEU 190 Ca 0.58 -0.44 0.26 0.00 -1.03 0.00 0.00 54.13 53.50 1a2v s LEU 190 Cb -0.13 -2.43 0.73 0.00 0.03 0.00 0.00 46.19 44.38 1a2v s LEU 190 CO 0.54 -0.52 1.56 -0.90 0.23 0.00 0.00 176.35 177.25 1a2v n ASP 191 N -1.58 0.71 -4.75 2.29 5.75 -1.26 -4.43 116.55 113.28 1a2v n ASP 191 Ca 0.02 -0.55 -0.23 0.00 -0.01 0.00 0.00 54.79 54.02 1a2v n ASP 191 Cb 0.59 0.13 -0.06 0.00 -1.03 0.00 0.00 41.12 40.76 1a2v n ASP 191 CO 0.00 0.00 0.00 0.72 -0.11 0.00 0.00 177.20 177.81 1a2v s PHE 192 N -2.71 2.75 -0.28 2.11 -0.71 -1.26 -4.36 117.98 113.52 1a2v s PHE 192 Ca 0.19 -0.35 -0.03 0.00 -1.04 0.00 0.00 56.93 55.71 1a2v s PHE 192 Cb 0.19 -1.63 0.09 0.00 -1.21 0.00 0.00 43.02 40.46 1a2v s PHE 192 CO 0.59 0.33 0.10 0.00 -1.34 0.00 0.00 175.22 174.90 1a2v s PRO 194 N 1.87 4.49 -0.17 0.00 0.02 -1.26 -0.31 135.00 139.65 1a2v s PRO 194 Ca 0.07 2.01 -0.04 0.00 0.02 0.00 0.00 61.00 63.06 1a2v s PRO 194 Cb -0.17 -3.12 -0.03 0.00 0.02 0.00 0.00 34.50 31.20 1a2v s PRO 194 CO -0.27 0.01 -0.03 0.42 -0.33 0.00 0.00 177.00 176.81 1a2v s ILE 195 N -1.16 3.91 -0.06 2.83 -1.09 0.22 -1.50 121.20 124.36 1a2v s ILE 195 Ca 0.47 -0.34 0.06 0.00 -2.23 0.00 0.00 60.65 58.60 1a2v s ILE 195 Cb -0.36 -2.73 -0.01 0.00 -1.58 0.00 0.00 42.46 37.78 1a2v s ILE 195 CO 0.47 0.47 -0.24 -0.69 -1.23 0.00 0.00 174.94 173.72 1a2v s VAL 196 N 0.57 1.98 -0.44 2.92 1.01 -0.11 -1.13 120.40 125.20 1a2v s VAL 196 Ca -0.02 -1.03 -0.27 0.00 0.00 0.00 0.00 61.98 60.66 1a2v s VAL 196 Cb -0.14 -1.68 0.03 0.00 0.00 0.00 0.00 36.38 34.58 1a2v s VAL 196 CO 0.02 0.55 1.02 -0.62 0.00 0.00 0.00 175.10 176.07 1a2v s ASP 197 N -0.12 6.62 0.11 3.32 -1.08 0.37 -1.77 116.67 124.12 1a2v s ASP 197 Ca -0.04 0.41 -0.32 0.00 -0.52 0.00 0.00 52.55 52.08 1a2v s ASP 197 Cb -0.14 -2.50 -0.11 0.00 -1.46 0.00 0.00 42.92 38.71 1a2v s ASP 197 CO 0.04 -1.08 1.59 0.74 0.52 0.00 0.00 175.17 176.97 1a2v h THR 198 N 6.06 0.14 0.27 1.71 2.02 -1.41 0.46 112.91 122.18 1a2v h THR 198 Ca -0.23 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 66.93 1a2v h THR 198 Cb 1.07 0.14 0.00 0.00 -1.74 0.00 0.00 68.15 67.63 1a2v h THR 198 CO 1.06 0.00 -0.13 -0.08 0.37 0.00 0.00 175.52 176.74 1a2v h GLU 199 N -0.71 -0.36 0.00 6.66 4.81 -1.92 -2.79 114.58 120.28 1a2v h GLU 199 Ca 0.01 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 1a2v h GLU 199 Cb 0.70 0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.17 1a2v h GLU 199 CO -0.21 -0.16 0.00 0.93 -0.73 0.00 0.00 179.01 178.84 1a2v h GLU 200 N -0.47 0.00 -6.03 1.92 4.39 -1.91 -3.47 114.58 109.00 1a2v h GLU 200 Ca -0.04 0.00 -0.39 0.00 0.34 0.00 0.00 59.36 59.27 1a2v h GLU 200 Cb 0.36 0.00 0.11 0.00 -0.10 0.00 0.00 28.75 29.11 1a2v h GLU 200 CO 0.06 0.00 -0.91 1.63 -1.16 0.00 0.00 179.01 178.64 1a2v n LYS 201 N -2.44 -1.96 -3.53 2.33 5.02 0.16 -5.00 118.16 112.73 1a2v n LYS 201 Ca 0.01 0.57 -0.17 0.00 -2.02 0.00 0.00 58.31 56.70 1a2v n LYS 201 Cb 0.22 -4.67 -0.06 0.00 -0.02 0.00 0.00 35.03 30.49 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 -5.61 1.03 -0.10 1.97 -2.85 -1.12 -4.97 119.74 108.07 1a2v s LYS 202 Ca 0.40 0.32 -0.30 0.00 -1.00 0.00 0.00 55.97 55.40 1a2v s LYS 202 Cb -0.12 0.49 -0.03 0.00 -2.06 0.00 0.00 37.83 36.11 1a2v s LYS 202 CO 0.83 -0.31 1.36 0.08 0.10 0.00 0.00 175.35 177.42 1a2v s VAL 203 N -1.05 4.04 -1.52 1.79 1.01 -1.26 -0.48 120.40 122.93 1a2v s VAL 203 Ca -0.10 1.29 0.17 0.00 0.00 0.00 0.00 61.98 63.35 1a2v s VAL 203 Cb -0.00 -3.83 -0.02 0.00 0.00 0.00 0.00 36.38 32.53 1a2v s VAL 203 CO 0.09 -0.08 0.88 2.30 0.00 0.00 0.00 175.10 178.29 1a2v n ILE 204 N 5.21 0.00 -3.60 2.22 -5.35 -0.28 -4.93 119.36 112.62 1a2v n ILE 204 Ca 0.14 -0.31 -0.05 0.00 -0.27 0.00 0.00 62.75 62.26 1a2v n ILE 204 Cb 0.44 1.19 -0.04 0.00 -1.74 0.00 0.00 39.64 39.50 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 -2.03 -0.17 -0.08 4.28 5.36 -1.19 -5.01 117.98 119.14 1a2v s PHE 205 Ca 0.14 0.24 -0.01 0.00 -0.96 0.00 0.00 56.93 56.34 1a2v s PHE 205 Cb 0.14 0.49 0.03 0.00 -0.34 0.00 0.00 43.02 43.33 1a2v s PHE 205 CO 0.45 -0.19 -0.04 0.42 -1.46 0.00 0.00 175.22 174.40 1a2v s ILE 206 N -1.57 0.66 -0.30 3.12 1.01 -1.26 0.70 121.20 123.56 1a2v s ILE 206 Ca 0.06 -0.08 -0.27 0.00 0.00 0.00 0.00 60.65 60.36 1a2v s ILE 206 Cb -0.01 -0.74 0.01 0.00 0.01 0.00 0.00 42.46 41.73 1a2v s ILE 206 CO -0.04 0.30 0.97 -1.81 0.00 0.00 0.00 174.94 174.36 1a2v s ASP 207 N 1.69 6.87 -0.10 3.58 1.01 0.58 -4.89 116.67 125.41 1a2v s ASP 207 Ca 0.02 0.97 0.03 0.00 0.71 0.00 0.00 52.55 54.28 1a2v s ASP 207 Cb -0.13 -2.50 -0.01 0.00 1.01 0.00 0.00 42.92 41.29 1a2v s ASP 207 CO -0.05 -0.76 -0.18 -0.63 0.21 0.00 0.00 175.17 173.76 1a2v s ILE 208 N 3.35 2.62 0.60 0.77 1.01 -1.26 -0.66 121.20 127.63 1a2v s ILE 208 Ca 0.41 -0.84 -0.17 0.00 0.00 0.00 0.00 60.65 60.05 1a2v s ILE 208 Cb -0.13 -2.04 -0.03 0.00 0.01 0.00 0.00 42.46 40.27 1a2v s ILE 208 CO 0.13 0.55 1.13 -2.16 0.00 0.00 0.00 174.94 174.59 1a2v s PRO 209 N 0.10 3.05 0.29 2.79 0.04 -1.26 -4.93 135.00 135.07 1a2v s PRO 209 Ca -0.08 1.52 0.06 0.00 0.04 0.00 0.00 61.00 62.54 1a2v s PRO 209 Cb -0.15 -1.97 0.42 0.00 0.04 0.00 0.00 34.50 32.84 1a2v s PRO 209 CO 0.05 -1.08 1.68 -0.91 0.04 0.00 0.00 177.00 176.79 1a2v h ASN 210 N 0.60 0.25 -3.64 6.66 2.35 -1.98 -3.38 115.58 116.44 1a2v h ASN 210 Ca -0.48 -0.11 -0.69 0.00 -0.55 0.00 0.00 56.30 54.47 1a2v h ASN 210 Cb 1.26 -0.07 -0.21 0.00 0.05 0.00 0.00 38.32 39.34 1a2v h ASN 210 CO 0.55 0.67 -0.50 -0.60 -1.65 0.00 0.00 177.43 175.90 1a2v s ARG 211 N -4.08 3.25 0.14 0.81 3.52 -1.26 -5.07 118.95 116.25 1a2v s ARG 211 Ca -0.04 -0.80 -0.26 0.00 -0.13 0.00 0.00 55.73 54.49 1a2v s ARG 211 Cb 0.13 -3.75 -0.07 0.00 -1.56 0.00 0.00 34.95 29.70 1a2v s ARG 211 CO 0.78 -0.53 0.80 1.03 -0.81 0.00 0.00 175.30 176.57 1a2v s ARG 212 N 1.65 4.58 -0.16 5.12 1.81 -1.26 -5.05 118.95 125.64 1a2v s ARG 212 Ca 0.05 1.19 -0.01 0.00 -1.72 0.00 0.00 55.73 55.24 1a2v s ARG 212 Cb -0.18 -3.30 0.04 0.00 -0.45 0.00 0.00 34.95 31.06 1a2v s ARG 212 CO 0.09 0.46 -0.05 1.03 -0.68 0.00 0.00 175.30 176.15 1a2v s ARG 213 N -0.77 1.36 0.60 3.54 3.00 -1.26 -5.07 118.95 120.35 1a2v s ARG 213 Ca 0.38 -0.47 -0.12 0.00 0.00 0.00 0.00 55.73 55.52 1a2v s ARG 213 Cb -0.23 -1.94 -0.04 0.00 0.00 0.00 0.00 34.95 32.74 1a2v s ARG 213 CO 0.26 -0.43 1.02 0.15 0.00 0.00 0.00 175.30 176.31 1a2v s LYS 214 N 1.66 3.63 0.31 3.54 1.02 -1.26 -4.23 119.74 124.41 1a2v s LYS 214 Ca 0.01 0.81 -0.25 0.00 0.02 0.00 0.00 55.97 56.56 1a2v s LYS 214 Cb -0.15 -2.08 -0.15 0.00 -0.52 0.00 0.00 37.83 34.92 1a2v s LYS 214 CO -0.08 -0.55 0.46 0.28 -0.92 0.00 0.00 175.35 174.55 1a2v n VAL 215 N -2.54 1.58 -2.17 3.17 0.31 -0.57 -4.88 118.33 113.23 1a2v n VAL 215 Ca 0.06 -0.50 -0.40 0.00 -0.01 0.00 0.00 64.34 63.50 1a2v n VAL 215 Cb 0.54 -0.23 -0.02 0.00 -0.91 0.00 0.00 33.84 33.22 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 -0.94 6.60 -0.04 4.52 0.15 -1.26 -4.91 113.70 117.83 1a2v s SER 216 Ca 0.62 2.56 0.20 0.00 0.70 0.00 0.00 55.95 60.03 1a2v s SER 216 Cb -0.75 -2.64 0.62 0.00 -1.71 0.00 0.00 66.02 61.54 1a2v s SER 216 CO 0.59 -0.64 1.52 0.29 1.20 0.00 0.00 173.24 176.20 1a2v n LYS 217 N 0.44 3.04 -2.39 5.44 5.02 -1.26 -4.97 118.16 123.47 1a2v n LYS 217 Ca 0.02 -2.65 -0.28 0.00 -2.02 0.00 0.00 58.31 53.39 1a2v n LYS 217 Cb 0.44 -1.62 0.02 0.00 -0.02 0.00 0.00 35.03 33.84 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 -1.28 3.42 0.60 2.13 3.76 -1.26 -5.04 115.29 117.62 1a2v s HIS 218 Ca 0.46 0.81 -0.19 0.00 -0.15 0.00 0.00 55.06 55.99 1a2v s HIS 218 Cb 0.26 -2.59 -0.03 0.00 1.11 0.00 0.00 32.58 31.32 1a2v s HIS 218 CO 0.28 -0.63 1.23 0.15 -0.85 0.00 0.00 174.74 174.92 1a2v s LYS 219 N -4.94 2.91 0.56 1.40 1.02 -1.26 -4.96 119.74 114.47 1a2v s LYS 219 Ca 0.52 1.88 -0.19 0.00 0.02 0.00 0.00 55.97 58.20 1a2v s LYS 219 Cb -0.11 -1.93 -0.05 0.00 -0.52 0.00 0.00 37.83 35.23 1a2v s LYS 219 CO 0.46 -1.27 1.14 -1.01 -0.92 0.00 0.00 175.35 173.76 1a2v s HIS 220 N -1.54 2.61 -0.74 3.18 3.76 -1.26 -4.94 115.29 116.36 1a2v s HIS 220 Ca 0.78 1.54 -0.19 0.00 -0.15 0.00 0.00 55.06 57.04 1a2v s HIS 220 Cb -0.32 -3.31 0.12 0.00 1.11 0.00 0.00 32.58 30.18 1a2v s HIS 220 CO 0.35 -1.70 0.87 0.00 -0.85 0.00 0.00 174.74 173.41 1a2v s ALA 221 N -1.80 3.46 0.28 -1.40 0.00 -1.26 -5.02 121.76 116.02 1a2v s ALA 221 Ca 0.73 -2.50 0.06 0.00 0.00 0.00 0.00 51.96 50.25 1a2v s ALA 221 Cb -0.25 -3.73 -0.02 0.00 0.00 0.00 0.00 23.12 19.13 1a2v s ALA 221 CO 0.29 -2.58 0.40 -0.80 0.00 0.00 0.00 175.76 173.07 1a2v s ASN 222 N 3.42 6.14 0.00 0.00 0.01 -1.26 -4.63 114.94 118.62 1a2v s ASN 222 Ca 0.20 -0.05 0.00 0.00 -0.71 0.00 0.00 52.86 52.30 1a2v s ASN 222 Cb -0.15 -1.59 0.00 0.00 0.41 0.00 0.00 41.25 39.92 1a2v s ASN 222 CO -0.00 -0.21 0.28 2.22 -1.51 0.00 0.00 177.10 177.88 1a2v n PHE 223 N -1.49 0.00 -2.17 2.20 1.16 -1.26 -4.70 117.46 111.20 1a2v n PHE 223 Ca -0.05 -0.02 -0.32 0.00 -1.87 0.00 0.00 57.45 55.18 1a2v n PHE 223 Cb 0.57 -0.00 -0.01 0.00 -1.61 0.00 0.00 39.48 38.44 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 -0.05 3.20 0.28 2.97 1.51 -1.26 -4.73 117.35 119.28 1a2v s TYR 224 Ca 0.00 1.48 -0.04 0.00 -1.01 0.00 0.00 57.07 57.50 1a2v s TYR 224 Cb 0.00 -2.91 0.56 0.00 -0.11 0.00 0.00 41.96 39.51 1a2v s TYR 224 CO 0.00 -0.80 1.60 -1.35 -1.11 0.00 0.00 175.55 173.89 1a2v h PRO 225 N 0.57 0.05 -0.81 -1.71 0.11 -1.98 0.38 132.00 128.62 1a2v h PRO 225 Ca -0.47 -0.00 0.03 0.00 0.11 0.00 0.00 66.00 65.67 1a2v h PRO 225 Cb 1.20 -0.01 -0.04 0.00 0.11 0.00 0.00 31.00 32.26 1a2v h PRO 225 CO 0.59 0.03 0.53 1.57 -0.21 0.00 0.00 178.00 180.51 1a2v h LYS 226 N 0.05 0.99 -0.23 1.05 2.10 -1.99 0.34 116.57 118.88 1a2v h LYS 226 Ca 0.50 -0.06 -0.06 0.00 -2.00 0.00 0.00 60.65 59.02 1a2v h LYS 226 Cb 0.92 -0.22 -0.01 0.00 -0.90 0.00 0.00 32.23 32.02 1a2v h LYS 226 CO -0.83 0.66 -0.10 0.45 -2.00 0.00 0.00 179.45 177.63 1a2v h HIS 227 N 1.02 0.55 -0.06 0.07 3.86 -0.72 -2.79 115.15 117.09 1a2v h HIS 227 Ca 0.31 -0.13 -0.00 0.00 -1.16 0.00 0.00 60.37 59.39 1a2v h HIS 227 Cb -0.01 -0.13 -0.00 0.00 1.06 0.00 0.00 27.41 28.33 1a2v h HIS 227 CO -0.00 0.75 0.03 0.52 0.86 0.00 0.00 177.93 180.09 1a2v h MET 228 N 0.20 0.08 -0.97 2.45 2.86 -0.02 0.97 114.93 120.50 1a2v h MET 228 Ca 0.05 -0.01 0.21 0.00 -2.06 0.00 0.00 59.70 57.89 1a2v h MET 228 Cb 0.60 -0.02 -0.09 0.00 0.06 0.00 0.00 31.60 32.15 1a2v h MET 228 CO 0.03 0.13 0.62 0.82 1.06 0.00 0.00 176.91 179.57 1a2v h ILE 229 N 0.01 0.67 -0.10 -1.22 2.04 -0.34 0.41 117.51 118.98 1a2v h ILE 229 Ca 0.02 -0.20 -0.16 0.00 1.00 0.00 0.00 64.86 65.52 1a2v h ILE 229 Cb 0.07 0.05 0.01 0.00 -0.74 0.00 0.00 36.82 36.21 1a2v h ILE 229 CO -0.00 0.10 -0.57 -0.33 0.00 0.00 0.00 178.15 177.35 1a2v h GLU 230 N 0.57 0.56 0.52 2.37 5.08 -1.12 -3.33 114.58 119.23 1a2v h GLU 230 Ca 0.54 -0.47 -0.03 0.00 -1.00 0.00 0.00 59.36 58.40 1a2v h GLU 230 Cb 1.10 0.10 0.01 0.00 0.50 0.00 0.00 28.75 30.45 1a2v h GLU 230 CO -0.28 1.10 -0.25 -0.22 -1.00 0.00 0.00 179.01 178.35 1a2v h LYS 231 N 0.17 -0.67 -6.18 2.33 3.64 0.14 -3.44 116.57 112.56 1a2v h LYS 231 Ca -0.04 0.05 -0.51 0.00 -1.27 0.00 0.00 60.65 58.87 1a2v h LYS 231 Cb 1.22 0.15 -0.04 0.00 -0.41 0.00 0.00 32.23 33.16 1a2v h LYS 231 CO 0.12 -0.45 -0.51 0.14 -2.27 0.00 0.00 179.45 176.48 1a2v s VAL 232 N -4.02 4.72 0.26 2.00 -7.23 0.12 -5.01 120.40 111.24 1a2v s VAL 232 Ca -0.10 -1.19 -0.11 0.00 -1.81 0.00 0.00 61.98 58.77 1a2v s VAL 232 Cb 0.01 -3.52 0.38 0.00 0.56 0.00 0.00 36.38 33.81 1a2v s VAL 232 CO 0.31 -0.28 1.56 1.23 -0.31 0.00 0.00 175.10 177.61 1a2v h GLY 233 N 1.63 0.51 -1.11 2.32 0.00 -1.80 -3.34 103.07 101.29 1a2v h GLY 233 Ca -0.49 0.38 0.01 0.00 0.00 0.00 0.00 47.33 47.23 1a2v h GLY 233 CO 0.62 -0.32 0.34 0.00 0.00 0.00 0.00 176.54 177.18 1a2v s ALA 234 N -6.16 -0.87 0.53 3.60 0.00 -1.25 -4.57 121.76 113.03 1a2v s ALA 234 Ca -0.15 -0.72 -0.09 0.00 0.00 0.00 0.00 51.96 51.01 1a2v s ALA 234 Cb 0.25 0.68 -0.04 0.00 0.00 0.00 0.00 23.12 24.00 1a2v s ALA 234 CO 0.76 -1.00 0.90 -1.64 0.00 0.00 0.00 175.76 174.78 1a2v s MET 235 N -2.13 3.63 0.51 0.00 1.00 -1.26 -4.71 119.30 116.33 1a2v s MET 235 Ca 0.17 0.51 -0.20 0.00 0.00 0.00 0.00 55.69 56.18 1a2v s MET 235 Cb -0.05 -2.24 -0.07 0.00 0.00 0.00 0.00 34.83 32.47 1a2v s MET 235 CO 0.11 -0.33 1.07 1.03 0.00 0.00 0.00 175.02 176.89 1a2v s ARG 236 N -4.75 3.64 0.43 2.03 0.52 -1.26 -4.97 118.95 114.59 1a2v s ARG 236 Ca 0.52 1.42 -0.25 0.00 -0.52 0.00 0.00 55.73 56.90 1a2v s ARG 236 Cb -0.11 -2.06 -0.08 0.00 0.52 0.00 0.00 34.95 33.22 1a2v s ARG 236 CO 0.46 -0.58 1.34 -2.14 0.02 0.00 0.00 175.30 174.39 1a2v s PRO 237 N -3.30 3.81 0.49 3.54 0.02 -1.26 -4.92 135.00 133.37 1a2v s PRO 237 Ca 0.69 2.22 -0.21 0.00 0.02 0.00 0.00 61.00 63.71 1a2v s PRO 237 Cb -0.18 -2.67 -0.09 0.00 0.02 0.00 0.00 34.50 31.58 1a2v s PRO 237 CO 0.23 -0.65 0.82 -1.91 -0.33 0.00 0.00 177.00 175.16 1a2v n GLU 238 N -0.09 0.94 -3.95 5.54 4.07 -1.26 -4.94 120.64 120.94 1a2v n GLU 238 Ca 0.05 0.35 -0.27 0.00 -0.06 0.00 0.00 57.16 57.23 1a2v n GLU 238 Cb 0.43 -1.90 -0.03 0.00 -0.06 0.00 0.00 31.44 29.88 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 -1.45 3.95 0.19 4.31 0.00 -1.26 -5.04 121.76 122.47 1a2v s ALA 239 Ca 0.67 -1.02 -0.32 0.00 0.00 0.00 0.00 51.96 51.28 1a2v s ALA 239 Cb -0.51 -1.76 -0.15 0.00 0.00 0.00 0.00 23.12 20.70 1a2v s ALA 239 CO 0.54 0.56 1.24 -2.30 0.00 0.00 0.00 175.76 175.80 1a2v n PRO 240 N -0.46 1.44 -1.60 0.00 -0.02 -1.26 -4.90 135.00 128.20 1a2v n PRO 240 Ca -0.07 0.51 -0.32 0.00 -2.02 0.00 0.00 63.50 61.60 1a2v n PRO 240 Cb 0.54 -2.06 0.06 0.00 -0.02 0.00 0.00 33.50 32.02 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 2.70 -0.29 0.52 0.04 -1.26 -5.02 135.00 131.29 1a2v s PRO 241 Ca 0.71 1.23 0.01 0.00 0.04 0.00 0.00 61.00 62.99 1a2v s PRO 241 Cb -0.79 -1.95 0.09 0.00 0.04 0.00 0.00 34.50 31.89 1a2v s PRO 241 CO 0.51 -1.30 0.03 0.42 0.04 0.00 0.00 177.00 176.71 1a2v s ILE 242 N -2.65 1.44 -0.12 0.56 1.01 -1.26 -5.11 121.20 115.07 1a2v s ILE 242 Ca 0.63 -1.56 -0.13 0.00 0.00 0.00 0.00 60.65 59.60 1a2v s ILE 242 Cb -0.18 -1.95 -0.05 0.00 0.01 0.00 0.00 42.46 40.29 1a2v s ILE 242 CO 0.48 -0.45 0.29 0.20 0.00 0.00 0.00 174.94 175.45 1a2v s ASN 243 N 1.37 6.51 -0.20 3.58 0.01 -1.26 -5.07 114.94 119.88 1a2v s ASN 243 Ca 0.05 0.60 -0.06 0.00 -0.71 0.00 0.00 52.86 52.74 1a2v s ASN 243 Cb -0.18 -2.18 -0.03 0.00 0.41 0.00 0.00 41.25 39.27 1a2v s ASN 243 CO -0.14 0.21 0.02 -0.69 -1.51 0.00 0.00 177.10 174.98 1a2v s VAL 244 N -0.14 4.16 0.01 1.60 1.01 -1.26 -5.10 120.40 120.68 1a2v s VAL 244 Ca 0.18 -0.24 0.01 0.00 0.00 0.00 0.00 61.98 61.92 1a2v s VAL 244 Cb -0.14 -2.88 -0.01 0.00 0.00 0.00 0.00 36.38 33.36 1a2v s VAL 244 CO 0.06 0.43 -0.03 0.42 0.00 0.00 0.00 175.10 175.98 1a2v s THR 245 N 0.85 0.24 -0.61 3.92 -4.23 -1.26 -4.77 115.64 109.78 1a2v s THR 245 Ca 0.01 -0.30 0.05 0.00 -1.18 0.00 0.00 61.69 60.27 1a2v s THR 245 Cb -0.14 -0.24 0.20 0.00 1.34 0.00 0.00 72.50 73.65 1a2v s THR 245 CO 0.02 -0.05 0.53 0.00 -0.54 0.00 0.00 174.62 174.59 1a2v n GLN 246 N 2.70 1.62 -0.32 3.99 6.02 -1.26 -4.98 117.38 125.14 1a2v n GLN 246 Ca -0.15 -4.20 0.13 0.00 -0.01 0.00 0.00 57.00 52.78 1a2v n GLN 246 Cb 0.58 -2.08 0.32 0.00 1.02 0.00 0.00 30.24 30.08 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 5.00 0.54 -0.65 -1.09 0.13 -2.05 -0.61 132.00 133.28 1a2v h PRO 247 Ca 0.18 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 1a2v h PRO 247 Cb 0.77 -0.12 0.00 0.00 0.13 0.00 0.00 31.00 31.78 1a2v h PRO 247 CO 0.66 0.36 0.00 0.39 -0.23 0.00 0.00 178.00 179.18 1a2v n GLU 248 N -4.92 3.28 0.00 0.86 1.02 -1.26 -5.05 120.64 114.58 1a2v n GLU 248 Ca 0.23 -2.52 0.00 0.00 -0.02 0.00 0.00 57.16 54.85 1a2v n GLU 248 Cb 0.62 -1.78 0.00 0.00 -0.02 0.00 0.00 31.44 30.27 