#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gof n SER 2 N 0.00 0.00 -3.51 0.00 2.88 -1.26 -3.64 113.62 108.08 1gof n SER 2 Ca 0.00 -0.49 -0.10 0.00 -1.33 0.00 0.00 58.87 56.95 1gof n SER 2 Cb 0.00 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.43 1gof n SER 2 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1gof s ALA 3 N -1.90 -1.83 0.40 -1.46 0.00 -1.25 -4.77 121.76 110.96 1gof s ALA 3 Ca 0.00 1.13 -0.00 0.00 0.00 0.00 0.00 51.96 53.08 1gof s ALA 3 Cb 0.00 0.18 -0.02 0.00 0.00 0.00 0.00 23.12 23.28 1gof s ALA 3 CO 0.00 -0.59 0.63 -1.25 0.00 0.00 0.00 175.76 174.54 1gof s PRO 4 N -2.60 3.32 0.03 0.00 0.04 -1.26 -4.99 135.00 129.53 1gof s PRO 4 Ca 0.02 -0.34 0.25 0.00 0.04 0.00 0.00 61.00 60.97 1gof s PRO 4 Cb -0.01 -2.59 0.45 0.00 0.04 0.00 0.00 34.50 32.39 1gof s PRO 4 CO -0.06 -0.06 1.37 0.44 0.04 0.00 0.00 177.00 178.73 1gof n ILE 5 N -1.96 0.08 -4.23 0.56 -5.35 -1.26 -4.96 119.36 102.25 1gof n ILE 5 Ca -0.02 -0.07 -0.10 0.00 -0.27 0.00 0.00 62.75 62.29 1gof n ILE 5 Cb 0.57 0.17 -0.02 0.00 -1.74 0.00 0.00 39.64 38.61 1gof n ILE 5 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1gof n GLY 6 N 1.46 4.00 3.66 3.28 0.00 -1.26 -4.93 105.19 111.40 1gof n GLY 6 Ca 0.05 -2.24 -0.34 0.00 0.00 0.00 0.00 46.02 43.49 1gof n GLY 6 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1gof s SER 7 N -1.85 5.07 0.31 1.61 1.04 -0.23 -4.72 113.70 114.92 1gof s SER 7 Ca 0.00 0.04 -0.29 0.00 0.48 0.00 0.00 55.95 56.18 1gof s SER 7 Cb 0.00 -1.35 -0.13 0.00 0.10 0.00 0.00 66.02 64.65 1gof s SER 7 CO 0.00 0.33 1.35 0.00 0.98 0.00 0.00 173.24 175.90 1gof n ALA 8 N 1.78 1.34 -2.42 5.32 0.00 -1.26 -0.59 120.51 124.69 1gof n ALA 8 Ca -0.16 0.38 -0.38 0.00 0.00 0.00 0.00 53.44 53.27 1gof n ALA 8 Cb 0.53 -2.28 -0.06 0.00 0.00 0.00 0.00 19.45 17.64 1gof n ALA 8 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1gof s ILE 9 N -0.73 4.92 0.07 0.00 1.01 0.56 -4.82 121.20 122.21 1gof s ILE 9 Ca 0.59 0.97 -0.31 0.00 0.00 0.00 0.00 60.65 61.91 1gof s ILE 9 Cb -0.58 -3.78 -0.08 0.00 0.01 0.00 0.00 42.46 38.02 1gof s ILE 9 CO 0.58 0.57 1.63 -0.94 0.00 0.00 0.00 174.94 176.77 1gof s SER 10 N -1.10 6.62 0.00 3.58 1.04 -1.26 -4.70 113.70 117.88 1gof s SER 10 Ca 0.26 2.47 0.29 0.00 0.48 0.00 0.00 55.95 59.45 1gof s SER 10 Cb -0.18 -2.56 1.21 0.00 0.10 0.00 0.00 66.02 64.59 1gof s SER 10 CO 0.16 -0.87 1.84 0.54 0.98 0.00 0.00 173.24 175.88 1gof n ARG 11 N 5.46 1.52 0.01 4.02 1.74 -1.26 -4.52 116.66 123.63 1gof n ARG 11 Ca 0.16 -0.77 -0.05 0.00 -0.77 0.00 0.00 57.85 56.41 1gof n ARG 11 Cb 0.41 -1.48 -0.03 0.00 -1.02 0.00 0.00 32.46 30.33 1gof n ARG 11 CO 0.00 0.00 0.00 -0.91 -1.52 0.00 0.00 177.63 175.20 1gof h ASN 12 N 1.87 -0.59 0.14 0.55 -0.26 -1.96 -2.98 115.58 112.35 1gof h ASN 12 Ca 0.00 0.07 0.00 0.00 -0.56 0.00 0.00 56.30 55.81 1gof h ASN 12 Cb 0.40 0.23 0.00 0.00 -1.06 0.00 0.00 38.32 37.89 1gof h ASN 12 CO 0.00 -0.18 0.00 0.59 -1.06 0.00 0.00 177.43 176.78 1gof n ASN 13 N -3.54 0.00 -4.78 5.81 4.13 -1.26 -4.91 115.26 110.71 1gof n ASN 13 Ca -0.02 -0.23 -0.33 0.00 1.68 0.00 0.00 54.58 55.68 1gof n ASN 13 Cb 0.13 -0.14 0.04 0.00 -1.54 0.00 0.00 39.78 38.27 1gof n ASN 13 CO 0.00 0.00 0.00 0.26 0.28 0.00 0.00 177.26 177.80 1gof s TRP 14 N -2.28 2.68 -0.16 3.10 0.52 -1.13 -4.66 118.94 117.01 1gof s TRP 14 Ca 0.20 1.54 -0.01 0.00 0.02 0.00 0.00 56.10 57.85 1gof s TRP 14 Cb 0.11 -3.16 0.04 0.00 -1.15 0.00 0.00 33.47 29.31 1gof s TRP 14 CO 0.21 -1.60 -0.04 0.00 0.02 0.00 0.00 176.95 175.55 1gof s ALA 15 N -2.29 1.36 -0.00 0.98 0.00 -0.76 -4.98 121.76 116.07 1gof s ALA 15 Ca 0.67 -0.75 0.06 0.00 0.00 0.00 0.00 51.96 51.95 1gof s ALA 15 Cb -0.20 -1.09 -0.03 0.00 0.00 0.00 0.00 23.12 21.80 1gof s ALA 15 CO 0.39 -0.78 -0.19 0.14 0.00 0.00 0.00 175.76 175.32 1gof s VAL 16 N 1.69 2.67 0.01 0.00 -7.23 -1.26 -0.50 120.40 115.77 1gof s VAL 16 Ca 0.01 -1.02 0.08 0.00 -1.81 0.00 0.00 61.98 59.24 1gof s VAL 16 Cb -0.15 -2.05 -0.02 0.00 0.56 0.00 0.00 36.38 34.72 1gof s VAL 16 CO -0.08 0.48 -0.24 -0.89 -0.31 0.00 0.00 175.10 174.06 1gof s THR 17 N -0.78 1.93 0.14 5.32 2.01 -0.30 -4.85 115.64 119.11 1gof s THR 17 Ca 0.12 -1.14 0.05 0.00 0.31 0.00 0.00 61.69 61.03 1gof s THR 17 Cb -0.10 -1.63 -0.04 0.00 0.01 0.00 0.00 72.50 70.74 1gof s THR 17 CO 0.02 0.45 -0.11 0.00 -0.69 0.00 0.00 174.62 174.29 1gof h ASP 19 N 3.08 0.94 -5.27 0.00 2.03 -1.86 -3.46 116.42 111.88 1gof h ASP 19 Ca -0.38 -0.63 -0.13 0.00 -0.73 0.00 0.00 57.03 55.17 1gof h ASP 19 Cb 1.19 -0.28 -0.15 0.00 -0.83 0.00 0.00 39.33 39.27 1gof h ASP 19 CO 0.58 1.42 -0.59 -0.44 -1.03 0.00 0.00 179.24 179.19 1gof s SER 20 N -7.10 0.35 -0.30 4.15 0.01 -1.26 -5.07 113.70 104.48 1gof s SER 20 Ca -0.10 -0.97 -0.14 0.00 1.31 0.00 0.00 55.95 56.04 1gof s SER 20 Cb 0.08 0.26 0.15 0.00 0.21 0.00 0.00 66.02 66.72 1gof s SER 20 CO 0.90 -0.67 0.88 0.00 0.41 0.00 0.00 173.24 174.77 1gof s ALA 21 N -3.94 -2.41 0.16 1.44 0.00 -1.25 -4.52 121.76 111.23 1gof s ALA 21 Ca 0.11 2.18 -0.26 0.00 0.00 0.00 0.00 51.96 53.99 1gof s ALA 21 Cb 0.07 -1.88 -0.08 0.00 0.00 0.00 0.00 23.12 21.23 1gof s ALA 21 CO -0.07 -0.80 0.80 -0.65 0.00 0.00 0.00 175.76 175.04 1gof s GLN 22 N 2.30 4.60 0.26 0.00 -0.21 -0.43 -4.78 119.66 121.41 1gof s GLN 22 Ca -0.05 1.20 -0.30 0.00 0.02 0.00 0.00 55.36 56.23 1gof s GLN 22 Cb -0.07 -3.28 -0.13 0.00 1.00 0.00 0.00 33.01 30.53 1gof s GLN 22 CO -0.18 0.51 1.34 -1.13 -2.12 0.00 0.00 175.29 173.72 1gof n SER 23 N 1.79 2.58 0.00 5.90 3.41 -1.26 0.18 113.62 126.22 1gof n SER 23 Ca -0.04 1.16 0.00 0.00 -0.26 0.00 0.00 58.87 59.72 1gof n SER 23 Cb 0.49 -1.42 0.00 0.00 -0.26 0.00 0.00 64.21 63.02 1gof n SER 23 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1gof n GLY 24 N 1.78 3.35 2.48 5.00 0.00 -1.26 -4.83 105.19 111.72 1gof n GLY 24 Ca 0.10 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.96 1gof n GLY 24 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1gof n ASN 25 N 0.02 3.35 -4.73 1.61 5.03 0.47 -4.81 115.26 116.20 1gof n ASN 25 Ca 0.00 -3.15 -0.36 0.00 0.87 0.00 0.00 54.58 51.94 1gof n ASN 25 Cb 0.00 -0.45 0.07 0.00 -1.02 0.00 0.00 39.78 38.38 1gof n ASN 25 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 1gof s GLU 26 N -3.50 2.43 0.26 3.52 8.01 -1.18 -1.92 118.70 126.31 1gof s GLU 26 Ca 0.39 1.95 -0.10 0.00 0.01 0.00 0.00 54.97 57.22 1gof s GLU 26 Cb 0.40 -1.85 0.38 0.00 -4.31 0.00 0.00 34.13 28.76 1gof s GLU 26 CO -0.05 -1.66 1.57 0.00 0.01 0.00 0.00 175.26 175.14 1gof n ASN 28 N -5.57 0.00 0.21 0.00 0.23 -1.26 -2.24 115.26 106.64 1gof n ASN 28 Ca 0.13 0.32 0.06 0.00 -0.53 0.00 0.00 54.58 54.57 1gof n ASN 28 Cb 0.45 -0.40 0.48 0.00 -2.08 0.00 0.00 39.78 38.23 1gof n ASN 28 CO 0.00 0.00 0.00 0.11 -0.93 0.00 0.00 177.26 176.44 1gof h LYS 29 N 0.00 0.00 0.00 -3.83 1.79 -0.87 -1.34 116.57 112.32 1gof h LYS 29 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1gof h LYS 29 Cb 0.17 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.82 1gof h LYS 29 CO 0.00 0.27 0.00 0.00 -1.08 0.00 0.00 179.45 178.64 1gof h ALA 30 N 1.73 1.00 -0.28 3.86 0.00 -1.58 -3.08 119.26 120.91 1gof h ALA 30 Ca -0.00 0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.69 1gof h ALA 30 Cb 0.53 0.00 -0.22 0.00 0.00 0.00 0.00 17.79 18.11 1gof h ALA 30 CO 0.03 0.00 -0.72 0.44 0.00 0.00 0.00 179.25 179.01 1gof n ILE 31 N -2.76 1.98 0.05 0.00 -5.35 -0.52 -1.34 119.36 111.41 1gof n ILE 31 Ca 0.01 -3.27 0.05 0.00 -0.27 0.00 0.00 62.75 59.26 1gof n ILE 31 Cb 0.24 -0.26 -0.06 0.00 -1.74 0.00 0.00 39.64 37.82 1gof n ILE 31 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 1gof n ASP 32 N -0.75 0.76 0.00 7.28 5.75 -1.12 -4.96 116.55 123.51 1gof n ASP 32 Ca 0.25 0.32 0.00 0.00 -0.01 0.00 0.00 54.79 55.35 1gof n ASP 32 Cb 0.84 0.43 0.00 0.00 -1.03 0.00 0.00 41.12 41.36 1gof n ASP 32 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1gof n GLY 33 N 1.32 0.55 3.29 6.12 0.00 -1.26 -5.04 105.19 110.17 1gof n GLY 33 Ca -0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.61 1gof n GLY 33 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1gof s ASN 34 N -2.75 4.21 0.00 1.61 2.47 -1.26 -4.95 114.94 114.27 1gof s ASN 34 Ca 0.00 -0.43 0.19 0.00 0.42 0.00 0.00 52.86 53.04 1gof s ASN 34 Cb 0.00 -1.72 0.97 0.00 -1.45 0.00 0.00 41.25 39.06 1gof s ASN 34 CO 0.00 -0.02 1.61 2.29 -3.72 0.00 0.00 177.10 177.25 1gof n LYS 35 N 4.78 0.26 0.07 0.43 2.85 -1.26 -2.73 118.16 122.55 1gof n LYS 35 Ca -0.18 0.11 0.09 0.00 -1.05 0.00 0.00 58.31 57.27 1gof n LYS 35 Cb 0.51 -1.50 -0.05 0.00 -0.65 0.00 0.00 35.03 33.34 1gof n LYS 35 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1gof n ASP 36 N -1.30 0.69 -4.64 -5.58 8.00 -1.26 -4.32 116.55 108.14 1gof n ASP 36 Ca 0.09 0.28 -0.34 0.00 0.71 0.00 0.00 54.79 55.52 1gof n ASP 36 Cb 0.16 0.66 -0.10 0.00 -0.02 0.00 0.00 41.12 41.82 1gof n ASP 36 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1gof s THR 37 N -3.29 4.07 -0.03 -3.53 -4.23 -1.11 -4.93 115.64 102.60 1gof s THR 37 Ca -0.02 -0.34 -0.09 0.00 -1.18 0.00 0.00 61.69 60.05 1gof s THR 37 Cb 0.10 -2.70 0.01 0.00 1.34 0.00 0.00 72.50 71.26 1gof s THR 37 CO 0.81 0.60 0.21 0.72 -0.54 0.00 0.00 174.62 176.43 1gof s PHE 38 N -0.82 -0.11 0.38 3.99 -0.12 -1.26 -4.49 117.98 115.55 1gof s PHE 38 Ca 0.12 0.21 -0.26 0.00 -0.05 0.00 0.00 56.93 56.95 1gof s PHE 38 Cb -0.11 0.03 -0.09 0.00 -0.63 0.00 0.00 43.02 42.22 1gof s PHE 38 CO 0.02 -0.26 1.16 -0.46 -0.05 0.00 0.00 175.22 175.63 1gof s TRP 39 N -0.89 3.14 -0.10 3.49 -0.00 -0.11 -4.43 118.94 120.04 1gof s TRP 39 Ca -0.10 1.57 -0.07 0.00 -0.00 0.00 0.00 56.10 57.50 1gof s TRP 39 Cb -0.05 -3.37 0.03 0.00 -0.00 0.00 0.00 33.47 30.08 1gof s TRP 39 CO 0.02 -1.20 0.24 -1.58 -0.00 0.00 0.00 176.95 174.43 1gof s HIS 40 N -1.40 -0.29 0.93 5.86 5.65 -0.81 -1.96 115.29 123.29 1gof s HIS 40 Ca 0.55 0.69 -0.15 0.00 0.25 0.00 0.00 55.06 56.41 1gof s HIS 40 Cb -0.30 0.08 0.16 0.00 -1.18 0.00 0.00 32.58 31.34 1gof s HIS 40 CO 0.39 -0.16 1.24 0.95 -0.65 0.00 0.00 174.74 176.50 1gof s THR 41 N 0.49 1.96 0.31 0.89 -4.23 -0.66 -1.31 115.64 113.10 1gof s THR 41 Ca -0.03 0.00 -0.29 0.00 -1.18 0.00 0.00 61.69 60.19 1gof s THR 41 Cb -0.04 -2.92 -0.12 0.00 1.34 0.00 0.00 72.50 70.76 1gof s THR 41 CO -0.03 0.00 1.43 0.49 -0.54 0.00 0.00 174.62 175.98 1gof n PHE 42 N -3.73 2.53 -3.96 3.99 3.72 -1.26 -4.29 117.46 114.47 1gof n PHE 42 Ca 0.12 0.43 -0.09 0.00 -0.05 0.00 0.00 57.45 57.85 1gof n PHE 42 Cb 0.60 -2.49 -0.06 0.00 -0.94 0.00 0.00 39.48 36.59 1gof n PHE 42 CO 0.00 0.00 0.00 1.52 -0.05 0.00 0.00 176.76 178.23 1gof s TYR 43 N -0.58 0.33 0.00 1.38 1.13 -0.73 -4.14 117.35 114.75 1gof s TYR 43 Ca 0.60 -0.69 0.00 0.00 -1.41 0.00 0.00 57.07 55.58 1gof s TYR 43 Cb -0.55 0.12 0.00 0.00 -1.10 0.00 0.00 41.96 40.43 1gof s TYR 43 CO 0.56 -0.89 0.00 0.41 -2.51 0.00 0.00 175.55 173.12 1gof n GLY 44 N -0.32 0.85 0.82 5.49 0.00 -1.22 -2.52 105.19 108.29 1gof n GLY 44 Ca -0.04 0.46 0.03 0.00 0.00 0.00 0.00 46.02 46.47 1gof n GLY 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gof n ALA 45 N 8.37 2.82 -0.22 4.61 0.00 -1.26 -2.81 120.51 132.03 1gof n ALA 45 Ca 0.00 -0.57 0.00 0.00 0.00 0.00 0.00 53.44 52.87 1gof n ALA 45 Cb 0.00 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.42 1gof n ALA 45 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1gof n ASN 46 N 0.21 0.57 0.00 0.00 5.03 -1.05 -5.10 115.26 114.91 1gof n ASN 46 Ca 0.09 -0.86 0.00 0.00 0.87 0.00 0.00 54.58 54.68 1gof n ASN 46 Cb 0.47 0.16 0.00 0.00 -1.02 0.00 0.00 39.78 39.38 1gof n ASN 46 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1gof n GLY 47 N 0.16 -0.21 2.51 7.41 0.00 -1.12 -4.79 105.19 109.15 1gof n GLY 47 Ca 0.00 -1.89 -0.26 0.00 0.00 0.00 0.00 46.02 43.87 1gof n GLY 47 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1gof n ASP 48 N -0.43 3.30 -4.67 1.61 8.00 -1.26 -1.76 116.55 121.33 1gof n ASP 48 Ca 0.00 -3.38 -0.46 0.00 0.71 0.00 0.00 54.79 51.65 1gof n ASP 48 Cb 0.00 -0.63 -0.04 0.00 -0.02 0.00 0.00 41.12 40.42 1gof n ASP 48 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 1gof n PRO 49 N 0.60 2.20 -1.55 -0.24 -0.02 -1.26 -4.90 135.00 129.82 1gof n PRO 49 Ca 0.29 0.80 -0.31 0.00 -2.02 0.00 0.00 63.50 62.26 1gof n PRO 49 Cb 0.44 -2.59 0.06 0.00 -0.02 0.00 0.00 33.50 31.39 1gof n PRO 49 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1gof s LYS 50 N 1.82 2.66 0.80 -0.52 1.02 -1.26 -4.51 119.74 119.76 1gof s LYS 50 Ca 0.82 0.87 -0.11 0.00 0.02 0.00 0.00 55.97 57.57 1gof s LYS 50 Cb -0.67 -1.97 0.07 0.00 -0.52 0.00 0.00 37.83 34.75 1gof s LYS 50 CO 0.41 -1.27 1.09 -1.25 -0.92 0.00 0.00 175.35 173.41 1gof s PRO 51 N -5.07 2.04 0.53 -1.68 0.05 -1.23 -4.66 135.00 124.98 1gof s PRO 51 Ca 0.59 0.93 -0.22 0.00 0.05 0.00 0.00 61.00 62.35 1gof s PRO 51 Cb -0.14 -1.89 -0.05 0.00 0.05 0.00 0.00 34.50 32.46 1gof s PRO 51 CO 0.55 -1.72 1.31 -2.14 0.05 0.00 0.00 177.00 175.04 1gof s PRO 52 N -4.99 3.28 0.14 0.56 0.02 -1.26 -4.99 135.00 127.78 1gof s PRO 52 Ca 0.61 2.11 0.09 0.00 0.02 0.00 0.00 61.00 63.83 1gof s PRO 52 Cb -0.16 -2.28 -0.04 0.00 0.02 0.00 0.00 34.50 32.04 1gof s PRO 52 CO 0.56 -1.04 -0.21 -1.01 -0.33 0.00 0.00 177.00 174.97 1gof s HIS 53 N -1.37 1.97 0.02 6.54 3.76 0.14 -4.97 115.29 121.37 1gof s HIS 53 Ca 0.70 -0.42 0.01 0.00 -0.15 0.00 0.00 55.06 55.20 1gof s HIS 53 Cb -0.37 -1.02 -0.02 0.00 1.11 0.00 0.00 32.58 32.28 1gof s HIS 53 CO 0.44 0.32 -0.04 0.99 -0.85 0.00 0.00 174.74 175.60 1gof s THR 54 N -1.54 0.27 -0.18 1.30 2.01 -1.26 -0.98 115.64 115.26 1gof s THR 54 Ca 0.13 -0.70 -0.01 0.00 0.31 0.00 0.00 61.69 61.42 1gof s THR 54 Cb -0.08 -0.34 0.05 0.00 0.01 0.00 0.00 72.50 72.14 1gof s THR 54 CO 0.06 -0.28 -0.01 -0.47 -0.69 0.00 0.00 174.62 173.22 1gof s TYR 55 N -0.98 1.50 -0.10 4.92 6.14 -0.45 -2.37 117.35 126.01 1gof s TYR 55 Ca -0.09 -1.06 0.03 0.00 0.64 0.00 0.00 57.07 56.59 1gof s TYR 55 Cb -0.07 -1.22 -0.01 0.00 0.42 0.00 0.00 41.96 41.08 1gof s TYR 55 CO -0.00 -0.62 -0.19 0.99 0.64 0.00 0.00 175.55 176.37 1gof s THR 56 N 1.70 2.58 0.01 4.34 2.01 0.20 -0.79 115.64 125.69 1gof s THR 56 Ca -0.01 -0.85 0.07 0.00 0.31 0.00 0.00 61.69 61.22 1gof s THR 56 Cb -0.16 -2.03 -0.02 0.00 0.01 0.00 0.00 72.50 70.30 1gof s THR 56 CO -0.07 0.55 -0.23 -0.63 -0.69 0.00 0.00 174.62 173.55 1gof s ILE 57 N 0.15 1.81 -0.31 1.82 1.01 0.12 -1.15 121.20 124.66 1gof s ILE 57 Ca -0.10 -1.08 0.03 0.00 0.00 0.00 0.00 60.65 59.50 1gof s ILE 57 Cb -0.16 -1.52 0.08 0.00 0.01 0.00 0.00 42.46 40.87 1gof s ILE 57 CO 0.06 0.41 -0.01 -0.62 0.00 0.00 0.00 174.94 174.78 1gof s ASP 58 N -0.79 4.58 0.00 3.58 -1.08 0.35 -1.50 116.67 121.81 1gof s ASP 58 Ca 0.09 -1.82 0.26 0.00 -0.52 0.00 0.00 52.55 50.56 1gof s ASP 58 Cb -0.09 -1.55 1.30 0.00 -1.46 0.00 0.00 42.92 41.12 1gof s ASP 58 CO 0.00 -0.31 1.89 0.23 0.52 0.00 0.00 175.17 177.50 1gof n MET 59 N 4.36 0.31 0.00 4.34 2.81 -0.30 -1.83 117.12 126.81 1gof n MET 59 Ca -0.03 0.04 0.00 0.00 -1.81 0.00 0.00 57.70 55.90 1gof