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 1.14 -1.71 3.85 0.62 0.00 -0.24 -5.01 105.19 103.84 1a2v n GLY 249 Ca 0.23 -2.02 -0.22 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 4.29 -1.11 1.61 -7.23 -1.26 -4.82 120.40 111.87 1a2v s VAL 250 Ca 0.00 -1.35 0.25 0.00 -1.81 0.00 0.00 61.98 59.07 1a2v s VAL 250 Cb 0.00 -3.39 0.05 0.00 0.56 0.00 0.00 36.38 33.60 1a2v s VAL 250 CO 0.00 -0.30 1.44 -1.54 -0.31 0.00 0.00 175.10 174.39 1a2v n SER 251 N -1.26 0.57 -4.91 4.85 3.41 -1.26 -4.90 113.62 110.12 1a2v n SER 251 Ca -0.06 -0.34 -0.27 0.00 -0.26 0.00 0.00 58.87 57.93 1a2v n SER 251 Cb 0.58 0.23 -0.02 0.00 -0.26 0.00 0.00 64.21 64.74 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 -2.92 3.50 -0.09 7.33 -0.12 -1.26 -4.83 117.98 119.58 1a2v s PHE 252 Ca 0.13 0.64 0.01 0.00 -0.05 0.00 0.00 56.93 57.66 1a2v s PHE 252 Cb 0.18 -2.12 0.02 0.00 -0.63 0.00 0.00 43.02 40.47 1a2v s PHE 252 CO 0.67 0.07 -0.10 0.21 -0.05 0.00 0.00 175.22 176.02 1a2v s LYS 253 N -3.94 1.59 -0.16 1.99 2.20 -0.14 -4.99 119.74 116.29 1a2v s LYS 253 Ca 0.44 -0.33 -0.03 0.00 -0.36 0.00 0.00 55.97 55.70 1a2v s LYS 253 Cb -0.10 -1.47 -0.02 0.00 -1.51 0.00 0.00 37.83 34.72 1a2v s LYS 253 CO 0.34 -0.12 -0.07 -1.64 -0.36 0.00 0.00 175.35 173.50 1a2v s MET 254 N 1.17 3.54 -0.68 4.03 -1.94 -1.26 -0.88 119.30 123.28 1a2v s MET 254 Ca -0.05 -0.59 0.02 0.00 -1.71 0.00 0.00 55.69 53.36 1a2v s MET 254 Cb -0.14 -2.84 0.17 0.00 2.01 0.00 0.00 34.83 34.03 1a2v s MET 254 CO -0.02 0.18 0.48 0.99 -0.01 0.00 0.00 175.02 176.63 1a2v s THR 255 N 0.51 3.22 0.00 2.05 2.01 0.43 -4.97 115.64 118.89 1a2v s THR 255 Ca -0.05 -3.75 0.00 0.00 0.31 0.00 0.00 61.69 58.20 1a2v s THR 255 Cb -0.15 -3.11 0.00 0.00 0.01 0.00 0.00 72.50 69.25 1a2v s THR 255 CO 0.03 -0.95 0.00 0.61 -0.69 0.00 0.00 174.62 173.63 1a2v n GLY 256 N 2.57 1.43 0.05 4.40 0.00 -1.26 -2.83 105.19 109.55 1a2v n GLY 256 Ca 0.14 -0.71 0.11 0.00 0.00 0.00 0.00 46.02 45.56 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 6.33 0.95 -4.68 1.61 3.02 -1.26 -4.90 115.26 116.32 1a2v n ASN 257 Ca 0.00 -0.84 -0.42 0.00 -0.03 0.00 0.00 54.58 53.29 1a2v n ASN 257 Cb 0.00 0.72 -0.03 0.00 -0.61 0.00 0.00 39.78 39.87 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 -2.94 4.13 0.09 2.41 1.01 -1.13 -0.92 120.40 123.05 1a2v s VAL 258 Ca 0.10 1.46 0.03 0.00 0.00 0.00 0.00 61.98 63.57 1a2v s VAL 258 Cb 0.17 -3.94 -0.04 0.00 0.00 0.00 0.00 36.38 32.57 1a2v s VAL 258 CO 0.79 -0.01 0.10 -0.32 0.00 0.00 0.00 175.10 175.66 1a2v s MET 259 N 2.39 2.96 -0.04 2.72 0.00 0.21 -0.43 119.30 127.11 1a2v s MET 259 Ca 0.58 -0.68 -0.02 0.00 0.00 0.00 0.00 55.69 55.56 1a2v s MET 259 Cb -0.26 -2.76 0.03 0.00 0.00 0.00 0.00 34.83 31.85 1a2v s MET 259 CO 0.22 0.56 0.06 -1.21 0.00 0.00 0.00 175.02 174.65 1a2v s GLU 260 N -2.51 -0.06 -0.28 4.11 2.02 -0.06 -2.15 118.70 119.77 1a2v s GLU 260 Ca 0.30 0.36 -0.17 0.00 0.02 0.00 0.00 54.97 55.49 1a2v s GLU 260 Cb -0.12 -0.56 0.09 0.00 0.10 0.00 0.00 34.13 33.65 1a2v s GLU 260 CO 0.23 -0.34 0.75 -0.46 0.02 0.00 0.00 175.26 175.46 1a2v s TRP 261 N 2.17 -0.95 -1.68 1.61 -0.00 -0.65 -0.97 118.94 118.46 1a2v s TRP 261 Ca 0.05 1.93 -0.18 0.00 -0.00 0.00 0.00 56.10 57.90 1a2v s TRP 261 Cb -0.12 0.56 0.15 0.00 -0.00 0.00 0.00 33.47 34.06 1a2v s TRP 261 CO -0.03 -0.47 0.81 0.43 -0.00 0.00 0.00 176.95 177.69 1a2v n SER 262 N 4.08 -3.46 0.00 5.86 7.64 -1.26 -0.03 113.62 126.45 1a2v n SER 262 Ca -0.19 -0.98 0.00 0.00 1.01 0.00 0.00 58.87 58.71 1a2v n SER 262 Cb 0.58 -2.91 0.00 0.00 -1.01 0.00 0.00 64.21 60.88 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 -2.68 0.00 -4.83 6.43 3.02 -1.26 -4.92 115.26 111.02 1a2v n ASN 263 Ca 0.07 0.00 -0.33 0.00 -0.03 0.00 0.00 54.58 54.29 1a2v n ASN 263 Cb 0.50 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.60 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 -2.52 3.33 -0.15 3.10 0.08 0.96 -0.18 117.98 122.60 1a2v s PHE 264 Ca 0.00 1.54 -0.09 0.00 0.12 0.00 0.00 56.93 58.51 1a2v s PHE 264 Cb 0.00 -2.80 0.05 0.00 -0.57 0.00 0.00 43.02 39.70 1a2v s PHE 264 CO 0.00 -0.10 0.36 0.21 -0.10 0.00 0.00 175.22 175.59 1a2v s LYS 265 N -3.22 0.35 0.22 0.44 2.20 -0.69 -1.64 119.74 117.39 1a2v s LYS 265 Ca 0.61 0.66 -0.23 0.00 -0.36 0.00 0.00 55.97 56.65 1a2v s LYS 265 Cb -0.09 -0.01 0.04 0.00 -1.51 0.00 0.00 37.83 36.26 1a2v s LYS 265 CO 0.15 -0.14 0.83 -0.59 -0.36 0.00 0.00 175.35 175.24 1a2v s PHE 266 N 1.13 -0.16 -0.13 4.03 -0.71 -0.91 -1.19 117.98 120.03 1a2v s PHE 266 Ca -0.08 -0.22 -0.04 0.00 -1.04 0.00 0.00 56.93 55.55 1a2v s PHE 266 Cb -0.08 0.68 -0.03 0.00 -1.21 0.00 0.00 43.02 42.37 1a2v s PHE 266 CO -0.09 -1.04 0.01 -1.58 -1.34 0.00 0.00 175.22 171.17 1a2v s HIS 267 N -3.62 3.16 -0.41 3.49 5.65 -0.43 0.68 115.29 123.81 1a2v s HIS 267 Ca 0.12 0.04 -0.13 0.00 0.25 0.00 0.00 55.06 55.34 1a2v s HIS 267 Cb -0.04 -1.91 0.05 0.00 -1.18 0.00 0.00 32.58 29.50 1a2v s HIS 267 CO 0.05 0.27 0.28 0.42 -0.65 0.00 0.00 174.74 175.10 1a2v s ILE 268 N -0.26 4.81 0.38 0.89 1.01 -0.10 -1.63 121.20 126.30 1a2v s ILE 268 Ca 0.06 -0.97 0.05 0.00 0.00 0.00 0.00 60.65 59.80 1a2v s ILE 268 Cb -0.12 -3.77 0.05 0.00 0.01 0.00 0.00 42.46 38.62 1a2v s ILE 268 CO 0.02 -0.38 0.43 0.61 0.00 0.00 0.00 174.94 175.61 1a2v n GLY 269 N 5.06 2.35 3.64 6.18 0.00 0.16 -4.82 105.19 117.76 1a2v n GLY 269 Ca -0.11 -2.22 -0.07 0.00 0.00 0.00 0.00 46.02 43.61 1a2v n GLY 269 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1a2v s PHE 270 N -1.61 -0.38 0.12 1.61 2.19 -1.26 -2.04 117.98 116.61 1a2v s PHE 270 Ca 0.32 0.90 -0.09 0.00 0.33 0.00 0.00 56.93 58.39 1a2v s PHE 270 Cb -0.03 0.38 -0.00 0.00 -1.31 0.00 0.00 43.02 42.07 1a2v s PHE 270 CO 0.21 -0.18 0.25 0.54 1.83 0.00 0.00 175.22 177.86 1a2v s ASN 271 N 0.28 0.06 0.36 6.13 2.20 -0.74 -4.76 114.94 118.48 1a2v s ASN 271 Ca 0.03 -0.72 0.17 0.00 -0.94 0.00 0.00 52.86 51.39 1a2v s ASN 271 Cb -0.05 0.39 1.09 0.00 -2.00 0.00 0.00 41.25 40.69 1a2v s ASN 271 CO -0.09 -0.81 1.70 0.10 -2.94 0.00 0.00 177.10 175.06 1a2v h TYR 272 N 2.63 0.83 0.00 1.54 -0.00 -1.90 -1.34 116.97 118.73 1a2v h TYR 272 Ca -0.33 0.03 0.00 0.00 -0.00 0.00 0.00 58.73 58.43 1a2v h TYR 272 Cb 1.22 -0.23 0.00 0.00 -0.00 0.00 0.00 36.73 37.72 1a2v h TYR 272 CO 0.41 -0.07 -0.15 -0.09 -0.00 0.00 0.00 178.16 178.26 1a2v h ARG 273 N 0.37 0.00 0.00 0.10 2.43 -1.88 0.54 114.38 115.93 1a2v h ARG 273 Ca 0.69 0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 59.78 1a2v h ARG 273 Cb 1.66 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 31.19 1a2v h ARG 273 CO -0.47 0.00 -0.41 0.93 -1.51 0.00 0.00 179.97 178.50 1a2v h GLU 274 N -0.40 0.00 0.00 0.20 5.08 -1.81 0.47 114.58 118.12 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 0.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.40 1a2v h GLU 274 CO 0.00 0.41 0.00 0.41 -1.00 0.00 0.00 179.01 178.83 1a2v n GLY 275 N 0.72 0.48 3.75 -3.84 0.00 -0.51 -4.63 105.19 101.17 1a2v n GLY 275 Ca 0.01 -0.96 -0.41 0.00 0.00 0.00 0.00 46.02 44.66 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 2.44 -0.13 -0.61 1.01 -1.26 -1.80 121.20 120.86 1a2v s ILE 276 Ca 0.00 0.39 -0.02 0.00 0.00 0.00 0.00 60.65 61.02 1a2v s ILE 276 Cb 0.00 -3.25 0.04 0.00 0.01 0.00 0.00 42.46 39.26 1a2v s ILE 276 CO 0.00 0.07 -0.00 -0.69 0.00 0.00 0.00 174.94 174.32 1a2v s VAL 277 N -0.24 0.57 -0.14 2.92 1.01 -0.87 -4.59 120.40 119.07 1a2v s VAL 277 Ca 0.59 -0.22 -0.10 0.00 0.00 0.00 0.00 61.98 62.24 1a2v s VAL 277 Cb -0.44 -0.83 -0.05 0.00 0.00 0.00 0.00 36.38 35.07 1a2v s VAL 277 CO 0.48 0.10 0.20 -0.76 0.00 0.00 0.00 175.10 175.12 1a2v s LEU 278 N 1.87 4.31 0.12 3.92 1.43 -0.93 0.37 118.68 129.77 1a2v s LEU 278 Ca 0.03 0.46 0.00 0.00 -1.03 0.00 0.00 54.13 53.59 1a2v s LEU 278 Cb -0.14 -2.20 -0.04 0.00 0.03 0.00 0.00 46.19 43.83 1a2v s LEU 278 CO -0.07 0.26 0.01 -0.44 0.23 0.00 0.00 176.35 176.34 1a2v s SER 279 N -0.27 0.71 -1.26 2.29 0.01 -0.65 -0.73 113.70 113.81 1a2v s SER 279 Ca 0.14 -1.13 -0.14 0.00 1.31 0.00 0.00 55.95 56.13 1a2v s SER 279 Cb -0.12 0.20 0.00 0.00 0.21 0.00 0.00 66.02 66.31 1a2v s SER 279 CO 0.03 -0.62 0.62 -0.67 0.41 0.00 0.00 173.24 173.01 1a2v n ASP 280 N -0.09 -3.11 -4.75 2.44 -0.08 0.72 -1.31 116.55 110.37 1a2v n ASP 280 Ca -0.08 -1.04 -0.39 0.00 -1.51 0.00 0.00 54.79 51.76 1a2v n ASP 280 Cb 0.63 -3.06 -0.05 0.00 2.34 0.00 0.00 41.12 40.97 1a2v n ASP 280 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 1a2v s VAL 281 N -3.68 4.81 0.20 5.18 1.01 0.10 -4.03 120.40 123.98 1a2v s VAL 281 Ca 0.28 1.45 -0.11 0.00 0.00 0.00 0.00 61.98 63.60 1a2v s VAL 281 Cb -0.11 -4.03 -0.00 0.00 0.00 0.00 0.00 36.38 32.24 1a2v s VAL 281 CO 0.88 0.39 0.38 -0.94 0.00 0.00 0.00 175.10 175.81 1a2v s SER 282 N -0.14 -0.04 -0.06 3.32 1.04 -0.33 -1.62 113.70 115.86 1a2v s SER 282 Ca 0.35 -0.86 0.02 0.00 0.48 0.00 0.00 55.95 55.93 1a2v s SER 282 Cb -0.19 0.51 0.02 0.00 0.10 0.00 0.00 66.02 66.45 1a2v s SER 282 CO 0.20 -1.00 -0.09 -0.47 0.98 0.00 0.00 173.24 172.86 1a2v s TYR 283 N -3.98 1.25 -0.88 5.02 6.14 0.07 -1.70 117.35 123.26 1a2v s TYR 283 Ca 0.19 -0.46 -0.24 0.00 0.64 0.00 0.00 57.07 57.21 1a2v s TYR 283 Cb 0.01 -0.96 0.05 0.00 0.42 0.00 0.00 41.96 41.48 1a2v s TYR 283 CO 0.03 -0.27 1.31 1.21 0.64 0.00 0.00 175.55 178.47 1a2v s ASN 284 N 0.85 6.37 -1.17 4.32 3.84 0.75 -0.63 114.94 129.26 1a2v s ASN 284 Ca -0.12 -1.14 -0.20 0.00 0.21 0.00 0.00 52.86 51.62 1a2v s ASN 284 Cb -0.15 -2.53 0.07 0.00 -0.55 0.00 0.00 41.25 38.09 1a2v s ASN 284 CO 0.01 -1.57 1.58 -0.62 -2.79 0.00 0.00 177.10 173.72 1a2v s ASP 285 N 4.30 6.71 -1.44 -4.21 2.15 0.25 -4.41 116.67 120.02 1a2v s ASP 285 Ca 0.39 -2.07 -0.10 0.00 0.43 0.00 0.00 52.55 51.20 1a2v s ASP 285 Cb -0.05 -2.56 0.01 0.00 -0.30 0.00 0.00 42.92 40.03 1a2v s ASP 285 CO 0.00 -1.28 0.23 1.41 -0.17 0.00 0.00 175.17 175.37 1a2v n HIS 286 N 8.36 -1.33 0.00 -5.34 8.25 -1.26 -0.57 115.22 123.32 1a2v n HIS 286 Ca 0.41 0.47 0.00 0.00 -0.26 0.00 0.00 57.72 58.34 1a2v n HIS 286 Cb 0.48 -2.88 0.00 0.00 1.12 0.00 0.00 29.99 28.71 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 -2.40 2.19 3.48 -1.41 0.00 -1.26 -5.02 105.19 100.77 1a2v n GLY 287 Ca -0.27 -0.23 -0.43 0.00 0.00 0.00 0.00 46.02 45.09 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 0.13 6.25 -0.44 1.61 3.04 0.26 -5.01 114.94 120.78 1a2v s ASN 288 Ca 0.00 -0.67 -0.27 0.00 0.04 0.00 0.00 52.86 51.97 1a2v s ASN 288 Cb 0.00 -2.28 0.02 0.00 -1.54 0.00 0.00 41.25 37.46 1a2v s ASN 288 CO 0.00 -0.76 0.99 -0.69 -3.04 0.00 0.00 177.10 173.60 1a2v s VAL 289 N 2.53 4.42 -0.17 -5.21 1.01 -1.26 0.87 120.40 122.60 1a2v s VAL 289 Ca 0.16 1.04 -0.03 0.00 0.00 0.00 0.00 61.98 63.15 1a2v s VAL 289 Cb -0.17 -4.46 -0.02 0.00 0.00 0.00 0.00 36.38 31.73 1a2v s VAL 289 CO 0.15 -0.80 -0.07 -0.13 0.00 0.00 0.00 175.10 174.25 1a2v s ARG 290 N 3.88 3.49 0.71 2.72 0.52 0.19 -4.91 118.95 125.56 1a2v s ARG 290 Ca 0.41 -0.61 -0.14 0.00 -0.52 0.00 0.00 55.73 54.87 1a2v s ARG 290 Cb -0.10 -2.86 0.03 0.00 0.52 0.00 0.00 34.95 32.55 1a2v s ARG 290 CO 0.26 0.09 1.15 -2.14 0.02 0.00 0.00 175.30 174.68 1a2v s PRO 291 N 0.72 2.35 0.17 3.54 0.02 -1.26 -0.75 135.00 139.79 1a2v s PRO 291 Ca -0.03 1.55 0.00 0.00 0.02 0.00 0.00 61.00 62.54 1a2v s PRO 291 Cb -0.15 -1.88 0.00 0.00 0.02 0.00 0.00 34.50 32.49 1a2v s PRO 291 CO 0.02 -1.63 0.00 -0.89 -0.33 0.00 0.00 177.00 174.17 1a2v n ILE 292 N -2.74 0.48 -4.18 2.83 5.41 -0.64 -0.66 119.36 119.87 1a2v n ILE 292 Ca 0.12 0.16 -0.16 0.00 1.00 0.00 0.00 62.75 63.87 1a2v n ILE 292 Cb 0.51 -1.01 -0.13 0.00 -0.71 0.00 0.00 39.64 38.30 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 -2.00 0.71 -0.05 1.39 0.08 -1.18 -1.46 117.98 115.47 1a2v s PHE 293 Ca 0.00 -0.28 0.02 0.00 0.12 0.00 0.00 56.93 56.79 1a2v s PHE 293 Cb 0.00 -0.44 -0.25 0.00 -0.57 0.00 0.00 43.02 41.76 1a2v s PHE 293 CO 0.00 -0.03 0.64 1.25 -0.10 0.00 0.00 175.22 176.99 1a2v h HIS 294 N 5.30 0.28 -2.24 0.36 -0.00 -0.51 0.31 115.15 118.66 1a2v h HIS 294 Ca -0.33 -0.20 -0.07 0.00 -0.00 0.00 0.00 60.37 59.77 1a2v h HIS 294 Cb 1.19 -0.01 -0.21 0.00 -0.00 0.00 0.00 27.41 28.38 1a2v h HIS 294 CO 0.51 1.36 0.03 0.50 -0.00 0.00 0.00 177.93 180.32 1a2v s ARG 295 N -2.59 0.78 -0.13 5.26 3.52 -1.04 -0.20 118.95 124.54 1a2v s ARG 295 Ca -0.11 0.72 -0.11 0.00 -0.13 0.00 0.00 55.73 56.09 1a2v s ARG 295 Cb 0.07 0.38 0.04 0.00 -1.56 0.00 0.00 34.95 33.87 1a2v s ARG 295 CO 0.82 -0.13 0.34 -1.50 -0.81 0.00 0.00 175.30 174.02 1a2v s ILE 296 N 0.00 -0.00 0.02 4.11 2.07 0.09 -0.85 121.20 126.64 1a2v s ILE 296 Ca -0.02 0.02 -0.21 0.00 -1.41 0.00 0.00 60.65 59.03 1a2v s ILE 296 Cb -0.04 -0.48 0.07 0.00 0.13 0.00 0.00 42.46 42.14 1a2v s ILE 296 CO 0.02 0.01 0.95 -1.54 -1.91 0.00 0.00 174.94 172.47 1a2v n SER 297 N 3.10 -1.01 -4.56 4.50 3.41 -0.86 -2.20 113.62 116.00 1a2v n SER 297 Ca -0.15 -1.30 -0.38 0.00 -0.26 0.00 0.00 58.87 56.78 1a2v n SER 297 Cb 0.57 1.59 -0.11 0.00 -0.26 0.00 0.00 64.21 66.00 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 3.98 0.02 1.04 1.43 -1.26 -0.77 118.68 123.12 1a2v s LEU 298 Ca 0.22 -0.09 0.23 0.00 -1.03 0.00 0.00 54.13 53.46 1a2v s LEU 298 Cb -0.01 -2.09 0.04 0.00 0.03 0.00 0.00 46.19 44.16 1a2v s LEU 298 CO 0.01 -0.07 1.05 -1.54 0.23 0.00 0.00 176.35 176.02 1a2v n SER 299 N 5.04 0.69 -3.66 2.29 3.41 -0.36 -4.60 113.62 116.44 1a2v n SER 299 Ca -0.14 -0.50 0.02 0.00 -0.26 0.00 0.00 58.87 58.00 1a2v n SER 299 Cb 0.52 0.80 0.00 0.00 -0.26 0.00 0.00 64.21 65.27 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 -3.09 0.30 0.26 4.33 2.56 -1.25 -4.58 118.70 117.23 1a2v s GLU 300 Ca 0.06 -0.17 -0.16 0.00 0.00 0.00 0.00 54.97 54.70 1a2v s GLU 300 Cb 0.16 0.10 0.01 0.00 2.00 0.00 0.00 34.13 36.39 1a2v s GLU 300 CO 0.81 -0.14 0.57 -1.64 -0.56 0.00 0.00 175.26 174.30 1a2v s MET 301 N -2.23 1.64 -0.29 4.30 -1.94 -1.26 -1.25 119.30 118.27 1a2v s MET 301 Ca 0.18 -1.14 -0.14 0.00 -1.71 0.00 0.00 55.69 52.89 1a2v s MET 301 Cb 0.04 0.53 0.10 0.00 2.01 0.00 0.00 34.83 37.51 1a2v s MET 301 CO -0.04 -0.71 0.69 -1.50 -0.01 0.00 0.00 175.02 173.45 1a2v s ILE 302 N -3.97 -0.37 -0.71 2.53 2.07 -0.59 -4.13 121.20 116.02 1a2v s ILE 302 Ca 0.18 0.00 0.04 0.00 -1.41 0.00 0.00 60.65 59.46 1a2v s ILE 302 Cb -0.03 -1.00 0.22 0.00 0.13 0.00 0.00 42.46 41.79 1a2v s ILE 302 CO 0.08 0.00 0.71 0.52 -1.91 0.00 0.00 174.94 174.34 1a2v n VAL 303 N 4.72 2.37 -2.13 4.00 0.31 -0.31 -1.00 118.33 126.28 1a2v n VAL 303 Ca -0.17 -5.14 -0.42 0.00 -0.01 0.00 0.00 64.34 58.60 1a2v n VAL 303 Cb 0.55 -2.16 -0.03 0.00 -0.91 0.00 0.00 33.84 31.30 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 -2.06 4.25 0.38 5.55 0.04 -1.15 -3.89 135.00 138.12 1a2v s PRO 304 Ca 0.33 2.07 -0.07 0.00 0.04 0.00 0.00 61.00 63.38 1a2v s PRO 304 Cb 0.06 -3.60 -0.05 0.00 0.04 0.00 0.00 34.50 30.95 1a2v s PRO 304 CO -0.07 -0.63 0.69 0.71 0.04 0.00 0.00 177.00 177.74 1a2v s TYR 305 N 2.54 3.50 -0.20 0.56 1.51 -0.87 -0.90 117.35 123.49 1a2v s TYR 305 Ca 0.67 0.81 0.16 0.00 -1.01 0.00 0.00 57.07 57.69 1a2v s TYR 305 Cb -0.34 -2.26 0.59 0.00 -0.11 0.00 0.00 41.96 39.84 1a2v s TYR 305 CO 0.28 -0.04 1.50 0.41 -1.11 0.00 0.00 175.55 176.58 1a2v n GLY 306 N -1.46 3.92 3.72 0.71 0.00 0.29 -4.92 105.19 107.45 1a2v n GLY 306 Ca 0.00 -1.04 -0.37 0.00 0.00 0.00 0.00 46.02 44.62 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 -1.75 6.42 0.00 1.61 0.15 -1.26 -4.79 113.70 114.08 1a2v s SER 307 Ca 0.45 0.49 0.29 0.00 0.70 0.00 0.00 55.95 57.89 1a2v s SER 307 Cb 0.36 -2.19 1.36 0.00 -1.71 0.00 0.00 66.02 63.85 1a2v s SER 307 CO 0.10 0.07 1.96 -0.81 1.20 0.00 0.00 173.24 175.76 1a2v n PRO 308 N 3.73 0.42 -2.43 5.44 -0.04 -1.26 -4.39 135.00 136.47 1a2v n PRO 308 Ca -0.11 -0.06 -0.41 0.00 -0.04 0.00 0.00 63.50 62.88 1a2v n PRO 308 Cb 0.52 -1.50 -0.04 