n MET 59 Cb 0.42 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.43 1gof n MET 59 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1gof n LYS 60 N -1.32 0.00 -4.40 0.03 4.76 -1.26 -4.71 118.16 111.26 1gof n LYS 60 Ca 0.11 0.00 -0.21 0.00 -2.87 0.00 0.00 58.31 55.34 1gof n LYS 60 Cb 0.23 -0.41 -0.09 0.00 -1.84 0.00 0.00 35.03 32.92 1gof n LYS 60 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 1gof s THR 61 N 0.00 0.44 -0.29 -0.18 -4.23 -1.26 -5.09 115.64 105.03 1gof s THR 61 Ca 0.00 -2.00 -0.20 0.00 -1.18 0.00 0.00 61.69 58.31 1gof s THR 61 Cb 0.00 -2.47 -0.01 0.00 1.34 0.00 0.00 72.50 71.35 1gof s THR 61 CO 0.00 0.00 0.62 -0.89 -0.54 0.00 0.00 174.62 173.81 1gof s THR 62 N -3.44 4.96 0.13 3.99 2.01 -1.26 -4.18 115.64 117.86 1gof s THR 62 Ca 0.32 0.95 0.09 0.00 0.31 0.00 0.00 61.69 63.36 1gof s THR 62 Cb 0.04 -3.97 -0.04 0.00 0.01 0.00 0.00 72.50 68.54 1gof s THR 62 CO 0.17 -0.07 -0.15 -1.10 -0.69 0.00 0.00 174.62 172.78 1gof s GLN 63 N 2.55 1.88 -1.09 4.92 -1.52 -0.32 -4.88 119.66 121.20 1gof s GLN 63 Ca 0.25 -1.20 -0.17 0.00 -1.95 0.00 0.00 55.36 52.29 1gof s GLN 63 Cb -0.15 -2.14 0.13 0.00 -0.22 0.00 0.00 33.01 30.63 1gof s GLN 63 CO 0.11 0.47 1.35 -0.80 -0.25 0.00 0.00 175.29 176.16 1gof s ASN 64 N -2.33 6.80 0.10 5.90 0.01 -1.26 -0.87 114.94 123.29 1gof s ASN 64 Ca 0.20 -2.37 -0.30 0.00 -0.71 0.00 0.00 52.86 49.68 1gof s ASN 64 Cb -0.10 -2.44 -0.06 0.00 0.41 0.00 0.00 41.25 39.06 1gof s ASN 64 CO 0.12 -1.01 1.03 -0.69 -1.51 0.00 0.00 177.10 175.03 1gof s VAL 65 N 2.73 4.37 0.00 1.60 1.01 -1.17 -0.91 120.40 128.03 1gof s VAL 65 Ca 0.40 1.88 0.00 0.00 0.00 0.00 0.00 61.98 64.26 1gof s VAL 65 Cb -0.02 -4.20 0.00 0.00 0.00 0.00 0.00 36.38 32.15 1gof s VAL 65 CO -0.04 0.25 0.56 -0.46 0.00 0.00 0.00 175.10 175.41 1gof n ASN 66 N 3.08 0.87 0.00 3.32 0.23 -0.19 -0.86 115.26 121.71 1gof n ASN 66 Ca 0.04 -1.32 0.00 0.00 -0.53 0.00 0.00 54.58 52.77 1gof n ASN 66 Cb 0.48 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.18 1gof n ASN 66 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1gof n GLY 67 N -0.16 -1.00 3.27 4.83 0.00 -1.23 -1.50 105.19 109.41 1gof n GLY 67 Ca 0.00 -1.17 -0.10 0.00 0.00 0.00 0.00 46.02 44.75 1gof n GLY 67 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1gof s LEU 68 N 0.00 0.81 0.07 0.99 0.05 -0.27 0.08 118.68 120.41 1gof s LEU 68 Ca 0.00 -0.44 0.06 0.00 0.05 0.00 0.00 54.13 53.80 1gof s LEU 68 Cb 0.00 1.51 -0.03 0.00 -2.05 0.00 0.00 46.19 45.62 1gof s LEU 68 CO 0.00 -0.79 -0.17 -0.94 -0.55 0.00 0.00 176.35 173.89 1gof s SER 69 N -2.79 2.05 -0.19 1.48 1.04 -0.60 -1.22 113.70 113.47 1gof s SER 69 Ca 0.03 -0.59 -0.03 0.00 0.48 0.00 0.00 55.95 55.84 1gof s SER 69 Cb 0.03 -0.11 0.06 0.00 0.10 0.00 0.00 66.02 66.10 1gof s SER 69 CO -0.11 0.02 0.04 -0.32 0.98 0.00 0.00 173.24 173.85 1gof s MET 70 N -1.58 0.61 -0.32 4.02 1.75 0.13 -2.64 119.30 121.27 1gof s MET 70 Ca 0.03 -0.37 -0.14 0.00 -1.25 0.00 0.00 55.69 53.95 1gof s MET 70 Cb -0.09 -2.03 -0.02 0.00 2.84 0.00 0.00 34.83 35.52 1gof s MET 70 CO 0.03 -0.63 0.32 -1.17 -0.65 0.00 0.00 175.02 172.92 1gof s LEU 71 N 1.88 4.35 1.30 4.11 2.96 0.83 -0.88 118.68 133.23 1gof s LEU 71 Ca -0.00 -0.17 -0.19 0.00 -0.22 0.00 0.00 54.13 53.54 1gof s LEU 71 Cb -0.17 -2.29 0.32 0.00 0.50 0.00 0.00 46.19 44.56 1gof s LEU 71 CO -0.08 -0.26 1.00 -2.84 -1.32 0.00 0.00 176.35 172.85 1gof s PRO 72 N 1.94 -1.97 0.28 0.98 0.02 -1.26 -1.07 135.00 133.91 1gof s PRO 72 Ca 0.11 0.24 -0.29 0.00 0.02 0.00 0.00 61.00 61.07 1gof s PRO 72 Cb -0.17 -1.48 -0.10 0.00 0.02 0.00 0.00 34.50 32.77 1gof s PRO 72 CO 0.11 -4.27 1.38 -0.98 -0.33 0.00 0.00 177.00 172.91 1gof s ARG 73 N -5.02 4.31 -0.07 5.54 1.70 -1.26 -4.20 118.95 119.94 1gof s ARG 73 Ca 0.69 2.25 0.17 0.00 -0.47 0.00 0.00 55.73 58.38 1gof s ARG 73 Cb -0.15 -3.10 0.59 0.00 -0.57 0.00 0.00 34.95 31.72 1gof s ARG 73 CO 0.59 -0.32 1.51 1.04 -1.08 0.00 0.00 175.30 177.04 1gof n GLN 74 N 1.70 3.27 -0.22 3.89 1.13 -1.26 -4.57 117.38 121.31 1gof n GLN 74 Ca 0.04 -2.65 0.04 0.00 -1.94 0.00 0.00 57.00 52.49 1gof n GLN 74 Cb 0.41 -1.69 0.14 0.00 0.11 0.00 0.00 30.24 29.22 1gof n GLN 74 CO 0.00 0.00 0.00 -0.40 -1.44 0.00 0.00 177.06 175.22 1gof n ASP 75 N 0.89 2.04 0.00 1.08 5.75 -1.26 -4.88 116.55 120.17 1gof n ASP 75 Ca 0.22 -2.12 0.00 0.00 -0.01 0.00 0.00 54.79 52.87 1gof n ASP 75 Cb 0.74 -0.32 0.00 0.00 -1.03 0.00 0.00 41.12 40.50 1gof n ASP 75 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1gof n GLY 76 N 0.74 2.88 3.81 6.12 0.00 -1.26 -5.02 105.19 112.46 1gof n GLY 76 Ca 0.10 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.74 1gof n GLY 76 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1gof s ASN 77 N -1.39 6.96 0.09 1.61 3.84 -1.26 -4.98 114.94 119.81 1gof s ASN 77 Ca 0.00 1.14 0.25 0.00 0.21 0.00 0.00 52.86 54.45 1gof s ASN 77 Cb 0.00 -2.32 0.44 0.00 -0.55 0.00 0.00 41.25 38.82 1gof s ASN 77 CO 0.00 0.27 1.39 0.00 -2.79 0.00 0.00 177.10 175.97 1gof n GLN 78 N 1.92 0.21 -1.68 0.43 6.02 -1.26 -4.81 117.38 118.22 1gof n GLN 78 Ca -0.11 0.07 -0.46 0.00 -0.01 0.00 0.00 57.00 56.49 1gof n GLN 78 Cb 0.51 -1.64 -0.04 0.00 1.02 0.00 0.00 30.24 30.09 1gof n GLN 78 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1gof n ASN 79 N -1.96 3.61 0.00 1.08 3.02 -1.26 -1.76 115.26 117.99 1gof n ASN 79 Ca 0.04 0.98 0.00 0.00 -0.03 0.00 0.00 54.58 55.57 1gof n ASN 79 Cb 0.41 -1.43 0.00 0.00 -0.61 0.00 0.00 39.78 38.15 1gof n ASN 79 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1gof n GLY 80 N 4.27 0.51 3.69 7.41 0.00 -1.26 -4.56 105.19 115.26 1gof n GLY 80 Ca 0.21 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.80 1gof n GLY 80 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1gof n TRP 81 N -1.90 2.63 -2.38 1.61 8.01 -0.72 -1.94 117.44 122.75 1gof n TRP 81 Ca 0.00 -0.10 -0.42 0.00 -1.31 0.00 0.00 57.50 55.66 1gof n TRP 81 Cb 0.00 -2.72 -0.03 0.00 -2.01 0.00 0.00 31.31 26.55 1gof n TRP 81 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.69 177.10 1gof s ILE 82 N 2.45 3.96 0.00 -0.99 1.01 -1.26 0.14 121.20 126.51 1gof s ILE 82 Ca 0.81 1.39 0.00 0.00 0.00 0.00 0.00 60.65 62.85 1gof s ILE 82 Cb -0.49 -3.89 0.00 0.00 0.01 0.00 0.00 42.46 38.08 1gof s ILE 82 CO 0.37 0.08 0.00 0.61 0.00 0.00 0.00 174.94 176.00 1gof n GLY 83 N 3.31 0.26 3.76 6.18 0.00 0.21 -4.31 105.19 114.60 1gof n GLY 83 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 1gof n GLY 83 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1gof s ARG 84 N 1.44 4.26 0.21 1.61 0.52 -1.25 -2.11 118.95 123.64 1gof s ARG 84 Ca 0.00 2.34 -0.12 0.00 -0.52 0.00 0.00 55.73 57.43 1gof s ARG 84 Cb 0.00 -3.07 0.00 0.00 0.52 0.00 0.00 34.95 32.40 1gof s ARG 84 CO 0.00 -0.39 0.43 -3.38 0.02 0.00 0.00 175.30 171.98 1gof s HIS 85 N -0.45 0.29 0.01 -0.53 -3.43 -0.61 -0.03 115.29 110.54 1gof s HIS 85 Ca 0.56 -0.65 0.00 0.00 -0.80 0.00 0.00 55.06 54.18 1gof s HIS 85 Cb -0.42 0.15 -0.01 0.00 -1.43 0.00 0.00 32.58 30.87 1gof s HIS 85 CO 0.49 -0.90 -0.02 -1.21 -2.00 0.00 0.00 174.74 171.10 1gof s GLU 86 N -3.98 0.16 -0.12 -0.38 2.02 -0.45 -2.27 118.70 113.68 1gof s GLU 86 Ca 0.19 -0.19 0.03 0.00 0.02 0.00 0.00 54.97 55.02 1gof s GLU 86 Cb 0.00 -0.07 0.01 0.00 0.10 0.00 0.00 34.13 34.17 1gof s GLU 86 CO 0.04 0.01 -0.22 0.08 0.02 0.00 0.00 175.26 175.19 1gof s VAL 87 N -0.38 2.03 0.12 2.63 1.01 0.08 -1.50 120.40 124.39 1gof s VAL 87 Ca -0.03 -0.98 0.10 0.00 0.00 0.00 0.00 61.98 61.07 1gof s VAL 87 Cb -0.03 -1.78 -0.04 0.00 0.00 0.00 0.00 36.38 34.54 1gof s VAL 87 CO -0.00 0.55 -0.25 -0.31 0.00 0.00 0.00 175.10 175.08 1gof s TYR 88 N 0.62 2.15 0.08 5.22 1.51 0.18 -0.74 117.35 126.37 1gof s TYR 88 Ca -0.12 -0.39 0.09 0.00 -1.01 0.00 0.00 57.07 55.63 1gof s TYR 88 Cb -0.17 -1.17 -0.03 0.00 -0.11 0.00 0.00 41.96 40.49 1gof s TYR 88 CO 0.03 0.30 -0.23 -0.51 -1.11 0.00 0.00 175.55 174.03 1gof s LEU 89 N -2.03 2.24 -0.14 -1.29 1.43 -1.26 -1.34 118.68 116.30 1gof s LEU 89 Ca 0.12 -0.63 -0.15 0.00 -1.03 0.00 0.00 54.13 52.43 1gof s LEU 89 Cb -0.10 -1.04 0.04 0.00 0.03 0.00 0.00 46.19 45.12 1gof s LEU 89 CO 0.06 0.14 0.43 -0.55 0.23 0.00 0.00 176.35 176.65 1gof s SER 90 N -1.61 -0.43 0.00 2.29 0.15 -0.08 -4.60 113.70 109.42 1gof s SER 90 Ca 0.09 0.79 0.23 0.00 0.70 0.00 0.00 55.95 57.75 1gof s SER 90 Cb -0.10 0.82 0.06 0.00 -1.71 0.00 0.00 66.02 65.09 1gof s SER 90 CO 0.03 -0.19 1.11 -1.54 1.20 0.00 0.00 173.24 173.85 1gof n SER 91 N 2.64 1.14 0.00 5.45 3.41 -1.26 -0.63 113.62 124.37 1gof n SER 91 Ca -0.14 -0.96 0.00 0.00 -0.26 0.00 0.00 58.87 57.51 1gof n SER 91 Cb 0.57 0.65 0.00 0.00 -0.26 0.00 0.00 64.21 65.17 1gof n SER 91 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1gof n ASP 92 N -1.08 4.33 0.00 4.04 5.68 -1.26 -4.71 116.55 123.55 1gof n ASP 92 Ca 0.06 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.35 1gof n ASP 92 Cb 0.36 0.81 0.00 0.00 -1.14 0.00 0.00 41.12 41.16 1gof n ASP 92 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1gof n GLY 93 N 2.23 1.34 0.03 6.12 0.00 -1.26 -4.82 105.19 108.83 1gof n GLY 93 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 1gof n GLY 93 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1gof n THR 94 N -2.00 0.32 -3.51 2.61 -1.04 -1.26 -4.92 114.28 104.48 1gof n THR 94 Ca 0.00 -0.15 -0.42 0.00 -2.04 0.00 0.00 64.05 61.44 1gof n THR 94 Cb 0.00 -0.77 -0.10 0.00 -1.82 0.00 0.00 70.33 67.64 1gof n THR 94 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 1gof s ASN 95 N -4.16 5.93 -0.09 8.00 0.02 -1.26 -4.92 114.94 118.45 1gof s ASN 95 Ca -0.06 -1.14 -0.05 0.00 -1.02 0.00 0.00 52.86 50.59 1gof s ASN 95 Cb 0.02 -2.10 -0.02 0.00 0.02 0.00 0.00 41.25 39.17 1gof s ASN 95 CO 0.15 -0.50 -0.10 -0.50 0.02 0.00 0.00 177.10 176.18 1gof h TRP 96 N 8.57 0.00 0.00 2.20 4.06 -1.92 -3.41 115.95 125.45 1gof h TRP 96 Ca -0.26 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.69 1gof h TRP 96 Cb 1.11 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.27 1gof h TRP 96 CO 0.59 0.00 0.00 0.41 -3.56 0.00 0.00 178.44 175.88 1gof n GLY 97 N 1.69 0.29 3.87 1.49 0.00 -1.26 -4.58 105.19 106.68 1gof n GLY 97 Ca -0.04 -1.81 -0.32 0.00 0.00 0.00 0.00 46.02 43.85 1gof n GLY 97 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1gof s SER 98 N -4.00 6.67 0.39 1.61 0.15 -1.26 -5.02 113.70 112.24 1gof s SER 98 Ca 0.00 1.01 -0.27 0.00 0.70 0.00 0.00 55.95 57.38 1gof s SER 98 Cb 0.00 -2.26 -0.11 0.00 -1.71 0.00 0.00 66.02 61.94 1gof s SER 98 CO 0.00 -0.09 1.44 -2.65 1.20 0.00 0.00 173.24 173.15 1gof n PRO 99 N -0.11 2.49 0.18 5.44 -0.02 -1.26 -4.80 135.00 136.91 1gof n PRO 99 Ca 0.01 0.87 0.07 0.00 -2.02 0.00 0.00 63.50 62.43 1gof n PRO 99 Cb 0.52 -2.61 0.11 0.00 -0.02 0.00 0.00 33.50 31.50 1gof n PRO 99 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 1gof h VAL 100 N 2.72 0.44 -2.94 -1.45 -1.51 -1.31 -3.46 116.25 108.74 1gof h VAL 100 Ca -0.50 -1.61 -0.06 0.00 -1.23 0.00 0.00 66.70 63.30 1gof h VAL 100 Cb 1.26 2.21 -0.16 0.00 -2.13 0.00 0.00 31.29 32.46 1gof h VAL 100 CO 0.63 0.25 -0.01 0.00 -1.23 0.00 0.00 177.57 177.21 1gof s ALA 101 N -3.10 -1.19 0.03 5.19 0.00 -1.22 -2.35 121.76 119.13 1gof s ALA 101 Ca 0.05 0.42 -0.28 0.00 0.00 0.00 0.00 51.96 52.15 1gof s ALA 101 Cb 0.06 0.44 0.09 0.00 0.00 0.00 0.00 23.12 23.71 1gof s ALA 101 CO 0.71 -0.52 0.93 -1.54 0.00 0.00 0.00 175.76 175.34 1gof s SER 102 N -2.13 -0.29 0.00 0.00 1.04 -0.85 -0.74 113.70 110.73 1gof s SER 102 Ca -0.04 -0.12 0.00 0.00 0.48 0.00 0.00 55.95 56.27 1gof s SER 102 Cb -0.00 0.40 0.00 0.00 0.10 0.00 0.00 66.02 66.52 1gof s SER 102 CO -0.04 -0.68 0.00 0.61 0.98 0.00 0.00 173.24 174.11 1gof n GLY 103 N -0.31 0.24 3.02 7.32 0.00 -0.96 -0.03 105.19 114.46 1gof n GLY 103 Ca -0.08 -1.22 -0.13 0.00 0.00 0.00 0.00 46.02 44.59 1gof n GLY 103 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1gof s SER 104 N -4.00 0.69 0.05 1.61 0.01 -0.46 -1.58 113.70 110.02 1gof s SER 104 Ca 0.00 -0.40 0.02 0.00 1.31 0.00 0.00 55.95 56.88 1gof s SER 104 Cb 0.00 0.01 -0.04 0.00 0.21 0.00 0.00 66.02 66.20 1gof s SER 104 CO 0.00 -0.13 0.06 0.26 0.41 0.00 0.00 173.24 173.84 1gof s TRP 105 N -0.98 3.18 0.72 2.43 0.51 -0.90 -2.51 118.94 121.39 1gof s TRP 105 Ca -0.07 0.10 -0.15 0.00 -2.12 0.00 0.00 56.10 53.86 1gof s TRP 105 Cb -0.07 -1.65 0.03 0.00 -0.81 0.00 0.00 33.47 30.97 1gof s TRP 105 CO 0.00 0.52 1.19 0.12 -0.51 0.00 0.00 176.95 178.27 1gof s PHE 106 N -1.29 2.15 -1.14 -1.98 5.36 -1.26 -4.63 117.98 115.18 1gof s PHE 106 Ca 0.26 1.59 -0.17 0.00 -0.96 0.00 0.00 56.93 57.65 1gof s PHE 106 Cb -0.12 -3.42 0.12 0.00 -0.34 0.00 0.00 43.02 39.26 1gof s PHE 106 CO 0.18 -2.44 1.45 0.00 -1.46 0.00 0.00 175.22 172.94 1gof s ALA 107 N -2.04 3.51 0.36 11.12 0.00 -1.26 -4.88 121.76 128.57 1gof s ALA 107 Ca 0.73 -2.97 -0.15 0.00 0.00 0.00 0.00 51.96 49.57 1gof s ALA 107 Cb -0.28 -4.30 0.04 0.00 0.00 0.00 0.00 23.12 18.59 1gof s ALA 107 CO 0.44 -3.07 0.73 0.16 0.00 0.00 0.00 175.76 174.02 1gof s ASP 108 N 3.65 0.06 -0.12 0.00 1.47 -1.26 -5.06 116.67 115.42 1gof s ASP 108 Ca 0.44 -1.08 0.17 0.00 1.18 0.00 0.00 52.55 53.26 1gof s ASP 108 Cb -0.01 0.80 0.71 0.00 -0.34 0.00 0.00 42.92 44.07 1gof s ASP 108 CO -0.01 -1.56 1.61 -1.54 0.68 0.00 0.00 175.17 174.34 1gof n SER 109 N -1.20 4.68 -4.82 2.11 3.41 -1.26 -4.91 113.62 111.62 1gof n SER 109 Ca -0.06 -2.45 -0.32 0.00 -0.26 0.00 0.00 58.87 55.78 1gof n SER 109 Cb 0.60 -0.58 -0.00 0.00 -0.26 0.00 0.00 64.21 63.97 1gof n SER 109 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1gof s THR 110 N -1.88 4.18 0.26 6.66 -4.23 -1.26 -4.45 115.64 114.92 1gof s THR 110 Ca 0.50 0.98 -0.30 0.00 -1.18 0.00 0.00 61.69 61.68 1gof s THR 110 Cb 0.32 -3.55 -0.11 0.00 1.34 0.00 0.00 72.50 70.50 1gof s THR 110 CO 0.24 -0.66 1.54 -0.89 -0.54 0.00 0.00 174.62 174.31 1gof s THR 111 N -2.64 2.34 0.09 3.99 2.01 -1.26 -4.42 115.64 115.75 1gof s THR 111 Ca 0.61 0.28 0.04 0.00 0.31 0.00 0.00 61.69 62.92 1gof s THR 111 Cb -0.13 -3.18 -0.04 0.00 0.01 0.00 0.00 72.50 69.16 1gof s THR 111 CO 0.38 0.04 0.02 -0.54 -0.69 0.00 0.00 174.62 173.83 1gof s LYS 112 N -0.18 2.65 0.16 4.92 -0.14 -0.06 -4.84 119.74 122.26 1gof s LYS 112 Ca 0.63 -0.80 0.06 0.00 -1.36 0.00 0.00 55.97 54.50 1gof s LYS 112 Cb -0.45 -2.60 -0.04 0.00 -1.68 0.00 0.00 37.83 33.06 1gof s LYS 112 CO 0.43 0.55 -0.12 0.71 -0.76 0.00 0.00 175.35 176.16 1gof s TYR 113 N -1.34 1.43 -0.22 3.18 1.51 -1.26 0.19 117.35 120.85 1gof s TYR 113 Ca 0.27 -0.67 -0.01 0.00 -1.01 0.00 0.00 57.07 55.65 1gof s TYR 113 Cb -0.12 -0.71 0.06 0.00 -0.11 0.00 0.00 41.96 41.09 1gof s TYR 113 CO 0.19 0.19 -0.01 -1.12 -1.11 0.00 0.00 175.55 173.69 1gof s SER 114 N -3.13 3.40 -0.15 2.29 0.01 -0.36 -4.99 113.70 110.77 1gof s SER 114 Ca 0.18 -1.02 -0.05 0.00 1.31 0.00 0.00 55.95 56.37 1gof s SER 114 Cb 0.00 -0.89 -0.03 0.00 0.21 0.00 0.00 66.02 65.31 1gof s SER 114 CO 0.03 -0.27 0.00 0.20 0.41 0.00 0.00 173.24 173.61 1gof s ASN 115 N 1.62 5.17 0.19 2.44 0.01 -1.26 -1.11 114.94 