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 -2.62 4.55 0.30 0.54 2.02 -1.26 -4.81 118.70 117.42 1a2v s GLU 309 Ca 0.26 1.83 -0.29 0.00 0.02 0.00 0.00 54.97 56.78 1a2v s GLU 309 Cb 0.20 -3.23 -0.10 0.00 0.10 0.00 0.00 34.13 31.09 1a2v s GLU 309 CO 0.48 0.03 1.43 0.12 0.02 0.00 0.00 175.26 177.35 1a2v s PHE 310 N -0.42 2.90 -0.43 1.61 5.36 -1.26 -0.02 117.98 125.72 1a2v s PHE 310 Ca 0.50 1.13 0.05 0.00 -0.96 0.00 0.00 56.93 57.64 1a2v s PHE 310 Cb -0.32 -3.86 0.64 0.00 -0.34 0.00 0.00 43.02 39.14 1a2v s PHE 310 CO 0.38 -2.64 1.84 -0.35 -1.46 0.00 0.00 175.22 172.99 1a2v n PRO 311 N 1.53 2.19 0.00 10.12 -0.04 -1.26 -4.98 135.00 142.55 1a2v n PRO 311 Ca 0.04 -3.05 0.06 0.00 -0.04 0.00 0.00 63.50 60.50 1a2v n PRO 311 Cb 0.40 -2.12 0.27 0.00 -0.04 0.00 0.00 33.50 32.01 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 -1.14 0.00 0.28 0.54 8.25 0.97 -1.91 115.22 122.21 1a2v n HIS 312 Ca 0.55 0.00 0.17 0.00 -0.26 0.00 0.00 57.72 58.18 1a2v n HIS 312 Cb 1.54 -0.44 0.73 0.00 1.12 0.00 0.00 29.99 32.94 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 -1.77 -1.66 115.11 118.77 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 0.18 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.71 1a2v h GLN 313 CO 0.00 0.03 0.00 0.54 -1.50 0.00 0.00 178.83 177.90 1a2v n ARG 314 N -3.16 0.99 -3.30 1.46 1.74 -0.80 -4.39 116.66 109.20 1a2v n ARG 314 Ca -0.00 0.00 -0.46 0.00 -0.77 0.00 0.00 57.85 56.62 1a2v n ARG 314 Cb 0.29 -1.44 -0.02 0.00 -1.02 0.00 0.00 32.46 30.27 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 3.73 -0.43 5.56 1.02 -0.63 -4.51 119.74 122.48 1a2v s LYS 315 Ca 0.42 -2.56 0.07 0.00 0.02 0.00 0.00 55.97 53.91 1a2v s LYS 315 Cb 0.19 -4.50 0.34 0.00 -0.52 0.00 0.00 37.83 33.35 1a2v s LYS 315 CO 0.32 -1.32 1.23 -2.39 -0.92 0.00 0.00 175.35 172.27 1a2v n HIS 316 N 3.93 -2.61 -1.68 3.18 1.44 -1.26 -2.05 115.22 116.16 1a2v n HIS 316 Ca 0.17 -1.99 -0.45 0.00 -2.01 0.00 0.00 57.72 53.45 1a2v n HIS 316 Cb 0.46 1.61 -0.03 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 n ALA 317 N -0.05 1.38 -3.31 1.59 0.00 -1.25 -4.44 120.51 114.42 1a2v n ALA 317 Ca 0.01 0.42 -0.37 0.00 0.00 0.00 0.00 53.44 53.50 1a2v n ALA 317 Cb 0.76 -2.32 -0.03 0.00 0.00 0.00 0.00 19.45 17.86 1a2v n ALA 317 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1a2v n LEU 318 N 2.52 5.08 -0.30 0.00 4.32 -1.26 -1.16 117.00 126.19 1a2v n LEU 318 Ca 0.13 -5.24 0.15 0.00 -0.02 0.00 0.00 56.01 51.03 1a2v n LEU 318 Cb 0.31 -1.10 0.32 0.00 -1.62 0.00 0.00 43.42 41.34 1a2v n LEU 318 CO 0.63 1.72 0.98 0.44 -1.22 0.00 0.00 177.39 179.93 1a2v h ASP 319 N 5.39 0.10 0.15 -1.43 3.32 -1.92 0.97 116.42 122.99 1a2v h ASP 319 Ca 0.19 0.19 -0.01 0.00 0.02 0.00 0.00 57.03 57.42 1a2v h ASP 319 Cb 0.70 0.24 0.00 0.00 0.22 0.00 0.00 39.33 40.49 1a2v h ASP 319 CO 1.05 -0.14 -0.07 0.40 -1.72 0.00 0.00 179.24 178.76 1a2v h ILE 320 N 0.24 0.93 0.00 0.35 2.04 -1.86 0.72 117.51 119.93 1a2v h ILE 320 Ca 0.58 -0.31 0.00 0.00 1.00 0.00 0.00 64.86 66.13 1a2v h ILE 320 Cb 1.19 1.12 0.00 0.00 -0.74 0.00 0.00 36.82 38.39 1a2v h ILE 320 CO -0.64 0.07 -0.06 0.61 0.00 0.00 0.00 178.15 178.14 1a2v n GLY 321 N -0.78 -1.62 0.00 5.37 0.00 -0.80 -1.78 105.19 105.58 1a2v n GLY 321 Ca -0.09 -0.07 0.07 0.00 0.00 0.00 0.00 46.02 45.94 1a2v n GLY 321 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1a2v n GLU 322 N -2.03 0.99 0.00 1.61 1.02 0.27 -4.37 120.64 118.13 1a2v n GLU 322 Ca 0.06 -0.09 0.00 0.00 -0.02 0.00 0.00 57.16 57.10 1a2v n GLU 322 Cb 0.41 -1.31 0.00 0.00 -0.02 0.00 0.00 31.44 30.52 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 -1.81 0.00 -0.07 -0.32 4.01 -0.40 -1.10 117.16 117.47 1a2v n TYR 323 Ca -0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.73 1a2v n TYR 323 Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.37 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 1.66 0.67 0.29 2.72 0.00 0.11 -4.54 105.19 106.10 1a2v n GLY 324 Ca 0.00 -1.14 0.19 0.00 0.00 0.00 0.00 46.02 45.07 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 0.07 -1.61 119.26 123.33 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 -0.40 0.78 0.00 0.00 0.00 179.25 179.63 1a2v h GLY 326 N 1.37 0.00 0.67 0.00 0.00 -0.06 -3.22 103.07 101.84 1a2v h GLY 326 Ca 0.00 0.00 0.17 0.00 0.00 0.00 0.00 47.33 47.50 1a2v h GLY 326 CO 0.00 0.00 0.49 -0.97 0.00 0.00 0.00 176.54 176.06 1a2v h TYR 327 N -1.00 0.30 -0.07 5.60 0.05 -0.93 -1.46 116.97 119.45 1a2v h TYR 327 Ca -0.09 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.70 1a2v h TYR 327 Cb 0.81 -0.09 0.00 0.00 1.01 0.00 0.00 36.73 38.46 1a2v h TYR 327 CO 0.11 0.11 0.00 -1.33 -1.05 0.00 0.00 178.16 175.99 1a2v n MET 328 N -4.43 2.02 -2.05 4.88 2.81 -0.63 -4.90 117.12 114.82 1a2v n MET 328 Ca 0.14 -1.49 -0.39 0.00 -1.81 0.00 0.00 57.70 54.15 1a2v n MET 328 Cb 0.62 -1.47 0.00 0.00 -0.71 0.00 0.00 33.22 31.66 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 -1.93 2.64 0.01 2.03 -1.32 -0.55 -1.33 115.64 115.18 1a2v s THR 329 Ca 0.33 0.54 -0.19 0.00 -1.21 0.00 0.00 61.69 61.16 1a2v s THR 329 Cb 0.20 -3.30 -0.06 0.00 -1.51 0.00 0.00 72.50 67.84 1a2v s THR 329 CO 0.31 0.05 0.55 0.20 -2.21 0.00 0.00 174.62 173.52 1a2v s ASN 330 N -0.90 6.96 0.04 8.08 0.01 0.88 -4.88 114.94 125.12 1a2v s ASN 330 Ca 0.61 1.14 -0.30 0.00 -0.71 0.00 0.00 52.86 53.59 1a2v s ASN 330 Cb -0.36 -2.34 -0.06 0.00 0.41 0.00 0.00 41.25 38.89 1a2v s ASN 330 CO 0.46 0.18 1.42 -2.84 -1.51 0.00 0.00 177.10 174.80 1a2v s PRO 331 N -0.52 4.29 0.22 -0.60 0.02 -1.26 -4.57 135.00 132.58 1a2v s PRO 331 Ca 0.29 2.03 0.05 0.00 0.02 0.00 0.00 61.00 63.39 1a2v s PRO 331 Cb -0.18 -3.50 0.19 0.00 0.02 0.00 0.00 34.50 31.03 1a2v s PRO 331 CO 0.17 -0.55 1.51 -0.07 -0.33 0.00 0.00 177.00 177.72 1a2v h LEU 332 N 7.98 0.19 0.00 -5.54 -0.00 0.15 -3.42 115.31 114.68 1a2v h LEU 332 Ca -0.39 -0.13 0.00 0.00 -0.00 0.00 0.00 57.88 57.36 1a2v h LEU 332 Cb 1.19 -0.06 0.00 0.00 -0.00 0.00 0.00 40.66 41.79 1a2v h LEU 332 CO 0.89 0.83 0.00 -0.24 -0.00 0.00 0.00 178.44 179.92 1a2v n SER 333 N -3.78 0.00 -0.35 -0.43 2.88 -1.26 -3.86 113.62 106.82 1a2v n SER 333 Ca -0.02 0.81 0.00 0.00 -1.33 0.00 0.00 58.87 58.32 1a2v n SER 333 Cb 0.68 -0.31 0.05 0.00 -0.75 0.00 0.00 64.21 63.89 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 -2.01 -0.56 0.03 2.46 0.00 -1.26 -2.40 117.00 113.26 1a2v n LEU 334 Ca 0.00 1.61 0.05 0.00 0.00 0.00 0.00 56.01 57.67 1a2v n LEU 334 Cb 0.00 -0.39 0.24 0.00 0.00 0.00 0.00 43.42 43.27 1a2v n LEU 334 CO 0.00 -1.46 0.67 0.61 0.00 0.00 0.00 177.39 177.21 1a2v n GLY 335 N -1.46 -0.82 2.11 -3.96 0.00 -1.25 -4.85 105.19 94.96 1a2v n GLY 335 Ca 0.10 0.01 -0.06 0.00 0.00 0.00 0.00 46.02 46.07 1a2v n GLY 335 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a2v h ASP 337 N -0.37 0.32 -3.62 0.00 5.19 -1.78 -3.41 116.42 112.74 1a2v h ASP 337 Ca -0.15 -0.36 -0.66 0.00 -0.62 0.00 0.00 57.03 55.23 1a2v h ASP 337 Cb 1.11 -0.09 -0.24 0.00 0.18 0.00 0.00 39.33 40.29 1a2v h ASP 337 CO 0.17 0.60 -0.61 0.00 -3.12 0.00 0.00 179.24 176.28 1a2v s LYS 339 N 1.58 4.24 0.00 0.00 2.20 -1.26 -4.90 119.74 121.60 1a2v s LYS 339 Ca 0.05 0.48 0.00 0.00 -0.36 0.00 0.00 55.97 56.14 1a2v s LYS 339 Cb -0.16 -3.37 0.00 0.00 -1.51 0.00 0.00 37.83 32.79 1a2v s LYS 339 CO 0.04 0.32 0.00 0.41 -0.36 0.00 0.00 175.35 175.75 1a2v n GLY 340 N 2.80 -0.55 3.56 5.54 0.00 -1.26 -4.87 105.19 110.41 1a2v n GLY 340 Ca -0.09 -2.18 -0.39 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 3.78 0.20 1.61 1.01 -1.26 -4.98 120.40 120.77 1a2v s VAL 341 Ca 0.00 -0.34 -0.06 0.00 0.00 0.00 0.00 61.98 61.58 1a2v s VAL 341 Cb 0.00 -4.85 -0.06 0.00 0.00 0.00 0.00 36.38 31.47 1a2v s VAL 341 CO 0.00 -1.76 0.46 -0.63 0.00 0.00 0.00 175.10 173.18 1a2v s ILE 342 N 5.96 5.07 -0.18 2.22 -1.09 -1.26 -4.67 121.20 127.25 1a2v s ILE 342 Ca 0.47 0.14 -0.00 0.00 -2.23 0.00 0.00 60.65 59.03 1a2v s ILE 342 Cb -0.04 -3.65 0.04 0.00 -1.58 0.00 0.00 42.46 37.24 1a2v s ILE 342 CO -0.00 -0.08 -0.07 -2.28 -1.23 0.00 0.00 174.94 171.28 1a2v s HIS 343 N -1.80 1.96 0.35 3.97 5.65 0.05 -4.96 115.29 120.51 1a2v s HIS 343 Ca 0.43 -1.26 0.06 0.00 0.25 0.00 0.00 55.06 54.53 1a2v s HIS 343 Cb -0.11 -1.43 -0.01 0.00 -1.18 0.00 0.00 32.58 29.85 1a2v s HIS 343 CO 0.25 -0.66 0.50 0.71 -0.65 0.00 0.00 174.74 174.89 1a2v s TYR 344 N 1.55 3.13 0.02 3.88 2.02 -1.26 0.32 117.35 127.01 1a2v s TYR 344 Ca 0.00 -0.15 0.01 0.00 -0.37 0.00 0.00 57.07 56.57 1a2v s TYR 344 Cb -0.16 -2.05 -0.02 0.00 -0.40 0.00 0.00 41.96 39.34 1a2v s TYR 344 CO -0.08 -0.07 -0.05 -0.51 -1.57 0.00 0.00 175.55 173.27 1a2v s LEU 345 N -4.24 2.17 0.25 -1.29 1.43 -0.47 -4.96 118.68 111.57 1a2v s LEU 345 Ca 0.46 -0.37 0.06 0.00 -1.03 0.00 0.00 54.13 53.25 1a2v s LEU 345 Cb -0.10 -0.12 -0.03 0.00 0.03 0.00 0.00 46.19 45.97 1a2v s LEU 345 CO 0.32 -0.14 0.24 -1.81 0.23 0.00 0.00 176.35 175.19 1a2v s ASP 346 N -1.04 5.73 -0.01 2.29 1.01 -1.26 -0.11 116.67 123.28 1a2v s ASP 346 Ca -0.07 -0.17 0.08 0.00 0.71 0.00 0.00 52.55 53.10 1a2v s ASP 346 Cb -0.07 -1.52 -0.02 0.00 1.01 0.00 0.00 42.92 42.32 1a2v s ASP 346 CO -0.00 -0.04 -0.26 0.00 0.21 0.00 0.00 175.17 175.08 1a2v s ALA 347 N -2.09 2.17 -0.07 5.23 0.00 0.07 -4.85 121.76 122.22 1a2v s ALA 347 Ca 0.33 -1.15 0.04 0.00 0.00 0.00 0.00 51.96 51.18 1a2v s ALA 347 Cb -0.08 -0.53 0.00 0.00 0.00 0.00 0.00 23.12 22.51 1a2v s ALA 347 CO 0.26 0.53 -0.18 -1.01 0.00 0.00 0.00 175.76 175.36 1a2v s HIS 348 N -0.65 1.89 0.00 0.00 3.76 -1.26 -0.68 115.29 118.35 1a2v s HIS 348 Ca 0.10 -0.68 0.00 0.00 -0.15 0.00 0.00 55.06 54.34 1a2v s HIS 348 Cb -0.10 -1.30 0.00 0.00 1.11 0.00 0.00 32.58 32.29 1a2v s HIS 348 CO -0.00 -0.28 0.00 1.19 -0.85 0.00 0.00 174.74 174.79 1a2v n PHE 349 N 3.50 0.00 -4.53 1.40 3.72 0.23 -4.90 117.46 116.88 1a2v n PHE 349 Ca -0.20 0.00 -0.24 0.00 -0.05 0.00 0.00 57.45 56.96 1a2v n PHE 349 Cb 0.52 0.00 -0.14 0.00 -0.94 0.00 0.00 39.48 38.93 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 -0.16 2.27 0.70 4.37 0.15 -1.26 -0.80 113.70 118.97 1a2v s SER 350 Ca 0.00 -0.52 0.02 0.00 0.70 0.00 0.00 55.95 56.15 1a2v s SER 350 Cb 0.00 -0.17 0.13 0.00 -1.71 0.00 0.00 66.02 64.27 1a2v s SER 350 CO 0.00 0.12 0.96 1.51 1.20 0.00 0.00 173.24 177.03 1a2v s ASP 351 N -1.25 4.45 0.49 5.45 1.47 0.18 -4.82 116.67 122.65 1a2v s ASP 351 Ca 0.06 -0.58 0.25 0.00 1.18 0.00 0.00 52.55 53.46 1a2v s ASP 351 Cb -0.09 0.22 1.30 0.00 -0.34 0.00 0.00 42.92 44.01 1a2v s ASP 351 CO 0.02 -1.80 1.89 -0.09 0.68 0.00 0.00 175.17 175.87 1a2v h ARG 352 N -0.39 0.17 -0.00 2.11 2.43 -1.89 -1.52 114.38 115.28 1a2v h ARG 352 Ca -0.33 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.83 1a2v h ARG 352 Cb 1.27 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.78 1a2v h ARG 352 CO 0.39 0.11 -0.04 0.00 -1.51 0.00 0.00 179.97 178.91 1a2v n ALA 353 N -2.62 2.48 -0.23 2.80 0.00 -1.26 -0.60 120.51 121.08 1a2v n ALA 353 Ca 0.17 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1a2v n ALA 353 Cb 0.79 -1.44 0.00 0.00 0.00 0.00 0.00 19.45 18.79 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 1.43 0.86 3.75 0.00 0.00 -0.57 -4.94 105.19 105.72 1a2v n GLY 354 Ca 0.09 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.10 6.07 0.43 1.61 1.01 -1.26 -4.55 116.67 117.88 1a2v s ASP 355 Ca 0.00 0.26 -0.24 0.00 0.71 0.00 0.00 52.55 53.28 1a2v s ASP 355 Cb 0.00 -2.02 -0.10 0.00 1.01 0.00 0.00 42.92 41.81 1a2v s ASP 355 CO 0.00 0.25 1.03 -2.65 0.21 0.00 0.00 175.17 174.02 1a2v n PRO 356 N 3.01 1.39 -4.40 8.23 -0.02 -1.26 -0.64 135.00 141.30 1a2v n PRO 356 Ca -0.17 0.50 -0.20 0.00 -2.02 0.00 0.00 63.50 61.60 1a2v n PRO 356 Cb 0.53 -2.08 -0.14 0.00 -0.02 0.00 0.00 33.50 31.79 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 -1.28 1.08 0.03 4.25 -4.36 0.02 -4.75 121.20 116.19 1a2v s ILE 357 Ca 0.63 -0.90 0.08 0.00 -0.26 0.00 0.00 60.65 60.20 1a2v s ILE 357 Cb -0.55 -0.96 -0.02 0.00 1.25 0.00 0.00 42.46 42.18 1a2v s ILE 357 CO 0.56 0.06 -0.22 -0.89 0.24 0.00 0.00 174.94 174.70 1a2v s THR 358 N -0.73 1.76 -0.21 8.37 2.01 -1.26 -0.60 115.64 124.98 1a2v s THR 358 Ca 0.02 -1.19 -0.00 0.00 0.31 0.00 0.00 61.69 60.83 1a2v s THR 358 Cb -0.07 -1.51 0.05 0.00 0.01 0.00 0.00 72.50 70.98 1a2v s THR 358 CO 0.01 0.28 -0.04 0.54 -0.69 0.00 0.00 174.62 174.72 1a2v s VAL 359 N -0.75 1.26 0.36 3.82 0.11 0.14 -4.97 120.40 120.37 1a2v s VAL 359 Ca 0.08 -0.95 -0.26 0.00 -2.93 0.00 0.00 61.98 57.92 1a2v s VAL 359 Cb -0.09 -1.54 -0.09 0.00 -1.53 0.00 0.00 36.38 33.13 1a2v s VAL 359 CO 0.01 -0.05 1.14 -0.54 -3.33 0.00 0.00 175.10 172.34 1a2v s LYS 360 N 1.53 4.26 -1.20 1.54 -0.14 -1.26 -0.75 119.74 123.72 1a2v s LYS 360 Ca -0.03 1.81 -0.15 0.00 -1.36 0.00 0.00 55.97 56.24 1a2v s LYS 360 Cb -0.18 -2.83 -0.01 0.00 -1.68 0.00 0.00 37.83 33.14 1a2v s LYS 360 CO -0.07 -0.13 0.72 0.09 -0.76 0.00 0.00 175.35 175.19 1a2v n ASN 361 N 0.42 -4.04 0.08 2.83 5.03 -1.12 -3.96 115.26 114.50 1a2v n ASN 361 Ca 0.03 -1.00 -0.11 0.00 0.87 0.00 0.00 54.58 54.37 1a2v n ASN 361 Cb 0.46 -3.38 -0.11 0.00 -1.02 0.00 0.00 39.78 35.73 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 0.82 0.27 -4.25 5.41 0.00 -0.62 1.26 119.26 122.15 1a2v h ALA 362 Ca -0.65 -0.87 -0.69 0.00 0.00 0.00 0.00 54.91 52.69 1a2v h ALA 362 Cb 1.36 -0.08 -0.31 0.00 0.00 0.00 0.00 17.79 18.77 1a2v h ALA 362 CO 0.51 1.09 -0.89 0.08 0.00 0.00 0.00 179.25 180.05 1a2v s VAL 363 N -2.76 2.07 -0.12 0.00 1.01 -1.06 -4.49 120.40 115.05 1a2v s VAL 363 Ca -0.02 -1.08 0.02 0.00 0.00 0.00 0.00 61.98 60.91 1a2v s VAL 363 Cb 0.09 -1.73 0.01 0.00 0.00 0.00 0.00 36.38 34.75 1a2v s VAL 363 CO 0.85 0.57 -0.18 0.00 0.00 0.00 0.00 175.10 176.34 1a2v s ILE 365 N 0.88 3.32 -0.09 0.00 1.01 0.15 -1.30 121.20 125.18 1a2v s ILE 365 Ca -0.08 -0.58 -0.32 0.00 0.00 0.00 0.00 60.65 59.67 1a2v s ILE 365 Cb -0.15 -2.39 0.12 0.00 0.01 0.00 0.00 42.46 40.05 1a2v s ILE 365 CO -0.01 0.54 1.08 -1.38 0.00 0.00 0.00 174.94 175.17 1a2v s HIS 366 N -0.02 -0.20 0.03 3.97 -3.43 -0.78 -0.77 115.29 114.09 1a2v s HIS 366 Ca -0.02 0.10 0.04 0.00 -0.80 0.00 0.00 55.06 54.39 1a2v s HIS 366 Cb -0.14 0.53 -0.03 0.00 -1.43 0.00 0.00 32.58 31.51 1a2v s HIS 366 CO 0.04 -0.37 -0.09 -1.83 -2.00 0.00 0.00 174.74 170.49 1a2v s GLU 367 N -2.73 2.42 0.21 -0.38 -1.05 -1.26 -0.43 118.70 115.49 1a2v s GLU 367 Ca 0.08 -0.81 0.01 0.00 -0.15 0.00 0.00 54.97 54.11 1a2v s GLU 367 Cb -0.01 -2.43 -0.05 0.00 -0.44 0.00 0.00 34.13 31.21 1a2v s GLU 367 CO -0.06 0.58 0.06 -1.21 0.95 0.00 0.00 175.26 175.58 1a2v s GLU 368 N -1.56 1.24 0.38 -4.83 2.02 -0.08 -4.95 118.70 110.92 1a2v s GLU 368 Ca 0.18 -1.64 -0.25 0.00 0.02 0.00 0.00 54.97 53.27 1a2v s GLU 368 Cb -0.11 -0.19 -0.09 0.00 0.10 0.00 0.00 34.13 33.85 1a2v s GLU 368 CO 0.08 -0.24 1.10 -0.51 0.02 0.00 0.00 175.26 175.72 1a2v s ASP 369 N -3.23 6.73 -0.21 -0.19 1.01 -1.26 -0.51 116.67 119.01 1a2v s ASP 369 Ca 0.32 2.20 0.19 0.00 0.71 0.00 0.00 52.55 55.97 1a2v s ASP 369 Cb 0.07 -2.60 0.48 0.00 1.01 0.00 0.00 42.92 41.87 1a2v s ASP 369 CO 0.09 -0.52 1.15 -0.67 0.21 0.00 0.00 175.17 175.43 1a2v n ASP 370 N 0.17 2.13 0.00 0.27 2.03 0.11 -4.74 116.55 116.52 1a2v n ASP 370 Ca 0.04 -2.51 0.00 0.00 0.52 0.00 0.00 54.79 52.83 1a2v n ASP 370 Cb 0.48 -0.42 0.00 0.00 -0.72 0.00 0.00 41.12 40.46 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 -0.44 1.00 3.80 0.27 0.00 -1.25 -4.56 105.19 104.00 1a2v n GLY 371 Ca 0.15 -0.74 -0.36 0.00 0.00 0.00 0.00 46.02 45.06 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 4.31 -0.19 0.99 1.43 -1.26 0.13 118.68 124.08 1a2v s LEU 372 Ca 0.00 1.67 0.05 0.00 -1.03 0.00 0.00 54.13 54.82 1a2v s LEU 372 Cb 0.00 -3.91 -0.21 0.00 0.03 0.00 0.00 46.19 42.10 1a2v s LEU 372 CO 0.00 -0.05 0.06 -0.11 0.23 0.00 0.00 176.35 176.47 1a2v n LEU 373 N 0.52 2.05 -3.62 1.79 7.94 0.70 -4.43 117.00 121.94 1a2v n LEU 373 Ca 0.01 0.02 -0.03 0.00 -1.11 0.00 0.00 56.01 54.90 1a2v n LEU 373 Cb 0.51 -0.54 -0.03 0.00 0.53 0.00 0.00 43.42 43.89 1a2v n LEU 373 CO 0.43 0.77 1.10 0.72 -1.11 0.00 0.00 177.39 179.31 1a2v s PHE 374 N -2.53 -0.07 -0.05 1.96 -0.12 -1.10 -5.01 117.98 111.07 1a2v s PHE 374 Ca -0.24 0.07 -0.30 0.00 -0.05 0.00 0.00 56.93 56.41 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 0.71 -0.10 0.74 0.21 -0.05 0.00 0.00 175.22 176.73 1a2v s LYS 375 N -1.87 0.99 -0.28 1.99 2.20 -1.26 -2.13 119.74 119.38 1a2v s LYS 375 Ca 0.10 0.14 -0.21 0.00 -0.36 0.00 0.00 55.97 55.64 1a2v s LYS 375 Cb -0.01 0.46 0.10 0.00 -1.51 0.00 0.00 37.83 36.87 1a2v s LYS 375 CO -0.04 -0.33 0.82 -1.58 -0.36 0.00 0.00 175.35 173.86 1a2v s HIS 376 N -1.52 -0.77 0.06 4.03 2.46 -1.02 -5.02 115.29 113.51 1a2v s HIS 376 Ca -0.07 1.69 0.05 0.00 0.47 0.00 0.00 55.06 57.20 1a2v s HIS 376 Cb -0.00 0.42 -0.03 0.00 -0.13 0.00 0.00 32.58 32.84 1a2v s HIS 376 CO 0.05 -0.38 -0.15 -1.12 -2.47 0.00 0.00 174.74 170.68 1a2v s SER 377 N 0.92 1.72 -0.02 9.88 0.01 -1.26 -1.77 113.70 123.18 1a2v s SER 377 Ca -0.04 -0.56 -0.23 0.00 1.31 0.00 0.00 55.95 56.43 1a2v s SER 377 Cb -0.05 -0.07 -0.05 0.00 0.21 0.00 0.00 66.02 66.06 1a2v s SER 377 CO -0.10 -0.03 0.67 -0.62 0.41 0.00 0.00 173.24 173.57 1a2v s ASP 378 N -1.53 7.03 0.45 2.44 -1.08 -0.02 -4.90 116.67 119.05 1a2v s ASP 378 Ca -0.00 1.23 0.25 0.00 -0.52 0.00 0.00 52.55 53.51 1a2v s ASP 378 Cb -0.09 -2.40 0.60 0.00 -1.46 0.00 0.00 42.92 39.57 1a2v s ASP 378 CO 0.02 0.00 1.70 2.19 0.52 0.00 0.00 175.17 179.60 1a2v h PHE 379 N 6.06 0.00 -0.82 -5.34 -5.15 -1.94 0.20 116.94 109.95 1a2v h PHE 379 Ca -0.43 0.00 0.11 0.00 -0.20 0.00 0.00 57.97 57.44 1a2v h PHE 379 Cb 1.20 0.00 -0.08 0.00 0.22 0.00 0.00 35.95 37.29 1a2v h PHE 379 CO 0.65 0.07 0.45 0.00 -2.00 0.00 0.00 178.31 177.48 1a2v h ARG 380 N 0.00 0.71 -1.05 6.09 3.08 -1.97 -1.32 114.38 119.92 1a2v h ARG 380 Ca -0.00 -0.04 -0.62 0.00 0.07 0.00 0.00 59.98 59.38 1a2v h ARG 380 Cb 0.91 -0.16 -0.36 0.00 0.08 0.00 0.00 29.97 30.43 1a2v h ARG 380 CO 0.01 0.47 0.00 -0.40 -1.07 0.00 0.00 179.97 178.98 1a2v n ASP 381 N -4.79 6.19 -4.09 7.04 5.68 -1.24 -4.90 116.55 120.44 1a2v n ASP 381 Ca 0.14 -3.77 -0.32 0.00 -0.50 0.00 0.00 54.79 50.34 1a2v n ASP 381 Cb 0.31 -0.66 -0.02 0.00 -1.14 0.00 0.00 41.12 39.61 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 -0.74 -2.26 0.00 -1.12 4.05 -0.50 -1.24 115.26 113.45 1a2v n ASN 382 Ca 0.51 -0.99 0.00 0.00 0.45 0.00 0.00 54.58 54.55 1a2v n ASN 382 Cb 0.75 -2.96 0.00 0.00 1.23 0.00 0.00 39.78 38.80 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 -4.43 0.00 -0.16 1.20 3.72 0.71 -4.88 117.46 113.62 1a2v n PHE 383 Ca -0.08 0.00 -0.04 0.00 -0.05 0.00 0.00 57.45 57.28 1a2v n PHE 383 Cb 0.57 -0.64 0.06 0.00 -0.94 0.00 0.00 39.48 38.53 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 0.64 -1.95 4.37 0.00 -1.36 -3.34 119.26 117.62 1a2v h ALA 384 Ca 0.00 0.04 -0.57 0.00 0.00 0.00 0.00 54.91 54.38 1a2v h ALA 384 Cb 0.25 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 1a2v h ALA 384 CO 0.00 -0.13 1.07 0.99 0.00 0.00 0.00 179.25 181.18 1a2v s THR 385 N -6.13 3.87 -0.09 0.00 2.01 -1.26 -4.59 115.64 109.45 1a2v s THR 385 Ca -0.13 0.96 -0.31 0.00 0.31 0.00 0.00 61.69 62.52 1a2v s THR 385 Cb 0.14 -3.94 0.09 0.00 0.01 0.00 0.00 72.50 68.80 1a2v s THR 385 CO 0.73 -0.45 0.80 -0.55 -0.69 0.00 0.00 174.62 174.47 1a2v s SER 386 N 3.83 -0.55 -0.04 3.53 0.15 -0.66 -0.84 113.70 119.12 1a2v s SER 386 Ca 0.65 0.60 -0.01 0.00 0.70 0.00 0.00 55.95 57.89 1a2v s SER 386 Cb -0.20 0.45 0.03 0.00 -1.71 0.00 0.00 66.02 64.60 1a2v s SER 386 CO 0.28 -0.51 0.07 -0.22 1.20 0.00 0.00 173.24 174.06 1a2v s LEU 387 N -1.15 0.80 -0.05 3.45 0.20 -0.73 -0.03 118.68 121.16 1a2v s LEU 387 Ca -0.08 0.12 0.03 0.00 0.69 0.00 0.00 54.13 54.89 1a2v s LEU 387 Cb -0.00 0.03 0.01 0.00 -0.43 0.00 0.00 46.19 45.80 1a2v s LEU 387 CO 0.07 -0.16 -0.13 -0.69 -0.29 0.00 0.00 176.35 175.16 1a2v s VAL 388 N 1.32 1.12 -0.08 1.68 1.01 -0.39 -2.42 120.40 122.64 1a2v s VAL 388 Ca -0.06 -0.50 0.00 0.00 0.00 0.00 0.00 61.98 61.42 1a2v s VAL 388 Cb -0.12 -1.01 0.02 0.00 0.00 0.00 0.00 36.38 35.27 1a2v s VAL 388 CO -0.04 0.35 -0.07 -0.89 0.00 0.00 0.00 175.10 174.45 1a2v s THR 389 N 0.45 0.87 0.51 3.92 2.01 -0.90 0.13 115.64 122.63 1a2v s THR 389 Ca -0.10 -0.24 -0.06 0.00 0.31 0.00 0.00 61.69 61.60 1a2v s THR 389 Cb -0.14 -0.88 -0.03 0.00 0.01 0.00 0.00 72.50 71.47 1a2v s THR 389 CO 0.03 0.32 0.82 -0.13 -0.69 0.00 0.00 174.62 174.97 1a2v s ARG 390 N 1.34 3.43 -0.00 4.92 0.52 -1.26 -0.22 118.95 127.67 1a2v s ARG 390 Ca -0.03 0.19 0.01 0.00 -0.52 0.00 0.00 55.73 55.39 1a2v s ARG 390 Cb -0.14 -2.34 -0.04 0.00 0.52 0.00 0.00 34.95 32.96 1a2v s ARG 390 CO -0.03 -0.32 0.02 0.00 0.02 0.00 0.00 175.30 174.98 1a2v s ALA 391 N -2.82 3.35 -0.02 2.13 0.00 0.34 -4.39 121.76 120.35 1a2v s ALA 391 Ca 0.49 -0.94 0.01 0.00 0.00 0.00 0.00 51.96 51.53 1a2v s ALA 391 Cb -0.10 -1.39 0.01 0.00 0.00 0.00 0.00 23.12 21.63 1a2v s ALA 391 CO 0.46 0.66 -0.05 -0.08 0.00 0.00 0.00 175.76 176.75 1a2v s THR 392 N -1.12 0.45 0.08 0.00 -1.32 -1.26 0.07 115.64 112.55 1a2v s THR 392 Ca 0.20 -0.16 0.07 0.00 -1.21 0.00 0.00 61.69 60.59 1a2v s THR 392 Cb -0.12 -0.43 -0.04 0.00 -1.51 0.00 0.00 72.50 70.40 1a2v s THR 392 CO 0.11 0.16 -0.13 -1.59 -2.21 0.00 0.00 174.62 170.96 1a2v s LYS 393 N 0.37 2.08 -0.21 7.08 -2.85 0.33 -4.27 119.74 122.27 1a2v s LYS 393 Ca -0.04 -1.02 -0.12 0.00 -1.00 0.00 0.00 55.97 53.79 1a2v s LYS 393 Cb -0.08 -2.26 -0.05 0.00 -2.06 0.00 0.00 37.83 33.39 1a2v s LYS 393 CO -0.00 0.52 0.24 -1.17 0.10 0.00 0.00 175.35 175.03 1a2v s LEU 394 N -1.93 4.17 -0.15 2.77 0.20 -0.78 -0.90 118.68 122.06 1a2v s LEU 394 Ca 0.19 0.31 0.02 0.00 0.69 0.00 0.00 54.13 55.33 1a2v s LEU 394 Cb -0.11 -2.25 0.01 0.00 -0.43 0.00 0.00 46.19 43.41 1a2v s LEU 394 CO 0.10 0.06 -0.21 -0.69 -0.29 0.00 0.00 176.35 175.33 1a2v s VAL 395 N 0.85 2.13 -0.30 1.68 1.01 0.43 -1.23 120.40 124.98 1a2v s VAL 395 Ca 0.12 -0.95 -0.03 0.00 0.00 0.00 0.00 61.98 61.12 1a2v s VAL 395 Cb -0.13 -1.86 0.04 0.00 0.00 0.00 0.00 36.38 34.42 1a2v s VAL 395 CO 0.04 0.54 0.01 -0.69 0.00 0.00 0.00 175.10 175.00 1a2v s VAL 396 N 0.93 3.19 0.30 2.92 1.01 -0.40 -1.86 120.40 126.48 1a2v s VAL 396 Ca -0.04 -1.21 0.07 0.00 0.00 0.00 0.00 61.98 60.80 1a2v s VAL 396 Cb -0.15 -2.77 -0.06 0.00 0.00 0.00 0.00 36.38 33.40 1a2v s VAL 396 CO -0.04 -0.04 -0.06 -0.55 0.00 0.00 0.00 175.10 174.40 1a2v s SER 397 N 1.31 3.02 0.06 3.32 0.15 -0.42 -0.93 113.70 120.22 1a2v s SER 397 Ca -0.03 -1.20 -0.22 0.00 0.70 0.00 0.00 55.95 55.20 1a2v s SER 397 Cb -0.19 -0.22 0.05 0.00 -1.71 0.00 0.00 66.02 63.96 1a2v s SER 397 CO -0.01 -0.31 0.53 0.00 1.20 0.00 0.00 173.24 174.65 1a2v s GLN 398 N -3.70 1.06 -0.05 5.44 -2.07 -0.86 -1.06 119.66 118.42 1a2v s GLN 398 Ca 0.31 -0.26 -0.02 0.00 -1.82 0.00 0.00 55.36 53.57 1a2v s GLN 398 Cb 0.04 0.48 0.03 0.00 -1.09 0.00 0.00 33.01 32.47 1a2v s GLN 398 CO 0.13 -0.39 0.04 0.42 -1.32 0.00 0.00 175.29 174.18 1a2v s ILE 399 N -2.59 0.03 0.19 3.63 1.01 -1.26 -1.00 121.20 121.21 1a2v s ILE 399 Ca -0.04 0.32 0.10 0.00 0.00 0.00 0.00 60.65 61.03 1a2v s ILE 399 Cb -0.01 -0.27 -0.04 0.00 0.01 0.00 0.00 42.46 42.15 1a2v s ILE 399 CO -0.03 0.19 -0.15 0.72 0.00 0.00 0.00 174.94 175.67 1a2v s PHE 400 N 2.11 2.49 -0.15 3.97 -0.12 -0.84 -0.09 117.98 125.36 1a2v s PHE 400 Ca 0.05 -0.28 -0.01 0.00 -0.05 0.00 0.00 56.93 56.64 1a2v s PHE 400 Cb -0.12 -1.22 -0.01 0.00 -0.63 0.00 0.00 43.02 41.03 1a2v s PHE 400 CO -0.04 0.52 -0.10 0.99 -0.05 0.00 0.00 175.22 176.53 1a2v s THR 401 N -1.72 3.20 -0.64 -4.49 2.01 -0.44 -1.34 115.64 112.21 1a2v s THR 401 Ca 0.23 -0.60 0.04 0.00 0.31 0.00 0.00 61.69 61.68 1a2v s THR 401 Cb -0.08 -2.37 0.16 0.00 0.01 0.00 0.00 72.50 70.21 1a2v s THR 401 CO 0.13 0.50 0.42 0.00 -0.69 0.00 0.00 174.62 174.98 1a2v s ALA 402 N 0.60 3.64 0.00 7.40 0.00 -1.26 -4.78 121.76 127.36 1a2v s ALA 402 Ca -0.06 -3.59 0.00 0.00 0.00 0.00 0.00 51.96 48.30 1a2v s ALA 402 Cb -0.15 -2.23 0.00 0.00 0.00 0.00 0.00 23.12 20.73 1a2v s ALA 402 CO 0.03 -2.07 0.00 0.00 0.00 0.00 0.00 175.76 173.72 1a2v n ALA 403 N 2.51 0.00 1.54 0.00 0.00 -1.26 -4.83 120.51 118.47 1a2v n ALA 403 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.57 1a2v n ALA 403 Cb 0.34 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.79 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 8.41 0.48 -3.63 0.00 6.94 -1.26 -4.97 115.26 121.22 1a2v n ASN 404 Ca 0.00 -2.00 -0.14 0.00 -0.02 0.00 0.00 54.58 52.41 1a2v n ASN 404 Cb 0.00 -0.23 -0.07 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 -1.55 0.81 -0.25 -3.83 0.41 -0.19 0.75 118.70 114.86 1a2v s GLU 406 Ca 0.00 0.78 0.01 0.00 -0.41 0.00 0.00 54.97 55.35 1a2v s GLU 406 Cb 0.00 0.39 0.04 0.00 -1.78 0.00 0.00 34.13 32.79 1a2v s GLU 406 CO 0.00 -0.13 -0.10 0.71 -0.49 0.00 0.00 175.26 175.25 1a2v s TYR 407 N 0.06 3.13 -0.31 1.61 1.51 -0.45 -1.65 117.35 121.24 1a2v s TYR 407 Ca -0.02 -1.94 -0.15 0.00 -1.01 0.00 0.00 57.07 53.95 1a2v s TYR 407 Cb -0.04 -1.99 -0.02 0.00 -0.11 0.00 0.00 41.96 39.80 1a2v s TYR 407 CO 0.02 -0.82 0.36 0.00 -1.11 0.00 0.00 175.55 174.00 1a2v s LEU 409 N 2.03 3.21 -0.21 0.00 1.43 -0.17 -1.32 118.68 123.65 1a2v s LEU 409 Ca 0.13 -0.11 -0.02 0.00 -1.03 0.00 0.00 54.13 53.09 1a2v s LEU 409 Cb -0.16 -1.76 0.06 0.00 0.03 0.00 0.00 46.19 44.37 1a2v s LEU 409 CO 0.11 0.21 0.02 -0.31 0.23 0.00 0.00 176.35 176.61 1a2v s TYR 410 N 0.11 1.42 -0.28 0.29 1.51 0.04 -2.02 117.35 118.42 1a2v s TYR 410 Ca -0.01 -1.14 -0.23 0.00 -1.01 0.00 0.00 57.07 54.67 1a2v s TYR 410 Cb -0.14 -1.21 -0.00 0.00 -0.11 0.00 0.00 41.96 40.50 1a2v s TYR 410 CO 0.03 -0.67 0.78 -1.58 -1.11 0.00 0.00 175.55 173.00 1a2v s TRP 411 N 1.72 3.24 -0.16 2.71 0.52 -0.10 -1.22 118.94 125.65 1a2v s TRP 411 Ca -0.02 0.89 -0.01 0.00 0.02 0.00 0.00 56.10 56.99 1a2v s TRP 411 Cb -0.18 -3.12 -0.01 0.00 -1.15 0.00 0.00 33.47 29.01 1a2v s TRP 411 CO -0.09 -0.49 -0.12 0.08 0.02 0.00 0.00 176.95 176.35 1a2v s VAL 412 N 2.87 2.99 -0.05 4.03 1.01 0.34 -1.28 120.40 130.32 1a2v s VAL 412 Ca 0.32 -0.66 -0.01 0.00 0.00 0.00 0.00 61.98 61.64 1a2v s VAL 412 Cb -0.15 -2.28 -0.03 0.00 0.00 0.00 0.00 36.38 33.92 1a2v s VAL 412 CO 0.11 0.50 0.01 -0.36 0.00 0.00 0.00 175.10 175.36 1a2v s PHE 413 N 0.76 3.14 0.24 5.22 0.40 -0.36 -0.20 117.98 127.18 1a2v s PHE 413 Ca -0.05 0.15 0.08 0.00 -0.60 0.00 0.00 56.93 56.52 1a2v s PHE 413 Cb -0.15 -1.74 -0.05 0.00 0.51 0.00 0.00 43.02 41.59 1a2v s PHE 413 CO 0.01 0.47 -0.13 -1.64 0.70 0.00 0.00 175.22 174.64 1a2v s MET 414 N -1.21 1.47 0.00 0.44 -1.94 -0.32 -1.86 119.30 115.89 1a2v s MET 414 Ca 0.16 -1.69 0.12 0.00 -1.71 0.00 0.00 55.69 52.58 1a2v s MET 414 Cb -0.11 -1.28 0.74 0.00 2.01 0.00 0.00 34.83 36.19 1a2v s MET 414 CO 0.06 0.17 1.37 1.04 -0.01 0.00 0.00 175.02 177.65 1a2v n GLN 415 N -0.49 0.86 -0.09 2.03 6.02 -1.26 -2.35 117.38 122.10 1a2v n GLN 415 Ca -0.07 0.00 0.07 0.00 -0.01 0.00 0.00 57.00 57.00 1a2v n GLN 415 Cb 0.61 -1.23 0.11 0.00 1.02 0.00 0.00 30.24 30.76 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 -0.73 2.61 0.00 1.08 5.75 -1.26 -4.06 116.55 119.95 1a2v n ASP 416 Ca 0.09 -1.76 0.00 0.00 -0.01 0.00 0.00 54.79 53.11 1a2v n ASP 416 Cb 0.04 -0.12 0.00 0.00 -1.03 0.00 0.00 41.12 40.02 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 0.85 0.65 3.82 6.12 0.00 -0.99 -4.77 105.19 110.86 1a2v n GLY 417 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.41 3.08 -0.04 4.61 0.00 -1.26 -4.47 121.76 121.27 1a2v s ALA 418 Ca 0.00 0.40 0.05 0.00 0.00 0.00 0.00 51.96 52.41 1a2v s ALA 418 Cb 0.00 -3.13 -0.01 0.00 0.00 0.00 0.00 23.12 19.98 1a2v s ALA 418 CO 0.00 0.15 -0.20 0.42 0.00 0.00 0.00 175.76 176.13 1a2v s ILE 419 N -2.10 1.63 0.04 0.00 1.01 -0.93 -1.17 121.20 119.68 1a2v s ILE 419 Ca 0.60 -0.83 0.03 0.00 0.00 0.00 0.00 60.65 60.44 1a2v s ILE 419 Cb -0.10 -1.39 -0.02 0.00 0.01 0.00 0.00 42.46 40.96 1a2v s ILE 419 CO 0.15 0.46 -0.08 -0.60 0.00 0.00 0.00 174.94 174.86 1a2v s ARG 420 N -0.07 0.56 -0.29 2.79 3.52 0.72 -0.82 118.95 125.36 1a2v s ARG 420 Ca -0.03 -0.73 -0.00 0.00 -0.13 0.00 0.00 55.73 54.84 1a2v s ARG 420 Cb -0.12 -0.38 0.05 0.00 -1.56 0.00 0.00 34.95 32.95 1a2v s ARG 420 CO 0.02 0.07 -0.03 -1.17 -0.81 0.00 0.00 175.30 173.39 1a2v s LEU 421 N -1.47 3.80 -0.14 -0.88 0.20 -0.42 -0.50 118.68 119.28 1a2v s LEU 421 Ca -0.08 -1.33 -0.06 0.00 0.69 0.00 0.00 54.13 53.36 1a2v s LEU 421 Cb -0.09 -1.67 -0.04 0.00 -0.43 0.00 0.00 46.19 43.96 1a2v s LEU 421 CO 0.01 -0.25 0.06 -1.81 -0.29 0.00 0.00 176.35 174.07 1a2v s ASP 422 N 1.22 5.71 0.05 3.68 1.01 -0.35 -2.56 116.67 125.41 1a2v s ASP 422 Ca -0.06 0.20 0.06 0.00 0.71 0.00 0.00 52.55 53.46 1a2v s ASP 422 Cb -0.20 -1.85 -0.02 0.00 1.01 0.00 0.00 42.92 41.86 1a2v s ASP 422 CO -0.02 0.29 -0.17 -0.63 0.21 0.00 0.00 175.17 174.85 1a2v s ILE 423 N -0.34 1.39 -0.08 0.77 1.01 0.66 -0.78 121.20 123.83 1a2v s ILE 423 Ca 0.09 -1.14 0.00 0.00 0.00 0.00 0.00 60.65 59.60 1a2v s ILE 423 Cb -0.12 -1.24 0.02 0.00 0.01 0.00 0.00 42.46 41.14 1a2v s ILE 423 CO 0.02 0.07 -0.06 -0.13 0.00 0.00 0.00 174.94 174.83 1a2v s ARG 424 N -1.25 1.19 -0.20 2.79 0.52 -0.43 -0.90 118.95 120.65 1a2v s ARG 424 Ca 0.04 -0.17 -0.10 0.00 -0.52 0.00 0.00 55.73 54.98 1a2v s ARG 424 Cb -0.09 -1.21 -0.05 0.00 0.52 0.00 0.00 34.95 34.12 1a2v s ARG 424 CO 0.02 -0.16 0.13 -0.51 0.02 0.00 0.00 175.30 174.80 1a2v s LEU 425 N 1.31 4.19 0.00 2.53 1.43 0.23 -1.34 118.68 127.03 1a2v s LEU 425 Ca -0.04 0.22 0.00 0.00 -1.03 0.00 0.00 54.13 53.28 1a2v s LEU 425 Cb -0.14 -2.09 0.00 0.00 0.03 0.00 0.00 46.19 44.00 1a2v s LEU 425 CO -0.03 0.18 0.00 1.07 0.23 0.00 0.00 176.35 177.80 1a2v n THR 426 N 3.55 0.00 0.00 5.49 5.66 -0.66 -0.88 114.28 127.44 1a2v n THR 426 Ca -0.16 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.84 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 0.49 3.17 1.09 0.00 -1.25 -1.03 105.19 107.66 1a2v n GLY 427 Ca 0.00 -1.77 -0.24 0.00 0.00 0.00 0.00 46.02 44.01 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 1.37 0.30 -0.61 1.01 0.23 -1.07 121.20 122.43 1a2v s ILE 428 Ca 0.00 -0.77 -0.30 0.00 0.00 0.00 0.00 60.65 59.58 1a2v s ILE 428 Cb 0.00 -1.14 -0.11 0.00 0.01 0.00 0.00 42.46 41.22 1a2v s ILE 428 CO 0.00 0.36 1.54 -0.76 0.00 0.00 0.00 174.94 176.09 1a2v s LEU 429 N -0.47 4.35 0.11 2.97 1.43 -1.26 -4.68 118.68 121.12 1a2v s LEU 429 Ca 0.06 2.93 -0.31 0.00 -1.03 0.00 0.00 54.13 55.79 1a2v s LEU 429 Cb -0.07 -3.64 -0.07 0.00 0.03 0.00 0.00 46.19 42.44 1a2v s LEU 429 CO -0.00 -0.87 1.25 0.21 0.23 0.00 0.00 176.35 177.17 1a2v s ASN 430 N 0.32 7.00 0.14 2.29 3.84 -1.26 -5.00 114.94 122.28 1a2v s ASN 430 Ca 0.60 2.17 0.08 0.00 0.21 0.00 0.00 52.86 55.92 1a2v s ASN 430 Cb -0.47 -2.59 -0.04 0.00 -0.55 0.00 0.00 41.25 37.61 1a2v s ASN 430 CO 0.51 -0.50 -0.18 0.42 -2.79 0.00 0.00 177.10 174.56 1a2v s THR 431 N 0.73 1.70 0.19 -5.21 -4.23 -1.26 -4.25 115.64 103.31 1a2v s THR 431 Ca 0.59 -1.78 0.04 0.00 -1.18 0.00 0.00 61.69 59.36 1a2v s THR 431 Cb -0.33 -1.71 -0.05 0.00 1.34 0.00 0.00 72.50 71.76 1a2v s THR 431 CO 0.32 -0.26 -0.06 -0.47 -0.54 0.00 0.00 174.62 173.60 1a2v s TYR 432 N -1.81 1.42 0.43 3.99 5.04 -0.19 -4.85 117.35 121.38 1a2v s TYR 432 Ca 0.12 -0.81 -0.23 0.00 -2.44 0.00 0.00 57.07 53.70 1a2v s TYR 432 Cb -0.07 -0.76 -0.08 0.00 0.35 0.00 0.00 41.96 41.39 1a2v s TYR 432 CO 0.05 0.05 1.09 -1.50 -1.34 0.00 0.00 175.55 173.90 1a2v s ILE 433 N -3.34 3.52 -0.08 3.14 2.07 -1.26 -0.74 121.20 124.52 1a2v s ILE 433 Ca 0.22 1.14 0.02 0.00 -1.41 0.00 0.00 60.65 60.62 1a2v s ILE 433 Cb 0.04 -3.57 0.01 0.00 0.13 0.00 0.00 42.46 39.07 1a2v s ILE 433 CO 