122.01 1gof s ASN 115 Ca -0.03 -0.01 -0.13 0.00 -0.71 0.00 0.00 52.86 51.98 1gof s ASN 115 Cb -0.18 -1.80 0.01 0.00 0.41 0.00 0.00 41.25 39.69 1gof s ASN 115 CO -0.07 0.21 0.43 0.72 -1.51 0.00 0.00 177.10 176.87 1gof s PHE 116 N 0.15 0.17 0.58 2.20 -0.12 -0.56 -4.77 117.98 115.62 1gof s PHE 116 Ca 0.01 -0.52 -0.19 0.00 -0.05 0.00 0.00 56.93 56.18 1gof s PHE 116 Cb -0.13 0.19 -0.04 0.00 -0.63 0.00 0.00 43.02 42.41 1gof s PHE 116 CO 0.02 -0.86 1.19 -1.21 -0.05 0.00 0.00 175.22 174.31 1gof s GLU 117 N -3.94 3.09 0.21 1.99 0.41 -1.26 -4.59 118.70 114.62 1gof s GLU 117 Ca 0.15 1.78 -0.32 0.00 -0.41 0.00 0.00 54.97 56.17 1gof s GLU 117 Cb 0.01 -1.96 -0.13 0.00 -1.78 0.00 0.00 34.13 30.27 1gof s GLU 117 CO 0.01 -1.10 1.64 2.41 -0.49 0.00 0.00 175.26 177.72 1gof n THR 118 N -1.48 0.25 -3.60 3.63 -1.04 -1.26 -4.74 114.28 106.03 1gof n THR 118 Ca 0.13 -0.06 -0.14 0.00 -2.04 0.00 0.00 64.05 61.94 1gof n THR 118 Cb 0.50 -1.82 -0.12 0.00 -1.82 0.00 0.00 70.33 67.07 1gof n THR 118 CO 0.00 0.00 0.00 -0.60 -0.64 0.00 0.00 175.07 173.83 1gof s ARG 119 N 0.69 0.18 0.13 -2.82 3.52 -0.04 -4.97 118.95 115.64 1gof s ARG 119 Ca 0.74 0.63 -0.35 0.00 -0.13 0.00 0.00 55.73 56.62 1gof s ARG 119 Cb -0.56 -0.30 -0.15 0.00 -1.56 0.00 0.00 34.95 32.38 1gof s ARG 119 CO 0.38 -0.39 1.42 -2.30 -0.81 0.00 0.00 175.30 173.60 1gof n PRO 120 N 5.35 1.60 -3.48 5.12 -0.01 -1.26 -3.05 135.00 139.27 1gof n PRO 120 Ca -0.06 0.58 -0.13 0.00 -0.01 0.00 0.00 63.50 63.88 1gof n PRO 120 Cb 0.50 -2.26 -0.03 0.00 -0.01 0.00 0.00 33.50 31.69 1gof n PRO 120 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 175.50 175.49 1gof s ALA 121 N 0.56 -1.73 -0.08 3.55 0.00 -0.04 -4.76 121.76 119.26 1gof s ALA 121 Ca 0.80 0.93 0.08 0.00 0.00 0.00 0.00 51.96 53.78 1gof s ALA 121 Cb -0.82 0.39 -0.12 0.00 0.00 0.00 0.00 23.12 22.57 1gof s ALA 121 CO 0.44 -0.60 0.05 -2.13 0.00 0.00 0.00 175.76 173.52 1gof n ARG 122 N 0.11 2.26 -4.88 0.00 0.63 -0.81 -1.17 116.66 112.79 1gof n ARG 122 Ca -0.15 -0.01 -0.32 0.00 -0.92 0.00 0.00 57.85 56.44 1gof n ARG 122 Cb 0.61 -1.23 -0.13 0.00 0.45 0.00 0.00 32.46 32.16 1gof n ARG 122 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 1gof s TYR 123 N -2.27 2.64 -0.01 -0.14 1.51 0.20 -1.15 117.35 118.13 1gof s TYR 123 Ca -0.04 -0.20 0.02 0.00 -1.01 0.00 0.00 57.07 55.83 1gof s TYR 123 Cb 0.03 -1.58 -0.00 0.00 -0.11 0.00 0.00 41.96 40.29 1gof s TYR 123 CO 0.38 0.18 -0.06 0.08 -1.11 0.00 0.00 175.55 175.02 1gof s VAL 124 N -0.76 0.47 -0.04 0.71 1.01 -0.56 -0.90 120.40 120.32 1gof s VAL 124 Ca 0.12 -0.25 0.01 0.00 0.00 0.00 0.00 61.98 61.86 1gof s VAL 124 Cb -0.11 -0.40 0.02 0.00 0.00 0.00 0.00 36.38 35.90 1gof s VAL 124 CO 0.01 0.13 -0.02 -0.60 0.00 0.00 0.00 175.10 174.63 1gof s ARG 125 N -0.10 0.52 -0.21 2.72 3.52 -0.45 0.16 118.95 125.11 1gof s ARG 125 Ca 0.02 0.00 -0.03 0.00 -0.13 0.00 0.00 55.73 55.59 1gof s ARG 125 Cb -0.03 -0.64 -0.01 0.00 -1.56 0.00 0.00 34.95 32.71 1gof s ARG 125 CO -0.00 -0.12 -0.06 -1.17 -0.81 0.00 0.00 175.30 173.14 1gof s LEU 126 N 1.01 2.83 -0.21 -0.88 2.96 0.03 -0.64 118.68 123.78 1gof s LEU 126 Ca -0.10 -0.41 -0.06 0.00 -0.22 0.00 0.00 54.13 53.35 1gof s LEU 126 Cb -0.14 -1.71 -0.03 0.00 0.50 0.00 0.00 46.19 44.81 1gof s LEU 126 CO -0.01 -0.01 0.03 -0.69 -1.32 0.00 0.00 176.35 174.35 1gof s VAL 127 N 1.40 4.20 -0.42 1.68 1.01 -0.56 -1.34 120.40 126.36 1gof s VAL 127 Ca 0.05 -0.23 -0.16 0.00 0.00 0.00 0.00 61.98 61.64 1gof s VAL 127 Cb -0.14 -2.91 0.02 0.00 0.00 0.00 0.00 36.38 33.35 1gof s VAL 127 CO -0.04 0.41 0.39 0.00 0.00 0.00 0.00 175.10 175.86 1gof s ALA 128 N 1.05 3.45 -0.05 5.51 0.00 -0.15 -1.34 121.76 130.22 1gof s ALA 128 Ca 0.03 -1.58 -0.05 0.00 0.00 0.00 0.00 51.96 50.36 1gof s ALA 128 Cb -0.14 -3.00 -0.28 0.00 0.00 0.00 0.00 23.12 19.71 1gof s ALA 128 CO 0.02 -1.54 0.65 0.82 0.00 0.00 0.00 175.76 175.71 1gof h ILE 129 N 5.69 0.91 -4.07 0.00 1.08 -0.73 0.43 117.51 120.82 1gof h ILE 129 Ca -0.27 -2.58 -0.16 0.00 -0.39 0.00 0.00 64.86 61.46 1gof h ILE 129 Cb 1.11 2.66 -0.16 0.00 -3.07 0.00 0.00 36.82 37.36 1gof h ILE 129 CO 0.77 0.82 -0.69 0.42 -0.69 0.00 0.00 178.15 178.78 1gof s THR 130 N -2.59 0.36 -0.11 -0.27 -4.23 -0.93 -4.24 115.64 103.63 1gof s THR 130 Ca -0.14 -1.70 -0.06 0.00 -1.18 0.00 0.00 61.69 58.61 1gof s THR 130 Cb 0.06 -1.37 -0.04 0.00 1.34 0.00 0.00 72.50 72.49 1gof s THR 130 CO 0.83 -0.87 0.12 -0.70 -0.54 0.00 0.00 174.62 173.46 1gof s GLU 131 N -3.49 3.37 0.58 3.99 -6.30 -1.26 -0.62 118.70 114.97 1gof s GLU 131 Ca 0.05 -0.19 0.29 0.00 -2.50 0.00 0.00 54.97 52.62 1gof s GLU 131 Cb 0.04 -3.12 1.49 0.00 0.00 0.00 0.00 34.13 32.53 1gof s GLU 131 CO -0.07 0.76 1.93 0.00 0.02 0.00 0.00 175.26 177.90 1gof h ALA 132 N 4.91 2.26 -0.24 6.30 0.00 0.98 -1.36 119.26 132.11 1gof h ALA 132 Ca -0.54 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1gof h ALA 132 Cb 1.22 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1gof h ALA 132 CO 0.58 -0.71 0.00 0.09 0.00 0.00 0.00 179.25 179.21 1gof n ASN 133 N -3.88 2.64 0.00 0.00 4.13 -1.26 -4.93 115.26 111.97 1gof n ASN 133 Ca 0.09 -1.81 0.00 0.00 1.68 0.00 0.00 54.58 54.54 1gof n ASN 133 Cb 0.66 -0.16 0.00 0.00 -1.54 0.00 0.00 39.78 38.74 1gof n ASN 133 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1gof n GLY 134 N 0.67 0.59 3.97 7.41 0.00 -0.51 -5.08 105.19 112.24 1gof n GLY 134 Ca 0.11 -0.70 -0.22 0.00 0.00 0.00 0.00 46.02 45.21 1gof n GLY 134 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1gof s GLN 135 N -1.29 2.34 0.15 1.61 -1.52 -1.26 -4.95 119.66 114.74 1gof s GLN 135 Ca 0.00 -0.79 0.26 0.00 -1.95 0.00 0.00 55.36 52.87 1gof s GLN 135 Cb 0.00 -2.43 0.72 0.00 -0.22 0.00 0.00 33.01 31.08 1gof s GLN 135 CO 0.00 -0.91 1.65 -2.30 -0.25 0.00 0.00 175.29 173.48 1gof n PRO 136 N -2.49 0.23 -2.48 2.91 -0.02 -1.26 -4.18 135.00 127.69 1gof n PRO 136 Ca 0.09 0.14 -0.26 0.00 -2.02 0.00 0.00 63.50 61.46 1gof n PRO 136 Cb 0.60 -1.72 0.03 0.00 -0.02 0.00 0.00 33.50 32.39 1gof n PRO 136 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 1gof s TRP 137 N -3.10 3.19 -0.03 6.00 0.51 -1.26 -3.51 118.94 120.74 1gof s TRP 137 Ca 0.10 0.52 0.01 0.00 -2.12 0.00 0.00 56.10 54.61 1gof s TRP 137 Cb 0.14 -2.71 0.02 0.00 -0.81 0.00 0.00 33.47 30.10 1gof s TRP 137 CO 0.63 -0.81 -0.01 0.99 -0.51 0.00 0.00 176.95 177.24 1gof s THR 138 N -2.93 0.25 -0.02 2.01 2.01 -1.26 -4.03 115.64 111.67 1gof s THR 138 Ca 0.54 0.01 -0.03 0.00 0.31 0.00 0.00 61.69 62.51 1gof s THR 138 Cb -0.10 -0.31 0.00 0.00 0.01 0.00 0.00 72.50 72.10 1gof s THR 138 CO 0.44 0.15 0.08 -0.94 -0.69 0.00 0.00 174.62 173.65 1gof s SER 139 N 0.81 -0.03 -0.10 3.53 1.04 -0.82 -1.66 113.70 116.48 1gof s SER 139 Ca -0.09 0.02 -0.04 0.00 0.48 0.00 0.00 55.95 56.33 1gof s SER 139 Cb -0.12 0.17 0.05 0.00 0.10 0.00 0.00 66.02 66.23 1gof s SER 139 CO -0.01 -0.12 0.19 -0.63 0.98 0.00 0.00 173.24 173.65 1gof s ILE 140 N -0.39 -0.31 -0.02 -1.02 1.01 -0.83 -4.62 121.20 115.02 1gof s ILE 140 Ca -0.05 0.33 -0.24 0.00 0.00 0.00 0.00 60.65 60.69 1gof s ILE 140 Cb -0.03 -0.34 -0.20 0.00 0.01 0.00 0.00 42.46 41.90 1gof s ILE 140 CO 0.00 0.13 1.19 0.00 0.00 0.00 0.00 174.94 176.26 1gof h ALA 141 N 8.34 0.08 -2.71 9.38 0.00 -1.27 -0.25 119.26 132.82 1gof h ALA 141 Ca -0.13 -0.35 -0.13 0.00 0.00 0.00 0.00 54.91 54.30 1gof h ALA 141 Cb 1.12 -0.01 -0.23 0.00 0.00 0.00 0.00 17.79 18.67 1gof h ALA 141 CO 0.14 -0.02 -0.26 -1.21 0.00 0.00 0.00 179.25 177.90 1gof s GLU 142 N -3.80 0.52 -0.06 0.00 0.41 -1.10 -4.09 118.70 110.59 1gof s GLU 142 Ca -0.15 0.31 0.01 0.00 -0.41 0.00 0.00 54.97 54.73 1gof s GLU 142 Cb 0.02 0.25 0.02 0.00 -1.78 0.00 0.00 34.13 32.64 1gof s GLU 142 CO 0.72 -0.10 -0.08 -1.50 -0.49 0.00 0.00 175.26 173.81 1gof s ILE 143 N -0.28 0.87 0.12 -1.63 2.07 -0.45 -0.12 121.20 121.78 1gof s ILE 143 Ca -0.04 -0.30 0.06 0.00 -1.41 0.00 0.00 60.65 58.95 1gof s ILE 143 Cb -0.03 -0.84 -0.04 0.00 0.13 0.00 0.00 42.46 41.68 1gof s ILE 143 CO 0.02 0.30 -0.14 0.20 -1.91 0.00 0.00 174.94 173.42 1gof s ASN 144 N 0.90 1.98 -0.03 4.50 0.01 -1.08 -4.76 114.94 116.45 1gof s ASN 144 Ca -0.11 -0.83 0.06 0.00 -0.71 0.00 0.00 52.86 51.27 1gof s ASN 144 Cb -0.15 -0.06 -0.01 0.00 0.41 0.00 0.00 41.25 41.44 1gof s ASN 144 CO 0.01 -0.16 -0.21 -0.69 -1.51 0.00 0.00 177.10 174.54 1gof s VAL 145 N -2.24 1.66 0.11 1.60 1.01 -1.26 -1.56 120.40 119.71 1gof s VAL 145 Ca 0.10 -0.87 0.06 0.00 0.00 0.00 0.00 61.98 61.26 1gof s VAL 145 Cb -0.04 -1.40 -0.04 0.00 0.00 0.00 0.00 36.38 34.90 1gof s VAL 145 CO 0.03 0.47 -0.02 -0.36 0.00 0.00 0.00 175.10 175.22 1gof s PHE 146 N -0.27 2.91 0.10 5.22 0.40 0.11 -0.32 117.98 126.13 1gof s PHE 146 Ca 0.02 -0.08 0.08 0.00 -0.60 0.00 0.00 56.93 56.36 1gof s PHE 146 Cb -0.10 -1.48 -0.04 0.00 0.51 0.00 0.00 43.02 41.91 1gof s PHE 146 CO 0.01 0.48 -0.21 1.14 0.70 0.00 0.00 175.22 177.34 1gof s GLN 147 N -2.44 1.14 0.58 0.44 -2.07 0.24 -1.02 119.66 116.53 1gof s GLN 147 Ca 0.25 -1.18 -0.10 0.00 -1.82 0.00 0.00 55.36 52.51 1gof s GLN 147 Cb -0.11 -1.41 -0.04 0.00 -1.09 0.00 0.00 33.01 30.36 1gof s GLN 147 CO 0.18 0.33 0.97 0.00 -1.32 0.00 0.00 175.29 175.44 1gof s ALA 148 N -1.18 3.16 0.38 2.60 0.00 -0.09 -1.07 121.76 125.57 1gof s ALA 148 Ca 0.07 -0.14 0.16 0.00 0.00 0.00 0.00 51.96 52.05 1gof s ALA 148 Cb -0.10 -2.98 0.93 0.00 0.00 0.00 0.00 23.12 20.97 1gof s ALA 148 CO 0.04 -0.56 1.91 0.66 0.00 0.00 0.00 175.76 177.81 1gof h SER 149 N -0.05 0.00 -5.01 0.00 4.64 -1.94 -3.45 113.55 107.74 1gof h SER 149 Ca -0.45 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 60.91 1gof h SER 149 Cb 1.19 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.21 1gof h SER 149 CO 0.62 0.28 0.21 -0.94 -0.87 0.00 0.00 176.83 176.13 1gof s SER 150 N -6.76 -0.35 -0.13 4.97 1.04 -1.26 -5.12 113.70 106.10 1gof s SER 150 Ca -0.03 -0.43 0.02 0.00 0.48 0.00 0.00 55.95 55.99 1gof s SER 150 Cb 0.14 0.69 0.01 0.00 0.10 0.00 0.00 66.02 66.96 1gof s SER 150 CO 0.69 -1.23 -0.18 -0.47 0.98 0.00 0.00 173.24 173.03 1gof s TYR 151 N -3.87 2.29 -0.19 5.02 5.04 -1.26 -5.04 117.35 119.34 1gof s TYR 151 Ca 0.08 -1.14 0.00 0.00 -2.44 0.00 0.00 57.07 53.57 1gof s TYR 151 Cb -0.04 -1.61 0.05 0.00 0.35 0.00 0.00 41.96 40.70 1gof s TYR 151 CO 0.01 -0.56 -0.07 0.99 -1.34 0.00 0.00 175.55 174.59 1gof s THR 152 N 0.96 1.34 0.24 4.34 2.01 -1.26 -5.12 115.64 118.16 1gof s THR 152 Ca -0.06 -0.85 -0.31 0.00 0.31 0.00 0.00 61.69 60.79 1gof s THR 152 Cb -0.15 -1.51 -0.11 0.00 0.01 0.00 0.00 72.50 70.75 1gof s THR 152 CO -0.03 0.09 1.57 0.00 -0.69 0.00 0.00 174.62 175.57 1gof s ALA 153 N 1.52 3.75 0.49 7.40 0.00 -1.26 -4.94 121.76 128.73 1gof s ALA 153 Ca -0.01 1.47 -0.22 0.00 0.00 0.00 0.00 51.96 53.20 1gof s ALA 153 Cb -0.16 -3.63 -0.08 0.00 0.00 0.00 0.00 23.12 19.25 1gof s ALA 153 CO -0.08 -0.87 1.03 -2.30 0.00 0.00 0.00 175.76 173.55 1gof n PRO 154 N 2.88 1.27 -3.12 0.00 -0.01 -1.26 -4.93 135.00 129.83 1gof n PRO 154 Ca 0.10 0.47 -0.38 0.00 -0.01 0.00 0.00 63.50 63.68 1gof n PRO 154 Cb 0.38 -2.15 -0.06 0.00 -0.01 0.00 0.00 33.50 31.66 1gof n PRO 154 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 175.50 174.84 1gof s GLN 155 N -2.34 4.31 0.41 -0.52 -0.21 -1.26 -5.03 119.66 115.03 1gof s GLN 155 Ca 0.68 0.90 -0.25 0.00 0.02 0.00 0.00 55.36 56.70 1gof s GLN 155 Cb -0.49 -3.07 -0.08 0.00 1.00 0.00 0.00 33.01 30.37 1gof s GLN 155 CO 0.53 0.50 1.21 -1.25 -2.12 0.00 0.00 175.29 174.17 1gof s PRO 156 N -1.56 3.98 0.00 2.91 0.04 -1.26 -3.13 135.00 135.99 1gof s PRO 156 Ca 0.38 1.93 0.00 0.00 0.04 0.00 0.00 61.00 63.35 1gof s PRO 156 Cb -0.19 -2.67 0.00 0.00 0.04 0.00 0.00 34.50 31.68 1gof s PRO 156 CO 0.22 -0.41 0.00 0.41 0.04 0.00 0.00 177.00 177.26 1gof n GLY 157 N 0.64 1.24 1.35 0.56 0.00 -1.26 -4.93 105.19 102.79 1gof n GLY 157 Ca 0.05 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.01 1gof n GLY 157 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1gof n LEU 158 N 0.00 4.65 -0.20 0.99 4.77 -1.18 -4.75 117.00 121.27 1gof n LEU 158 Ca 0.00 -3.60 0.03 0.00 -0.03 0.00 0.00 56.01 52.41 1gof n LEU 158 Cb 0.00 -0.66 -0.01 0.00 -2.33 0.00 0.00 43.42 40.42 1gof n LEU 158 CO 0.00 1.11 -0.07 0.61 -1.33 0.00 0.00 177.39 177.71 1gof n GLY 159 N -0.97 -2.11 3.06 -0.72 0.00 -1.26 -0.92 105.19 102.27 1gof n GLY 159 Ca 0.36 -1.44 -0.12 0.00 0.00 0.00 0.00 46.02 44.83 1gof n GLY 159 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1gof s ARG 160 N -2.27 0.33 -0.05 1.61 1.81 -0.22 -4.60 118.95 115.56 1gof s ARG 160 Ca 0.00 -0.12 -0.03 0.00 -1.72 0.00 0.00 55.73 53.86 1gof s ARG 160 Cb 0.00 0.14 -0.04 0.00 -0.45 0.00 0.00 34.95 34.60 1gof s ARG 160 CO 0.00 -0.07 0.10 -1.58 -0.68 0.00 0.00 175.30 173.07 1gof s TRP 161 N -0.69 3.39 0.00 -0.53 0.52 -1.26 -0.17 118.94 120.20 1gof s TRP 161 Ca -0.08 0.32 0.00 0.00 0.02 0.00 0.00 56.10 56.36 1gof s TRP 161 Cb -0.05 -1.82 0.00 0.00 -1.15 0.00 0.00 33.47 30.46 1gof s TRP 161 CO 0.01 0.60 0.00 0.41 0.02 0.00 0.00 176.95 177.99 1gof n GLY 162 N 1.54 3.91 2.11 0.98 0.00 0.15 -4.89 105.19 109.00 1gof n GLY 162 Ca -0.16 -1.59 -0.16 0.00 0.00 0.00 0.00 46.02 44.12 1gof n GLY 162 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1gof n PRO 163 N -1.43 -0.67 -3.50 1.61 -0.04 -1.26 -4.37 135.00 125.33 1gof n PRO 163 Ca 0.00 -1.14 -0.37 0.00 -0.04 0.00 0.00 63.50 61.94 1gof n PRO 163 Cb 0.00 -0.73 -0.06 0.00 -0.04 0.00 0.00 33.50 32.67 1gof n PRO 163 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 1gof s THR 164 N -2.54 5.18 -0.32 0.52 2.01 -0.99 -2.33 115.64 117.17 1gof s THR 164 Ca 0.41 0.72 -0.09 0.00 0.31 0.00 0.00 61.69 63.05 1gof s THR 164 Cb -0.01 -3.68 0.01 0.00 0.01 0.00 0.00 72.50 68.82 1gof s THR 164 CO 0.29 0.47 0.13 -0.63 -0.69 0.00 0.00 174.62 174.19 1gof s ILE 165 N -0.25 4.31 0.07 1.82 -1.09 0.07 -2.00 121.20 124.13 1gof s ILE 165 Ca 0.21 -0.65 -0.29 0.00 -2.23 0.00 0.00 60.65 57.69 1gof s ILE 165 Cb -0.15 -3.26 -0.05 0.00 -1.58 0.00 0.00 42.46 37.42 1gof s ILE 165 CO 0.09 -0.00 0.92 -1.81 -1.23 0.00 0.00 174.94 172.91 1gof s ASP 166 N 1.55 7.40 0.25 3.58 1.01 0.96 -1.78 116.67 129.64 1gof s ASP 166 Ca 0.03 1.68 0.11 0.00 0.71 0.00 0.00 52.55 55.08 1gof s ASP 166 Cb -0.18 -2.56 -0.05 0.00 1.01 0.00 0.00 42.92 41.15 1gof s ASP 166 CO 0.05 -0.09 -0.18 -0.76 0.21 0.00 0.00 175.17 174.39 1gof s LEU 167 N 0.23 2.57 0.00 1.23 1.43 0.18 -1.36 118.68 122.96 1gof s LEU 167 Ca 0.46 -1.02 0.28 0.00 -1.03 0.00 0.00 54.13 52.83 1gof s LEU 167 Cb -0.22 -0.97 1.25 0.00 0.03 0.00 0.00 46.19 46.28 1gof s LEU 167 CO 0.28 -0.02 1.92 -0.81 0.23 0.00 0.00 176.35 177.94 1gof n PRO 168 N -0.50 0.07 -4.25 1.29 -0.04 -1.04 -4.53 135.00 125.99 1gof n PRO 168 Ca -0.06 0.02 -0.14 0.00 -0.04 0.00 0.00 63.50 63.27 1gof n PRO 168 Cb 0.60 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.46 1gof n PRO 168 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 1gof s ILE 169 N -2.93 0.21 -0.35 0.52 -4.36 -1.26 -4.49 121.20 108.53 1gof s ILE 169 Ca 0.16 -2.00 -0.20 0.00 -0.26 0.00 