0.04 -0.02 -0.13 -0.22 -1.91 0.00 0.00 174.94 172.70 1a2v s LEU 434 N -2.84 1.66 0.93 8.50 2.96 -0.64 -4.68 118.68 124.56 1a2v s LEU 434 Ca 0.61 -0.34 -0.11 0.00 -0.22 0.00 0.00 54.13 54.07 1a2v s LEU 434 Cb -0.24 -0.92 0.15 0.00 0.50 0.00 0.00 46.19 45.69 1a2v s LEU 434 CO 0.29 0.03 1.12 -0.83 -1.32 0.00 0.00 176.35 175.64 1a2v s GLY 435 N 0.77 1.67 0.25 7.98 0.00 -1.26 -4.30 107.32 112.42 1a2v s GLY 435 Ca -0.12 0.43 -0.05 0.00 0.00 0.00 0.00 44.72 44.98 1a2v s GLY 435 CO 0.02 0.88 1.87 -0.55 0.00 0.00 0.00 173.10 175.33 1a2v h ASP 436 N -1.88 0.94 -0.28 1.64 3.32 -1.98 -2.19 116.42 115.99 1a2v h ASP 436 Ca -0.46 0.01 -0.13 0.00 0.02 0.00 0.00 57.03 56.47 1a2v h ASP 436 Cb 1.27 -0.20 -0.08 0.00 0.22 0.00 0.00 39.33 40.55 1a2v h ASP 436 CO 0.44 0.62 -0.14 0.47 -1.72 0.00 0.00 179.24 178.91 1a2v n ASP 437 N -4.55 2.45 -4.80 6.45 8.00 -1.26 -4.99 116.55 117.85 1a2v n ASP 437 Ca 0.13 -3.71 -0.37 0.00 0.71 0.00 0.00 54.79 51.55 1a2v n ASP 437 Cb 0.14 -0.61 -0.07 0.00 -0.02 0.00 0.00 41.12 40.57 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 -3.20 3.93 -0.05 -1.24 2.12 -0.83 -5.07 118.70 114.36 1a2v s GLU 438 Ca 0.43 0.04 -0.22 0.00 0.36 0.00 0.00 54.97 55.58 1a2v s GLU 438 Cb 0.39 -3.31 -0.04 0.00 0.26 0.00 0.00 34.13 31.43 1a2v s GLU 438 CO -0.01 0.50 0.63 -2.00 -0.54 0.00 0.00 175.26 173.85 1a2v s GLU 439 N -0.32 4.38 0.00 4.30 2.56 -1.26 -4.62 118.70 123.75 1a2v s GLU 439 Ca 0.16 0.76 0.05 0.00 0.00 0.00 0.00 54.97 55.95 1a2v s GLU 439 Cb -0.13 -3.41 0.32 0.00 2.00 0.00 0.00 34.13 32.91 1a2v s GLU 439 CO 0.05 0.20 0.83 0.00 -0.56 0.00 0.00 175.26 175.77 1a2v n ALA 440 N 3.35 1.66 -0.42 6.30 0.00 -1.26 -4.89 120.51 125.26 1a2v n ALA 440 Ca -0.04 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1a2v n ALA 440 Cb 0.51 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 18.87 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 -0.68 0.71 0.00 0.00 0.00 -1.26 -1.87 105.19 102.09 1a2v n GLY 441 Ca 0.04 -0.84 0.13 0.00 0.00 0.00 0.00 46.02 45.34 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 0.01 0.06 1.61 -0.04 -1.26 -4.00 135.00 131.37 1a2v n PRO 442 Ca 0.00 -0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.58 1a2v n PRO 442 Cb 0.00 -1.50 0.18 0.00 -0.04 0.00 0.00 33.50 32.14 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 -1.49 0.57 -3.97 0.54 7.02 -1.23 -4.94 117.44 113.94 1a2v n TRP 443 Ca 0.06 0.16 -0.12 0.00 -1.02 0.00 0.00 57.50 56.59 1a2v n TRP 443 Cb 0.34 -0.66 -0.02 0.00 -2.42 0.00 0.00 31.31 28.55 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 -3.65 0.99 -0.00 6.99 0.00 -0.78 0.06 107.32 110.92 1a2v s GLY 444 Ca 0.06 -1.17 0.06 0.00 0.00 0.00 0.00 44.72 43.68 1a2v s GLY 444 CO 0.72 -0.70 -0.20 -1.59 0.00 0.00 0.00 173.10 171.33 1a2v s THR 445 N -2.83 1.58 -0.82 0.90 2.01 0.33 -4.45 115.64 112.35 1a2v s THR 445 Ca 0.24 -0.92 -0.22 0.00 0.31 0.00 0.00 61.69 61.10 1a2v s THR 445 Cb -0.02 -1.33 0.09 0.00 0.01 0.00 0.00 72.50 71.25 1a2v s THR 445 CO 0.16 0.39 1.13 -0.60 -0.69 0.00 0.00 174.62 175.01 1a2v s ARG 446 N -0.62 3.38 0.00 4.92 3.52 -1.26 -0.61 118.95 128.28 1a2v s ARG 446 Ca 0.08 -1.18 0.28 0.00 -0.13 0.00 0.00 55.73 54.78 1a2v s ARG 446 Cb -0.08 -4.66 1.17 0.00 -1.56 0.00 0.00 34.95 29.82 1a2v s ARG 446 CO -0.00 -1.89 1.82 1.33 -0.81 0.00 0.00 175.30 175.75 1a2v n VAL 447 N 5.95 0.00 -3.60 7.11 0.24 -1.17 -4.84 118.33 122.02 1a2v n VAL 447 Ca 0.13 -0.11 -0.07 0.00 -2.04 0.00 0.00 64.34 62.25 1a2v n VAL 447 Cb 0.48 0.08 -0.05 0.00 -1.47 0.00 0.00 33.84 32.89 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 -2.32 -0.23 0.06 6.34 5.04 -1.26 -4.75 117.35 120.23 1a2v s TYR 448 Ca 0.32 0.38 -0.37 0.00 -2.44 0.00 0.00 57.07 54.96 1a2v s TYR 448 Cb 0.20 0.47 -0.17 0.00 0.35 0.00 0.00 41.96 42.82 1a2v s TYR 448 CO 0.44 -0.22 1.37 -2.30 -1.34 0.00 0.00 175.55 173.50 1a2v n PRO 449 N 0.60 1.15 -1.22 4.97 -0.02 -1.26 -0.53 135.00 138.70 1a2v n PRO 449 Ca -0.06 0.42 -0.08 0.00 -2.02 0.00 0.00 63.50 61.76 1a2v n PRO 449 Cb 0.58 -2.06 -0.03 0.00 -0.02 0.00 0.00 33.50 31.97 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 2.71 -4.98 -4.24 2.55 3.02 -1.26 -4.98 115.26 108.08 1a2v n ASN 450 Ca 0.19 0.19 -0.33 0.00 -0.03 0.00 0.00 54.58 54.60 1a2v n ASN 450 Cb 0.19 -3.15 -0.16 0.00 -0.61 0.00 0.00 39.78 36.05 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 -1.92 2.38 -0.24 2.41 1.01 0.31 -1.62 120.40 122.73 1a2v s VAL 451 Ca 0.00 -0.88 -0.00 0.00 0.00 0.00 0.00 61.98 61.09 1a2v s VAL 451 Cb 0.00 -1.96 0.03 0.00 0.00 0.00 0.00 36.38 34.45 1a2v s VAL 451 CO 0.00 0.54 -0.09 0.21 0.00 0.00 0.00 175.10 175.76 1a2v s ASN 452 N 0.59 4.15 -0.45 3.32 3.04 0.08 -3.05 114.94 122.63 1a2v s ASN 452 Ca -0.11 -0.96 -0.15 0.00 0.04 0.00 0.00 52.86 51.67 1a2v s ASN 452 Cb -0.16 -1.61 0.05 0.00 -1.54 0.00 0.00 41.25 37.99 1a2v s ASN 452 CO 0.03 -0.12 0.36 0.00 -3.04 0.00 0.00 177.10 174.33 1a2v s ALA 453 N 1.27 3.53 0.52 1.71 0.00 0.22 -1.02 121.76 127.98 1a2v s ALA 453 Ca -0.01 -1.97 -0.21 0.00 0.00 0.00 0.00 51.96 49.77 1a2v s ALA 453 Cb -0.17 -3.00 -0.06 0.00 0.00 0.00 0.00 23.12 19.89 1a2v s ALA 453 CO -0.06 -1.63 1.15 -1.01 0.00 0.00 0.00 175.76 174.21 1a2v s HIS 454 N 1.66 2.72 0.68 0.00 0.09 -1.26 -0.51 115.29 118.66 1a2v s HIS 454 Ca 0.04 1.54 -0.16 0.00 -0.00 0.00 0.00 55.06 56.48 1a2v s HIS 454 Cb -0.22 -3.34 0.01 0.00 -0.00 0.00 0.00 32.58 29.03 1a2v s HIS 454 CO 0.08 -1.62 1.19 -0.80 -0.00 0.00 0.00 174.74 173.60 1a2v s ASN 455 N -1.60 4.59 0.05 1.40 0.01 0.11 -4.75 114.94 114.75 1a2v s ASN 455 Ca 0.70 2.31 -0.28 0.00 -0.71 0.00 0.00 52.86 54.88 1a2v s ASN 455 Cb -0.26 -2.59 0.09 0.00 0.41 0.00 0.00 41.25 38.90 1a2v s ASN 455 CO 0.30 -1.99 0.97 -1.38 -1.51 0.00 0.00 177.10 173.49 1a2v s HIS 456 N -1.93 -0.22 0.16 2.20 -3.43 -0.79 -0.55 115.29 110.73 1a2v s HIS 456 Ca 0.74 0.03 0.11 0.00 -0.80 0.00 0.00 55.06 55.14 1a2v s HIS 456 Cb -0.28 0.58 -0.04 0.00 -1.43 0.00 0.00 32.58 31.40 1a2v s HIS 456 CO 0.41 -0.61 -0.22 -0.65 -2.00 0.00 0.00 174.74 171.67 1a2v s GLN 457 N -3.09 1.62 -0.28 -0.38 -0.21 -0.08 0.71 119.66 117.96 1a2v s GLN 457 Ca 0.09 -1.38 0.00 0.00 0.02 0.00 0.00 55.36 54.09 1a2v s GLN 457 Cb -0.01 -1.95 0.05 0.00 1.00 0.00 0.00 33.01 32.10 1a2v s GLN 457 CO -0.04 0.43 -0.06 -1.01 -2.12 0.00 0.00 175.29 172.50 1a2v s HIS 458 N -1.44 3.24 -0.03 0.91 3.76 -0.23 -2.95 115.29 118.56 1a2v s HIS 458 Ca 0.19 -2.04 0.07 0.00 -0.15 0.00 0.00 55.06 53.13 1a2v s HIS 458 Cb -0.09 -2.02 -0.02 0.00 1.11 0.00 0.00 32.58 31.56 1a2v s HIS 458 CO 0.10 -0.83 -0.25 -0.51 -0.85 0.00 0.00 174.74 172.40 1a2v s LEU 459 N 1.19 2.12 0.13 0.89 1.43 -0.17 -1.51 118.68 122.77 1a2v s LEU 459 Ca -0.06 -0.45 0.09 0.00 -1.03 0.00 0.00 54.13 52.68 1a2v s LEU 459 Cb -0.20 -1.37 -0.04 0.00 0.03 0.00 0.00 46.19 44.62 1a2v s LEU 459 CO -0.03 0.31 -0.23 -0.36 0.23 0.00 0.00 176.35 176.28 1a2v s PHE 460 N -0.56 2.00 -0.46 0.29 0.40 0.33 -1.55 117.98 118.43 1a2v s PHE 460 Ca 0.08 -0.41 0.03 0.00 -0.60 0.00 0.00 56.93 56.03 1a2v s PHE 460 Cb -0.11 -1.06 0.12 0.00 0.51 0.00 0.00 43.02 42.48 1a2v s PHE 460 CO -0.00 0.30 0.20 0.45 0.70 0.00 0.00 175.22 176.86 1a2v s SER 461 N -2.17 4.64 -0.08 1.36 0.15 -0.38 -2.08 113.70 115.15 1a2v s SER 461 Ca 0.12 -2.61 -0.30 0.00 0.70 0.00 0.00 55.95 53.86 1a2v s SER 461 Cb -0.09 -1.67 -0.04 0.00 -1.71 0.00 0.00 66.02 62.51 1a2v s SER 461 CO 0.06 -0.32 1.44 -0.22 1.20 0.00 0.00 173.24 175.39 1a2v s LEU 462 N 0.27 4.27 -0.26 3.45 0.20 0.23 -1.22 118.68 125.62 1a2v s LEU 462 Ca 0.14 2.00 -0.08 0.00 0.69 0.00 0.00 54.13 56.89 1a2v s LEU 462 Cb -0.23 -3.54 -0.03 0.00 -0.43 0.00 0.00 46.19 41.96 1a2v s LEU 462 CO -0.04 -0.80 0.09 -0.60 -0.29 0.00 0.00 176.35 174.71 1a2v s ARG 463 N 3.33 3.64 -0.16 1.98 3.52 0.05 -0.48 118.95 130.83 1a2v s ARG 463 Ca 0.64 -0.50 0.01 0.00 -0.13 0.00 0.00 55.73 55.75 1a2v s ARG 463 Cb -0.29 -3.38 0.00 0.00 -1.56 0.00 0.00 34.95 29.73 1a2v s ARG 463 CO 0.23 -0.22 -0.17 0.42 -0.81 0.00 0.00 175.30 174.76 1a2v s ILE 464 N 1.63 2.49 -0.48 4.11 1.01 -0.26 -2.03 121.20 127.66 1a2v s ILE 464 Ca 0.06 -0.82 -0.05 0.00 0.00 0.00 0.00 60.65 59.84 1a2v s ILE 464 Cb -0.15 -2.04 0.13 0.00 0.01 0.00 0.00 42.46 40.40 1a2v s ILE 464 CO 0.05 0.52 0.30 -0.62 0.00 0.00 0.00 174.94 175.19 1a2v s ASP 465 N 0.92 5.40 0.64 3.58 -1.08 -0.03 -1.20 116.67 124.92 1a2v s ASP 465 Ca -0.04 -2.19 -0.09 0.00 -0.52 0.00 0.00 52.55 49.71 1a2v s ASP 465 Cb -0.15 -1.89 0.00 0.00 -1.46 0.00 0.00 42.92 39.42 1a2v s ASP 465 CO -0.02 -0.55 1.01 -2.16 0.52 0.00 0.00 175.17 173.96 1a2v s PRO 466 N 0.92 3.01 -0.39 4.34 0.04 -1.26 0.17 135.00 141.83 1a2v s PRO 466 Ca 0.10 0.32 0.10 0.00 0.04 0.00 0.00 61.00 61.56 1a2v s PRO 466 Cb -0.23 -2.13 0.40 0.00 0.04 0.00 0.00 34.50 32.58 1a2v s PRO 466 CO -0.03 -0.82 1.32 -2.13 0.04 0.00 0.00 177.00 175.38 1a2v n ARG 467 N -2.79 1.21 -1.52 4.56 0.63 -0.53 -4.52 116.66 113.69 1a2v n ARG 467 Ca 0.06 -1.96 -0.41 0.00 -0.92 0.00 0.00 57.85 54.62 1a2v n ARG 467 Cb 0.57 -0.16 -0.07 0.00 0.45 0.00 0.00 32.46 33.25 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 -0.59 0.03 -2.56 5.15 2.08 -1.01 -1.41 119.36 121.05 1a2v n ILE 468 Ca -0.02 -0.47 -0.19 0.00 0.56 0.00 0.00 62.75 62.63 1a2v n ILE 468 Cb 0.85 -1.99 -0.00 0.00 -0.75 0.00 0.00 39.64 37.75 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 12.97 -5.29 0.00 4.38 2.03 0.17 -4.38 116.55 126.43 1a2v n ASP 469 Ca 0.44 -0.02 0.00 0.00 0.52 0.00 0.00 54.79 55.73 1a2v n ASP 469 Cb 0.35 -4.40 0.00 0.00 -0.72 0.00 0.00 41.12 36.35 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 -1.05 0.48 3.89 0.27 0.00 -0.50 -4.85 105.19 103.43 1a2v n GLY 470 Ca -0.19 -2.23 -0.31 0.00 0.00 0.00 0.00 46.02 43.29 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 -3.20 6.55 0.00 1.61 1.01 -1.26 -4.46 116.67 116.92 1a2v s ASP 471 Ca 0.00 0.84 0.00 0.00 0.71 0.00 0.00 52.55 54.10 1a2v s ASP 471 Cb 0.00 -2.19 0.00 0.00 1.01 0.00 0.00 42.92 41.74 1a2v s ASP 471 CO 0.00 -0.12 0.00 0.61 0.21 0.00 0.00 175.17 175.87 1a2v n GLY 472 N -0.45 -0.25 3.68 0.21 0.00 -1.26 -4.94 105.19 102.18 1a2v n GLY 472 Ca -0.00 -0.50 -0.27 0.00 0.00 0.00 0.00 46.02 45.25 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 -0.22 4.15 0.17 1.61 -0.87 -0.35 -4.07 114.94 115.36 1a2v s ASN 473 Ca 0.00 -1.24 -0.09 0.00 -1.57 0.00 0.00 52.86 49.95 1a2v s ASN 473 Cb 0.00 -0.40 -0.01 0.00 -0.02 0.00 0.00 41.25 40.82 1a2v s ASN 473 CO 0.00 -0.51 0.30 -0.44 -2.57 0.00 0.00 177.10 173.88 1a2v s SER 474 N -3.81 0.03 0.11 -1.22 0.01 0.28 -1.19 113.70 107.90 1a2v s SER 474 Ca 0.37 -0.88 0.06 0.00 1.31 0.00 0.00 55.95 56.81 1a2v s SER 474 Cb 0.07 0.45 -0.04 0.00 0.21 0.00 0.00 66.02 66.71 1a2v s SER 474 CO 0.20 -0.91 -0.16 0.00 0.41 0.00 0.00 173.24 172.78 1a2v s ALA 475 N -3.97 1.52 0.03 1.44 0.00 -1.26 -0.68 121.76 118.84 1a2v s ALA 475 Ca 0.18 -1.24 -0.16 0.00 0.00 0.00 0.00 51.96 50.75 1a2v s ALA 475 Cb 0.03 -0.12 0.03 0.00 0.00 0.00 0.00 23.12 23.06 1a2v s ALA 475 CO 0.01 0.17 0.35 0.00 0.00 0.00 0.00 175.76 176.29 1a2v s ALA 476 N -1.77 -0.83 -0.05 0.00 0.00 -0.06 -1.29 121.76 117.76 1a2v s ALA 476 Ca 0.07 0.19 -0.07 0.00 0.00 0.00 0.00 51.96 52.15 1a2v s ALA 476 Cb -0.07 0.28 -0.04 0.00 0.00 0.00 0.00 23.12 23.29 1a2v s ALA 476 CO 0.03 -0.40 0.21 0.00 0.00 0.00 0.00 175.76 175.60 1a2v s ALA 477 N -2.30 3.87 -0.22 0.00 0.00 -0.72 -0.74 121.76 121.65 1a2v s ALA 477 Ca -0.07 -0.61 0.01 0.00 0.00 0.00 0.00 51.96 51.30 1a2v s ALA 477 Cb -0.01 -2.02 0.05 0.00 0.00 0.00 0.00 23.12 21.14 1a2v s ALA 477 CO -0.01 0.64 -0.10 0.00 0.00 0.00 0.00 175.76 176.29 1a2v s ASP 479 N 1.31 3.60 0.09 0.00 1.01 -0.33 -2.15 116.67 120.20 1a2v s ASP 479 Ca -0.04 -0.43 -0.30 0.00 0.71 0.00 0.00 52.55 52.49 1a2v s ASP 479 Cb -0.17 -1.52 -0.06 0.00 1.01 0.00 0.00 42.92 42.18 1a2v s ASP 479 CO -0.07 0.16 1.06 0.00 0.21 0.00 0.00 175.17 176.53 1a2v s ALA 480 N 0.36 3.29 0.01 5.23 0.00 -0.10 0.64 121.76 131.20 1a2v s ALA 480 Ca -0.14 0.70 -0.01 0.00 0.00 0.00 0.00 51.96 52.51 1a2v s ALA 480 Cb -0.17 -3.35 -0.01 0.00 0.00 0.00 0.00 23.12 19.59 1a2v s ALA 480 CO 0.07 -0.22 0.01 0.15 0.00 0.00 0.00 175.76 175.77 1a2v s LYS 481 N 0.37 0.25 0.57 0.00 1.02 0.38 -4.65 119.74 117.69 1a2v s LYS 481 Ca 0.52 -0.40 -0.17 0.00 0.02 0.00 0.00 55.97 55.93 1a2v s LYS 481 Cb -0.26 0.10 -0.04 0.00 -0.52 0.00 0.00 37.83 37.10 1a2v s LYS 481 CO 0.31 -0.05 1.07 -1.12 -0.92 0.00 0.00 175.35 174.64 1a2v s SER 482 N -1.03 5.78 0.57 2.83 0.01 -1.26 -0.46 113.70 120.13 1a2v s SER 482 Ca -0.11 1.92 -0.21 0.00 1.31 0.00 0.00 55.95 58.86 1a2v s SER 482 Cb -0.07 -2.55 -0.04 0.00 0.21 0.00 0.00 66.02 63.57 1a2v s SER 482 CO -0.00 -1.17 1.31 -0.55 0.41 0.00 0.00 173.24 173.23 1a2v s SER 483 N -2.43 5.20 0.54 2.44 0.15 -0.38 -4.79 113.70 114.42 1a2v s SER 483 Ca 0.66 2.64 0.32 0.00 0.70 0.00 0.00 55.95 60.27 1a2v s SER 483 Cb -0.18 -2.62 1.38 0.00 -1.71 0.00 0.00 66.02 62.88 1a2v s SER 483 CO 0.33 -1.61 2.00 1.55 1.20 0.00 0.00 173.24 176.71 1a2v h PRO 484 N 1.24 0.00 -6.87 5.44 0.13 -1.93 -3.43 132.00 126.58 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 1.30 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.44 1a2v h PRO 484 CO 0.56 0.06 0.43 0.71 -0.23 0.00 0.00 178.00 179.53 1a2v s TYR 485 N -3.76 3.49 0.66 1.56 1.51 -1.26 -5.03 117.35 114.53 1a2v s TYR 485 Ca 0.00 1.70 -0.08 0.00 -1.01 0.00 0.00 57.07 57.68 1a2v s TYR 485 Cb 0.10 -3.16 0.03 0.00 -0.11 0.00 0.00 41.96 38.82 1a2v s TYR 485 CO 0.56 -0.43 1.00 -1.25 -1.11 0.00 0.00 175.55 174.32 1a2v s PRO 486 N -1.92 2.66 0.32 -1.71 0.04 -1.26 -4.82 135.00 128.31 1a2v s PRO 486 Ca 0.50 0.07 -0.29 0.00 0.04 0.00 0.00 61.00 61.33 1a2v s PRO 486 Cb -0.26 -2.16 -0.13 0.00 0.04 0.00 0.00 34.50 32.00 1a2v s PRO 486 CO 0.33 -0.98 1.32 -0.11 0.04 0.00 0.00 177.00 177.60 1a2v n LEU 487 N -2.83 3.46 0.00 -3.56 0.00 -1.26 -1.79 117.00 111.01 1a2v n LEU 487 Ca 0.06 1.19 0.00 0.00 0.00 0.00 0.00 56.01 57.26 1a2v n LEU 487 Cb 0.58 -1.47 0.00 0.00 0.00 0.00 0.00 43.42 42.53 1a2v n LEU 487 CO 0.54 -0.47 0.00 0.61 0.00 0.00 0.00 177.39 178.07 1a2v n GLY 488 N 1.14 1.83 3.85 -3.96 0.00 -0.16 -4.96 105.19 102.92 1a2v n GLY 488 Ca 0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.77 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 -3.35 6.62 0.49 1.61 1.04 -0.74 -4.79 113.70 114.59 1a2v s SER 489 Ca 0.00 1.45 0.22 0.00 0.48 0.00 0.00 55.95 58.09 1a2v s SER 489 Cb 0.00 -2.45 1.26 0.00 0.10 0.00 0.00 66.02 64.93 1a2v s SER 489 CO 0.00 -0.51 1.96 -0.65 0.98 0.00 0.00 173.24 175.02 1a2v h PRO 490 N 1.12 0.16 0.00 4.02 0.11 -1.96 0.41 132.00 135.87 1a2v h PRO 490 Ca -0.47 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1a2v h PRO 490 Cb 1.18 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1a2v h PRO 490 CO 0.62 0.11 -0.07 0.93 -0.21 0.00 0.00 178.00 179.38 1a2v h GLU 491 N 0.17 0.00 -0.55 1.05 3.07 -1.92 -3.37 114.58 113.03 1a2v h GLU 491 Ca 0.31 0.00 -0.30 0.00 -0.50 0.00 0.00 59.36 58.87 1a2v h GLU 491 Cb 0.97 0.00 -0.25 0.00 -0.84 0.00 0.00 28.75 28.63 1a2v h GLU 491 CO -0.05 0.00 -0.71 -1.71 -1.40 0.00 0.00 179.01 175.14 1a2v n ASN 492 N -2.62 -0.78 -0.28 1.42 5.15 -0.74 -4.99 115.26 112.42 1a2v n ASN 492 Ca 0.05 -2.90 0.04 0.00 -0.60 0.00 0.00 54.58 51.17 1a2v n ASN 492 Cb 0.48 0.60 0.13 0.00 -0.53 0.00 0.00 39.78 40.46 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 2.63 0.03 -0.38 1.20 1.85 -1.12 -0.94 114.93 118.19 1a2v h MET 493 Ca -0.14 -0.00 0.00 0.00 -0.61 0.00 0.00 59.70 58.95 1a2v h MET 493 Cb 1.17 -0.01 0.00 0.00 0.43 0.00 0.00 31.60 33.20 1a2v h MET 493 CO 0.20 0.02 0.00 0.66 -0.40 0.00 0.00 176.91 177.39 1a2v n TYR 494 N -5.47 0.49 -2.31 1.39 4.02 -1.26 -0.99 117.16 113.03 1a2v n TYR 494 Ca 0.13 -0.25 -0.17 0.00 -0.01 0.00 0.00 57.90 57.60 1a2v n TYR 494 Cb 0.46 0.00 -0.01 0.00 -0.02 0.00 0.00 39.34 39.77 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 1.47 -0.30 0.00 2.72 0.00 -0.36 -4.90 105.19 103.81 1a2v n GLY 495 Ca 0.19 -0.15 0.08 0.00 0.00 0.00 0.00 46.02 46.14 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 -1.33 0.82 -4.75 1.61 6.94 -1.26 -4.97 115.26 112.32 1a2v n ASN 496 Ca -0.21 -0.85 -0.41 0.00 -0.02 0.00 0.00 54.58 53.09 1a2v n ASN 496 Cb 0.66 1.05 -0.02 0.00 -2.36 0.00 0.00 39.78 39.11 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 -2.66 3.70 -0.01 -2.53 0.00 -1.26 -4.97 121.76 114.03 1a2v s ALA 497 Ca 0.06 1.52 -0.30 0.00 0.00 0.00 0.00 51.96 53.24 1a2v s ALA 497 Cb 0.13 -3.62 0.07 0.00 0.00 0.00 0.00 23.12 19.69 1a2v s ALA 497 CO 0.71 -0.94 0.67 -0.59 0.00 0.00 0.00 175.76 175.60 1a2v s PHE 498 N -0.13 -0.64 0.14 0.00 -0.12 -1.26 -1.25 117.98 114.72 1a2v s PHE 498 Ca 0.61 0.99 0.02 0.00 -0.05 0.00 0.00 56.93 58.50 1a2v s PHE 498 Cb -0.46 0.44 -0.01 0.00 -0.63 0.00 0.00 43.02 42.36 1a2v s PHE 498 CO 0.49 -0.65 0.15 2.48 -0.05 0.00 0.00 175.22 177.63 1a2v n TYR 499 N 0.68 -0.52 -4.12 3.49 4.11 0.39 -4.91 117.16 116.28 1a2v n TYR 499 Ca -0.19 -1.09 -0.34 0.00 -0.00 0.00 0.00 57.90 56.28 1a2v n TYR 499 Cb 0.58 0.16 -0.14 0.00 -0.00 0.00 0.00 39.34 39.94 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 -1.94 4.09 -0.31 9.48 0.15 -1.26 -0.47 113.70 123.45 1a2v s SER 500 Ca 0.15 -0.41 -0.19 0.00 0.70 0.00 0.00 55.95 56.20 1a2v s SER 500 Cb 0.00 -1.68 -0.01 0.00 -1.71 0.00 0.00 66.02 62.62 1a2v s SER 500 CO 0.11 0.02 0.59 -0.70 1.20 0.00 0.00 173.24 174.46 1a2v s GLU 501 N 1.20 3.87 -0.25 5.44 2.12 0.21 -4.89 118.70 126.40 1a2v s GLU 501 Ca 0.02 0.20 -0.12 0.00 0.36 0.00 0.00 54.97 55.44 1a2v s GLU 501 Cb -0.14 -3.73 -0.05 0.00 0.26 0.00 0.00 34.13 30.46 1a2v s GLU 501 CO -0.03 -0.56 0.22 0.21 -0.54 0.00 0.00 175.26 174.57 1a2v s LYS 502 N 2.53 4.04 -0.42 4.30 2.20 -1.26 -1.18 119.74 129.95 1a2v s LYS 502 Ca 0.23 -0.19 0.02 0.00 -0.36 0.00 0.00 55.97 55.67 1a2v s LYS 502 Cb -0.15 -3.58 0.11 0.00 -1.51 0.00 0.00 37.83 32.70 1a2v s LYS 502 CO 0.12 -0.05 0.17 0.99 -0.36 0.00 0.00 175.35 176.21 1a2v s THR 503 N 1.39 2.72 0.03 3.43 2.01 -0.49 -4.97 115.64 119.75 1a2v s THR 503 Ca 0.10 -2.54 -0.27 0.00 0.31 0.00 0.00 61.69 59.29 1a2v s THR 503 Cb -0.15 -2.92 -0.04 0.00 0.01 0.00 0.00 72.50 69.40 1a2v s THR 503 CO 0.07 -0.69 0.86 0.42 -0.69 0.00 0.00 174.62 174.59 1a2v s THR 504 N 0.62 4.78 0.04 -0.82 -4.23 -1.26 -1.76 115.64 113.01 1a2v s THR 504 Ca 0.12 1.82 -0.30 0.00 -1.18 0.00 0.00 61.69 62.15 1a2v s THR 504 Cb -0.21 -4.21 -0.07 0.00 1.34 0.00 0.00 72.50 69.35 1a2v s THR 504 CO -0.05 0.27 1.46 -0.36 -0.54 0.00 0.00 174.62 175.40 1a2v s PHE 505 N 0.43 2.83 -0.22 3.99 0.08 -0.41 -4.90 117.98 119.79 1a2v s PHE 505 Ca 0.44 0.72 0.04 0.00 0.12 0.00 0.00 56.93 58.26 1a2v s PHE 505 Cb -0.21 -3.74 -0.20 0.00 -0.57 0.00 0.00 43.02 38.30 1a2v s PHE 505 CO 0.25 -2.78 -0.04 1.63 -0.10 0.00 0.00 175.22 174.18 1a2v n LYS 506 N 5.15 0.67 -4.29 0.44 5.02 -1.26 -4.18 118.16 119.71 1a2v n LYS 506 Ca 0.13 0.14 -0.23 0.00 -2.02 0.00 0.00 58.31 56.33 1a2v n LYS 506 Cb 0.43 -1.56 -0.12 0.00 -0.02 0.00 0.00 35.03 33.75 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 1.70 0.25 -0.18 2.01 -1.26 -2.14 115.64 113.50 1a2v s THR 507 Ca -0.27 -1.60 -0.10 0.00 0.31 0.00 0.00 61.69 60.03 1a2v s THR 507 Cb 0.08 -1.59 0.36 0.00 0.01 0.00 0.00 72.50 71.36 1a2v s THR 507 CO 0.68 -0.11 1.59 0.58 -0.69 0.00 0.00 174.62 176.67 1a2v h VAL 508 N 3.94 0.17 -0.95 3.82 2.07 -1.02 0.17 116.25 124.45 1a2v h VAL 508 Ca -0.45 -0.00 0.22 0.00 0.82 0.00 0.00 66.70 67.28 1a2v h VAL 508 Cb 1.18 0.16 -0.08 0.00 -1.52 0.00 0.00 31.29 31.04 1a2v h VAL 508 CO 0.42 0.00 0.62 0.50 0.02 0.00 0.00 177.57 179.13 1a2v h LYS 509 N 0.01 0.43 0.00 1.57 3.64 -1.44 -1.17 116.57 119.60 1a2v h LYS 509 Ca 0.41 -0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.71 1a2v h LYS 509 Cb 0.63 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.35 1a2v h LYS 509 CO -0.85 0.28 -0.25 -0.44 -2.27 0.00 0.00 179.45 175.92 1a2v h ASP 510 N 0.44 0.00 1.49 4.20 3.32 -0.94 -3.13 116.42 121.80 1a2v h ASP 510 Ca 0.51 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 57.49 1a2v h ASP 510 Cb 1.24 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.78 1a2v h ASP 510 CO -0.22 0.25 -0.36 0.77 -1.72 0.00 0.00 179.24 177.96 1a2v h SER 511 N 0.00 0.00 -0.30 6.45 4.64 -1.22 -3.42 113.55 119.70 1a2v h SER 511 Ca -0.00 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.22 1a2v h SER 511 Cb 0.49 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.56 1a2v h SER 511 CO 0.03 0.36 0.30 -0.76 -0.87 0.00 0.00 176.83 175.89 1a2v s LEU 512 N -6.47 2.69 0.21 5.97 1.43 -1.19 -4.43 118.68 116.89 1a2v s LEU 512 Ca 0.04 -0.81 0.08 0.00 -1.03 0.00 0.00 54.13 52.41 1a2v s LEU 512 Cb 0.08 -2.58 -0.05 0.00 0.03 0.00 0.00 46.19 43.67 1a2v s LEU 512 CO 0.71 -4.05 -0.15 0.42 0.23 0.00 0.00 176.35 173.51 1a2v s THR 513 N 14.74 1.81 0.25 5.49 -4.23 -1.12 -4.98 115.64 127.60 1a2v s THR 513 Ca 0.81 -2.23 0.12 0.00 -1.18 0.00 0.00 61.69 59.20 1a2v s THR 513 Cb -0.06 -2.07 -0.05 0.00 1.34 0.00 0.00 72.50 71.66 1a2v s THR 513 CO 0.13 -0.58 -0.20 0.20 -0.54 0.00 0.00 174.62 173.63 1a2v s ASN 514 N -3.33 3.60 0.30 3.99 0.01 -1.26 -0.84 114.94 117.41 1a2v s ASN 514 Ca 0.23 -0.95 -0.29 0.00 -0.71 0.00 0.00 52.86 51.14 1a2v s ASN 514 Cb -0.01 -0.32 -0.10 0.00 0.41 0.00 0.00 41.25 41.23 1a2v s ASN 514 CO 0.08 0.07 1.29 -0.47 -1.51 0.00 0.00 177.10 176.56 1a2v s TYR 515 N -2.21 3.13 -0.13 2.20 5.04 -1.26 -4.93 117.35 119.18 1a2v s TYR 515 Ca 0.27 1.40 0.00 0.00 -2.44 0.00 0.00 57.07 56.30 1a2v s TYR 515 Cb -0.06 -3.64 0.02 0.00 0.35 0.00 0.00 41.96 38.63 1a2v s TYR 515 CO 0.14 -1.77 -0.12 -1.21 -1.34 0.00 0.00 175.55 171.24 1a2v s GLU 516 N -1.46 2.06 0.24 4.97 0.41 -1.26 -5.00 118.70 118.66 1a2v s GLU 516 Ca 0.50 -0.47 -0.01 0.00 -0.41 0.00 0.00 54.97 54.58 1a2v s GLU 516 Cb -0.39 -1.93 0.28 0.00 -1.78 0.00 0.00 34.13 30.31 1a2v s GLU 516 CO 0.49 -0.23 1.67 0.66 -0.49 0.00 0.00 175.26 177.36 1a2v h SER 517 N 8.02 0.65 -0.48 -0.19 4.64 -1.96 -2.64 113.55 121.59 1a2v h SER 517 Ca -0.35 -0.23 0.14 0.00 -0.47 0.00 0.00 61.79 60.88 1a2v h SER 517 Cb 1.14 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 63.03 1a2v h SER 517 CO 0.49 0.88 0.50 0.00 -0.87 0.00 0.00 176.83 177.83 1a2v h ALA 518 N 1.17 2.22 0.00 5.18 0.00 -1.99 -1.67 119.26 124.17 1a2v h ALA 518 Ca 0.08 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1a2v h ALA 518 Cb 0.71 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1a2v h ALA 518 CO 0.05 -0.75 -0.04 0.25 0.00 0.00 0.00 179.25 178.77 1a2v n THR 519 N -3.73 0.93 -4.03 0.00 -2.24 -1.15 -4.94 114.28 99.12 1a2v n THR 519 Ca 0.09 -1.02 -0.29 0.00 -2.27 0.00 0.00 64.05 60.56 1a2v n THR 519 Cb 0.70 0.43 -0.02 0.00 -2.10 0.00 0.00 70.33 69.34 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 -0.58 -0.31 3.75 3.38 0.00 -0.63 -0.92 105.19 109.88 1a2v n GLY 520 Ca 0.04 0.15 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 1a2v n GLY 520 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1a2v n ARG 521 N -4.42 2.49 -4.23 1.61 0.63 -1.03 -4.68 116.66 107.03 1a2v n ARG 521 Ca -0.17 0.88 -0.13 0.00 -0.92 0.00 0.00 57.85 57.50 1a2v n ARG 521 Cb 0.62 -2.56 -0.10 0.00 0.45 0.00 0.00 32.46 30.86 1a2v n ARG 521 CO 0.00 0.00 0.00 -1.54 -2.51 0.00 0.00 177.63 173.58 1a2v s SER 522 N -0.11 0.69 -0.01 6.15 1.04 -0.91 -4.76 113.70 115.78 1a2v s SER 522 Ca 0.55 -1.31 0.05 0.00 0.48 0.00 0.00 55.95 55.72 1a2v s SER 522 Cb -0.51 0.25 -0.01 0.00 0.10 0.00 0.00 66.02 65.85 1a2v s SER 522 CO 0.62 -0.74 -0.15 0.26 0.98 0.00 0.00 173.24 174.20 1a2v s TRP 523 N -3.92 1.38 -0.07 5.02 0.51 -1.08 -0.29 118.94 120.48 1a2v s TRP 523 Ca 0.33 -0.26 0.00 0.00 -2.12 0.00 0.00 56.10 54.05 1a2v s TRP 523 Cb 0.07 -0.89 -0.03 0.00 -0.81 0.00 0.00 33.47 31.81 1a2v s TRP 523 CO 0.09 -0.02 -0.04 -0.51 -0.51 0.00 0.00 176.95 175.95 1a2v s ASP 524 N -0.35 4.86 -0.21 2.95 1.01 0.08 0.11 116.67 125.12 1a2v s ASP 524 Ca 0.06 0.03 -0.00 0.00 0.71 0.00 0.00 52.55 53.35 1a2v s ASP 524 Cb -0.06 -1.27 0.02 0.00 1.01 0.00 0.00 42.92 42.62 1a2v s ASP 524 CO -0.01 0.36 -0.13 -0.63 0.21 0.00 0.00 175.17 174.98 1a2v s ILE 525 N -0.85 2.51 0.23 0.77 1.01 -0.73 -0.88 121.20 123.26 1a2v s ILE 525 Ca 0.13 -0.98 0.01 0.00 0.00 0.00 0.00 60.65 59.81 1a2v s ILE 525 Cb -0.11 -2.18 -0.04 0.00 0.01 0.00 0.00 42.46 40.14 1a2v s ILE 525 CO 0.02 0.36 0.15 0.72 0.00 0.00 0.00 174.94 176.20 1a2v s PHE 526 N 1.31 1.32 -0.47 3.97 -0.71 0.14 -1.44 117.98 122.10 1a2v s PHE 526 Ca 0.02 -1.41 -0.09 0.00 -1.04 0.00 0.00 56.93 54.41 1a2v s PHE 526 Cb -0.15 -0.63 0.12 0.00 -1.21 0.00 0.00 43.02 41.15 1a2v s PHE 526 CO -0.08 -0.65 0.34 1.21 -1.34 0.00 0.00 175.22 174.70 1a2v s ASN 527 N -3.22 5.67 0.14 1.98 3.04 -0.87 -0.56 114.94 121.12 1a2v s ASN 527 Ca 0.39 -1.94 0.16 0.00 0.04 0.00 0.00 52.86 51.51 1a2v s ASN 527 Cb 0.06 -2.00 0.71 0.00 -1.54 0.00 0.00 41.25 38.49 1a2v s ASN 527 CO 0.15 -0.68 1.48 -0.81 -3.04 0.00 0.00 177.10 174.20 1a2v n PRO 528 N 4.87 0.09 0.00 0.43 -0.04 -1.26 -2.21 135.00 136.88 1a2v n PRO 528 Ca -0.07 0.43 0.15 0.00 -0.04 0.00 0.00 63.50 63.97 1a2v n PRO 528 Cb 0.41 -1.70 0.70 0.00 -0.04 0.00 0.00 33.50 32.86 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 -1.87 0.64 -4.19 3.54 3.02 -1.26 -4.89 115.26 110.26 1a2v n ASN 529 Ca 0.01 -1.01 -0.12 0.00 -0.03 0.00 0.00 54.58 53.43 1a2v n ASN 529 Cb 0.13 -0.02 -0.10 0.00 -0.61 0.00 0.00 39.78 39.17 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 -2.16 0.88 -0.01 3.52 1.02 -0.94 -5.14 119.74 116.90 1a2v s LYS 530 Ca 0.38 -1.32 0.03 0.00 0.02 0.00 0.00 55.97 55.08 1a2v s LYS 530 Cb 0.21 -0.36 -0.00 0.00 -0.52 0.00 0.00 37.83 37.16 1a2v s LYS 530 CO 0.40 0.02 -0.10 0.08 -0.92 0.00 0.00 175.35 174.83 1a2v s VAL 531 N -3.30 0.81 -0.03 3.17 1.01 -1.26 -3.97 120.40 116.83 1a2v s VAL 531 Ca 0.11 -0.41 -0.30 0.00 0.00 0.00 0.00 61.98 61.38 1a2v s VAL 531 Cb 0.03 -0.69 -0.04 0.00 0.00 0.00 0.00 36.38 35.68 1a2v s VAL 531 CO -0.03 0.24 1.23 0.21 0.00 0.00 0.00 175.10 176.75 1a2v s ASN 532 N -0.09 7.02 0.66 3.32 3.84 0.23 -4.89 114.94 125.04 1a2v s ASN 532 Ca 0.01 1.89 0.43 0.00 0.21 0.00 0.00 52.86 55.41 1a2v s ASN 532 Cb -0.06 -2.56 2.35 0.00 -0.55 0.00 0.00 41.25 40.44 1a2v s ASN 532 CO -0.00 -0.59 2.33 1.55 -2.79 0.00 0.00 177.10 177.60 1a2v h PRO 533 N 7.42 0.00 0.00 0.43 0.13 -1.93 0.10 132.00 138.15 1a2v h PRO 533 Ca -0.36 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.77 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 0.87 0.00 -0.80 0.66 -0.23 0.00 0.00 178.00 178.50 1a2v n TYR 534 N -3.04 0.32 0.14 1.56 4.01 -1.26 -4.65 117.16 114.24 1a2v n TYR 534 Ca -0.03 0.14 0.01 0.00 -0.16 0.00 0.00 57.90 57.86 1a2v n TYR 534 Cb 0.09 -0.58 0.10 0.00 -0.31 0.00 0.00 39.34 38.64 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 -0.97 0.00 0.00 7.72 4.64 -1.97 -3.47 113.55 119.50 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 0.80 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.89 1a2v h SER 535 CO 0.00 0.59 0.00 0.61 -0.87 0.00 0.00 176.83 177.16 1a2v n GLY 536 N 0.85 0.89 3.93 -0.77 0.00 0.36 -4.99 105.19 105.45 1a2v n GLY 536 Ca 0.01 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.26 3.53 0.69 1.61 -0.14 -1.26 -4.59 119.74 119.33 1a2v s LYS 537 Ca 0.00 -0.20 -0.12 0.00 -1.36 0.00 0.00 55.97 54.29 1a2v s LYS 537 Cb 0.00 -2.64 0.01 0.00 -1.68 0.00 0.00 37.83 33.52 1a2v s LYS 537 CO 0.00 0.15 1.08 -1.25 -0.76 0.00 0.00 175.35 174.56 1a2v s PRO 538 N -4.10 2.78 0.42 -1.68 0.04 -1.25 0.77 135.00 131.97 1a2v s PRO 538 Ca 0.42 1.14 -0.24 0.00 0.04 0.00 0.00 61.00 62.35 1a2v s PRO 538 Cb -0.10 -1.96 -0.08 0.00 0.04 0.00 0.00 34.50 32.40 1a2v s PRO 538 CO 0.35 -1.24 1.15 -1.25 0.04 0.00 0.00 177.00 176.05 1a2v s PRO 539 N -4.66 3.98 0.23 0.56 0.04 -1.25 -4.72 135.00 129.17 1a2v s PRO 539 Ca 0.61 1.78 -0.23 0.00 0.04 0.00 0.00 61.00 63.21 1a2v s PRO 539 Cb -0.16 -2.58 0.04 0.00 0.04 0.00 0.00 34.50 31.83 1a2v s PRO 539 CO 0.50 -0.36 0.78 -1.54 0.04 0.00 0.00 177.00 176.41 1a2v s SER 540 N -1.25 -0.27 -0.10 6.66 1.04 -1.10 -2.05 113.70 116.63 1a2v s SER 540 Ca 0.59 -0.48 0.03 0.00 0.48 0.00 0.00 55.95 56.57 1a2v s SER 540 Cb -0.29 0.64 0.01 0.00 0.10 0.00 0.00 66.02 66.48 1a2v s SER 540 CO 0.36 -1.17 -0.19 -0.31 0.98 0.00 0.00 173.24 172.91 1a2v s TYR 541 N -3.71 2.18 -0.23 5.02 1.51 -0.52 -1.22 117.35 120.39 1a2v s TYR 541 Ca 0.10 -0.93 -0.09 0.00 -1.01 0.00 0.00 57.07 55.14 1a2v s TYR 541 Cb -0.04 -1.51 -0.04 0.00 -0.11 0.00 0.00 41.96 40.26 1a2v s TYR 541 CO 0.03 -0.42 0.12 0.21 -1.11 0.00 0.00 175.55 174.38 1a2v s LYS 542 N 0.60 3.97 -0.44 -0.62 2.20 0.14 -1.77 119.74 123.82 1a2v s LYS 542 Ca -0.14 -0.33 -0.29 0.00 -0.36 0.00 0.00 55.97 54.85 1a2v s LYS 542 Cb -0.17 -3.41 0.03 0.00 -1.51 0.00 0.00 37.83 32.77 1a2v s LYS 542 CO 0.04 0.07 1.12 -1.17 -0.36 0.00 0.00 175.35 175.05 1a2v s LEU 543 N 0.97 3.72 -0.65 5.43 2.96 0.12 -1.43 118.68 129.81 1a2v s LEU 543 Ca 0.06 0.60 -0.06 0.00 -0.22 0.00 0.00 54.13 54.51 1a2v s LEU 543 Cb -0.14 -3.54 0.17 0.00 0.50 0.00 0.00 46.19 43.19 1a2v s LEU 543 CO 0.03 -1.15 0.50 -0.69 -1.32 0.00 0.00 176.35 173.72 1a2v s VAL 544 N 4.23 4.22 -0.04 1.68 1.01 0.14 -2.65 120.40 129.00 1a2v s VAL 544 Ca 0.47 -2.66 0.03 0.00 0.00 0.00 0.00 61.98 59.82 1a2v s VAL 544 Cb -0.08 -3.71 0.00 0.00 0.00 0.00 0.00 36.38 32.58 1a2v s VAL 544 CO 0.27 -0.89 -0.12 -0.55 0.00 0.00 0.00 175.10 173.81 1a2v s SER 545 N 1.34 1.60 0.00 3.32 0.15 -1.26 -1.91 113.70 116.93 1a2v s SER 545 Ca 0.15 -0.26 0.00 0.00 0.70 0.00 0.00 55.95 56.55 1a2v s SER 545 Cb -0.19 -0.48 0.00 0.00 -1.71 0.00 0.00 66.02 63.65 1a2v s SER 545 CO -0.04 0.09 0.00 0.41 1.20 0.00 0.00 173.24 174.90 1a2v n THR 546 N 3.31 0.00 -2.55 6.45 -1.04 -1.26 -4.81 114.28 114.38 1a2v n THR 546 Ca -0.19 -0.06 -0.43 0.00 -2.04 0.00 0.00 64.05 61.33 1a2v n THR 546 Cb 0.53 0.46 0.00 0.00 -1.82 0.00 0.00 70.33 69.50 1a2v n THR 546 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1a2v n GLN 547 N -0.93 3.66 -3.87 -2.82 6.02 -1.26 -4.82 117.38 113.36 1a2v n GLN 547 Ca 0.00 -3.72 -0.29 0.00 -0.01 0.00 0.00 57.00 52.98 1a2v n GLN 547 Cb 0.00 -2.89 -0.12 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 -1.28 4.14 0.46 0.00 0.02 -1.26 -4.79 135.00 132.29 1a2v s PRO 549 Ca 0.24 1.93 -0.21 0.00 0.02 0.00 0.00 61.00 62.98 1a2v s PRO 549 Cb -0.08 -2.79 -0.09 0.00 0.02 0.00 0.00 34.50 31.56 1a2v s PRO 549 CO -0.14 -0.27 1.02 -1.25 -0.33 0.00 0.00 177.00 176.03 1a2v s PRO 550 N -2.14 3.94 -0.24 5.54 0.04 -1.26 -4.93 135.00 135.96 1a2v s PRO 550 Ca 0.55 1.32 -0.29 0.00 0.04 0.00 0.00 61.00 62.61 1a2v s PRO 550 Cb -0.33 -2.16 -0.03 0.00 0.04 0.00 0.00 34.50 32.02 1a2v s PRO 550 CO 0.42 -0.30 1.72 -1.17 0.04 0.00 0.00 177.00 177.71 1a2v s LEU 551 N -3.33 3.78 0.42 -3.56 2.96 -1.26 -4.86 118.68 112.83 1a2v s LEU 551 Ca 0.65 1.60 0.28 0.00 -0.22 0.00 0.00 54.13 56.44 1a2v s LEU 551 Cb -0.15 -3.53 1.02 0.00 0.50 0.00 0.00 46.19 44.03 1a2v s LEU 551 CO 0.19 -1.42 1.82 -0.07 -1.32 0.00 0.00 176.35 175.56 1a2v h LEU 552 N 12.39 0.00 -9.68 -0.68 3.38 -1.95 -3.44 115.31 115.31 1a2v h LEU 552 Ca -0.35 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.10 1a2v h LEU 552 Cb 1.17 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.95 1a2v h LEU 552 CO 1.00 0.00 0.62 0.00 0.09 0.00 0.00 178.44 180.16 1a2v s ALA 553 N -3.43 3.50 0.93 1.53 0.00 -1.26 -4.98 121.76 118.05 1a2v s ALA 553 Ca 0.04 1.07 -0.11 0.00 0.00 0.00 0.00 51.96 52.96 1a2v s ALA 553 Cb 0.09 -3.46 0.10 0.00 0.00 0.00 0.00 23.12 19.85 1a2v s ALA 553 CO 