0.00 60.65 58.35 1gof s ILE 169 Cb 0.19 -2.55 0.00 0.00 1.25 0.00 0.00 42.46 41.35 1gof s ILE 169 CO 0.50 0.00 0.60 -0.69 0.24 0.00 0.00 174.94 175.59 1gof s VAL 170 N -3.96 4.93 -1.14 8.37 1.01 -0.88 -4.40 120.40 124.31 1gof s VAL 170 Ca 0.38 0.52 -0.20 0.00 0.00 0.00 0.00 61.98 62.69 1gof s VAL 170 Cb 0.07 -4.04 0.07 0.00 0.00 0.00 0.00 36.38 32.49 1gof s VAL 170 CO 0.13 -0.28 1.55 -2.16 0.00 0.00 0.00 175.10 174.34 1gof s PRO 171 N 2.61 3.80 0.00 2.72 0.04 -1.26 -4.38 135.00 138.52 1gof s PRO 171 Ca 0.23 -1.65 0.27 0.00 0.04 0.00 0.00 61.00 59.89 1gof s PRO 171 Cb -0.15 -5.38 0.97 0.00 0.04 0.00 0.00 34.50 29.98 1gof s PRO 171 CO 0.14 -2.16 1.72 0.00 0.04 0.00 0.00 177.00 176.73 1gof n ALA 172 N 8.26 2.92 -3.15 8.56 0.00 -1.14 -4.25 120.51 131.71 1gof n ALA 172 Ca 0.39 -0.26 -0.13 0.00 0.00 0.00 0.00 53.44 53.45 1gof n ALA 172 Cb 0.48 -1.29 -0.13 0.00 0.00 0.00 0.00 19.45 18.52 1gof n ALA 172 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1gof s ALA 173 N -2.78 -0.40 0.11 0.00 0.00 -1.09 -4.17 121.76 113.43 1gof s ALA 173 Ca 0.19 0.52 -0.13 0.00 0.00 0.00 0.00 51.96 52.54 1gof s ALA 173 Cb 0.19 -0.31 0.02 0.00 0.00 0.00 0.00 23.12 23.02 1gof s ALA 173 CO 0.56 -0.09 0.31 0.00 0.00 0.00 0.00 175.76 176.54 1gof s ALA 174 N 0.26 -0.63 0.04 0.00 0.00 -0.53 -0.70 121.76 120.20 1gof s ALA 174 Ca -0.01 -0.29 -0.17 0.00 0.00 0.00 0.00 51.96 51.49 1gof s ALA 174 Cb -0.03 0.60 0.03 0.00 0.00 0.00 0.00 23.12 23.73 1gof s ALA 174 CO -0.01 -0.59 0.38 0.00 0.00 0.00 0.00 175.76 175.54 1gof s ALA 175 N -3.82 -0.91 0.04 0.00 0.00 0.85 -0.31 121.76 117.61 1gof s ALA 175 Ca 0.04 0.22 -0.19 0.00 0.00 0.00 0.00 51.96 52.02 1gof s ALA 175 Cb 0.03 0.34 -0.06 0.00 0.00 0.00 0.00 23.12 23.43 1gof s ALA 175 CO -0.12 -0.44 0.56 0.42 0.00 0.00 0.00 175.76 176.18 1gof s ILE 176 N -2.48 4.82 -0.49 0.00 -1.09 -1.13 -0.28 121.20 120.56 1gof s ILE 176 Ca -0.05 1.18 -0.22 0.00 -2.23 0.00 0.00 60.65 59.32 1gof s ILE 176 Cb -0.01 -3.88 0.04 0.00 -1.58 0.00 0.00 42.46 37.02 1gof s ILE 176 CO -0.03 0.52 0.77 -1.61 -1.23 0.00 0.00 174.94 173.36 1gof s GLU 177 N -0.82 3.30 0.24 2.79 2.02 0.85 -4.90 118.70 122.18 1gof s GLU 177 Ca 0.29 -0.36 -0.07 0.00 0.02 0.00 0.00 54.97 54.85 1gof s GLU 177 Cb -0.19 -4.00 0.23 0.00 0.10 0.00 0.00 34.13 30.27 1gof s GLU 177 CO 0.18 -1.22 1.89 -1.35 0.02 0.00 0.00 175.26 174.79 1gof h PRO 178 N 9.05 1.27 0.00 0.39 0.11 -1.94 0.74 132.00 141.62 1gof h PRO 178 Ca -0.26 -0.11 -0.11 0.00 0.11 0.00 0.00 66.00 65.63 1gof h PRO 178 Cb 1.09 -0.27 -0.02 0.00 0.11 0.00 0.00 31.00 31.91 1gof h PRO 178 CO 0.98 0.88 -0.53 1.79 -0.21 0.00 0.00 178.00 180.91 1gof h THR 179 N 1.30 1.20 0.00 -1.15 1.35 -1.91 -3.29 112.91 110.41 1gof h THR 179 Ca 0.34 -1.93 0.00 0.00 -0.55 0.00 0.00 66.41 64.27 1gof h THR 179 Cb -0.08 2.09 0.00 0.00 -1.73 0.00 0.00 68.15 68.44 1gof h THR 179 CO -0.07 0.52 -1.41 -1.54 -0.25 0.00 0.00 175.52 172.77 1gof n SER 180 N -3.65 1.07 0.00 5.36 3.41 -1.13 -4.99 113.62 113.69 1gof n SER 180 Ca -0.01 -0.30 0.00 0.00 -0.26 0.00 0.00 58.87 58.30 1gof n SER 180 Cb 0.59 1.49 0.00 0.00 -0.26 0.00 0.00 64.21 66.03 1gof n SER 180 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1gof n GLY 181 N 1.50 0.81 3.83 5.00 0.00 0.26 -5.02 105.19 111.58 1gof n GLY 181 Ca -0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.69 1gof n GLY 181 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1gof s ARG 182 N -0.16 3.99 -0.25 1.61 0.52 -1.21 -4.60 118.95 118.86 1gof s ARG 182 Ca 0.00 1.02 -0.17 0.00 -0.52 0.00 0.00 55.73 56.06 1gof s ARG 182 Cb 0.00 -2.14 -0.03 0.00 0.52 0.00 0.00 34.95 33.30 1gof s ARG 182 CO 0.00 -0.24 0.46 0.08 0.02 0.00 0.00 175.30 175.63 1gof s VAL 183 N -2.48 5.12 -0.21 3.52 1.01 0.41 -0.10 120.40 127.67 1gof s VAL 183 Ca 0.60 0.79 -0.13 0.00 0.00 0.00 0.00 61.98 63.23 1gof s VAL 183 Cb -0.10 -3.78 -0.04 0.00 0.00 0.00 0.00 36.38 32.45 1gof s VAL 183 CO 0.26 0.14 0.28 -0.22 0.00 0.00 0.00 175.10 175.57 1gof s LEU 184 N 2.00 4.15 0.09 3.92 2.96 0.62 -1.14 118.68 131.29 1gof s LEU 184 Ca 0.20 0.35 0.07 0.00 -0.22 0.00 0.00 54.13 54.52 1gof s LEU 184 Cb -0.15 -2.32 -0.03 0.00 0.50 0.00 0.00 46.19 44.18 1gof s LEU 184 CO 0.09 0.01 -0.18 -0.04 -1.32 0.00 0.00 176.35 174.91 1gof s MET 185 N 1.07 1.02 0.09 1.98 -1.94 -0.01 -0.10 119.30 121.41 1gof s MET 185 Ca 0.14 -1.10 -0.11 0.00 -1.71 0.00 0.00 55.69 52.91 1gof s MET 185 Cb -0.14 -1.17 0.01 0.00 2.01 0.00 0.00 34.83 35.55 1gof s MET 185 CO 0.06 0.26 0.25 1.67 -0.01 0.00 0.00 175.02 177.25 1gof s TRP 186 N -1.28 0.04 0.00 -0.03 -2.14 0.12 -1.07 118.94 114.57 1gof s TRP 186 Ca 0.04 -0.41 0.00 0.00 2.66 0.00 0.00 56.10 58.39 1gof s TRP 186 Cb -0.10 0.04 0.00 0.00 -3.10 0.00 0.00 33.47 30.31 1gof s TRP 186 CO 0.04 -0.58 0.00 -1.13 -2.66 0.00 0.00 176.95 172.61 1gof n SER 187 N -0.05 0.00 0.00 -2.66 3.41 -0.68 -2.67 113.62 110.97 1gof n SER 187 Ca -0.16 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.45 1gof n SER 187 Cb 0.62 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.57 1gof n SER 187 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1gof n SER 188 N 0.00 0.48 0.28 4.04 2.88 -1.26 -3.97 113.62 116.06 1gof n SER 188 Ca 0.00 0.00 0.17 0.00 -1.33 0.00 0.00 58.87 57.71 1gof n SER 188 Cb 0.00 0.00 0.71 0.00 -0.75 0.00 0.00 64.21 64.17 1gof n SER 188 CO 0.00 0.00 0.00 0.10 -1.23 0.00 0.00 175.04 173.91 1gof h TYR 189 N 0.00 0.00 -2.24 0.66 -0.00 -1.72 0.27 116.97 113.94 1gof h TYR 189 Ca 0.00 0.00 -0.57 0.00 -0.00 0.00 0.00 58.73 58.16 1gof h TYR 189 Cb 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 36.73 36.59 1gof h TYR 189 CO 0.00 0.01 -0.69 1.03 -0.00 0.00 0.00 178.16 178.51 1gof s ARG 190 N -3.70 1.69 0.42 0.10 0.52 -1.22 -4.61 118.95 112.15 1gof s ARG 190 Ca 0.01 -1.85 0.23 0.00 -0.52 0.00 0.00 55.73 53.59 1gof s ARG 190 Cb 0.09 -1.51 0.74 0.00 0.52 0.00 0.00 34.95 34.79 1gof s ARG 190 CO 0.54 0.13 1.75 -2.95 0.02 0.00 0.00 175.30 174.79 1gof h ASN 191 N 2.16 0.00 0.00 0.23 -1.07 -1.88 -3.34 115.58 111.68 1gof h ASN 191 Ca -0.41 0.00 0.00 0.00 0.07 0.00 0.00 56.30 55.96 1gof h ASN 191 Cb 1.24 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.49 1gof h ASN 191 CO 0.68 0.25 -0.31 -0.90 0.07 0.00 0.00 177.43 177.22 1gof n ASP 192 N -3.33 0.65 -3.50 6.14 5.75 -1.26 -2.08 116.55 118.91 1gof n ASP 192 Ca 0.01 -2.17 -0.12 0.00 -0.01 0.00 0.00 54.79 52.50 1gof n ASP 192 Cb 0.49 -0.23 -0.04 0.00 -1.03 0.00 0.00 41.12 40.31 1gof n ASP 192 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1gof s ALA 193 N -0.74 -1.78 0.00 2.12 0.00 -1.26 -0.76 121.76 119.35 1gof s ALA 193 Ca 0.08 1.07 0.00 0.00 0.00 0.00 0.00 51.96 53.11 1gof s ALA 193 Cb 0.07 0.21 0.00 0.00 0.00 0.00 0.00 23.12 23.40 1gof s ALA 193 CO 0.01 -0.56 0.00 1.97 0.00 0.00 0.00 175.76 177.18 1gof n PHE 194 N 0.18 0.00 -2.03 0.00 1.16 -1.26 -3.41 117.46 112.10 1gof n PHE 194 Ca -0.13 0.00 -0.42 0.00 -1.87 0.00 0.00 57.45 55.03 1gof n PHE 194 Cb 0.61 0.00 -0.03 0.00 -1.61 0.00 0.00 39.48 38.45 1gof n PHE 194 CO 0.00 0.00 0.00 0.20 -1.87 0.00 0.00 176.76 175.09 1gof s GLY 195 N -1.94 2.00 0.00 4.97 0.00 -1.26 -2.93 107.32 108.15 1gof s GLY 195 Ca 0.00 1.28 0.00 0.00 0.00 0.00 0.00 44.72 46.00 1gof s GLY 195 CO 0.00 2.40 0.00 0.61 0.00 0.00 0.00 173.10 176.11 1gof n GLY 196 N 3.01 0.65 3.75 0.20 0.00 -1.26 -5.04 105.19 106.50 1gof n GLY 196 Ca 0.10 -0.42 -0.41 0.00 0.00 0.00 0.00 46.02 45.29 1gof n GLY 196 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1gof s SER 197 N -2.38 6.67 0.00 1.61 0.15 -1.15 -4.84 113.70 113.76 1gof s SER 197 Ca 0.00 2.66 0.25 0.00 0.70 0.00 0.00 55.95 59.56 1gof s SER 197 Cb 0.00 -2.62 1.50 0.00 -1.71 0.00 0.00 66.02 63.19 1gof s SER 197 CO 0.00 -0.69 1.87 -0.81 1.20 0.00 0.00 173.24 174.82 1gof n PRO 198 N 2.24 0.82 -0.41 5.44 -0.04 -1.26 -5.00 135.00 136.79 1gof n PRO 198 Ca 0.06 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.57 1gof n PRO 198 Cb 0.40 -1.48 -0.02 0.00 -0.04 0.00 0.00 33.50 32.36 1gof n PRO 198 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1gof n GLY 199 N 0.62 -2.22 1.67 0.55 0.00 -1.26 -4.97 105.19 99.59 1gof n GLY 199 Ca 0.19 -1.38 0.00 0.00 0.00 0.00 0.00 46.02 44.83 1gof n GLY 199 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gof n GLY 200 N -2.97 1.31 3.01 -0.02 0.00 -1.26 -4.83 105.19 100.42 1gof n GLY 200 Ca -0.01 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.89 1gof n GLY 200 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1gof s ILE 201 N -2.78 0.02 -0.03 -0.61 2.07 -1.25 -3.59 121.20 115.03 1gof s ILE 201 Ca 0.00 -0.16 0.01 0.00 -1.41 0.00 0.00 60.65 59.10 1gof s ILE 201 Cb 0.00 -0.22 0.02 0.00 0.13 0.00 0.00 42.46 42.39 1gof s ILE 201 CO 0.00 -0.09 -0.05 -0.89 -1.91 0.00 0.00 174.94 172.00 1gof s THR 202 N -0.24 0.53 -0.13 4.00 2.01 -0.19 -3.58 115.64 118.04 1gof s THR 202 Ca -0.03 -0.16 -0.20 0.00 0.31 0.00 0.00 61.69 61.61 1gof s THR 202 Cb -0.02 -0.53 -0.04 0.00 0.01 0.00 0.00 72.50 71.92 1gof s THR 202 CO 0.00 0.21 0.57 -0.76 -0.69 0.00 0.00 174.62 173.95 1gof s LEU 203 N 0.67 4.24 0.33 4.42 1.02 0.94 0.48 118.68 130.79 1gof s LEU 203 Ca -0.09 0.90 0.10 0.00 0.02 0.00 0.00 54.13 55.05 1gof s LEU 203 Cb -0.12 -2.84 -0.06 0.00 0.02 0.00 0.00 46.19 43.19 1gof s LEU 203 CO 0.00 -0.11 -0.06 0.42 0.02 0.00 0.00 176.35 176.62 1gof s THR 204 N 1.06 2.49 -0.03 5.49 -4.23 0.31 -1.69 115.64 119.04 1gof s THR 204 Ca 0.29 -2.13 -0.17 0.00 -1.18 0.00 0.00 61.69 58.51 1gof s THR 204 Cb -0.16 -2.67 0.03 0.00 1.34 0.00 0.00 72.50 71.04 1gof s THR 204 CO 0.12 -0.24 0.37 -0.55 -0.54 0.00 0.00 174.62 173.79 1gof s SER 205 N -3.64 -0.28 0.05 3.99 0.15 -0.23 -1.27 113.70 112.47 1gof s SER 205 Ca 0.33 0.25 0.04 0.00 0.70 0.00 0.00 55.95 57.27 1gof s SER 205 Cb -0.00 0.40 -0.02 0.00 -1.71 0.00 0.00 66.02 64.68 1gof s SER 205 CO 0.18 -0.44 -0.12 -0.94 1.20 0.00 0.00 173.24 173.12 1gof s SER 206 N -1.15 1.35 -0.07 5.45 1.04 0.02 -0.83 113.70 119.52 1gof s SER 206 Ca -0.12 -0.54 0.03 0.00 0.48 0.00 0.00 55.95 55.81 1gof s SER 206 Cb -0.04 -0.03 0.00 0.00 0.10 0.00 0.00 66.02 66.05 1gof s SER 206 CO 0.05 -0.09 -0.17 0.86 0.98 0.00 0.00 173.24 174.86 1gof s TRP 207 N -1.18 1.85 -0.41 5.02 -0.00 -0.29 -1.21 118.94 122.72 1gof s TRP 207 Ca -0.04 -0.66 -0.07 0.00 -0.00 0.00 0.00 56.10 55.33 1gof s TRP 207 Cb -0.09 -1.28 0.08 0.00 -0.00 0.00 0.00 33.47 32.19 1gof s TRP 207 CO 0.01 -0.27 0.23 0.34 -0.00 0.00 0.00 176.95 177.26 1gof s ASP 208 N 0.35 5.50 0.60 5.86 -1.08 -0.79 -0.45 116.67 126.66 1gof s ASP 208 Ca -0.12 -1.60 0.30 0.00 -0.52 0.00 0.00 52.55 50.61 1gof s ASP 208 Cb -0.15 -1.93 1.78 0.00 -1.46 0.00 0.00 42.92 41.16 1gof s ASP 208 CO 0.05 -0.52 2.19 -0.65 0.52 0.00 0.00 175.17 176.75 1gof h PRO 209 N 8.30 0.00 0.11 4.34 0.11 -1.90 0.68 132.00 143.65 1gof h PRO 209 Ca -0.21 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 65.72 1gof h PRO 209 Cb 1.07 0.00 0.02 0.00 0.11 0.00 0.00 31.00 32.20 1gof h PRO 209 CO 0.73 0.00 -0.78 0.66 -0.21 0.00 0.00 178.00 178.40 1gof h SER 210 N 0.00 0.49 0.41 -2.05 4.64 -1.93 -3.36 113.55 111.75 1gof h SER 210 Ca 0.04 -0.91 0.00 0.00 -0.47 0.00 0.00 61.79 60.44 1gof h SER 210 Cb 0.23 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 1gof h SER 210 CO -0.00 1.36 -1.41 0.35 -0.87 0.00 0.00 176.83 176.26 1gof n THR 211 N -4.14 0.23 -0.98 2.95 -2.24 -1.01 -4.98 114.28 104.11 1gof n THR 211 Ca -0.13 -0.43 0.00 0.00 -2.27 0.00 0.00 64.05 61.22 1gof n THR 211 Cb 0.80 -0.01 0.00 0.00 -2.10 0.00 0.00 70.33 69.02 1gof n THR 211 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1gof n GLY 212 N 1.27 0.91 3.71 3.38 0.00 0.23 -5.00 105.19 109.70 1gof n GLY 212 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 1gof n GLY 212 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1gof s ILE 213 N -3.67 4.63 -0.23 -0.61 1.01 -1.24 -4.74 121.20 116.35 1gof s ILE 213 Ca 0.00 1.94 -0.08 0.00 0.00 0.00 0.00 60.65 62.51 1gof s ILE 213 Cb 0.00 -4.24 -0.03 0.00 0.01 0.00 0.00 42.46 38.20 1gof s ILE 213 CO 0.00 0.18 0.08 -0.69 0.00 0.00 0.00 174.94 174.50 1gof s VAL 214 N 0.84 4.50 0.20 2.92 1.01 -1.26 -1.89 120.40 126.73 1gof s VAL 214 Ca 0.52 -0.12 0.10 0.00 0.00 0.00 0.00 61.98 62.49 1gof s VAL 214 Cb -0.23 -3.09 -0.04 0.00 0.00 0.00 0.00 36.38 33.02 1gof s VAL 214 CO 0.29 0.36 -0.20 -0.94 0.00 0.00 0.00 175.10 174.61 1gof s SER 215 N 1.32 3.07 0.07 3.32 1.04 -0.35 -4.74 113.70 117.42 1gof s SER 215 Ca 0.05 -0.92 0.06 0.00 0.48 0.00 0.00 55.95 55.63 1gof s SER 215 Cb -0.15 -0.21 -0.03 0.00 0.10 0.00 0.00 66.02 65.73 1gof s SER 215 CO 0.04 0.01 -0.17 1.51 0.98 0.00 0.00 173.24 175.61 1gof s ASP 216 N -2.92 2.02 -0.20 7.02 -4.77 -1.26 -0.80 116.67 115.76 1gof s ASP 216 Ca 0.21 -0.57 -0.13 0.00 -3.30 0.00 0.00 52.55 48.75 1gof s ASP 216 Cb -0.06 -0.11 0.06 0.00 -1.09 0.00 0.00 42.92 41.72 1gof s ASP 216 CO 0.09 0.03 0.50 -0.60 0.70 0.00 0.00 175.17 175.89 1gof s ARG 217 N -1.52 0.52 -0.09 2.11 3.52 -0.39 -4.97 118.95 118.13 1gof s ARG 217 Ca 0.03 0.85 -0.19 0.00 -0.13 0.00 0.00 55.73 56.29 1gof s ARG 217 Cb -0.09 0.11 -0.04 0.00 -1.56 0.00 0.00 34.95 33.37 1gof s ARG 217 CO 0.02 -0.13 0.52 0.99 -0.81 0.00 0.00 175.30 175.90 1gof s THR 218 N 1.08 5.12 -0.17 4.11 2.01 -1.26 -0.53 115.64 125.99 1gof s THR 218 Ca -0.07 1.06 -0.02 0.00 0.31 0.00 0.00 61.69 62.98 1gof s THR 218 Cb -0.06 -3.86 -0.01 0.00 0.01 0.00 0.00 72.50 68.58 1gof s THR 218 CO -0.10 0.34 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.40 1gof s VAL 219 N 0.44 3.22 0.00 3.82 1.01 0.18 -4.91 120.40 124.16 1gof s VAL 219 Ca 0.28 -0.57 0.00 0.00 0.00 0.00 0.00 61.98 61.69 1gof s VAL 219 Cb -0.16 -2.41 0.00 0.00 0.00 0.00 0.00 36.38 33.81 1gof s VAL 219 CO 0.13 0.48 0.00 0.35 0.00 0.00 0.00 175.10 176.05 1gof n THR 220 N 4.14 0.00 0.26 3.92 -2.24 -1.26 -1.02 114.28 118.08 1gof n THR 220 Ca -0.18 -0.26 0.10 0.00 -2.27 0.00 0.00 64.05 61.43 1gof n THR 220 Cb 0.52 0.96 0.68 0.00 -2.10 0.00 0.00 70.33 70.39 1gof n THR 220 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 1gof h VAL 221 N 0.00 0.92 -0.27 2.28 3.04 -1.91 0.06 116.25 120.37 1gof h VAL 221 Ca 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 1gof h VAL 221 Cb 0.00 0.99 0.00 0.00 -2.01 0.00 0.00 31.29 30.27 1gof h VAL 221 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.57 176.91 1gof n THR 222 N -4.43 0.34 -3.94 3.17 -2.24 -1.26 -4.73 114.28 101.19 1gof n THR 222 Ca -0.03 -0.59 -0.26 0.00 -2.27 0.00 0.00 64.05 60.90 1gof n THR 222 Cb 0.11 0.88 -0.01 0.00 -2.10 0.00 0.00 70.33 69.20 1gof n THR 222 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1gof n LYS 223 N 1.12 -3.76 -3.70 -0.78 5.02 0.01 -4.92 118.16 111.14 1gof n LYS 223 Ca 0.18 0.46 -0.17 0.00 -2.02 0.00 0.00 58.31 56.75 1gof n LYS 223 Cb 0.52 -4.79 -0.16 0.00 -0.02 0.00 0.00 35.03 30.58 1gof n LYS 223 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 1gof s HIS 224 N -3.78 -0.05 -0.65 2.13 2.46 -1.24 -4.16 115.29 110.02 1gof s HIS 224 Ca 0.14 0.36 -0.21 0.00 0.47 0.00 0.00 55.06 55.83 1gof s HIS 224 Cb -0.08 -0.31 0.09 0.00 -0.13 0.00 0.00 32.58 32.16 1gof s HIS 224 CO 0.87 -0.19 0.86 0.34 -2.47 0.00 0.00 174.74 174.15 1gof s ASP 225 N 1.81 6.21 0.00 9.88 -1.08 -1.25 -3.53 116.67 128.71 1gof s ASP 225 Ca -0.01 -1.27 0.00 0.00 -0.52 0.00 0.00 52.55 50.76 1gof s ASP 225 Cb -0.12 -2.36 0.00 0.00 -1.46 0.00 0.00 42.92 38.98 1gof s ASP 225 CO -0.04 -1.27 0.41 0.23 0.52 0.00 0.00 175.17 175.02 1gof n MET 226 N 6.99 0.80 -2.61 4.34 2.81 -1.26 -2.77 117.12 125.41 1gof n MET 226 Ca -0.05 0.00 -0.37 0.00 -1.81 0.00 0.00 57.70 55.47 1gof n MET 226 Cb 0.44 -1.39 -0.05 0.00 -0.71 0.00 0.00 33.22 31.51 1gof n MET 226 CO 0.00 0.00 0.00 0.12 1.51 0.00 0.00 175.97 177.60 1gof s PHE 227 N -1.02 3.44 -1.16 2.03 5.36 -1.25 -3.87 117.98 121.50 1gof s PHE 227 Ca 0.00 1.69 -0.04 0.00 -0.96 0.00 0.00 56.93 57.63 1gof s PHE 227 Cb 0.00 -3.08 0.00 0.00 -0.34 0.00 0.00 43.02 39.61 1gof s PHE 227 CO 0.00 -0.34 0.99 0.00 -1.46 0.00 0.00 175.22 174.41 1gof s PRO 229 N -5.69 2.46 0.26 0.00 0.04 -1.25 -1.55 135.00 129.27 1gof s PRO 229 Ca 0.25 -1.62 -0.18 0.00 0.04 0.00 0.00 61.00 59.49 1gof s PRO 229 Cb -0.11 -2.45 -0.09 0.00 0.04 0.00 0.00 34.50 31.89 1gof s PRO 229 CO 0.66 -0.48 0.74 0.20 0.04 0.00 0.00 177.00 178.16 1gof s GLY 230 N -4.34 2.52 -0.03 0.56 0.00 -0.49 -4.68 107.32 100.86 1gof s GLY 230 Ca 0.50 0.13 -0.00 0.00 0.00 0.00 0.00 44.72 45.35 1gof s GLY 230 CO 0.30 0.44 0.02 -0.42 0.00 0.00 0.00 173.10 173.44 1gof s ILE 231 N -1.69 0.04 -0.05 0.90 1.01 -1.26 -0.65 121.20 119.50 1gof s ILE 231 Ca 0.47 0.19 -0.07 0.00 0.00 0.00 0.00 60.65 61.24 1gof s ILE 231 Cb -0.14 -0.18 0.01 0.00 0.01 0.00 0.00 42.46 42.16 1gof s ILE 231 CO 0.20 0.13 0.19 -0.44 0.00 0.00 0.00 174.94 175.01 1gof s SER 232 N 1.23 -0.15 -0.31 3.58 0.01 -0.72 -4.52 113.70 112.82 1gof s SER 232 Ca -0.07 0.23 -0.20 0.00 1.31 0.00 0.00 55.95 57.21 1gof s SER 232 Cb -0.13 0.35 -0.01 0.00 0.21 0.00 0.00 66.02 66.44 1gof s SER 232 CO -0.03 -0.17 0.63 -0.32 0.41 0.00 0.00 173.24 173.76 1gof s MET 233 N -0.36 3.88 0.46 12.44 1.75 -1.26 0.69 119.30 136.89 1gof s MET 233 Ca -0.05 0.26 -0.08 0.00 -1.25 0.00 0.00 55.69 54.58 1gof s MET 233 Cb -0.03 -3.74 0.11 0.00 2.84 0.00 0.00 34.83 34.01 1gof s MET 233 CO 0.01 -0.58 0.57 -0.40 -0.65 0.00 0.00 175.02 173.96 1gof n ASP 234 N 5.89 -0.28 0.28 1.11 5.68 0.10 -4.73 116.55 124.60 1gof n ASP 234 Ca -0.01 -1.12 0.15 0.00 -0.50 0.00 0.00 54.79 53.30 1gof n ASP 234 Cb 0.49 -0.45 0.85 0.00 -1.14 0.00 0.00 41.12 40.87 1gof n ASP 234 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 1gof h GLY 235 N -0.93 0.00 0.55 6.12 0.00 -1.21 -1.02 103.07 106.59 1gof h GLY 235 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.14 1gof h GLY 235 CO 0.13 0.00 -0.17 0.70 0.00 0.00 0.00 176.54 177.20 1gof n ASN 236 N -3.65 0.76 0.00 0.19 3.02 -1.26 -3.95 115.26 110.37 1gof n ASN 236 Ca -0.02 -0.75 0.00 0.00 -0.03 0.00 0.00 54.58 53.78 1gof n ASN 236 Cb 0.16 0.03 0.00 0.00 -0.61 0.00 0.00 39.78 39.36 1gof n ASN 236 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1gof n GLY 237 N 1.30 0.69 3.80 7.41 0.00 -0.39 -5.02 105.19 112.99 1gof n GLY 237 Ca 0.13 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.78 1gof n GLY 237 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1gof s GLN 238 N -0.29 4.36 -0.19 1.61 -0.21 -1.26 -4.61 119.66 119.07 1gof s GLN 238 Ca 0.00 0.96 -0.20 0.00 0.02 0.00 0.00 55.36 56.14 1gof s GLN 238 Cb 0.00 -3.05 -0.03 0.00 1.00 0.00 0.00 33.01 30.93 1gof s GLN 238 CO 0.00 0.48 0.59 0.42 -2.12 0.00 0.00 175.29 174.66 1gof s ILE 239 N -1.35 5.06 -0.34 1.08 1.01 -0.17 0.03 121.20 126.52 1gof s ILE 239 Ca 0.39 1.11 -0.12 0.00 0.00 0.00 0.00 60.65 62.03 1gof s ILE 239 Cb -0.19 -3.91 -0.01 0.00 0.01 0.00 0.00 42.46 38.36 1gof s ILE 239 CO 0.23 0.15 0.22 -0.69 0.00 0.00 0.00 174.94 174.84 1gof s VAL 240 N 1.72 5.06 -0.25 2.92 1.01 0.22 -1.29 120.40 129.78 1gof s VAL 240 Ca 0.27 -0.33 -0.06 0.00 0.00 0.00 0.00 61.98 61.87 1gof s VAL 240 Cb -0.16 -3.61 -0.01 0.00 0.00 0.00 0.00 36.38 32.60 1gof s VAL 240 CO 0.10 -0.01 0.02 -0.69 0.00 0.00 0.00 175.10 174.52 1gof s VAL 241 N 1.68 3.78 -0.02 2.92 1.01 -0.53 -1.75 120.40 127.49 1gof s VAL 241 Ca 0.05 -0.48 0.07 0.00 0.00 0.00 0.00 61.98 61.62 1gof s VAL 241 Cb -0.17 -2.81 -0.02 0.00 0.00 0.00 0.00 36.38 33.38 1gof s VAL 241 CO 0.09 0.29 -0.22 0.42 0.00 0.00 0.00 175.10 175.68 1gof s THR 242 N 1.52 1.75 0.00 3.92 -4.23 0.18 -1.67 115.64 117.10 1gof s THR 242 Ca 0.05 -0.94 0.00 0.00 -1.18 0.00 0.00 61.69 59.62 1gof s THR 242 Cb -0.15 -1.45 0.00 0.00 1.34 0.00 0.00 72.50 72.23 1gof s THR 242 CO 0.00 0.49 0.00 0.61 -0.54 0.00 0.00 174.62 175.19 1gof n GLY 243 N 2.59 1.21 1.90 3.99 0.00 0.22 -1.39 105.19 113.70 1gof n GLY 243 Ca -0.16 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.27 1gof n GLY 243 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gof n GLY 244 N 0.00 0.81 0.36 -0.02 0.00 -0.01 -4.21 105.19 102.13 1gof n GLY 244 Ca 0.00 -1.20 0.08 0.00 0.00 0.00 0.00 46.02 44.90 1gof n GLY 244 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1gof h ASN 245 N 0.00 0.65 -4.17 1.61 2.35 -0.83 -2.86 115.58 112.34 1gof h ASN 245 Ca 0.00 0.01 -0.70 0.00 -0.55 0.00 0.00 56.30 55.06 1gof h ASN 245 Cb 0.00 -0.13 -0.35 0.00 0.05 0.00 0.00 38.32 37.89 1gof h ASN 245 CO 0.00 0.40 -0.35 -1.81 -1.65 0.00 0.00 177.43 174.02 1gof s ASP 246 N -6.13 5.25 0.56 5.81 1.01 -1.16 -4.91 116.67 117.10 1gof s ASP 246 Ca -0.10 -2.90 0.28 0.00 0.71 0.00 0.00 52.55 50.55 1gof s ASP 246 Cb 0.20 -1.86 1.47 0.00 1.01 0.00 0.00 42.92 43.74 1gof s ASP 246 CO 0.77 -0.36 1.94 0.00 0.21 0.00 0.00 175.17 177.73 1gof h ALA 247 N 6.98 2.41 -0.02 5.23 0.00 -1.74 -2.46 119.26 129.65 1gof h ALA 247 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1gof h ALA 247 Cb 0.95 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1gof h ALA 247 CO 0.71 -0.76 -0.14 1.63 0.00 0.00 0.00 179.25 180.69 1gof n LYS 248 N -4.05 1.61 -2.43 0.00 5.02 -1.26 -1.08 118.16 115.97 1gof n LYS 248 Ca 0.11 -1.34 -0.31 0.00 -2.02 0.00 0.00 58.31 54.74 1gof n LYS 248 Cb 0.70 -1.35 -0.02 0.00 -0.02 0.00 0.00 35.03 34.33 1gof n LYS 248 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1gof s LYS 249 N -1.76 3.83 -0.07 1.97 -0.14 -0.93 -1.00 119.74 121.63 1gof s LYS 249 Ca 0.19 0.76 0.02 0.00 -1.36 0.00 0.00 55.97 55.58 1gof s LYS 249 Cb 0.15 -2.20 0.02 0.00 -1.68 0.00 0.00 37.83 34.12 1gof s LYS 249 CO 0.32 -0.26 -0.11 0.99 -0.76 0.00 0.00 175.35 175.53 1gof s THR 250 N -2.67 1.06 -0.02 2.17 2.01 -1.25 0.73 115.64 117.67 1gof s THR 250 Ca 0.56 -0.42 0.07 0.00 0.31 0.00 0.00 61.69 62.21 1gof s THR 250 Cb -0.10 -1.00 -0.02 0.00 0.01 0.00 0.00 72.50 71.40 1gof s THR 250 CO 0.36 0.34 -0.24 -0.44 -0.69 0.00 0.00 174.62 173.95 1gof s SER 251 N 0.86 2.84 -0.11 3.53 0.01 -0.67 -0.87 113.70 119.29 1gof s SER 251 Ca -0.11 -0.44 0.02 0.00 1.31 0.00 0.00 55.95 56.73 1gof s SER 251 Cb -0.15 -0.39 -0.01 0.00 0.21 0.00 0.00 66.02 65.68 1gof s SER 251 CO 0.01 0.29 -0.17 -0.76 0.41 0.00 0.00 173.24 173.02 1gof s LEU 252 N -0.50 2.49 -0.20 2.44 1.43 0.78 -1.45 118.68 123.67 1gof s LEU 252 Ca 0.07 -0.39 -0.05 0.00 -1.03 0.00 0.00 54.13 52.73 1gof s LEU 252 Cb -0.10 -1.53 -0.02 0.00 0.03 0.00 0.00 46.19 44.57 1gof s LEU 252 CO -0.00 0.19 -0.01 -0.47 0.23 0.00 0.00 176.35 176.29 1gof s TYR 253 N 0.17 3.03 -0.35 0.29 5.04 -0.42 -0.06 117.35 125.05 1gof s TYR 253 Ca -0.10 -0.48 -0.10 0.00 -2.44 0.00 0.00 57.07 53.95 1gof s TYR 253 Cb -0.16 -2.07 0.02 0.00 0.35 0.00 0.00 41.96 40.10 1gof s TYR 253 CO 0.06 -0.25 0.18 0.34 -1.34 0.00 0.00 175.55 174.54 1gof s ASP 254 N 0.98 5.62 0.35 4.32 2.15 0.61 -0.99 116.67 129.70 1gof s ASP 254 Ca 0.01 -0.87 0.04 0.00 0.43 0.00 0.00 52.55 52.17 1gof s ASP 254 Cb -0.14 -2.00 0.63 0.00 -0.30 0.00 0.00 42.92 41.11 1gof s ASP 254 CO 0.02 -0.32 1.92 -1.28 -0.17 0.00 0.00 175.17 175.33 1gof h SER 255 N 8.38 0.53 0.07 -0.34 0.87 -1.86 -1.83 113.55 119.39 1gof h SER 255 Ca -0.27 -0.08 0.02 0.00 -1.23 0.00 0.00 61.79 60.23 1gof h SER 255 Cb 1.11 -0.14 -0.03 0.00 -0.44 0.00 0.00 62.40 62.90 1gof h SER 255 CO 0.65 0.54 -0.22 0.28 -0.53 0.00 0.00 176.83 177.54 1gof h SER 256 N 0.57 -0.64 0.03 6.23 0.02 -1.93 -2.95 113.55 114.88 1gof h SER 256 Ca 0.13 0.08 0.00 0.00 -0.84 0.00 0.00 61.79 61.16 1gof h SER 256 Cb 0.22 0.25 0.00 0.00 0.14 0.00 0.00 62.40 63.01 1gof h SER 256 CO -0.00 -0.30 -0.16 -1.54 -1.14 0.00 0.00 176.83 173.69 1gof n SER 257 N -5.35 1.95 -3.85 3.07 3.41 -1.24 -4.97 113.62 106.65 1gof n SER 257 Ca -0.06 -1.52 -0.26 0.00 -0.26 0.00 0.00 58.87 56.77 1gof n SER 257 Cb 0.26 0.13 0.02 0.00 -0.26 0.00 0.00 64.21 64.36 1gof n SER 257 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1gof n ASP 258 N 0.30 -2.20 -4.22 4.04 2.03 -0.74 -4.97 116.55 110.78 1gof n ASP 258 Ca 0.14 -0.86 -0.13 0.00 0.52 0.00 0.00 54.79 54.46 1gof n ASP 258 Cb 0.45 -3.71 -0.10 0.00 -0.72 0.00 0.00 41.12 37.04 1gof n ASP 258 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 1gof s SER 259 N -3.98 1.12 -0.20 1.67 1.04 -0.87 -4.97 113.70 107.49 1gof s SER 259 Ca 0.25 -1.16 -0.08 0.00 0.48 0.00 0.00 55.95 55.44 1gof s SER 259 Cb -0.13 0.13 -0.04 0.00 0.10 0.00 0.00 66.02 66.08 1gof s SER 259 CO 0.84 -0.57 0.09 0.26 0.98 0.00 0.00 173.24 174.83 1gof s TRP 260 N -3.69 3.26 -0.07 5.02 0.52 -1.26 -0.28 118.94 122.43 1gof s TRP 260 Ca 0.23 0.07 0.04 0.00 0.02 0.00 0.00 56.10 56.46 1gof s TRP 260 Cb 0.06 -2.14 -0.00 0.00 -1.15 0.00 0.00 33.47 30.24 1gof s TRP 260 CO 0.03 0.10 -0.20 0.42 0.02 0.00 0.00 176.95 177.31 1gof s ILE 261 N 0.63 1.73 0.28 2.03 1.01 0.91 -4.84 121.20 122.95 1gof s ILE 261 Ca 0.05 -0.85 -0.30 0.00 0.00 0.00 0.00 60.65 59.55 1gof s ILE 261 Cb -0.13 -1.50 -0.10 0.00 0.01 0.00 0.00 42.46 40.74 1gof s ILE 261 CO 0.01 0.49 1.39 -2.84 0.00 0.00 0.00 174.94 173.99 1gof s PRO 262 N 0.22 4.30 0.47 2.79 0.02 -1.26 -0.16 135.00 141.38 1gof s PRO 262 Ca -0.11 2.27 0.04 0.00 0.02 0.00 0.00 61.00 63.22 1gof s PRO 262 Cb -0.15 -3.10 0.04 0.00 0.02 0.00 0.00 34.50 31.31 1gof s PRO 262 CO 0.05 -0.34 0.34 0.41 -0.33 0.00 0.00 177.00 177.13 1gof n GLY 263 N 1.71 2.81 3.81 0.52 0.00 -0.05 -4.81 105.19 109.18 1gof n GLY 263 Ca 0.04 -2.28 -0.33 0.00 0.00 0.00 0.00 46.02 43.45 1gof n GLY 263 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1gof s PRO 264 N -3.91 3.54 0.32 1.61 0.04 -1.26 -4.54 135.00 130.79 1gof s PRO 264 Ca 0.26 1.18 -0.28 0.00 0.04 0.00 0.00 61.00 62.20 1gof s PRO 264 Cb -0.02 -2.07 -0.10 0.00 0.04 0.00 0.00 34.50 32.36 1gof s PRO 264 CO 0.16 -0.63 1.15 -0.51 0.04 0.00 0.00 177.00 177.22 1gof s ASP 265 N -2.69 7.02 0.94 6.66 1.11 -1.26 -3.91 116.67 124.53 1gof s ASP 265 Ca 0.63 2.36 -0.11 0.00 0.18 0.00 0.00 52.55 55.61 1gof s ASP 265 Cb -0.15 -2.63 0.15 0.00 1.07 0.00 0.00 42.92 41.37 1gof s ASP 265 CO 0.32 -0.33 1.09 -0.04 1.18 0.00 0.00 175.17 177.40 1gof s MET 266 N -1.71 0.90 0.17 8.23 -1.94 -0.17 -4.62 119.30 120.14 1gof s MET 266 Ca 0.48 1.02 0.03 0.00 -1.71 0.00 0.00 55.69 55.51 1gof s MET 266 Cb -0.33 -1.75 -0.00 0.00 2.01 0.00 0.00 34.83 34.76 1gof s MET 266 CO 0.43 -2.55 1.38 1.96 -0.01 0.00 0.00 175.02 176.23 1gof h GLN 267 N -1.78 0.19 -5.25 2.03 1.08 -1.90 -3.44 115.11 106.04 1gof h GLN 267 Ca -0.50 -0.21 -0.57 0.00 -1.45 0.00 0.00 58.65 55.93 1gof h GLN 267 Cb 1.28 0.06 -0.32 0.00 -0.05 0.00 0.00 27.48 28.46 1gof h GLN 267 CO 0.51 0.95 -0.84 0.08 -0.95 0.00 0.00 178.83 178.57 1gof s VAL 268 N -3.21 1.47 0.14 -0.54 1.01 -1.26 -5.11 120.40 112.91 1gof s VAL 268 Ca -0.03 -0.73 -0.30 0.00 0.00 0.00 0.00 61.98 60.92 1gof s VAL 268 Cb 0.10 -1.27 -0.07 0.00 0.00 0.00 0.00 36.38 35.14 1gof s VAL 268 CO 0.83 0.42 1.24 0.00 0.00 0.00 0.00 175.10 177.59 1gof s ALA 269 N 0.12 3.46 0.12 5.51 0.00 -1.26 -4.85 121.76 124.86 1gof s ALA 269 Ca -0.06 0.96 -0.09 0.00 0.00 0.00 0.00 51.96 52.77 1gof s ALA 269 Cb -0.13 -3.45 -0.00 0.00 0.00 0.00 0.00 23.12 19.55 1gof s ALA 269 CO 0.03 -0.44 0.24 1.03 0.00 0.00 0.00 175.76 176.62 1gof s ARG 270 N 0.30 0.98 -0.10 0.00 0.52 -0.24 -4.55 118.95 115.86 1gof s ARG 270 Ca 0.56 -1.02 -0.12 0.00 -0.52 0.00 0.00 55.73 54.64 1gof s ARG 270 Cb -0.33 0.36 0.03 0.00 0.52 0.00 0.00 34.95 35.54 1gof s ARG 270 CO 0.34 -0.34 0.31 0.20 0.02 0.00 0.00 175.30 175.84 1gof s GLY 271 N -2.90 -0.22 -0.80 -3.53 0.00 -0.54 -0.83 107.32 98.52 1gof s GLY 271 Ca 0.09 0.78 0.00 0.00 0.00 0.00 0.00 44.72 45.59 1gof s GLY 271 CO -0.07 0.64 0.00 -1.72 0.00 0.00 0.00 173.10 171.95 1gof n TYR 272 N 2.61 0.00 -2.06 1.90 4.02 -0.60 -1.85 117.16 121.18 1gof n TYR 272 Ca -0.15 0.00 -0.29 0.00 -0.01 0.00 0.00 57.90 57.45 1gof n TYR 272 Cb 0.57 -1.67 0.03 0.00 -0.02 0.00 0.00 39.34 38.26 1gof n TYR 272 CO 0.00 0.00 0.00 1.14 -1.01 0.00 0.00 176.86 176.99 1gof s GLN 273 N -2.39 3.11 0.09 -0.72 0.00 -1.26 -0.95 119.66 117.54 1gof s GLN 273 Ca 0.00 0.40 0.03 0.00 -0.00 0.00 0.00 55.36 55.79 1gof s GLN 273 Cb 0.00 -2.12 -0.04 0.00 0.00 0.00 0.00 33.01 30.85 1gof s GLN 273 CO 0.00 -0.77 0.11 -1.12 0.00 0.00 0.00 175.29 173.50 1gof s SER 274 N -4.28 5.64 0.10 12.60 0.01 -1.26 -3.95 113.70 122.56 1gof s SER 274 Ca 0.55 0.01 0.06 0.00 1.31 0.00 0.00 55.95 57.89 1gof s SER 274 Cb -0.11 -1.54 -0.03 0.00 0.21 0.00 0.00 66.02 64.54 1gof s SER 274 CO 0.50 0.15 -0.16 -0.94 0.41 0.00 0.00 173.24 173.20 1gof s SER 275 N -2.54 2.03 -0.02 2.44 1.04 -1.26 -3.56 113.70 111.83 1gof s SER 275 Ca 0.30 -0.70 0.00 0.00 0.48 0.00 0.00 55.95 56.03 1gof s SER 275 Cb -0.12 -0.08 0.02 0.00 0.10 0.00 0.00 66.02 65.94 1gof s SER 275 CO 0.23 -0.06 0.01 0.00 0.98 0.00 0.00 173.24 174.39 1gof s ALA 276 N -1.55 0.17 0.35 5.32 0.00 0.51 -4.71 121.76 121.86 1gof s ALA 276 Ca 0.04 0.14 -0.27 0.00 0.00 0.00 0.00 51.96 51.87 1gof s ALA 276 Cb -0.08 -0.20 -0.09 0.00 0.00 0.00 0.00 23.12 22.74 1gof s ALA 276 CO 0.03 -0.05 1.18 0.99 0.00 0.00 0.00 175.76 177.91 1gof s THR 277 N 0.70 3.15 0.37 0.00 2.01 -1.26 -1.77 115.64 118.84 1gof s THR 277 Ca -0.06 1.07 0.07 0.00 0.31 0.00 0.00 61.69 63.08 1gof s THR 277 Cb -0.09 -3.64 -0.00 0.00 0.01 0.00 0.00 72.50 68.77 1gof s THR 277 CO -0.02 0.18 0.49 -0.04 -0.69 0.00 0.00 174.62 174.55 1gof s MET 278 N -1.94 2.95 0.65 4.92 -1.94 0.72 -3.50 119.30 121.17 1gof s MET 278 Ca 0.51 -1.14 0.32 0.00 -1.71 0.00 0.00 55.69 53.67 1gof s MET 278 Cb -0.33 -2.75 1.74 0.00 2.01 0.00 0.00 34.83 35.49 1gof s MET 278 CO 0.42 -0.07 2.01 0.66 -0.01 0.00 0.00 175.02 178.03 1gof h SER 279 N 0.83 0.00 -0.50 3.03 4.64 -1.76 -1.10 113.55 118.69 1gof h SER 279 Ca -0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 1gof h SER 279 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1gof h SER 279 CO 0.50 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.56 1gof n ASP 280 N -3.14 4.28 0.00 4.97 5.68 -1.26 -4.63 116.55 122.45 1gof n ASP 280 Ca -0.00 -2.52 0.00 0.00 -0.50 0.00 0.00 54.79 51.76 1gof n ASP 280 Cb 0.36 -0.51 