0.54 -0.49 0.82 1.63 0.00 0.00 0.00 175.76 178.25 1a2v n LYS 554 N 2.50 -0.40 -2.38 0.00 4.01 -1.26 -4.79 118.16 115.83 1a2v n LYS 554 Ca 0.05 -0.06 -0.39 0.00 -0.51 0.00 0.00 58.31 57.40 1a2v n LYS 554 Cb 0.43 -2.15 -0.03 0.00 -0.51 0.00 0.00 35.03 32.77 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 -4.20 4.34 0.00 1.97 2.02 -1.26 -2.48 118.70 119.09 1a2v s GLU 555 Ca 0.62 1.83 0.00 0.00 0.02 0.00 0.00 54.97 57.44 1a2v s GLU 555 Cb -0.22 -2.91 0.00 0.00 0.10 0.00 0.00 34.13 31.10 1a2v s GLU 555 CO 0.62 -0.07 0.00 0.41 0.02 0.00 0.00 175.26 176.24 1a2v n GLY 556 N 0.83 0.80 3.89 -1.39 0.00 -1.26 -5.04 105.19 103.02 1a2v n GLY 556 Ca 0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.76 5.41 0.14 1.61 1.04 -1.04 -4.85 113.70 113.26 1a2v s SER 557 Ca 0.00 1.05 -0.21 0.00 0.48 0.00 0.00 55.95 57.26 1a2v s SER 557 Cb 0.00 -1.86 0.01 0.00 0.10 0.00 0.00 66.02 64.27 1a2v s SER 557 CO 0.00 -1.33 1.66 -0.07 0.98 0.00 0.00 173.24 174.48 1a2v h LEU 558 N -0.61 -0.51 0.14 2.42 3.38 -1.91 -0.30 115.31 117.93 1a2v h LEU 558 Ca -0.45 0.10 0.02 0.00 0.09 0.00 0.00 57.88 57.64 1a2v h LEU 558 Cb 1.26 0.25 -0.04 0.00 0.09 0.00 0.00 40.66 42.22 1a2v h LEU 558 CO 0.63 -0.20 -0.31 0.58 0.09 0.00 0.00 178.44 179.24 1a2v h VAL 559 N -0.17 0.34 -0.78 1.22 2.07 -1.92 -0.68 116.25 116.32 1a2v h VAL 559 Ca 0.12 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.68 1a2v h VAL 559 Cb 0.34 0.34 -0.05 0.00 -1.52 0.00 0.00 31.29 30.41 1a2v h VAL 559 CO -0.29 0.00 0.51 0.00 0.02 0.00 0.00 177.57 177.81 1a2v h ALA 560 N 0.11 1.56 -0.13 1.67 0.00 -1.73 -1.47 119.26 119.26 1a2v h ALA 560 Ca 0.02 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 1a2v h ALA 560 Cb 0.56 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1a2v h ALA 560 CO -0.16 0.35 -0.26 0.87 0.00 0.00 0.00 179.25 180.05 1a2v h LYS 561 N 0.93 0.40 0.00 0.00 1.57 -0.69 -3.17 116.57 115.61 1a2v h LYS 561 Ca 0.32 -0.26 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1a2v h LYS 561 Cb 0.09 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.43 1a2v h LYS 561 CO -0.10 0.86 0.00 0.00 -0.57 0.00 0.00 179.45 179.64 1a2v h ARG 562 N -0.01 0.00 -2.18 3.15 3.08 -1.01 -3.34 114.38 114.07 1a2v h ARG 562 Ca 0.00 0.00 -0.58 0.00 0.07 0.00 0.00 59.98 59.47 1a2v h ARG 562 Cb 0.85 0.00 -0.41 0.00 0.08 0.00 0.00 29.97 30.48 1a2v h ARG 562 CO 0.06 0.00 -0.73 0.00 -1.07 0.00 0.00 179.97 178.23 1a2v n ALA 563 N -1.93 3.87 -0.06 0.04 0.00 -0.57 -4.72 120.51 117.14 1a2v n ALA 563 Ca 0.04 -4.45 0.23 0.00 0.00 0.00 0.00 53.44 49.25 1a2v n ALA 563 Cb 0.41 -0.84 0.70 0.00 0.00 0.00 0.00 19.45 19.72 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 3.67 0.00 0.00 0.00 0.13 -1.67 -1.49 132.00 132.64 1a2v h PRO 564 Ca 0.15 -0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.24 1a2v h PRO 564 Cb 0.67 -0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.79 1a2v h PRO 564 CO 0.75 0.00 -0.19 0.11 -0.23 0.00 0.00 178.00 178.44 1a2v h TRP 565 N 0.00 0.00 0.00 1.56 5.08 -1.88 -3.28 115.95 117.43 1a2v h TRP 565 Ca 0.31 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.28 1a2v h TRP 565 Cb 1.26 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.42 1a2v h TRP 565 CO -0.00 0.19 0.00 0.00 -1.28 0.00 0.00 178.44 177.35 1a2v n ALA 566 N -2.19 1.90 0.66 0.11 0.00 -0.56 -3.26 120.51 117.17 1a2v n ALA 566 Ca 0.01 0.02 0.12 0.00 0.00 0.00 0.00 53.44 53.59 1a2v n ALA 566 Cb 0.45 -1.40 0.47 0.00 0.00 0.00 0.00 19.45 18.97 1a2v n ALA 566 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1a2v n SER 567 N -2.10 0.36 -4.10 0.00 7.64 -1.24 -4.22 113.62 109.96 1a2v n SER 567 Ca 0.04 0.55 -0.19 0.00 1.01 0.00 0.00 58.87 60.28 1a2v n SER 567 Cb 0.29 -0.64 -0.14 0.00 -1.01 0.00 0.00 64.21 62.71 1a2v n SER 567 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 1a2v s HIS 568 N -3.09 1.08 0.36 1.43 3.76 -1.20 -4.77 115.29 112.86 1a2v s HIS 568 Ca 0.09 -0.31 0.10 0.00 -0.15 0.00 0.00 55.06 54.80 1a2v s HIS 568 Cb 0.13 -0.66 0.69 0.00 1.11 0.00 0.00 32.58 33.85 1a2v s HIS 568 CO 0.46 0.01 1.83 0.77 -0.85 0.00 0.00 174.74 176.95 1a2v h SER 569 N 5.19 0.12 -3.86 1.40 0.02 -1.50 -3.37 113.55 111.55 1a2v h SER 569 Ca -0.36 -0.04 -0.32 0.00 -0.84 0.00 0.00 61.79 60.24 1a2v h SER 569 Cb 1.18 -0.03 -0.29 0.00 0.14 0.00 0.00 62.40 63.40 1a2v h SER 569 CO 0.45 0.43 -0.75 -0.69 -1.14 0.00 0.00 176.83 175.13 1a2v s VAL 570 N -4.33 0.36 -0.08 2.27 1.01 -0.02 -0.74 120.40 118.87 1a2v s VAL 570 Ca -0.04 -0.18 -0.02 0.00 0.00 0.00 0.00 61.98 61.73 1a2v s VAL 570 Cb 0.14 -0.32 0.04 0.00 0.00 0.00 0.00 36.38 36.24 1a2v s VAL 570 CO 0.74 0.11 0.04 0.20 0.00 0.00 0.00 175.10 176.19 1a2v s ASN 571 N -0.03 1.63 -0.18 3.32 0.01 -0.46 -2.80 114.94 116.43 1a2v s ASN 571 Ca 0.01 -0.16 -0.00 0.00 -0.71 0.00 0.00 52.86 52.00 1a2v s ASN 571 Cb -0.03 -0.30 0.01 0.00 0.41 0.00 0.00 41.25 41.34 1a2v s ASN 571 CO -0.00 -0.25 -0.16 -0.69 -1.51 0.00 0.00 177.10 174.49 1a2v s VAL 572 N 2.07 2.46 0.24 1.60 1.01 -1.26 -0.63 120.40 125.88 1a2v s VAL 572 Ca 0.04 -0.81 0.06 0.00 0.00 0.00 0.00 61.98 61.26 1a2v s VAL 572 Cb -0.13 -2.06 -0.05 0.00 0.00 0.00 0.00 36.38 34.14 1a2v s VAL 572 CO -0.05 0.51 -0.05 0.68 0.00 0.00 0.00 175.10 176.18 1a2v s VAL 573 N 1.25 1.41 0.53 2.92 -7.23 -0.36 -4.58 120.40 114.34 1a2v s VAL 573 Ca 0.03 -2.10 -0.22 0.00 -1.81 0.00 0.00 61.98 57.89 1a2v s VAL 573 Cb -0.14 -2.31 -0.05 0.00 0.56 0.00 0.00 36.38 34.44 1a2v s VAL 573 CO -0.08 -0.39 1.28 -2.84 -0.31 0.00 0.00 175.10 172.76 1a2v s PRO 574 N -3.76 3.28 0.39 4.82 0.02 -1.26 0.07 135.00 138.55 1a2v s PRO 574 Ca 0.27 2.05 -0.24 0.00 0.02 0.00 0.00 61.00 63.10 1a2v s PRO 574 Cb 0.04 -2.25 -0.09 0.00 0.02 0.00 0.00 34.50 32.21 1a2v s PRO 574 CO 0.09 -1.02 1.03 -0.47 -0.33 0.00 0.00 177.00 176.30 1a2v s TYR 575 N -1.41 3.34 -0.19 6.54 5.04 0.84 -4.59 117.35 126.92 1a2v s TYR 575 Ca 0.70 1.66 -0.17 0.00 -2.44 0.00 0.00 57.07 56.83 1a2v s TYR 575 Cb -0.36 -3.08 0.05 0.00 0.35 0.00 0.00 41.96 38.93 1a2v s TYR 575 CO 0.42 -0.46 0.51 0.21 -1.34 0.00 0.00 175.55 174.89 1a2v s LYS 576 N -2.47 0.58 0.31 4.97 2.47 -1.26 -4.96 119.74 119.38 1a2v s LYS 576 Ca 0.57 0.74 -0.29 0.00 -1.56 0.00 0.00 55.97 55.43 1a2v s LYS 576 Cb -0.21 0.25 -0.12 0.00 -1.46 0.00 0.00 37.83 36.29 1a2v s LYS 576 CO 0.26 -0.08 1.42 -0.25 0.16 0.00 0.00 175.35 176.85 1a2v n ASP 577 N 3.03 3.16 -0.97 1.43 8.00 -1.26 -2.57 116.55 127.37 1a2v n ASP 577 Ca -0.15 1.18 -0.09 0.00 0.71 0.00 0.00 54.79 56.45 1a2v n ASP 577 Cb 0.56 -1.52 -0.01 0.00 -0.02 0.00 0.00 41.12 40.14 1a2v n ASP 577 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1a2v n ASN 578 N 1.36 -3.20 -4.27 -2.24 3.02 -1.26 -4.96 115.26 103.72 1a2v n ASN 578 Ca 0.07 0.02 -0.43 0.00 -0.03 0.00 0.00 54.58 54.20 1a2v n ASN 578 Cb 0.35 -2.37 -0.03 0.00 -0.61 0.00 0.00 39.78 37.13 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 -4.24 3.71 -0.12 3.52 0.52 -1.06 -4.76 118.95 116.51 1a2v s ARG 579 Ca 0.00 -2.96 -0.08 0.00 -0.52 0.00 0.00 55.73 52.17 1a2v s ARG 579 Cb 0.00 -4.33 -0.05 0.00 0.52 0.00 0.00 34.95 31.09 1a2v s ARG 579 CO 0.00 -1.25 -0.18 1.28 0.02 0.00 0.00 175.30 175.16 1a2v n LEU 580 N 3.04 1.16 -4.48 2.53 4.77 -1.26 -4.96 117.00 117.80 1a2v n LEU 580 Ca 0.19 0.19 -0.43 0.00 -0.03 0.00 0.00 56.01 55.94 1a2v n LEU 580 Cb 0.41 -0.46 -0.09 0.00 -2.33 0.00 0.00 43.42 40.95 1a2v n LEU 580 CO 0.40 0.08 0.03 -0.31 -1.33 0.00 0.00 177.39 176.25 1a2v s TYR 581 N -2.32 3.20 0.21 -1.77 2.02 -1.26 -4.81 117.35 112.62 1a2v s TYR 581 Ca -0.19 -0.44 0.35 0.00 -0.37 0.00 0.00 57.07 56.42 1a2v s TYR 581 Cb 0.06 -2.75 1.74 0.00 -0.40 0.00 0.00 41.96 40.61 1a2v s TYR 581 CO 0.24 -0.64 2.05 -1.00 -1.57 0.00 0.00 175.55 174.64 1a2v h PRO 582 N 8.67 0.00 -0.48 -1.71 0.13 -1.94 -2.19 132.00 134.48 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 0.76 0.00 0.00 0.43 -0.23 0.00 0.00 178.00 178.96 1a2v n SER 583 N -2.80 3.83 0.00 1.44 7.64 -1.26 -1.01 113.62 121.46 1a2v n SER 583 Ca -0.01 -2.32 0.00 0.00 1.01 0.00 0.00 58.87 57.55 1a2v n SER 583 Cb 0.13 -0.43 0.00 0.00 -1.01 0.00 0.00 64.21 62.90 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 0.69 2.32 0.24 0.23 0.00 -0.82 -4.64 105.19 103.21 1a2v n GLY 584 Ca 0.20 -1.89 -0.10 0.00 0.00 0.00 0.00 46.02 44.23 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 0.75 -3.95 1.61 3.32 -1.98 -3.38 116.42 112.80 1a2v h ASP 585 Ca 0.00 -0.35 -0.64 0.00 0.02 0.00 0.00 57.03 56.06 1a2v h ASP 585 Cb 0.00 -0.21 -0.40 0.00 0.22 0.00 0.00 39.33 38.93 1a2v h ASP 585 CO 0.00 1.08 -0.68 -1.00 -1.72 0.00 0.00 179.24 176.92 1a2v s HIS 586 N -4.25 3.05 0.03 4.55 3.76 -1.26 -4.91 115.29 116.27 1a2v s HIS 586 Ca -0.09 -2.90 -0.17 0.00 -0.15 0.00 0.00 55.06 51.75 1a2v s HIS 586 Cb 0.12 -2.62 -0.24 0.00 1.11 0.00 0.00 32.58 30.95 1a2v s HIS 586 CO 0.85 -0.82 1.13 0.28 -0.85 0.00 0.00 174.74 175.33 1a2v h VAL 587 N 5.86 1.37 -2.72 -0.90 2.07 -1.75 -3.42 116.25 116.75 1a2v h VAL 587 Ca -0.06 -2.17 -0.59 0.00 0.82 0.00 0.00 66.70 64.69 1a2v h VAL 587 Cb 0.94 2.54 0.10 0.00 -1.52 0.00 0.00 31.29 33.35 1a2v h VAL 587 CO 0.59 0.65 0.35 -2.65 0.02 0.00 0.00 177.57 176.53 1a2v n PRO 588 N -4.06 1.70 -0.99 1.57 -0.02 -1.25 -2.40 135.00 129.55 1a2v n PRO 588 Ca -0.11 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 61.97 1a2v n PRO 588 Cb 0.77 -2.10 0.00 0.00 -0.02 0.00 0.00 33.50 32.15 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 1.01 -1.88 -2.48 -0.52 6.02 -0.58 -4.11 117.38 114.84 1a2v n GLN 589 Ca 0.09 0.47 -0.41 0.00 -0.01 0.00 0.00 57.00 57.14 1a2v n GLN 589 Cb 0.32 -4.89 -0.04 0.00 1.02 0.00 0.00 30.24 26.65 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 -1.05 3.55 -0.07 1.08 -0.00 -1.01 -4.35 118.94 117.08 1a2v s TRP 590 Ca 0.00 1.55 0.20 0.00 -0.00 0.00 0.00 56.10 57.85 1a2v s TRP 590 Cb 0.00 -3.32 0.48 0.00 -0.00 0.00 0.00 33.47 30.64 1a2v s TRP 590 CO 0.00 -0.77 1.64 0.66 -0.00 0.00 0.00 176.95 178.48 1a2v h SER 591 N 5.22 0.00 0.00 5.86 4.64 -1.93 -3.47 113.55 123.87 1a2v h SER 591 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 1a2v h SER 591 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1a2v h SER 591 CO 0.73 0.31 0.00 0.61 -0.87 0.00 0.00 176.83 177.61 1a2v n GLY 592 N 0.74 0.74 3.76 -0.77 0.00 -1.26 -4.51 105.19 103.89 1a2v n GLY 592 Ca 0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 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 -1.96 7.02 0.00 1.61 1.01 -1.26 -4.65 116.67 118.43 1a2v s ASP 593 Ca 0.00 1.21 0.00 0.00 0.71 0.00 0.00 52.55 54.47 1a2v s ASP 593 Cb 0.00 -2.38 0.00 0.00 1.01 0.00 0.00 42.92 41.55 1a2v s ASP 593 CO 0.00 0.10 0.00 0.61 0.21 0.00 0.00 175.17 176.09 1a2v n GLY 594 N 2.39 3.37 3.40 0.21 0.00 -1.26 -4.98 105.19 108.32 1a2v n GLY 594 Ca -0.06 -1.86 -0.45 0.00 0.00 0.00 0.00 46.02 43.64 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 -2.56 4.98 0.19 1.61 1.01 -1.26 -4.90 120.40 119.46 1a2v s VAL 595 Ca 0.00 -1.64 -0.12 0.00 0.00 0.00 0.00 61.98 60.21 1a2v s VAL 595 Cb 0.00 -4.63 0.00 0.00 0.00 0.00 0.00 36.38 31.76 1a2v s VAL 595 CO 0.00 -1.29 0.40 0.00 0.00 0.00 0.00 175.10 174.21 1a2v s ARG 596 N 2.05 1.32 4.45 2.72 1.70 -1.26 -4.67 118.95 125.25 1a2v s ARG 596 Ca 0.23 -1.11 0.00 0.00 -0.47 0.00 0.00 55.73 54.39 1a2v s ARG 596 Cb -0.11 0.44 0.00 0.00 -0.57 0.00 0.00 34.95 34.71 1a2v s ARG 596 CO -0.05 -0.52 0.00 0.41 -1.08 0.00 0.00 175.30 174.06 1a2v n GLY 597 N -0.29 1.44 0.26 3.88 0.00 -1.26 -2.97 105.19 106.26 1a2v n GLY 597 Ca -0.07 -0.57 0.04 0.00 0.00 0.00 0.00 46.02 45.42 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 0.38 -0.68 1.61 1.85 -1.33 0.69 114.93 117.45 1a2v h MET 598 Ca 0.00 -0.02 0.11 0.00 -0.61 0.00 0.00 59.70 59.18 1a2v h MET 598 Cb 0.00 -0.09 -0.04 0.00 0.43 0.00 0.00 31.60 31.90 1a2v h MET 598 CO 0.00 0.25 0.45 -0.09 -0.40 0.00 0.00 176.91 177.13 1a2v h ARG 599 N 0.40 0.47 0.09 0.39 2.43 -1.79 0.28 114.38 116.65 1a2v h ARG 599 Ca 0.39 -0.03 -0.27 0.00 -0.81 0.00 0.00 59.98 59.26 1a2v h ARG 599 Cb 0.58 -0.11 0.01 0.00 -0.42 0.00 0.00 29.97 30.04 1a2v h ARG 599 CO -0.40 0.31 -1.16 1.49 -1.51 0.00 0.00 179.97 178.70 1a2v h GLU 600 N 0.48 0.41 -0.09 0.20 4.81 -0.82 -2.47 114.58 117.10 1a2v h GLU 600 Ca 0.32 -0.56 -0.14 0.00 -0.13 0.00 0.00 59.36 58.85 1a2v h GLU 600 Cb 0.60 0.19 -0.01 0.00 0.63 0.00 0.00 28.75 30.16 1a2v h GLU 600 CO -0.10 1.23 -0.57 -1.49 -0.73 0.00 0.00 179.01 177.34 1a2v h TRP 601 N 0.17 0.36 -0.35 0.92 6.55 0.13 -2.94 115.95 120.79 1a2v h TRP 601 Ca -0.13 -0.13 -0.13 0.00 0.95 0.00 0.00 58.89 59.45 1a2v h TRP 601 Cb 1.84 -0.07 -0.01 0.00 -0.86 0.00 0.00 29.16 30.06 1a2v h TRP 601 CO 0.08 0.79 -0.28 0.82 -1.05 0.00 0.00 178.44 178.80 1a2v h ILE 602 N 0.22 1.29 0.00 1.49 2.04 -0.59 -3.44 117.51 118.52 1a2v h ILE 602 Ca -0.00 -1.44 0.00 0.00 1.00 0.00 0.00 64.86 64.42 1a2v h ILE 602 Cb 1.07 1.43 0.00 0.00 -0.74 0.00 0.00 36.82 38.58 1a2v h ILE 602 CO 0.09 0.47 0.00 0.61 0.00 0.00 0.00 178.15 179.33 1a2v n GLY 603 N 0.08 3.30 1.15 5.37 0.00 -0.93 -0.27 105.19 113.89 1a2v n GLY 603 Ca -0.03 -0.16 0.07 0.00 0.00 0.00 0.00 46.02 45.91 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 5.23 3.34 0.00 1.61 5.68 -1.26 -4.91 116.55 126.24 1a2v n ASP 604 Ca 0.00 -2.25 0.00 0.00 -0.50 0.00 0.00 54.79 52.04 1a2v n ASP 604 Cb 0.00 -0.45 0.00 0.00 -1.14 0.00 0.00 41.12 39.53 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 0.98 0.23 0.28 6.12 0.00 0.62 -4.89 105.19 108.54 1a2v n GLY 605 Ca 0.18 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.31 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 -0.54 1.41 -4.76 1.61 3.41 -1.26 -1.17 113.62 112.32 1a2v n SER 606 Ca 0.00 -1.13 -0.36 0.00 -0.26 0.00 0.00 58.87 57.12 1a2v n SER 606 Cb 0.27 0.47 0.01 0.00 -0.26 0.00 0.00 64.21 64.70 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 -2.64 3.34 0.24 4.33 2.02 -1.26 -4.69 118.70 120.03 1a2v s GLU 607 Ca 0.17 1.80 -0.30 0.00 0.02 0.00 0.00 54.97 56.67 1a2v s GLU 607 Cb 0.18 -2.13 -0.09 0.00 0.10 0.00 0.00 34.13 32.19 1a2v s GLU 607 CO 0.63 -0.91 1.18 1.21 0.02 0.00 0.00 175.26 177.39 1a2v s ASN 608 N -1.49 7.12 -0.04 -0.19 2.47 -1.26 -0.94 114.94 120.61 1a2v s ASN 608 Ca 0.71 2.30 0.06 0.00 0.42 0.00 0.00 52.86 56.35 1a2v s ASN 608 Cb -0.29 -2.62 0.09 0.00 -1.45 0.00 0.00 41.25 36.98 1a2v s ASN 608 CO 0.34 -0.31 1.05 2.30 -3.72 0.00 0.00 177.10 176.75 1a2v n ILE 609 N 1.85 0.53 -3.75 -5.21 -5.35 -0.91 -4.64 119.36 101.87 1a2v n ILE 609 Ca 0.02 -0.67 -0.36 0.00 -0.27 0.00 0.00 62.75 61.47 1a2v n ILE 609 Cb 0.44 0.30 -0.12 0.00 -1.74 0.00 0.00 39.64 38.52 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 -1.55 5.16 -1.03 7.28 2.15 -1.25 -4.45 116.67 122.98 1a2v s ASP 610 Ca 0.10 -0.20 -0.11 0.00 0.43 0.00 0.00 52.55 52.76 1a2v s ASP 610 Cb 0.09 -1.93 -0.03 0.00 -0.30 0.00 0.00 42.92 40.75 1a2v s ASP 610 CO 0.00 -0.03 0.82 -3.20 -0.17 0.00 0.00 175.17 172.59 1a2v n ASN 611 N 4.91 -6.15 -1.14 -0.34 5.15 -0.34 -4.99 115.26 112.36 1a2v n ASN 611 Ca -0.16 -0.77 -0.01 0.00 -0.60 0.00 0.00 54.58 53.04 1a2v n ASN 611 Cb 0.51 -4.22 0.00 0.00 -0.53 0.00 0.00 39.78 35.55 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 -3.41 0.00 -2.96 -0.44 5.66 -0.51 -4.67 114.28 107.96 1a2v n THR 612 Ca -0.08 -0.09 -0.42 0.00 -3.05 0.00 0.00 64.05 60.40 1a2v n THR 612 Cb 0.59 0.08 -0.05 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 -1.16 6.59 0.43 1.09 1.01 -1.26 -1.21 116.67 122.16 1a2v s ASP 613 Ca 0.02 0.47 0.06 0.00 0.71 0.00 0.00 52.55 53.80 1a2v s ASP 613 Cb -0.00 -2.40 -0.06 0.00 1.01 0.00 0.00 42.92 41.47 1a2v s ASP 613 CO 0.01 -0.68 0.06 0.27 0.21 0.00 0.00 175.17 175.04 1a2v s ILE 614 N 3.02 1.89 -0.05 0.77 -4.36 -1.26 -0.11 121.20 121.10 1a2v s ILE 614 Ca 0.31 -1.92 0.01 0.00 -0.26 0.00 0.00 60.65 58.79 1a2v s ILE 614 Cb -0.14 -2.82 0.02 0.00 1.25 0.00 0.00 42.46 40.78 1a2v s ILE 614 CO 0.15 0.00 -0.05 -0.76 0.24 0.00 0.00 174.94 174.52 1a2v s LEU 615 N -3.80 1.31 -0.28 0.37 1.43 0.11 -4.35 118.68 113.47 1a2v s LEU 615 Ca 0.31 -0.16 -0.03 0.00 -1.03 0.00 0.00 54.13 53.22 1a2v s LEU 615 Cb 0.07 -0.52 0.03 0.00 0.03 0.00 0.00 46.19 45.80 1a2v s LEU 615 CO 0.16 -0.06 -0.01 0.12 0.23 0.00 0.00 176.35 176.80 1a2v s PHE 616 N 1.00 3.16 -0.27 0.29 2.19 -0.34 -1.22 117.98 122.79 1a2v s PHE 616 Ca -0.10 -1.57 -0.08 0.00 0.33 0.00 0.00 56.93 55.52 1a2v s PHE 616 Cb -0.14 -2.12 -0.01 0.00 -1.31 0.00 0.00 43.02 39.44 1a2v s PHE 616 CO -0.00 -0.73 0.09 -0.06 1.83 0.00 0.00 175.22 176.34 1a2v s PHE 617 N 1.33 3.12 -0.19 10.12 0.40 0.19 -1.11 117.98 131.84 1a2v s PHE 617 Ca -0.02 -0.64 -0.05 0.00 -0.60 0.00 0.00 56.93 55.62 1a2v s PHE 617 Cb -0.18 -2.26 -0.03 0.00 0.51 0.00 0.00 43.02 41.06 1a2v s PHE 617 CO -0.02 -0.45 0.01 -1.58 0.70 0.00 0.00 175.22 173.88 1a2v s HIS 618 N 1.58 3.06 -0.24 0.36 2.46 0.37 -1.35 115.29 121.53 1a2v s HIS 618 Ca 0.05 -0.37 -0.11 0.00 0.47 0.00 0.00 55.06 55.10 1a2v s HIS 618 Cb -0.16 -2.07 -0.05 0.00 -0.13 0.00 0.00 32.58 30.17 1a2v s HIS 618 CO 0.04 -0.17 0.19 0.99 -2.47 0.00 0.00 174.74 173.32 1a2v s THR 619 N 0.87 5.33 0.20 0.89 2.01 0.08 -0.60 115.64 124.43 1a2v s THR 619 Ca 0.01 0.25 -0.06 0.00 0.31 0.00 0.00 61.69 62.19 1a2v s THR 619 Cb -0.14 -3.53 -0.02 0.00 0.01 0.00 0.00 72.50 68.81 1a2v s THR 619 CO 0.02 0.32 0.27 0.72 -0.69 0.00 0.00 174.62 175.26 1a2v s PHE 620 N 1.17 0.74 -5.00 4.92 -0.71 -0.88 -4.62 117.98 113.60 1a2v s PHE 620 Ca 0.09 -1.04 0.00 0.00 -1.04 0.00 0.00 56.93 54.94 1a2v s PHE 620 Cb -0.14 -0.22 0.00 0.00 -1.21 0.00 0.00 43.02 41.45 1a2v s PHE 620 CO 0.06 -0.76 0.00 0.41 -1.34 0.00 0.00 175.22 173.58 1a2v n GLY 621 N -0.29 -0.32 3.33 1.99 0.00 0.80 -0.52 105.19 110.18 1a2v n GLY 621 Ca -0.01 -0.96 -0.10 0.00 0.00 0.00 0.00 46.02 44.95 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 -3.77 0.06 -0.23 -0.61 -4.36 -0.57 -4.39 121.20 107.33 1a2v s ILE 622 Ca 0.00 -1.44 -0.02 0.00 -0.26 0.00 0.00 60.65 58.94 1a2v s ILE 622 Cb 0.00 -1.88 0.02 0.00 1.25 0.00 0.00 42.46 41.85 1a2v s ILE 622 CO 0.00 -0.29 -0.08 -0.89 0.24 0.00 0.00 174.94 173.91 1a2v s THR 623 N -3.98 2.82 -0.35 8.37 2.01 -1.26 -1.06 115.64 122.18 1a2v s THR 623 Ca 0.18 -0.91 -0.15 0.00 0.31 0.00 0.00 61.69 61.13 1a2v s THR 623 Cb 0.04 -2.36 -0.01 0.00 0.01 0.00 0.00 72.50 70.17 1a2v s THR 623 CO 0.01 0.31 0.34 -2.28 -0.69 0.00 0.00 174.62 172.30 1a2v s HIS 624 N 1.35 3.21 -0.52 4.92 2.46 0.22 -4.99 115.29 121.94 1a2v s HIS 624 Ca 0.02 -0.12 -0.04 0.00 0.47 0.00 0.00 55.06 55.39 1a2v s HIS 624 Cb -0.15 -2.64 0.14 0.00 -0.13 0.00 0.00 32.58 29.80 1a2v s HIS 624 CO -0.06 -0.44 0.34 -0.06 -2.47 0.00 0.00 174.74 172.05 1a2v s PHE 625 N 1.94 3.50 0.29 3.88 0.08 -1.26 -1.89 117.98 124.52 1a2v s PHE 625 Ca 0.10 -2.47 -0.27 0.00 0.12 0.00 0.00 56.93 54.41 1a2v s PHE 625 Cb -0.17 -3.27 -0.14 0.00 -0.57 0.00 0.00 43.02 38.87 1a2v s PHE 625 CO 0.11 -0.92 0.90 -2.30 -0.10 0.00 0.00 175.22 172.91 1a2v n PRO 626 N 4.14 1.08 -4.18 0.24 -0.02 -1.26 -5.04 135.00 129.96 1a2v n PRO 626 Ca 0.02 0.38 -0.16 0.00 -2.02 0.00 0.00 63.50 61.72 1a2v n PRO 626 Cb 0.40 -1.70 -0.11 0.00 -0.02 0.00 0.00 33.50 32.07 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 -1.09 1.18 0.56 3.55 0.00 -1.26 -4.66 121.76 120.04 1a2v s ALA 627 Ca 0.60 -1.15 0.29 0.00 0.00 0.00 0.00 51.96 51.70 1a2v s ALA 627 Cb -0.72 -0.02 1.46 0.00 0.00 0.00 0.00 23.12 23.84 1a2v s ALA 627 CO 0.59 0.04 1.90 -1.35 0.00 0.00 0.00 175.76 176.93 1a2v h PRO 628 N 3.75 0.00 -0.06 0.00 0.11 -1.88 0.12 132.00 134.04 1a2v h PRO 628 Ca -0.38 0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.74 1a2v h PRO 628 Cb 1.19 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 1a2v h PRO 628 CO 0.49 0.00 0.12 0.93 -0.21 0.00 0.00 178.00 179.33 1a2v h GLU 629 N 0.00 0.00 -0.00 1.05 3.07 -1.96 0.06 114.58 116.80 1a2v h GLU 629 Ca 0.31 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.17 1a2v h GLU 629 Cb 1.40 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.31 1a2v h GLU 629 CO -0.00 0.00 -0.07 -0.25 -1.40 0.00 0.00 179.01 177.28 1a2v n ASP 630 N -3.47 0.19 -4.53 1.42 8.00 0.42 -4.54 116.55 114.03 1a2v n ASP 630 Ca -0.01 -0.16 -0.29 0.00 0.71 0.00 0.00 54.79 55.04 1a2v n ASP 630 Cb 0.20 -0.22 -0.10 0.00 -0.02 0.00 0.00 41.12 40.98 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 -2.66 2.62 -0.94 1.24 5.36 0.01 -2.37 117.98 121.25 1a2v s PHE 631 Ca 0.24 -0.22 0.28 0.00 -0.96 0.00 0.00 56.93 56.27 1a2v s PHE 631 Cb 0.20 -1.36 1.01 0.00 -0.34 0.00 0.00 43.02 42.53 1a2v s PHE 631 CO 0.50 0.43 1.80 -0.35 -1.46 0.00 0.00 175.22 176.13 1a2v n PRO 632 N 0.62 0.06 -4.33 10.12 -0.04 -1.26 -4.90 135.00 135.27 1a2v n PRO 632 Ca -0.14 0.04 -0.21 0.00 -0.04 0.00 0.00 63.50 63.15 1a2v n PRO 632 Cb 0.53 -1.56 -0.16 0.00 -0.04 0.00 0.00 33.50 32.27 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 -3.33 1.55 -0.11 1.53 0.20 -1.25 -4.71 118.68 112.56 1a2v s LEU 633 Ca 0.13 -0.18 -0.10 0.00 0.69 0.00 0.00 54.13 54.67 1a2v s LEU 633 Cb 0.17 -0.56 -0.05 0.00 -0.43 0.00 0.00 46.19 45.33 1a2v s LEU 633 CO 0.58 0.00 0.20 0.00 -0.29 0.00 0.00 176.35 176.84 1a2v s MET 634 N 0.62 3.71 0.42 1.98 0.23 -0.23 -4.77 119.30 121.26 1a2v s MET 634 Ca -0.10 -0.02 -0.25 0.00 -1.03 0.00 0.00 55.69 54.29 1a2v s MET 634 Cb -0.13 -3.25 -0.08 0.00 -1.53 0.00 0.00 34.83 29.84 1a2v s MET 634 CO 0.01 0.65 1.29 -2.14 -2.03 0.00 0.00 175.02 172.79 1a2v s PRO 635 N -0.71 3.87 0.22 3.16 0.02 -1.26 -3.88 135.00 136.42 1a2v s PRO 635 Ca 0.16 2.10 -0.31 0.00 0.02 0.00 0.00 61.00 62.97 1a2v s PRO 635 Cb -0.13 -2.66 -0.14 0.00 0.02 0.00 0.00 34.50 31.58 1a2v s PRO 635 CO 0.05 -0.56 1.23 0.00 -0.33 0.00 0.00 177.00 177.39 1a2v n ALA 636 N -0.06 0.05 -3.44 -1.55 0.00 -1.26 -4.80 120.51 109.46 1a2v n ALA 636 Ca 0.05 0.43 -0.34 0.00 0.00 0.00 0.00 53.44 53.58 1a2v n ALA 636 Cb 0.44 -2.12 -0.15 0.00 0.00 0.00 0.00 19.45 17.63 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 -0.65 3.30 0.18 0.00 2.12 -0.06 -4.89 118.70 118.71 1a2v s GLU 637 Ca 0.68 -0.69 -0.18 0.00 0.36 0.00 0.00 54.97 55.14 1a2v s GLU 637 Cb -0.74 -2.76 -0.08 0.00 0.26 0.00 0.00 34.13 30.81 1a2v s GLU 637 CO 0.53 -0.03 0.65 -1.25 -0.54 0.00 0.00 175.26 174.62 1a2v s PRO 638 N 0.97 4.16 -0.00 4.30 0.04 -1.26 -0.60 135.00 142.60 1a2v s PRO 638 Ca -0.02 0.73 0.01 0.00 0.04 0.00 0.00 61.00 61.76 1a2v s PRO 638 Cb -0.15 -2.94 -0.00 0.00 0.04 0.00 0.00 34.50 31.45 1a2v s PRO 638 CO -0.01 0.45 -0.02 0.42 0.04 0.00 0.00 177.00 177.87 1a2v s ILE 639 N -1.46 0.20 0.14 0.56 1.01 -0.08 -4.99 121.20 116.59 1a2v s ILE 639 Ca 0.40 -0.10 -0.13 0.00 0.00 0.00 0.00 60.65 60.81 1a2v s ILE 639 Cb -0.16 -0.18 0.02 0.00 0.01 0.00 0.00 42.46 42.15 1a2v s ILE 639 CO 0.20 0.06 0.36 0.28 0.00 0.00 0.00 174.94 175.84 1a2v s THR 640 N -0.04 0.07 -0.03 2.92 -1.32 -1.26 -0.25 115.64 115.74 1a2v s THR 640 Ca 0.01 -0.93 -0.30 0.00 -1.21 0.00 0.00 61.69 59.26 1a2v s THR 640 Cb -0.01 -1.44 0.07 0.00 -1.51 0.00 0.00 72.50 69.61 1a2v s THR 640 CO -0.00 -0.34 0.70 -1.48 -2.21 0.00 0.00 174.62 171.28 1a2v s LEU 641 N -2.87 -0.62 0.03 9.08 2.34 -1.06 -4.60 118.68 120.98 1a2v s LEU 641 Ca 0.08 0.60 -0.01 0.00 0.06 0.00 0.00 54.13 54.86 1a2v s LEU 641 Cb 0.02 2.49 -0.02 0.00 -0.56 0.00 0.00 46.19 48.12 1a2v s LEU 641 CO -0.07 -0.64 -0.01 -0.32 -1.06 0.00 0.00 176.35 174.25 1a2v s MET 642 N -1.52 0.44 -0.39 1.48 1.75 -0.80 -1.30 119.30 118.96 1a2v s MET 642 Ca -0.09 -0.81 0.02 0.00 -1.25 0.00 0.00 55.69 53.56 1a2v s MET 642 Cb -0.00 0.16 0.12 0.00 2.84 0.00 0.00 34.83 37.94 1a2v s MET 642 CO 0.06 -0.08 0.16 -0.51 -0.65 0.00 0.00 175.02 174.00 1a2v s LEU 643 N -1.99 3.25 0.01 4.11 1.43 -0.00 0.28 118.68 125.77 1a2v s LEU 643 Ca -0.08 -2.28 -0.11 0.00 -1.03 0.00 0.00 54.13 50.63 1a2v s LEU 643 Cb -0.03 -1.20 -0.05 0.00 0.03 0.00 0.00 46.19 44.93 1a2v s LEU 643 CO -0.04 -0.33 0.36 -0.13 0.23 0.00 0.00 176.35 176.43 1a2v s ARG 644 N 0.76 3.77 0.01 1.70 0.52 -0.51 -2.18 118.95 123.02 1a2v s ARG 644 Ca 0.14 0.21 -0.30 0.00 -0.52 0.00 0.00 55.73 55.25 1a2v s ARG 644 Cb -0.21 -3.12 -0.05 0.00 0.52 0.00 0.00 34.95 32.08 1a2v s ARG 644 CO -0.09 0.65 1.23 -1.25 0.02 0.00 0.00 175.30 175.87 1a2v s PRO 645 N -1.43 4.38 -0.12 3.54 0.04 -1.26 0.24 135.00 140.38 1a2v s PRO 645 Ca 0.26 1.77 -0.02 0.00 0.04 0.00 0.00 61.00 63.06 1a2v s PRO 645 Cb -0.15 -3.45 0.04 0.00 0.04 0.00 0.00 34.50 30.98 1a2v s PRO 645 CO 0.14 -0.37 0.00 1.03 0.04 0.00 0.00 177.00 177.84 1a2v s ARG 646 N 1.64 0.74 -0.06 4.56 1.81 -0.36 -4.69 118.95 122.59 1a2v s ARG 646 Ca 0.59 -0.14 0.00 0.00 -1.72 0.00 0.00 55.73 54.46 1a2v s ARG 646 Cb -0.28 -1.47 0.00 0.00 -0.45 0.00 0.00 34.95 32.75 1a2v s ARG 646 CO 0.26 -0.42 0.00 0.72 -0.68 0.00 0.00 175.30 175.18 1a2v n HIS 647 N 5.08 0.00 0.03 -0.53 8.25 -1.26 -2.71 115.22 124.08 1a2v n HIS 647 Ca -0.08 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.19 1a2v n HIS 647 Cb 0.49 -0.71 -0.14 0.00 1.12 0.00 0.00 29.99 30.75 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 0.46 -1.99 4.41 3.57 -1.84 -3.34 116.94 118.20 1a2v h PHE 648 Ca -0.01 -0.33 -0.49 0.00 3.53 0.00 0.00 57.97 60.67 1a2v h PHE 648 Cb 0.33 -0.02 -0.03 0.00 2.79 0.00 0.00 35.95 39.01 1a2v h PHE 648 CO 0.20 1.25 -0.46 -0.06 -2.23 0.00 0.00 178.31 177.01 1a2v s PHE 649 N -2.43 3.05 -2.35 0.41 0.08 -1.26 -4.93 117.98 110.55 1a2v s PHE 649 Ca -0.14 -0.20 0.25 0.00 0.12 0.00 0.00 56.93 56.96 1a2v s PHE 649 Cb 0.00 -1.66 0.52 0.00 -0.57 0.00 0.00 43.02 41.31 1a2v s PHE 649 CO 0.81 0.30 1.43 0.25 -0.10 0.00 0.00 175.22 177.91 1a2v n THR 650 N -1.34 0.00 -3.62 0.64 -2.24 -1.26 -4.97 114.28 101.49 1a2v n THR 650 Ca -0.04 -0.29 -0.04 0.00 -2.27 0.00 0.00 64.05 61.41 1a2v n THR 650 Cb 0.59 0.90 -0.01 0.00 -2.10 0.00 0.00 70.33 69.70 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 -2.23 0.77 -0.19 -0.78 -1.05 -1.26 -5.00 118.70 108.96 1a2v s GLU 651 Ca 0.28 -0.36 -0.39 0.00 -0.15 0.00 0.00 54.97 54.34 1a2v s GLU 651 Cb 0.20 0.30 -0.16 0.00 -0.44 0.00 0.00 34.13 34.03 1a2v s GLU 651 CO 0.42 -0.34 1.66 -1.71 0.95 0.00 0.00 175.26 176.24 1a2v n ASN 652 N -0.34 2.28 0.09 0.83 2.85 -1.26 -4.86 115.26 114.85 1a2v n ASN 652 Ca -0.06 1.08 0.12 0.00 -0.11 0.00 0.00 54.58 55.61 1a2v n ASN 652 Cb 0.61 -1.16 0.46 0.00 1.24 0.00 0.00 39.78 40.92 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 4.80 0.18 -0.84 1.20 -0.04 -1.26 -3.67 135.00 135.37 1a2v n PRO 653 Ca 0.25 0.24 0.03 0.00 -0.04 0.00 0.00 63.50 63.98 1a2v n PRO 653 Cb 0.15 -1.75 0.34 0.00 -0.04 0.00 0.00 33.50 32.20 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 0.88 3.49 0.15 0.55 0.00 -1.26 -4.50 105.19 104.49 1a2v n GLY 654 Ca 0.05 -0.99 0.13 0.00 0.00 0.00 0.00 46.02 45.21 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 3.05 0.00 -2.24 0.99 3.38 -1.93 -2.74 115.31 115.82 1a2v h LEU 655 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1a2v h LEU 655 Cb 1.97 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.72 1a2v h LEU 655 CO 0.51 0.00 0.00 -0.90 0.09 0.00 0.00 178.44 178.14 1a2v n ASP 656 N -2.45 3.30 -4.75 -0.43 5.75 -1.26 -4.86 116.55 111.85 1a2v n ASP 656 Ca 0.03 -2.08 -0.40 0.00 -0.01 0.00 0.00 54.79 52.33 1a2v n ASP 656 Cb 0.33 -0.42 -0.05 0.00 -1.03 0.00 0.00 41.12 39.95 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 -1.35 4.47 0.11 2.12 1.01 -1.04 -4.97 121.20 121.55 1a2v s ILE 657 Ca 0.39 1.82 -0.31 0.00 0.00 0.00 0.00 60.65 62.56 1a2v s ILE 657 Cb 0.22 -4.20 -0.10 0.00 0.01 0.00 0.00 42.46 38.38 1a2v s ILE 657 CO 0.25 0.42 1.79 -1.10 0.00 0.00 0.00 174.94 176.31 1a2v s GLN 658 N -0.55 4.15 0.67 2.79 -1.52 -1.26 -4.95 119.66 118.99 1a2v s GLN 658 Ca 0.40 2.54 -0.15 0.00 -1.95 0.00 0.00 55.36 56.19 1a2v s GLN 658 Cb -0.23 -3.61 0.01 0.00 -0.22 0.00 0.00 33.01 28.96 1a2v s GLN 658 CO 0.27 -0.82 1.13 -1.25 -0.25 0.00 0.00 175.29 174.37 1a2v s PRO 659 N 2.76 2.68 0.13 2.91 0.05 -1.26 -4.80 135.00 137.47 1a2v s PRO 659 Ca 0.80 1.48 -0.10 0.00 0.05 0.00 0.00 61.00 63.23 1a2v s PRO 659 Cb -0.45 -1.93 -0.07 0.00 0.05 0.00 0.00 34.50 32.11 1a2v s PRO 659 CO 0.36 -1.36 1.39 0.77 0.05 0.00 0.00 177.00 178.21 1a2v h SER 660 N 0.02 0.88 -5.07 6.66 0.02 0.69 -3.46 113.55 113.30 1a2v h SER 660 Ca -0.47 -0.51 -0.11 0.00 -0.84 0.00 0.00 61.79 59.85 1a2v h SER 660 Cb 1.26 -0.26 -0.17 0.00 0.14 0.00 0.00 62.40 63.37 1a2v h SER 660 CO 0.53 1.30 -0.42 -0.47 -1.14 0.00 0.00 176.83 176.63 1a2v s TYR 661 N -3.96 0.09 -0.30 3.45 5.04 -0.94 -4.99 117.35 115.74 1a2v s TYR 661 Ca -0.10 -0.32 -0.13 0.00 -2.44 0.00 0.00 57.07 54.08 1a2v s TYR 661 Cb 0.10 -0.05 0.17 0.00 0.35 0.00 0.00 41.96 42.52 1a2v s TYR 661 CO 0.89 -0.41 0.96 0.00 -1.34 0.00 0.00 175.55 175.64 1a2v s ALA 662 N -2.55 -2.82 -0.11 3.97 0.00 -1.25 -1.27 121.76 117.73 1a2v s ALA 662 Ca -0.05 1.89 0.00 0.00 0.00 0.00 0.00 51.96 53.80 1a2v s ALA 662 Cb -0.01 -2.16 0.02 0.00 0.00 0.00 0.00 23.12 20.97 1a2v s ALA 662 CO -0.04 -1.11 -0.10 1.41 0.00 0.00 0.00 175.76 175.93 1a2v s MET 663 N 2.62 1.68 0.66 0.00 0.00 0.96 -4.98 119.30 120.23 1a2v s MET 663 Ca -0.00 -0.34 -0.11 0.00 0.00 0.00 0.00 55.69 55.24 1a2v s MET 663 Cb -0.08 -1.61 -0.02 0.00 0.00 0.00 0.00 34.83 33.12 1a2v s MET 663 CO -0.16 -0.19 1.05 -0.08 0.00 0.00 0.00 175.02 175.64 1a2v s THR 664 N 1.41 4.25 0.12 10.11 -1.32 -1.26 -1.66 115.64 127.29 1a2v s THR 664 Ca -0.00 0.73 -0.17 0.00 -1.21 0.00 0.00 61.69 61.04 1a2v s THR 664 Cb -0.13 -3.69 -0.02 0.00 -1.51 0.00 0.00 72.50 67.14 1a2v s THR 664 CO -0.06 -0.95 1.67 0.74 -2.21 0.00 0.00 174.62 173.81 1a2v h THR 665 N -0.47 1.19 -0.49 5.08 2.02 -1.95 0.32 112.91 118.61 1a2v h THR 665 Ca -0.44 -0.57 -0.00 0.00 0.77 0.00 0.00 66.41 66.17 1a2v h THR 665 Cb 1.21 0.91 -0.02 0.00 -1.74 0.00 0.00 68.15 68.51 1a2v h THR 665 CO 0.62 0.20 0.29 0.77 0.37 0.00 0.00 175.52 177.78 1a2v h SER 666 N 0.42 0.59 -0.81 4.18 4.64 -2.00 -2.28 113.55 118.28 1a2v h SER 666 Ca 0.12 -0.06 -0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1a2v h SER 666 Cb 0.18 -0.15 -0.04 0.00 -0.31 0.00 0.00 62.40 62.08 1a2v h SER 666 CO -0.01 0.47 0.49 -0.33 -0.87 0.00 0.00 176.83 176.58 1a2v h GLU 667 N 0.65 1.10 0.00 4.77 5.08 -1.87 -0.80 114.58 123.52 1a2v h GLU 667 Ca 0.17 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 58.42 1a2v h GLU 667 Cb -0.01 -0.23 -0.00 0.00 0.50 0.00 0.00 28.75 29.01 1a2v h GLU 667 CO -0.03 0.78 -0.05 0.00 -1.00 0.00 0.00 179.01 178.70 1a2v h ALA 668 N 1.26 1.59 -0.02 3.43 0.00 -0.40 -1.15 119.26 123.97 1a2v h ALA 668 Ca 0.29 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 55.09 1a2v h ALA 668 Cb -0.04 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1a2v h ALA 668 CO -0.05 0.06 -0.24 0.87 0.00 0.00 0.00 179.25 179.89 1a2v h LYS 669 N 0.00 0.20 -0.59 0.00 1.57 -0.68 -3.22 116.57 113.84 1a2v h LYS 669 Ca -0.00 -0.19 0.09 0.00 -1.87 0.00 0.00 60.65 58.68 1a2v h LYS 669 Cb 0.11 0.05 -0.07 0.00 0.08 0.00 0.00 32.23 32.40 1a2v h LYS 669 CO 0.01 0.89 0.23 0.00 -0.57 0.00 0.00 179.45 180.00 1a2v h ARG 670 N -0.43 0.41 0.00 3.15 3.08 -0.29 0.68 114.38 120.99 1a2v h ARG 670 Ca -0.02 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.00 1a2v h ARG 670 Cb 0.96 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.91 1a2v h ARG 670 CO 0.05 0.27 0.02 0.00 -1.07 0.00 0.00 179.97 179.24 1a2v n ALA 671 N -2.45 1.10 -0.84 0.04 0.00 -0.53 -5.11 120.51 112.72 1a2v n ALA 671 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.52 1a2v n ALA 671 Cb 0.25 -0.95 0.00 0.00 0.00 0.00 0.00 19.45 18.75 1a2v n ALA 671 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78