0.00 0.00 -1.14 0.00 0.00 41.12 39.83 1gof n ASP 280 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1gof n GLY 281 N 0.60 2.54 3.73 6.12 0.00 -0.42 -4.89 105.19 112.86 1gof n GLY 281 Ca 0.22 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.95 1gof n GLY 281 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1gof s ARG 282 N -0.30 0.98 -0.11 1.61 0.52 -1.26 -0.83 118.95 119.56 1gof s ARG 282 Ca 0.00 0.56 0.02 0.00 -0.52 0.00 0.00 55.73 55.79 1gof s ARG 282 Cb 0.00 -1.80 0.01 0.00 0.52 0.00 0.00 34.95 33.69 1gof s ARG 282 CO 0.00 -2.37 -0.17 0.08 0.02 0.00 0.00 175.30 172.87 1gof s VAL 283 N -3.05 1.59 -0.09 3.52 1.01 -0.92 -0.20 120.40 122.26 1gof s VAL 283 Ca 0.64 -0.70 -0.02 0.00 0.00 0.00 0.00 61.98 61.90 1gof s VAL 283 Cb -0.17 -1.43 -0.03 0.00 0.00 0.00 0.00 36.38 34.74 1gof s VAL 283 CO 0.56 0.46 0.01 0.12 0.00 0.00 0.00 175.10 176.25 1gof s PHE 284 N 0.89 3.18 0.04 5.22 5.36 -0.73 0.14 117.98 132.08 1gof s PHE 284 Ca -0.08 0.21 -0.00 0.00 -0.96 0.00 0.00 56.93 56.09 1gof s PHE 284 Cb -0.15 -1.79 -0.03 0.00 -0.34 0.00 0.00 43.02 40.70 1gof s PHE 284 CO -0.00 0.48 -0.04 -0.08 -1.46 0.00 0.00 175.22 174.12 1gof s THR 285 N -0.89 0.25 0.06 0.12 -1.32 -0.57 -0.36 115.64 112.92 1gof s THR 285 Ca 0.13 -1.46 -0.20 0.00 -1.21 0.00 0.00 61.69 58.95 1gof s THR 285 Cb -0.11 -1.04 0.04 0.00 -1.51 0.00 0.00 72.50 69.88 1gof s THR 285 CO 0.02 -0.78 0.46 -0.51 -2.21 0.00 0.00 174.62 171.61 1gof s ILE 286 N -2.88 0.05 0.00 5.08 2.07 -1.23 -1.43 121.20 122.86 1gof s ILE 286 Ca -0.02 -0.38 0.00 0.00 -1.41 0.00 0.00 60.65 58.85 1gof s ILE 286 Cb 0.00 -1.00 0.00 0.00 0.13 0.00 0.00 42.46 41.59 1gof s ILE 286 CO -0.06 -0.21 0.00 0.61 -1.91 0.00 0.00 174.94 173.38 1gof n GLY 287 N 0.31 -0.11 0.13 1.50 0.00 -0.46 -3.99 105.19 102.57 1gof n GLY 287 Ca -0.18 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 44.84 1gof n GLY 287 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gof n GLY 288 N 0.00 0.90 0.68 -0.02 0.00 -1.16 -4.67 105.19 100.92 1gof n GLY 288 Ca 0.00 -0.77 0.09 0.00 0.00 0.00 0.00 46.02 45.34 1gof n GLY 288 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1gof n SER 289 N -0.13 2.02 -0.14 1.61 7.64 -1.17 -1.46 113.62 121.99 1gof n SER 289 Ca 0.00 -1.86 0.01 0.00 1.01 0.00 0.00 58.87 58.03 1gof n SER 289 Cb 0.04 -0.19 0.29 0.00 -1.01 0.00 0.00 64.21 63.35 1gof n SER 289 CO 0.00 0.00 0.00 -0.25 -3.01 0.00 0.00 175.04 171.78 1gof h TRP 290 N 2.46 0.80 -4.34 1.43 7.01 -1.48 -3.41 115.95 118.41 1gof h TRP 290 Ca 0.00 0.00 -0.19 0.00 2.11 0.00 0.00 58.89 60.81 1gof h TRP 290 Cb 0.55 -0.26 -0.15 0.00 -2.10 0.00 0.00 29.16 27.20 1gof h TRP 290 CO 0.19 0.53 -0.65 -1.54 -2.79 0.00 0.00 178.44 174.18 1gof s SER 291 N -6.50 0.42 0.00 2.65 1.04 -1.26 -4.85 113.70 105.20 1gof s SER 291 Ca -0.10 -1.19 0.00 0.00 0.48 0.00 0.00 55.95 55.14 1gof s SER 291 Cb 0.17 0.27 0.00 0.00 0.10 0.00 0.00 66.02 66.56 1gof s SER 291 CO 0.77 -0.70 0.00 0.61 0.98 0.00 0.00 173.24 174.90 1gof n GLY 292 N -0.10 0.95 0.00 7.32 0.00 -1.26 -3.18 105.19 108.93 1gof n GLY 292 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 1gof n GLY 292 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gof n GLY 293 N -2.01 2.72 3.17 -0.02 0.00 -1.26 -4.74 105.19 103.05 1gof n GLY 293 Ca 0.00 -1.97 -0.37 0.00 0.00 0.00 0.00 46.02 43.68 1gof n GLY 293 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1gof s VAL 294 N -2.85 3.44 0.23 1.61 1.01 -1.26 -4.61 120.40 117.96 1gof s VAL 294 Ca 0.00 -1.69 -0.21 0.00 0.00 0.00 0.00 61.98 60.08 1gof s VAL 294 Cb 0.00 -3.18 0.06 0.00 0.00 0.00 0.00 36.38 33.26 1gof s VAL 294 CO 0.00 -0.47 0.91 0.72 0.00 0.00 0.00 175.10 176.26 1gof s PHE 295 N 1.25 -0.02 -0.18 5.22 -0.71 -1.26 -5.04 117.98 117.24 1gof s PHE 295 Ca 0.03 -0.42 -0.29 0.00 -1.04 0.00 0.00 56.93 55.21 1gof s PHE 295 Cb -0.22 0.71 -0.03 0.00 -1.21 0.00 0.00 43.02 42.28 1gof s PHE 295 CO -0.02 -1.08 1.52 -1.21 -1.34 0.00 0.00 175.22 173.09 1gof s GLU 296 N -2.82 3.99 -0.49 1.99 2.02 -1.26 -4.91 118.70 117.23 1gof s GLU 296 Ca 0.16 1.74 -0.09 0.00 0.02 0.00 0.00 54.97 56.80 1gof s GLU 296 Cb -0.03 -3.95 0.12 0.00 0.10 0.00 0.00 34.13 30.37 1gof s GLU 296 CO 0.06 -1.05 0.36 0.15 0.02 0.00 0.00 175.26 174.80 1gof s LYS 297 N 4.23 2.50 0.81 1.61 1.02 -1.26 -5.02 119.74 123.62 1gof s LYS 297 Ca 0.67 -1.82 -0.14 0.00 0.02 0.00 0.00 55.97 54.70 1gof s LYS 297 Cb -0.25 -3.92 0.19 0.00 -0.52 0.00 0.00 37.83 33.33 1gof s LYS 297 CO 0.26 -1.20 0.88 0.09 -0.92 0.00 0.00 175.35 174.46 1gof n ASN 298 N 4.82 -0.90 -4.77 2.83 5.03 -1.26 -1.35 115.26 119.66 1gof n ASN 298 Ca -0.07 -1.16 -0.31 0.00 0.87 0.00 0.00 54.58 53.91 1gof n ASN 298 Cb 0.41 -0.73 0.09 0.00 -1.02 0.00 0.00 39.78 38.52 1gof n ASN 298 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 1gof s GLY 299 N -4.50 1.67 0.03 7.41 0.00 -0.01 -4.40 107.32 107.53 1gof s GLY 299 Ca 0.53 0.26 -0.13 0.00 0.00 0.00 0.00 44.72 45.38 1gof s GLY 299 CO 0.39 0.60 0.29 -1.83 0.00 0.00 0.00 173.10 172.56 1gof s GLU 300 N -4.91 0.77 -0.02 2.90 -1.05 -0.51 -0.32 118.70 115.55 1gof s GLU 300 Ca 0.61 -0.46 0.02 0.00 -0.15 0.00 0.00 54.97 54.99 1gof s GLU 300 Cb -0.17 0.33 0.01 0.00 -0.44 0.00 0.00 34.13 33.86 1gof s GLU 300 CO 0.56 -0.24 -0.07 0.54 0.95 0.00 0.00 175.26 177.00 1gof s VAL 301 N -2.31 0.62 -0.15 1.83 0.11 0.20 -1.51 120.40 119.18 1gof s VAL 301 Ca -0.07 -0.27 -0.09 0.00 -2.93 0.00 0.00 61.98 58.63 1gof s VAL 301 Cb -0.02 -0.56 -0.04 0.00 -1.53 0.00 0.00 36.38 34.23 1gof s VAL 301 CO -0.02 0.20 0.15 -0.47 -3.33 0.00 0.00 175.10 171.64 1gof s TYR 302 N 0.25 3.52 -0.30 1.54 5.04 0.12 -0.55 117.35 126.98 1gof s TYR 302 Ca -0.03 0.47 -0.04 0.00 -2.44 0.00 0.00 57.07 55.03 1gof s TYR 302 Cb -0.08 -2.06 0.04 0.00 0.35 0.00 0.00 41.96 40.21 1gof s TYR 302 CO 0.00 0.53 0.03 0.45 -1.34 0.00 0.00 175.55 175.22 1gof s SER 303 N -0.40 4.97 0.44 4.32 0.15 -0.20 -2.17 113.70 120.81 1gof s SER 303 Ca 0.13 -1.14 0.13 0.00 0.70 0.00 0.00 55.95 55.77 1gof s SER 303 Cb -0.12 -1.77 1.04 0.00 -1.71 0.00 0.00 66.02 63.46 1gof s SER 303 CO 0.02 -0.26 2.03 -0.65 1.20 0.00 0.00 173.24 175.58 1gof h PRO 304 N 8.08 0.36 -0.08 5.44 0.11 -1.87 0.30 132.00 144.35 1gof h PRO 304 Ca -0.24 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 65.78 1gof h PRO 304 Cb 1.08 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.11 1gof h PRO 304 CO 0.56 0.24 -0.20 0.66 -0.21 0.00 0.00 178.00 179.05 1gof h SER 305 N 0.37 0.31 0.10 -2.05 4.64 -1.97 -3.22 113.55 111.74 1gof h SER 305 Ca 0.20 -0.59 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 1gof h SER 305 Cb 0.32 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 1gof h SER 305 CO -0.05 0.85 -0.23 -1.54 -0.87 0.00 0.00 176.83 174.99 1gof n SER 306 N -4.54 1.54 -3.78 4.97 3.41 -1.10 -4.96 113.62 109.15 1gof n SER 306 Ca -0.08 -1.26 -0.24 0.00 -0.26 0.00 0.00 58.87 57.04 1gof n SER 306 Cb 0.42 0.17 0.02 0.00 -0.26 0.00 0.00 64.21 64.56 1gof n SER 306 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1gof n LYS 307 N -0.15 -4.76 -4.21 4.33 4.76 0.11 -5.00 118.16 113.23 1gof n LYS 307 Ca 0.13 0.58 -0.17 0.00 -2.87 0.00 0.00 58.31 55.98 1gof n LYS 307 Cb 0.40 -5.13 -0.11 0.00 -1.84 0.00 0.00 35.03 28.34 1gof n LYS 307 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 1gof s THR 308 N -3.65 1.21 -0.12 -0.18 -4.23 -1.20 -4.60 115.64 102.87 1gof s THR 308 Ca 0.13 -1.60 -0.02 0.00 -1.18 0.00 0.00 61.69 59.01 1gof s THR 308 Cb -0.06 -1.39 -0.03 0.00 1.34 0.00 0.00 72.50 72.36 1gof s THR 308 CO 0.83 -0.39 -0.06 0.26 -0.54 0.00 0.00 174.62 174.72 1gof s TRP 309 N -1.97 2.98 -0.07 3.99 0.52 -1.26 -1.04 118.94 122.10 1gof s TRP 309 Ca 0.06 -0.23 0.03 0.00 0.02 0.00 0.00 56.10 55.98 1gof s TRP 309 Cb -0.06 -1.87 0.01 0.00 -1.15 0.00 0.00 33.47 30.40 1gof s TRP 309 CO 0.02 0.07 -0.16 0.99 0.02 0.00 0.00 176.95 177.89 1gof s THR 310 N -0.03 1.40 0.36 2.01 2.01 0.29 -4.78 115.64 116.91 1gof s THR 310 Ca 0.00 -0.65 -0.27 0.00 0.31 0.00 0.00 61.69 61.08 1gof s THR 310 Cb -0.13 -1.24 -0.09 0.00 0.01 0.00 0.00 72.50 71.05 1gof s THR 310 CO 0.03 0.41 1.20 -0.55 -0.69 0.00 0.00 174.62 175.02 1gof s SER 311 N 0.42 6.71 -0.61 3.53 0.15 -1.26 -0.63 113.70 122.01 1gof s SER 311 Ca -0.12 2.44 0.06 0.00 0.70 0.00 0.00 55.95 59.02 1gof s SER 311 Cb -0.15 -2.63 0.21 0.00 -1.71 0.00 0.00 66.02 61.74 1gof s SER 311 CO 0.04 -0.55 0.58 0.18 1.20 0.00 0.00 173.24 174.69 1gof n LEU 312 N 0.47 2.59 0.29 3.45 4.77 0.56 -4.90 117.00 124.23 1gof n LEU 312 Ca 0.02 -5.15 0.14 0.00 -0.03 0.00 0.00 56.01 50.99 1gof n LEU 312 Cb 0.45 -0.41 0.88 0.00 -2.33 0.00 0.00 43.42 42.01 1gof n LEU 312 CO 0.54 1.93 1.11 1.55 -1.33 0.00 0.00 177.39 181.18 1gof h PRO 313 N 4.76 0.00 -0.01 3.23 0.13 -1.70 -0.90 132.00 137.52 1gof h PRO 313 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1gof h PRO 313 Cb 0.75 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.88 1gof h PRO 313 CO 0.70 0.01 -0.11 0.09 -0.23 0.00 0.00 178.00 178.46 1gof n ASN 314 N -3.88 0.77 -4.46 1.44 3.02 -0.37 -4.29 115.26 107.49 1gof n ASN 314 Ca -0.03 -0.88 -0.44 0.00 -0.03 0.00 0.00 54.58 53.21 1gof n ASN 314 Cb 0.10 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.25 1gof n ASN 314 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1gof s ALA 315 N -2.34 3.45 0.17 5.41 0.00 -0.35 -3.63 121.76 124.47 1gof s ALA 315 Ca 0.31 -2.86 -0.30 0.00 0.00 0.00 0.00 51.96 49.11 1gof s ALA 315 Cb 0.20 -4.11 -0.07 0.00 0.00 0.00 0.00 23.12 19.14 1gof s ALA 315 CO 0.45 -2.99 0.97 0.15 0.00 0.00 0.00 175.76 174.34 1gof s LYS 316 N 2.65 4.75 0.20 0.00 -0.14 -1.26 -0.83 119.74 125.11 1gof s LYS 316 Ca 0.36 1.50 0.11 0.00 -1.36 0.00 0.00 55.97 56.58 1gof s LYS 316 Cb -0.04 -3.33 -0.05 0.00 -1.68 0.00 0.00 37.83 32.73 1gof s LYS 316 CO -0.07 0.31 1.37 -0.24 -0.76 0.00 0.00 175.35 175.96 1gof h VAL 317 N 3.66 1.30 -0.96 3.17 3.04 -1.91 -3.37 116.25 121.17 1gof h VAL 317 Ca -0.44 -2.80 0.26 0.00 -1.01 0.00 0.00 66.70 62.71 1gof h VAL 317 Cb 1.21 2.62 -0.18 0.00 -2.01 0.00 0.00 31.29 32.93 1gof h VAL 317 CO 0.70 0.73 0.05 -1.13 -1.01 0.00 0.00 177.57 176.92 1gof h ASN 318 N 0.00 -0.43 0.65 3.17 -0.73 -1.93 -1.57 115.58 114.74 1gof h ASN 318 Ca -0.01 0.27 0.00 0.00 1.87 0.00 0.00 56.30 58.43 1gof h ASN 318 Cb 1.56 0.46 0.00 0.00 0.27 0.00 0.00 38.32 40.61 1gof h ASN 318 CO 0.10 -0.33 0.00 -2.65 -0.37 0.00 0.00 177.43 174.18 1gof n PRO 319 N -5.46 0.20 0.00 6.67 -0.02 -1.26 -2.54 135.00 132.59 1gof n PRO 319 Ca 0.23 0.46 0.11 0.00 -2.02 0.00 0.00 63.50 62.28 1gof n PRO 319 Cb 0.74 -1.91 0.09 0.00 -0.02 0.00 0.00 33.50 32.40 1gof n PRO 319 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1gof n MET 320 N -2.29 2.12 -2.01 -0.52 0.00 -0.59 -4.80 117.12 109.03 1gof n MET 320 Ca 0.02 -1.81 -0.40 0.00 0.00 0.00 0.00 57.70 55.51 1gof n MET 320 Cb 0.21 -1.44 -0.01 0.00 0.00 0.00 0.00 33.22 31.98 1gof n MET 320 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 1gof s LEU 321 N -1.95 4.32 0.94 3.17 1.43 -1.05 -4.34 118.68 121.19 1gof s LEU 321 Ca 0.26 2.77 -0.14 0.00 -1.03 0.00 0.00 54.13 55.99 1gof s LEU 321 Cb 0.19 -3.75 0.21 0.00 0.03 0.00 0.00 46.19 42.86 1gof s LEU 321 CO 0.31 -0.75 1.29 0.42 0.23 0.00 0.00 176.35 177.85 1gof s THR 322 N -1.18 2.01 -0.46 5.49 -4.23 -0.68 -4.82 115.64 111.76 1gof s THR 322 Ca 0.53 -0.10 0.02 0.00 -1.18 0.00 0.00 61.69 60.96 1gof s THR 322 Cb -0.41 -2.91 0.57 0.00 1.34 0.00 0.00 72.50 71.09 1gof s THR 322 CO 0.54 0.00 1.89 0.00 -0.54 0.00 0.00 174.62 176.51 1gof n ALA 323 N -3.68 5.56 -1.55 3.99 0.00 -1.26 -4.82 120.51 118.75 1gof n ALA 323 Ca 0.16 -2.80 -0.50 0.00 0.00 0.00 0.00 53.44 50.30 1gof n ALA 323 Cb 0.59 -1.49 -0.04 0.00 0.00 0.00 0.00 19.45 18.51 1gof n ALA 323 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1gof n ASP 324 N -0.95 0.88 0.28 0.00 -0.08 -1.26 -4.86 116.55 110.56 1gof n ASP 324 Ca 0.56 1.14 0.15 0.00 -1.51 0.00 0.00 54.79 55.14 1gof n ASP 324 Cb 1.36 -1.15 0.84 0.00 2.34 0.00 0.00 41.12 44.51 1gof n ASP 324 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 1gof h LYS 325 N 3.07 0.00 -0.01 -0.67 1.57 -1.95 -1.51 116.57 117.07 1gof h LYS 325 Ca -0.43 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.35 1gof h LYS 325 Cb 1.37 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.68 1gof h LYS 325 CO 0.68 0.07 -0.04 1.04 -0.57 0.00 0.00 179.45 180.63 1gof n GLN 326 N -3.51 1.12 0.00 3.15 6.02 -1.26 -5.02 117.38 117.88 1gof n GLN 326 Ca -0.02 -0.41 0.00 0.00 -0.01 0.00 0.00 57.00 56.56 1gof n GLN 326 Cb 0.19 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 29.96 1gof n GLN 326 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1gof n GLY 327 N 1.16 -0.66 0.33 1.08 0.00 -0.57 -4.04 105.19 102.48 1gof n GLY 327 Ca 0.19 -1.14 0.16 0.00 0.00 0.00 0.00 46.02 45.22 1gof n GLY 327 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1gof h LEU 328 N 0.00 0.00 -1.10 0.99 5.85 -1.94 -1.08 115.31 118.02 1gof h LEU 328 Ca 0.00 0.00 0.19 0.00 0.84 0.00 0.00 57.88 58.91 1gof h LEU 328 Cb 0.00 0.00 -0.10 0.00 0.37 0.00 0.00 40.66 40.93 1gof h LEU 328 CO 0.00 0.00 0.61 0.22 -0.34 0.00 0.00 178.44 178.93 1gof h TYR 329 N 0.00 0.97 0.00 1.25 3.20 -1.86 -3.07 116.97 117.47 1gof h TYR 329 Ca 0.11 0.03 -0.26 0.00 3.14 0.00 0.00 58.73 61.76 1gof h TYR 329 Cb 0.50 -0.29 -0.05 0.00 1.54 0.00 0.00 36.73 38.43 1gof h TYR 329 CO 0.00 0.22 -1.97 0.54 -1.64 0.00 0.00 178.16 175.32 1gof n ARG 330 N -4.71 1.68 0.30 1.82 5.12 -0.73 -3.89 116.66 116.26 1gof n ARG 330 Ca 0.23 -0.01 0.18 0.00 -1.93 0.00 0.00 57.85 56.32 1gof n ARG 330 Cb 0.60 -1.36 0.97 0.00 -1.16 0.00 0.00 32.46 31.50 1gof n ARG 330 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 1gof h SER 331 N 0.00 0.00 -0.55 0.55 4.64 -1.12 -1.95 113.55 115.11 1gof h SER 331 Ca -0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 1gof h SER 331 Cb 1.86 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.95 1gof h SER 331 CO 0.02 0.03 0.00 -0.90 -0.87 0.00 0.00 176.83 175.11 1gof n ASP 332 N -3.35 4.25 -4.90 4.97 5.75 -1.24 -1.69 116.55 120.34 1gof n ASP 332 Ca -0.02 -2.40 -0.28 0.00 -0.01 0.00 0.00 54.79 52.08 1gof n ASP 332 Cb 0.15 -0.50 -0.01 0.00 -1.03 0.00 0.00 41.12 39.72 1gof n ASP 332 CO 0.00 0.00 0.00 0.20 -0.11 0.00 0.00 177.20 177.29 1gof s ASN 333 N -1.07 6.36 -1.45 -1.12 0.02 -0.74 -3.00 114.94 113.95 1gof s ASN 333 Ca 0.45 0.94 -0.11 0.00 -1.02 0.00 0.00 52.86 53.12 1gof s ASN 333 Cb 0.29 -2.25 0.01 0.00 0.02 0.00 0.00 41.25 39.33 1gof s ASN 333 CO 0.22 -0.46 0.22 1.41 0.02 0.00 0.00 177.10 178.50 1gof n HIS 334 N -1.79 -1.30 -1.76 2.20 8.25 -0.12 -4.83 115.22 115.85 1gof n HIS 334 Ca 0.01 0.44 -0.39 0.00 -0.26 0.00 0.00 57.72 57.52 1gof n HIS 334 Cb 0.55 -2.81 0.03 0.00 1.12 0.00 0.00 29.99 28.87 1gof n HIS 334 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1gof s ALA 335 N -4.12 3.09 -1.25 -1.41 0.00 -1.26 -4.51 121.76 112.30 1gof s ALA 335 Ca 0.15 1.45 -0.15 0.00 0.00 0.00 0.00 51.96 53.41 1gof s ALA 335 Cb -0.08 -3.59 0.13 0.00 0.00 0.00 0.00 23.12 19.57 1gof s ALA 335 CO 0.99 -1.30 1.57 0.91 0.00 0.00 0.00 175.76 177.94 1gof n TRP 336 N -0.51 4.82 -3.46 0.00 8.01 0.22 -4.75 117.44 121.78 1gof n TRP 336 Ca 0.07 -3.14 -0.36 0.00 -1.31 0.00 0.00 57.50 52.76 1gof n TRP 336 Cb 0.43 -2.37 -0.06 0.00 -2.01 0.00 0.00 31.31 27.29 1gof n TRP 336 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.69 176.17 1gof s LEU 337 N 2.64 4.39 -0.06 -0.99 1.43 -1.26 -1.20 118.68 123.63 1gof s LEU 337 Ca 0.47 0.96 -0.01 0.00 -1.03 0.00 0.00 54.13 54.53 1gof s LEU 337 Cb 0.00 -2.98 0.03 0.00 0.03 0.00 0.00 46.19 43.27 1gof s LEU 337 CO 0.03 0.19 0.01 -0.36 0.23 0.00 0.00 176.35 176.46 1gof s PHE 338 N -1.32 0.48 0.32 0.29 0.40 -0.29 -4.75 117.98 113.11 1gof s PHE 338 Ca 0.32 -0.05 -0.29 0.00 -0.60 0.00 0.00 56.93 56.32 1gof s PHE 338 Cb -0.15 -0.65 -0.10 0.00 0.51 0.00 0.00 43.02 42.62 1gof s PHE 338 CO 0.17 -0.25 1.30 0.20 0.70 0.00 0.00 175.22 177.34 1gof s GLY 339 N 1.77 2.97 0.00 4.36 0.00 -1.23 -0.63 107.32 114.56 1gof s GLY 339 Ca 0.01 1.23 0.00 0.00 0.00 0.00 0.00 44.72 45.96 1gof s GLY 339 CO -0.04 1.90 0.00 1.87 0.00 0.00 0.00 173.10 176.83 1gof n TRP 340 N 0.93 0.00 -1.97 1.90 -0.00 -0.05 -4.82 117.44 113.43 1gof n TRP 340 Ca 0.00 0.00 -0.37 0.00 -0.00 0.00 0.00 57.50 57.14 1gof n TRP 340 Cb 0.42 0.00 0.03 0.00 -0.00 0.00 0.00 31.31 31.76 1gof n TRP 340 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 177.69 177.84 1gof s LYS 341 N -0.39 3.08 -1.37 5.87 1.02 -1.26 -3.78 119.74 122.90 1gof s LYS 341 Ca 0.00 1.93 -0.03 0.00 0.02 0.00 0.00 55.97 57.89 1gof s LYS 341 Cb 0.00 -2.06 0.02 0.00 -0.52 0.00 0.00 37.83 35.27 1gof s LYS 341 CO 0.00 -1.15 0.73 1.63 -0.92 0.00 0.00 175.35 175.64 1gof n LYS 342 N -1.34 -4.84 -0.96 1.68 5.02 -1.26 -1.76 118.16 114.70 1gof n LYS 342 Ca 0.12 0.59 0.00 0.00 -2.02 0.00 0.00 58.31 57.00 1gof n LYS 342 Cb 0.48 -5.17 0.00 0.00 -0.02 0.00 0.00 35.03 30.33 1gof n LYS 342 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1gof n GLY 343 N -1.65 0.47 3.90 0.72 0.00 -1.25 -4.90 105.19 102.49 1gof n GLY 343 Ca -0.22 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.51 1gof n GLY 343 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1gof s SER 344 N -2.22 5.78 -0.07 1.61 1.04 -0.72 -3.82 113.70 115.30 1gof s SER 344 Ca 0.00 0.99 0.01 0.00 0.48 0.00 0.00 55.95 57.43 1gof s SER 344 Cb 0.00 -1.99 0.02 0.00 0.10 0.00 0.00 66.02 64.15 1gof s SER 344 CO 0.00 -1.02 -0.08 -0.69 0.98 0.00 0.00 173.24 172.43 1gof s VAL 345 N -3.09 0.86 -0.06 5.02 1.01 -0.20 -0.87 120.40 123.07 1gof s VAL 345 Ca 0.54 -0.28 -0.13 0.00 0.00 0.00 0.00 61.98 62.12 1gof s VAL 345 Cb -0.11 -0.84 -0.05 0.00 0.00 0.00 0.00 36.38 35.38 1gof s VAL 345 CO 0.48 0.31 0.32 0.12 0.00 0.00 0.00 175.10 176.34 1gof s PHE 346 N 1.06 3.65 -0.32 5.22 5.36 0.19 -0.62 117.98 132.52 1gof s PHE 346 Ca -0.08 0.81 -0.02 0.00 -0.96 0.00 0.00 56.93 56.68 1gof s PHE 346 Cb -0.14 -2.22 0.06 0.00 -0.34 0.00 0.00 43.02 40.38 1gof s PHE 346 CO -0.01 0.59 0.05 -1.14 -1.46 0.00 0.00 175.22 173.25 1gof s GLN 347 N -0.77 2.34 0.08 10.12 -0.44 0.21 -1.14 119.66 130.06 1gof s GLN 347 Ca 0.20 -1.38 0.27 0.00 -2.50 0.00 0.00 55.36 51.95 1gof s GLN 347 Cb -0.15 -3.27 0.82 0.00 -1.64 0.00 0.00 33.01 28.77 1gof s GLN 347 CO 0.09 -0.71 1.68 0.00 0.50 0.00 0.00 175.29 176.85 1gof n ALA 348 N 4.62 2.66 0.00 1.58 0.00 -0.34 -2.03 120.51 127.00 1gof n ALA 348 Ca -0.11 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.18 1gof n ALA 348 Cb 0.43 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.53 1gof n ALA 348 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1gof n GLY 349 N 1.42 -0.56 0.26 0.00 0.00 -1.26 -4.79 105.19 100.25 1gof n GLY 349 Ca 0.06 -1.27 0.17 0.00 0.00 0.00 0.00 46.02 44.99 1gof n GLY 349 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1gof h PRO 350 N 0.43 0.00 -7.09 1.61 0.13 -1.83 0.65 132.00 125.90 1gof h PRO 350 Ca 0.00 0.00 -0.54 0.00 -0.87 0.00 0.00 66.00 64.59 1gof h PRO 350 Cb 0.00 0.00 0.19 0.00 0.13 0.00 0.00 31.00 31.32 1gof h PRO 350 CO 0.00 0.00 0.17 -1.13 -0.23 0.00 0.00 178.00 176.81 1gof n SER 351 N -2.88 0.54 -0.33 1.44 3.41 -1.26 -1.01 113.62 113.53 1gof n SER 351 Ca -0.00 0.58 0.02 0.00 -0.26 0.00 0.00 58.87 59.20 1gof n SER 351 Cb 0.21 -1.45 0.19 0.00 -0.26 0.00 0.00 64.21 62.90 1gof n SER 351 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 1gof h THR 352 N -0.82 1.14 -3.11 6.66 2.02 -1.82 -3.41 112.91 113.57 1gof h THR 352 Ca -0.46 -0.40 -0.54 0.00 0.77 0.00 0.00 66.41 65.78 1gof h THR 352 Cb 1.31 -0.12 0.00 0.00 -1.74 0.00 0.00 68.15 67.60 1gof h THR 352 CO 0.45 0.21 0.64 0.00 0.37 0.00 0.00 175.52 177.19 1gof s ALA 353 N -5.99 3.46 0.07 6.16 0.00 -1.26 -0.06 121.76 124.15 1gof s ALA 353 Ca -0.12 0.87 0.03 0.00 0.00 0.00 0.00 51.96 52.73 1gof s ALA 353 Cb 0.19 -3.49 -0.04 0.00 0.00 0.00 0.00 23.12 19.78 1gof s ALA 353 CO 0.81 -0.57 0.08 -1.64 0.00 0.00 0.00 175.76 174.43 1gof s MET 354 N 1.41 2.90 0.04 0.00 1.00 -0.06 -4.60 119.30 119.99 1gof s MET 354 Ca 0.60 -0.67 -0.03 0.00 0.00 0.00 0.00 55.69 55.59 1gof s MET 354 Cb -0.30 -2.74 -0.02 0.00 0.00 0.00 0.00 34.83 31.76 1gof s MET 354 CO 0.28 0.57 0.03 -0.80 0.00 0.00 0.00 175.02 175.10 1gof s ASN 355 N -2.36 0.30 -0.22 3.03 0.01 -0.86 -1.13 114.94 113.72 1gof s ASN 355 Ca 0.29 -0.70 -0.09 0.00 -0.71 0.00 0.00 52.86 51.65 1gof s ASN 355 Cb -0.12 0.20 -0.04 0.00 0.41 0.00 0.00 41.25 41.69 1gof s ASN 355 CO 0.22 -0.51 0.10 0.26 -1.51 0.00 0.00 177.10 175.66 1gof s TRP 356 N -2.91 3.25 -0.14 2.20 0.52 0.91 -0.62 118.94 122.15 1gof s TRP 356 Ca -0.02 0.06 -0.04 0.00 0.02 0.00 0.00 56.10 56.12 1gof s TRP 356 Cb 0.01 -2.18 -0.03 0.00 -1.15 0.00 0.00 33.47 30.11 1gof s TRP 356 CO -0.06 0.04 -0.01 0.71 0.02 0.00 0.00 176.95 177.65 1gof s TYR 357 N 0.85 3.10 0.05 -1.98 2.02 0.21 -0.81 117.35 120.79 1gof s TYR 357 Ca 0.05 -0.08 0.07 0.00 -0.37 0.00 0.00 57.07 56.74 1gof s TYR 357 Cb -0.13 -1.93 -0.03 0.00 -0.40 0.00 0.00 41.96 39.46 1gof s TYR 357 CO 0.03 0.14 -0.18 0.71 -1.57 0.00 0.00 175.55 174.68 1gof s TYR 358 N 0.01 2.55 -0.40 2.71 2.02 -0.38 -1.03 117.35 122.82 1gof s TYR 358 Ca 0.02 -0.26 0.05 0.00 -0.37 0.00 0.00 57.07 56.51 1gof s TYR 358 Cb -0.13 -1.44 0.14 0.00 -0.40 0.00 0.00 41.96 40.13 1gof s TYR 358 CO 0.02 0.27 1.12 0.25 -1.57 0.00 0.00 175.55 175.64 1gof n THR 359 N 1.43 1.04 -2.76 -0.71 -2.24 -1.25 -1.96 114.28 107.82 1gof n THR 359 Ca -0.16 -1.04 -0.33 0.00 -2.27 0.00 0.00 64.05 60.26 1gof n THR 359 Cb 0.52 0.48 -0.06 0.00 -2.10 0.00 0.00 70.33 69.17 1gof n THR 359 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1gof s SER 360 N -1.05 6.81 0.83 3.42 1.04 -1.26 -4.62 113.70 118.88 1gof s SER 360 Ca 0.11 1.57 0.00 0.00 0.48 0.00 0.00 55.95 58.11 1gof s SER 360 Cb 0.06 -2.50 0.00 0.00 0.10 0.00 0.00 66.02 63.69 1gof s SER 360 CO 0.07 -0.40 0.00 0.61 0.98 0.00 0.00 173.24 174.50 1gof n GLY 361 N -0.88 2.42 0.81 7.32 0.00 -1.26 -0.70 105.19 112.90 1gof n GLY 361 Ca 0.06 -0.39 0.02 0.00 0.00 0.00 0.00 46.02 45.71 1gof n GLY 361 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1gof n SER 362 N -0.14 2.16 0.00 1.61 7.64 -1.26 -4.97 113.62 118.66 1gof n SER 362 Ca 0.00 -2.22 0.00 0.00 1.01 0.00 0.00 58.87 57.66 1gof n SER 362 Cb 0.00 -0.47 0.00 0.00 -1.01 0.00 0.00 64.21 62.73 1gof n SER 362 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1gof n GLY 363 N 0.33 -0.30 3.85 0.23 0.00 0.12 -1.24 105.19 108.18 1gof n GLY 363 Ca 0.08 -1.70 -0.07 0.00 0.00 0.00 0.00 46.02 44.33 1gof n GLY 363 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1gof s ASP 364 N -2.30 -0.24 -0.12 1.61 2.15 -0.83 -4.18 116.67 112.76 1gof s ASP 364 Ca 0.00 -0.62 -0.11 0.00 0.43 0.00 0.00 52.55 52.25 1gof s ASP 364 Cb 0.00 0.72 0.03 0.00 -0.30 0.00 0.00 42.92 43.37 1gof s ASP 364 CO 0.00 -1.33 0.32 0.54 -0.17 0.00 0.00 175.17 174.53 1gof s VAL 365 N -3.81 0.00 -0.01 1.11 0.11 -1.26 -1.25 120.40 115.30 1gof s VAL 365 Ca 0.11 -0.01 0.00 0.00 -2.93 0.00 0.00 61.98 59.16 1gof s VAL 365 Cb -0.06 -0.46 0.01 0.00 -1.53 0.00 0.00 36.38 34.34 1gof s VAL 365 CO 0.07 -0.01 -0.01 -0.75 -3.33 0.00 0.00 175.10 171.07 1gof s LYS 366 N 0.14 0.16 0.31 1.54 2.20 0.01 -4.97 119.74 119.12 1gof s LYS 366 Ca -0.00 -0.01 -0.29 0.00 -0.36 0.00 0.00 55.97 55.31 1gof s LYS 366 Cb -0.02 -0.22 -0.11 0.00 -1.51 0.00 0.00 37.83 35.96 1gof s LYS 366 CO 0.01 -0.02 1.50 0.45 -0.36 0.00 0.00 175.35 176.93 1gof s SER 367 N 0.31 6.46 -0.08 1.43 0.15 -1.26 -0.07 113.70 120.64 1gof s SER 367 Ca -0.03 2.89 0.11 0.00 0.70 0.00 0.00 55.95 59.63 1gof s SER 367 Cb -0.05 -2.64 0.25 0.00 -1.71 0.00 0.00 66.02 61.87 1gof s SER 367 CO -0.01 -0.82 1.18 0.00 1.20 0.00 0.00 173.24 174.79 1gof n ALA 368 N 1.62 2.31 0.00 5.45 0.00 -0.28 -4.77 120.51 124.83 1gof n ALA 368 Ca 0.05 -1.82 0.00 0.00 0.00 0.00 0.00 53.44 51.68 1gof n ALA 368 Cb 0.39 -0.34 0.00 0.00 0.00 0.00 0.00 19.45 19.50 1gof n ALA 368 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1gof n GLY 369 N -0.63 -1.77 3.62 0.00 0.00 -1.24 -4.27 105.19 100.91 1gof n GLY 369 Ca 0.11 -1.50 -0.34 0.00 0.00 0.00 0.00 46.02 44.30 1gof n GLY 369 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gof s LYS 370 N 0.00 2.79 -0.05 1.61 1.02 -1.26 -0.88 119.74 122.96 1gof s LYS 370 Ca 0.00 -0.54 -0.30 0.00 0.02 0.00 0.00 55.97 55.15 1gof s LYS 370 Cb 0.00 -2.64 -0.05 0.00 -0.52 0.00 0.00 37.83 34.62 1gof s LYS 370 CO 0.00 0.66 1.50 0.50 -0.92 0.00 0.00 175.35 177.09 1gof s ARG 371 N -1.01 4.22 0.29 1.68 3.52 0.92 -4.93 118.95 123.64 1gof s ARG 371 Ca 0.14 2.02 -0.18 0.00 -0.13 0.00 0.00 55.73 57.58 1gof s ARG 371 Cb -0.11 -3.79 0.07 0.00 -1.56 0.00 0.00 34.95 29.55 1gof s ARG 371 CO 0.04 -0.73 0.91 0.00 -0.81 0.00 0.00 175.30 174.71 1gof n GLN 372 N 6.40 0.89 -1.83 5.12 10.64 -1.26 -0.60 117.38 136.74 1gof n GLN 372 Ca 0.15 -1.85 -0.01 0.00 -1.83 0.00 0.00 57.00 53.46 1gof n GLN 372 Cb 0.43 2.39 0.01 0.00 -0.86 0.00 0.00 30.24 32.21 1gof n GLN 372 CO 0.00 0.00 0.00 -1.13 -1.83 0.00 0.00 177.06 174.10 1gof n SER 373 N -1.42 -0.45 0.07 2.61 3.41 -0.60 -4.11 113.62 113.14 1gof n SER 373 Ca -0.05 -1.27 0.06 0.00 -0.26 0.00 0.00 58.87 57.35 1gof n SER 373 Cb 0.59 0.73 0.31 0.00 -0.26 0.00 0.00 64.21 65.58 1gof n SER 373 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1gof n ASN 374 N -0.90 0.27 -0.38 4.04 0.23 -1.26 -1.12 115.26 116.16 1gof n ASN 374 Ca -0.01 0.61 0.13 0.00 -0.53 0.00 0.00 54.58 54.78 1gof n ASN 374 Cb 0.13 -0.65 0.37 0.00 -2.08 0.00 0.00 39.78 37.55 1gof n ASN 374 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 1gof n ARG 375 N -1.85 1.20 0.00 -3.83 1.74 -1.26 -5.04 116.66 107.62 1gof n ARG 375 Ca 0.00 -0.76 0.00 0.00 -0.77 0.00 0.00 57.85 56.33 1gof n ARG 375 Cb 0.07 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.03 1gof n ARG 375 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1gof n GLY 376 N 1.30 0.86 3.73 -0.13 0.00 -0.27 -5.03 105.19 105.65 1gof n GLY 376 Ca 0.14 -2.22 -0.41 0.00 0.00 0.00 0.00 46.02 43.52 1gof n GLY 376 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1gof s VAL 377 N -0.95 4.53 0.18 1.61 1.01 -1.26 -1.55 120.40 123.96 1gof s VAL 377 Ca 0.00 2.07 -0.30 0.00 0.00 0.00 0.00 61.98 63.75 1gof s VAL 377 Cb 0.00 -4.32 -0.08 0.00 0.00 0.00 0.00 36.38 31.98 1gof s VAL 377 CO 0.00 0.31 1.15 0.00 0.00 0.00 0.00 175.10 176.56 1gof s ALA 378 N 0.06 3.40 0.90 5.51 0.00 0.23 -4.96 121.76 126.90 1gof s ALA 378 Ca 0.47 0.89 -0.12 0.00 0.00 0.00 0.00 51.96 53.20 1gof s ALA 378 Cb -0.23 -3.38 0.13 0.00 0.00 0.00 0.00 23.12 19.63 1gof s ALA 378 CO 0.30 -0.30 1.10 -1.25 0.00 0.00 0.00 175.76 175.61 1gof s PRO 379 N -0.31 1.24 0.30 0.00 0.04 -1.26 -4.49 135.00 130.52 1gof s PRO 379 Ca 0.51 0.62 -0.28 0.00 0.04 0.00 0.00 61.00 61.89 1gof s PRO 379 Cb -0.31 -1.82 -0.13 0.00 0.04 0.00 0.00 34.50 32.27 1gof s PRO 379 CO 0.36 -2.20 1.12 -0.25 0.04 0.00 0.00 177.00 176.07 1gof n ASP 380 N -3.83 1.86 -3.20 6.66 8.00 -1.26 -4.64 116.55 120.14 1gof n ASP 380 Ca 0.06 1.19 -0.23 0.00 0.71 0.00 0.00 54.79 56.52 1gof n ASP 380 Cb 0.57 -1.36 -0.06 0.00 -0.02 0.00 0.00 41.12 40.25 1gof n ASP 380 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1gof n ALA 381 N 0.33 2.86 -1.73 2.24 0.00 -0.18 -3.00 120.51 121.03 1gof n ALA 381 Ca 0.08 -3.80 -0.42 0.00 0.00 0.00 0.00 53.44 49.30 1gof n ALA 381 Cb 0.33 -0.85 -0.02 0.00 0.00 0.00 0.00 19.45 18.91 1gof n ALA 381 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1gof n MET 382 N 0.81 2.68 -1.09 0.00 1.56 0.13 -1.28 117.12 119.94 1gof n MET 382 Ca 0.25 0.96 -0.03 0.00 -0.27 0.00 0.00 57.70 58.61 1gof n MET 382 Cb 0.53 -2.76 -0.01 0.00 2.15 0.00 0.00 33.22 33.13 1gof n MET 382 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1gof s GLY 384 N -2.26 1.59 0.20 0.00 0.00 -0.40 -3.54 107.32 102.90 1gof s GLY 384 Ca 0.00 -0.37 0.08 0.00 0.00 0.00 0.00 44.72 44.43 1gof s GLY 384 CO 0.00 0.15 -0.05 -1.31 0.00 0.00 0.00 173.10 171.89 1gof s ASN 385 N -3.87 4.48 -0.02 1.64 0.02 -0.72 -4.91 114.94 111.56 1gof s ASN 385 Ca 0.63 -0.53 -0.00 0.00 -1.02 0.00 0.00 52.86 51.93 1gof s ASN 385 Cb -0.15 -0.84 0.03 0.00 0.02 0.00 0.00 41.25 40.30 1gof s ASN 385 CO 0.54 0.08 0.04 0.00 0.02 0.00 0.00 177.10 177.78 1gof s ALA 386 N -1.84 0.03 -0.05 0.60 0.00 -1.26 -1.26 121.76 117.98 1gof s ALA 386 Ca 0.27 0.30 0.01 0.00 0.00 0.00 0.00 51.96 52.55 1gof s ALA 386 Cb -0.08 -0.23 0.02 0.00 0.00 0.00 0.00 23.12 22.82 1gof s ALA 386 CO 0.17 -0.10 -0.06 0.08 0.00 0.00 0.00 175.76 175.85 1gof s VAL 387 N 0.93 0.64 -0.82 0.00 1.01 0.19 -4.86 120.40 117.48 1gof s VAL 387 Ca -0.08 -0.19 -0.18 0.00 0.00 0.00 0.00 61.98 61.53 1gof s VAL 387 Cb -0.11 -0.64 0.13 0.00 0.00 0.00 0.00 36.38 35.76 1gof s VAL 387 CO -0.03 0.25 0.98 -0.32 0.00 0.00 0.00 175.10 175.98 1gof s MET 388 N 0.85 3.45 0.01 2.72 1.75 -1.26 -0.61 119.30 126.20 1gof s MET 388 Ca -0.12 -1.68 0.26 0.00 -1.25 0.00 0.00 55.69 52.90 1gof s MET 388 Cb -0.15 -4.64 0.76 0.00 2.84 0.00 0.00 34.83 33.63 1gof s MET 388 CO 0.01 -1.66 1.59 2.48 -0.65 0.00 0.00 175.02 176.79 1gof n TYR 389 N 6.25 0.04 -3.37 4.11 0.18 -0.93 -2.07 117.16 121.37 1gof n TYR 389 Ca 0.13 0.01 -0.17 0.00 1.88 0.00 0.00 57.90 59.75 1gof n TYR 389 Cb 0.47 -0.36 -0.08 0.00 -0.38 0.00 0.00 39.34 38.99 1gof n TYR 389 CO 0.00 0.00 0.00 0.34 -2.08 0.00 0.00 176.86 175.12 1gof s ASP 390 N -3.07 1.27 0.51 9.48 -1.08 -1.19 -4.42 116.67 118.17 1gof s ASP 390 Ca 0.12 -1.49 0.28 0.00 -0.52 0.00 0.00 52.55 50.94 1gof s ASP 390 Cb 0.18 0.53 1.31 0.00 -1.46 0.00 0.00 42.92 43.48 1gof s ASP 390 CO 0.64 -0.28 1.99 0.00 0.52 0.00 0.00 175.17 178.04 1gof h ALA 391 N 7.21 1.12 -0.02 3.66 0.00 -0.93 0.17 119.26 130.48 1gof h ALA 391 Ca 0.03 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1gof h ALA 391 Cb 1.06 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.82 1gof h ALA 391 CO 0.22 0.16 -0.01 0.28 0.00 0.00 0.00 179.25 179.90 1gof h VAL 392 N 0.00 1.34 -0.11 0.00 2.07 -1.93 -3.14 116.25 114.48 1gof h VAL 392 Ca -0.00 -1.03 0.00 0.00 0.82 0.00 0.00 66.70 66.49 1gof h VAL 392 Cb 0.49 2.00 0.00 0.00 -1.52 0.00 0.00 31.29 32.26 1gof h VAL 392 CO 0.02 0.27 0.00 0.29 0.02 0.00 0.00 177.57 178.17 1gof n LYS 393 N -4.85 1.41 -3.43 1.57 4.76 -1.12 -4.93 118.16 111.57 1gof n LYS 393 Ca -0.08 -0.63 -0.20 0.00 -2.87 0.00 0.00 58.31 54.53 1gof n LYS 393 Cb 0.23 -1.32 0.07 0.00 -1.84 0.00 0.00 35.03 32.17 1gof n LYS 393 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1gof n GLY 394 N 0.96 -0.33 3.68 0.72 0.00 -0.63 -4.47 105.19 105.11 1gof n GLY 394 Ca 0.14 0.12 -0.38 0.00 0.00 0.00 0.00 46.02 45.90 1gof n GLY 394 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gof s LYS 395 N -6.05 4.19 -0.11 1.61 -0.14 -0.05 -0.92 119.74 118.28 1gof s LYS 395 Ca 0.46 0.13 0.03 0.00 -1.36 0.00 0.00 55.97 55.23 1gof s LYS 395 Cb -0.20 -3.51 0.01 0.00 -1.68 0.00 0.00 37.83 32.45 1gof s LYS 395 CO 0.63 0.04 -0.19 0.42 -0.76 0.00 0.00 175.35 175.49 1gof s ILE 396 N 1.07 1.73 -0.22 2.17 1.01 -0.31 -2.19 121.20 124.46 1gof s ILE 396 Ca 0.17 -0.80 -0.10 0.00 0.00 0.00 0.00 60.65 59.92 1gof s ILE 396 Cb -0.14 -1.54 -0.05 0.00 0.01 0.00 0.00 42.46 40.74 1gof s ILE 396 CO 0.07 0.49 0.14 -0.22 0.00 0.00 0.00 174.94 175.41 1gof s LEU 397 N 0.69 4.13 0.06 2.97 2.96 0.22 0.37 118.68 130.09 1gof s LEU 397 Ca -0.12 0.16 0.09 0.00 -0.22 0.00 0.00 54.13 54.04 1gof s LEU 397 Cb -0.16 -2.09 -0.03 0.00 0.50 0.00 0.00 46.19 44.41 1gof s LEU 397 CO 0.03 0.12 -0.25 0.42 -1.32 0.00 0.00 176.35 175.35 1gof s THR 398 N 0.71 2.00 -0.14 3.68 -4.23 -0.14 -0.64 115.64 116.88 1gof s THR 398 Ca 0.07 -1.42 -0.29 0.00 -1.18 0.00 0.00 61.69 58.88 1gof s THR 398 Cb -0.12 -1.73 0.09 0.00 1.34 0.00 0.00 72.50 72.07 1gof s THR 398 CO 0.01 0.24 0.81 0.72 -0.54 0.00 0.00 174.62 175.87 1gof s PHE 399 N -0.88 -0.58 0.00 3.99 -0.71 -0.39 -1.29 117.98 118.13 1gof s PHE 399 Ca 0.11 1.13 0.00 0.00 -1.04 0.00 0.00 56.93 57.13 1gof s PHE 399 Cb -0.10 0.39 0.00 0.00 -1.21 0.00 0.00 43.02 42.10 1gof s PHE 399 CO 0.03 -0.45 0.00 0.41 -1.34 0.00 0.00 175.22 173.87 1gof n GLY 400 N 1.32 -1.17 0.00 1.99 0.00 -0.18 -1.76 105.19 105.39 1gof n GLY 400 Ca -0.15 -1.23 0.00 0.00 0.00 0.00 0.00 46.02 44.64 1gof n GLY 400 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gof n GLY 401 N 0.00 -0.64 3.21 -0.02 0.00 0.12 -4.25 105.19 103.63 1gof n GLY 401 Ca 0.00 -1.74 -0.10 0.00 0.00 0.00 0.00 46.02 44.19 1gof n GLY 401 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1gof s SER 402 N -1.90 0.22 0.39 1.61 1.04 -0.62 -1.64 113.70 112.79 1gof s SER 402 Ca 0.00 -1.08 0.06 0.00 0.48 0.00 0.00 55.95 55.40 1gof s SER 402 Cb 0.00 0.34 0.77 0.00 0.10 0.00 0.00 66.02 67.23 1gof s SER 402 CO 0.00 -0.78 2.01 -0.65 0.98 0.00 0.00 173.24 174.80 1gof h PRO 403 N 2.76 0.58 -6.55 4.02 0.11 -1.76 0.37 132.00 131.54 1gof h PRO 403 Ca -0.34 -0.05 -0.64 0.00 0.11 0.00 0.00 66.00 65.08 1gof h PRO 403 Cb 1.21 -0.12 -0.17 0.00 0.11 0.00 0.00 31.00 32.03 1gof h PRO 403 CO 0.55 0.43 -0.78 -0.51 -0.21 0.00 0.00 178.00 177.48 1gof s ASP 404 N -6.66 3.77 0.19 -2.05 1.01 -1.26 -4.46 116.67 107.20 1gof s ASP 404 Ca -0.08 -0.75 -0.13 0.00 0.71 0.00 0.00 52.55 52.30 1gof s ASP 404 Cb 0.17 -0.44 0.19 0.00 1.01 0.00 0.00 42.92 43.84 1gof s ASP 404 CO 0.74 0.11 1.71 0.22 0.21 0.00 0.00 175.17 178.17 1gof h TYR 405 N 3.09 0.13 -4.26 4.23 5.03 -1.90 -3.43 116.97 119.86 1gof h TYR 405 Ca -0.47 0.03 -0.22 0.00 2.58 0.00 0.00 58.73 60.65 1gof h TYR 405 Cb 1.21 0.02 -0.15 0.00 1.55 0.00 0.00 36.73 39.36 1gof h TYR 405 CO 0.67 -0.02 -0.65 1.14 -1.32 0.00 0.00 178.16 177.98 1gof s GLN 406 N -6.14 1.03 -1.42 1.82 -2.07 -1.26 -4.81 119.66 106.80 1gof s GLN 406 Ca -0.13 -1.50 -0.05 0.00 -1.82 0.00 0.00 55.36 51.86 1gof s GLN 406 Cb 0.15 0.11 0.01 0.00 -1.09 0.00 0.00 33.01 32.19 1gof s GLN 406 CO 0.73 -0.25 0.61 -0.25 -1.32 0.00 0.00 175.29 174.81 1gof n ASP 407 N -0.17 -5.82 -3.97 12.60 8.00 0.23 -4.97 116.55 122.45 1gof n ASP 407 Ca -0.04 -0.29 -0.13 0.00 0.71 0.00 0.00 54.79 55.04 1gof n ASP 407 Cb 0.64 -4.63 -0.13 0.00 -0.02 0.00 0.00 41.12 36.98 1gof n ASP 407 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1gof s SER 408 N -2.78 0.48 0.13 -2.24 0.15 -1.26 -4.98 113.70 103.21 1gof s SER 408 Ca 0.30 -0.25 -0.30 0.00 0.70 0.00 0.00 55.95 56.40 1gof s SER 408 Cb -0.13 -0.00 -0.07 0.00 -1.71 0.00 0.00 66.02 64.11 1gof s SER 408 CO 0.37 -0.07 1.12 -1.81 1.20 0.00 0.00 173.24 174.05 1gof s ASP 409 N -0.67 7.22 0.90 5.45 1.01 -1.26 -2.44 116.67 126.88 1gof s ASP 409 Ca -0.04 2.04 -0.12 0.00 0.71 0.00 0.00 52.55 55.14 1gof s ASP 409 Cb -0.05 -2.59 0.13 0.00 1.01 0.00 0.00 42.92 41.42 1gof s ASP 409 CO -0.00 -0.30 1.12 0.00 0.21 0.00 0.00 175.17 176.20 1gof s ALA 410 N 0.21 1.73 0.37 5.23 0.00 0.11 -4.49 121.76 124.92 1gof s ALA 410 Ca 0.52 -0.39 0.04 0.00 0.00 0.00 0.00 51.96 52.13 1gof s ALA 410 Cb -0.29 -3.07 -0.06 0.00 0.00 0.00 0.00 23.12 19.70 1gof s ALA 410 CO 0.33 -2.25 0.06 0.95 0.00 0.00 0.00 175.76 174.85 1gof s THR 411 N -3.18 1.21 -2.55 0.00 -4.23 -0.65 -4.70 115.64 101.55 1gof s THR 411 Ca 0.63 -2.00 0.23 0.00 -1.18 0.00 0.00 61.69 59.37 1gof s THR 411 Cb -0.16 -2.70 0.39 0.00 1.34 0.00 0.00 72.50 71.38 1gof s THR 411 CO 0.54 0.00 1.43 0.35 -0.54 0.00 0.00 174.62 176.40 1gof n THR 412 N -0.81 0.30 -1.68 3.99 -2.24 -1.26 -3.16 114.28 109.42 1gof n THR 412 Ca -0.05 -0.58 -0.41 0.00 -2.27 0.00 0.00 64.05 60.75 1gof n THR 412 Cb 0.66 0.92 0.02 0.00 -2.10 0.00 0.00 70.33 69.83 1gof n THR 412 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1gof n ASN 413 N 1.12 2.13 -3.70 3.42 5.03 -1.26 -1.11 115.26 120.88 1gof n ASN 413 Ca 0.18 1.06 -0.13 0.00 0.87 0.00 0.00 54.58 56.56 1gof n ASN 413 Cb 0.53 -1.46 -0.09 0.00 -1.02 0.00 0.00 39.78 37.73 1gof n ASN 413 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1gof s ALA 414 N -1.24 -1.22 0.08 5.41 0.00 -1.26 -1.01 121.76 122.51 1gof s ALA 414 Ca 0.63 1.45 0.01 0.00 0.00 0.00 0.00 51.96 54.05 1gof s ALA 414 Cb -0.51 -0.85 -0.04 0.00 0.00 0.00 0.00 23.12 21.72 1gof s ALA 414 CO 0.56 -0.24 -0.05 -1.01 0.00 0.00 0.00 175.76 175.02 1gof s HIS 415 N 0.46 0.74 -0.18 0.00 3.76 -0.41 -0.70 115.29 118.95 1gof s HIS 415 Ca -0.02 -0.99 -0.02 0.00 -0.15 0.00 0.00 55.06 53.89 1gof s HIS 415 Cb -0.04 -0.46 -0.00 0.00 1.11 0.00 0.00 32.58 33.18 1gof s HIS 415 CO -0.02 -0.26 -0.11 0.42 -0.85 0.00 0.00 174.74 173.93 1gof s ILE 416 N -3.76 2.94 -0.10 0.60 1.01 -0.04 -0.96 121.20 120.88 1gof s ILE 416 Ca 0.10 -0.66 -0.03 0.00 0.00 0.00 0.00 60.65 60.07 1gof s ILE 416 Cb 0.06 -2.29 -0.03 0.00 0.01 0.00 0.00 42.46 40.22 1gof s ILE 416 CO -0.07 0.48 0.00 -0.63 0.00 0.00 0.00 174.94 174.73 1gof s ILE 417 N 1.11 4.31 -0.21 2.92 1.01 0.16 -1.69 121.20 128.80 1gof s ILE 417 Ca 0.01 -0.24 0.01 0.00 0.00 0.00 0.00 60.65 60.43 1gof s ILE 417 Cb -0.14 -2.83 0.04 0.00 0.01 0.00 0.00 42.46 39.54 1gof s ILE 417 CO -0.03 0.58 -0.11 -0.89 0.00 0.00 0.00 174.94 174.49 1gof s THR 418 N -0.62 1.77 0.28 2.92 2.01 0.40 -1.16 115.64 121.25 1gof s THR 418 Ca 0.10 -1.13 -0.19 0.00 0.31 0.00 0.00 61.69 60.79 1gof s THR 418 Cb -0.12 -1.84 -0.09 0.00 0.01 0.00 0.00 72.50 70.47 1gof s THR 418 CO 0.02 0.16 0.77 -0.76 -0.69 0.00 0.00 174.62 174.12 1gof s LEU 419 N 1.33 4.21 0.00 4.42 1.43 -0.09 -2.82 118.68 127.16 1gof s LEU 419 Ca -0.02 1.44 0.00 0.00 -1.03 0.00 0.00 54.13 54.51 1gof s LEU 419 Cb -0.17 -3.88 0.00 0.00 0.03 0.00 0.00 46.19 42.17 1gof s LEU 419 CO -0.08 -0.09 0.00 0.61 0.23 0.00 0.00 176.35 177.02 1gof n GLY 420 N 0.22 4.01 3.81 -3.19 0.00 -1.26 -4.44 105.19 104.34 1gof n GLY 420 Ca 0.01 -1.08 -0.34 0.00 0.00 0.00 0.00 46.02 44.61 1gof n GLY 420 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1gof s GLU 421 N 4.67 4.33 0.61 1.61 0.41 -1.26 -4.95 118.70 124.12 1gof s GLU 421 Ca 0.00 1.16 -0.18 0.00 -0.41 0.00 0.00 54.97 55.53 1gof s GLU 421 Cb 0.00 -2.40 -0.04 0.00 -1.78 0.00 0.00 34.13 29.91 1gof s GLU 421 CO 0.00 0.09 1.04 -2.30 -0.49 0.00 0.00 175.26 173.60 1gof n PRO 422 N -0.22 0.96 -0.13 0.39 -0.02 -1.26 -1.81 135.00 132.91 1gof n PRO 422 Ca 0.05 0.37 0.00 0.00 -2.02 0.00 0.00 63.50 61.90 1gof n PRO 422 Cb 0.53 -2.25 0.00 0.00 -0.02 0.00 0.00 33.50 31.75 1gof n PRO 422 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1gof n GLY 423 N 1.20 1.91 3.93 -1.23 0.00 -1.26 -5.03 105.19 104.71 1gof n GLY 423 Ca 0.14 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.87 1gof n GLY 423 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1gof s THR 424 N -2.84 5.36 -0.34 2.61 -4.23 -0.75 -5.00 115.64 110.45 1gof s THR 424 Ca 0.00 -0.50 -0.27 0.00 -1.18 0.00 0.00 61.69 59.74 1gof s THR 424 Cb 0.00 -3.68 0.01 0.00 1.34 0.00 0.00 72.50 70.18 1gof s THR 424 CO 0.00 0.04 0.99 -0.44 -0.54 0.00 0.00 174.62 174.67 1gof s SER 425 N -2.80 6.81 0.70 3.99 0.01 -1.26 -4.88 113.70 116.26 1gof s SER 425 Ca 0.35 0.84 -0.13 0.00 1.31 0.00 0.00 55.95 58.32 1gof s SER 425 Cb -0.12 -2.50 0.02 0.00 0.21 0.00 0.00 66.02 63.63 1gof s SER 425 CO 0.28 -0.84 1.09 -2.16 0.41 0.00 0.00 173.24 172.02 1gof s PRO 426 N 3.52 2.68 0.12 12.44 0.04 -1.26 -4.97 135.00 147.57 1gof s PRO 426 Ca 0.41 1.23 -0.24 0.00 0.04 0.00 0.00 61.00 62.44 1gof s PRO 426 Cb -0.12 -1.95 -0.07 0.00 0.04 0.00 0.00 34.50 32.40 1gof s PRO 426 CO 0.16 -1.32 0.73 1.21 0.04 0.00 0.00 177.00 177.83 1gof s ASN 427 N -3.07 7.29 -0.02 6.66 2.47 -1.13 -4.86 114.94 122.29 1gof s ASN 427 Ca 0.63 1.53 0.04 0.00 0.42 0.00 0.00 52.86 55.48 1gof s ASN 427 Cb -0.18 -2.47 -0.01 0.00 -1.45 0.00 0.00 41.25 37.15 1gof s ASN 427 CO 0.48 0.18 -0.13 0.42 -3.72 0.00 0.00 177.10 174.33 1gof s THR 428 N -0.92 1.08 0.27 -5.21 -4.23 -1.26 -0.46 115.64 104.92 1gof s THR 428 Ca 0.35 -0.56 0.02 0.00 -1.18 0.00 0.00 61.69 60.32 1gof s THR 428 Cb -0.22 -0.92 -0.05 0.00 1.34 0.00 0.00 72.50 72.65 1gof s THR 428 CO 0.24 0.31 0.09 0.68 -0.54 0.00 0.00 174.62 175.41 1gof s VAL 429 N -0.11 0.66 0.29 2.29 -7.23 -0.68 -4.63 120.40 110.99 1gof s VAL 429 Ca 0.01 -2.00 -0.24 0.00 -1.81 0.00 0.00 61.98 57.94 1gof s VAL 429 Cb -0.07 -2.66 -0.09 0.00 0.56 0.00 0.00 36.38 34.11 1gof s VAL 429 CO 0.00 0.00 0.88 0.12 -0.31 0.00 0.00 175.10 175.79 1gof s PHE 430 N -3.66 3.67 -0.41 2.82 5.36 -1.26 -0.86 117.98 123.64 1gof s PHE 430 Ca 0.37 1.66 -0.20 0.00 -0.96 0.00 0.00 56.93 57.80 1gof s PHE 430 Cb 0.08 -2.83 0.02 0.00 -0.34 0.00 0.00 43.02 39.95 1gof s PHE 430 CO 0.14 0.25 0.62 0.00 -1.46 0.00 0.00 175.22 174.77 1gof s ALA 431 N -1.59 3.39 0.00 11.12 0.00 0.12 -4.69 121.76 130.10 1gof s ALA 431 Ca 0.48 -1.11 0.00 0.00 0.00 0.00 0.00 51.96 51.33 1gof s ALA 431 Cb -0.18 -3.23 0.00 0.00 0.00 0.00 0.00 23.12 19.71 1gof s ALA 431 CO 0.23 -1.61 0.00 0.45 0.00 0.00 0.00 175.76 174.83 1gof n SER 432 N 6.13 0.00 -1.33 0.00 2.88 -1.26 -0.84 113.62 119.21 1gof n SER 432 Ca -0.02 0.00 0.07 0.00 -1.33 0.00 0.00 58.87 57.59 1gof n SER 432 Cb 0.48 0.00 0.32 0.00 -0.75 0.00 0.00 64.21 64.26 1gof n SER 432 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1gof n ASN 433 N 2.89 4.63 0.00 -3.46 5.15 -1.26 -5.10 115.26 118.11 1gof n ASN 433 Ca 0.00 -3.01 0.00 0.00 -0.60 0.00 0.00 54.58 50.97 1gof n ASN 433 Cb 0.00 -0.61 0.00 0.00 -0.53 0.00 0.00 39.78 38.64 1gof n ASN 433 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1gof n GLY 434 N -0.07 -0.97 3.74 8.20 0.00 -0.02 -4.93 105.19 111.14 1gof n GLY 434 Ca 0.25 -1.65 -0.33 0.00 0.00 0.00 0.00 46.02 44.28 1gof n GLY 434 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1gof s LEU 435 N -1.94 3.27 0.14 0.99 1.43 -0.27 -4.91 118.68 117.39 1gof s LEU 435 Ca 0.00 2.19 -0.09 0.00 -1.03 0.00 0.00 54.13 55.19 1gof s LEU 435 Cb 0.00 -4.57 -0.04 0.00 0.03 0.00 0.00 46.19 41.61 1gof s LEU 435 CO 0.00 -2.13 1.42 1.88 0.23 0.00 0.00 176.35 177.75 1gof h TYR 436 N -0.42 0.99 -3.21 0.29 0.05 -1.91 -3.44 116.97 109.31 1gof h TYR 436 Ca -0.47 -0.36 -0.67 0.00 0.05 0.00 0.00 58.73 57.28 1gof h TYR 436 Cb 1.27 -0.18 -0.34 0.00 1.01 0.00 0.00 36.73 38.49 1gof h TYR 436 CO 0.51 1.17 -0.87 -0.06 -1.05 0.00 0.00 178.16 177.86 1gof s PHE 437 N -4.04 2.64 0.30 4.88 0.08 -1.26 -5.09 117.98 115.49 1gof s PHE 437 Ca -0.10 -1.31 -0.29 0.00 0.12 0.00 0.00 56.93 55.35 1gof s PHE 437 Cb 0.10 -1.79 -0.10 0.00 -0.57 0.00 0.00 43.02 40.65 1gof s PHE 437 CO 0.88 -0.59 1.42 0.00 -0.10 0.00 0.00 175.22 176.82 1gof s ALA 438 N 0.78 3.59 0.06 5.36 0.00 -1.26 -4.82 121.76 125.46 1gof s ALA 438 Ca -0.08 1.36 -0.24 0.00 0.00 0.00 0.00 51.96 53.00 1gof s ALA 438 Cb -0.16 -3.55 0.06 0.00 0.00 0.00 0.00 23.12 19.48 1gof s ALA 438 CO -0.01 -0.78 0.58 -0.98 0.00 0.00 0.00 175.76 174.57 1gof s ARG 439 N -1.12 1.12 0.06 0.00 1.70 -1.19 -4.15 118.95 115.38 1gof s ARG 439 Ca 0.55 -0.21 0.01 0.00 -0.47 0.00 0.00 55.73 55.61 1gof s ARG 439 Cb -0.42 0.52 -0.03 0.00 -0.57 0.00 0.00 34.95 34.44 1gof s ARG 439 CO 0.50 -0.43 -0.05 -0.08 -1.08 0.00 0.00 175.30 174.16 1gof s THR 440 N -2.62 0.44 0.00 4.99 -1.32 -0.54 0.16 115.64 116.75 1gof s THR 440 Ca -0.04 -1.58 0.00 0.00 -1.21 0.00 0.00 61.69 58.85 1gof s THR 440 Cb -0.01 -1.22 0.00 0.00 -1.51 0.00 0.00 72.50 69.76 1gof s THR 440 CO -0.03 -0.76 0.00 0.49 -2.21 0.00 0.00 174.62 172.11 1gof n PHE 441 N 0.53 0.00 -1.44 9.09 3.72 -1.23 -2.19 117.46 125.95 1gof n PHE 441 Ca -0.16 0.00 -0.29 0.00 -0.05 0.00 0.00 57.45 56.95 1gof n PHE 441 Cb 0.59 -1.27 0.14 0.00 -0.94 0.00 0.00 39.48 38.00 1gof n PHE 441 CO 0.00 0.00 0.00 -3.38 -0.05 0.00 0.00 176.76 173.33 1gof s HIS 442 N -1.40 2.43 0.18 1.38 -3.43 -1.26 -4.18 115.29 109.00 1gof s HIS 442 Ca 0.00 0.91 0.01 0.00 -0.80 0.00 0.00 55.06 55.18 1gof s HIS 442 Cb 0.00 -3.33 -0.05 0.00 -1.43 0.00 0.00 32.58 27.77 1gof s HIS 442 CO 0.00 -2.46 0.03 0.95 -2.00 0.00 0.00 174.74 171.26 1gof s THR 443 N -3.18 0.51 0.10 -5.38 -4.23 -0.44 -4.72 115.64 98.28 1gof s THR 443 Ca 0.64 -1.97 -0.25 0.00 -1.18 0.00 0.00 61.69 58.93 1gof s THR 443 Cb -0.16 -2.18 0.07 0.00 1.34 0.00 0.00 72.50 71.57 1gof s THR 443 CO 0.54 -0.39 0.63 -0.94 -0.54 0.00 0.00 174.62 173.92 1gof s SER 444 N -3.16 -0.59 0.01 3.99 1.04 -1.26 -0.49 113.70 113.24 1gof s SER 444 Ca 0.26 0.21 -0.05 0.00 0.48 0.00 0.00 55.95 56.85 1gof s SER 444 Cb 0.07 0.58 -0.01 0.00 0.10 0.00 0.00 66.02 66.76 1gof s SER 444 CO 0.05 -0.86 0.08 0.68 0.98 0.00 0.00 173.24 174.17 1gof s VAL 445 N -3.00 0.09 -0.06 5.02 -7.23 -0.30 -4.88 120.40 110.05 1gof s VAL 445 Ca -0.02 -0.78 -0.20 0.00 -1.81 0.00 0.00 61.98 59.17 1gof s VAL 445 Cb -0.01 -0.38 -0.05 0.00 0.56 0.00 0.00 36.38 36.51 1gof s VAL 445 CO -0.06 -0.43 0.56 0.54 -0.31 0.00 0.00 175.10 175.40 1gof s VAL 446 N -1.44 5.06 0.52 1.32 0.11 -1.26 -0.69 120.40 124.02 1gof s VAL 446 Ca -0.15 1.15 -0.03 0.00 -2.93 0.00 0.00 61.98 60.02 1gof s VAL 446 Cb -0.08 -3.90 0.00 0.00 -1.53 0.00 0.00 36.38 30.87 1gof s VAL 446 CO 0.01 0.35 0.79 -0.76 -3.33 0.00 0.00 175.10 172.16 1gof s LEU 447 N 0.30 3.43 0.48 2.54 1.43 0.74 -4.94 118.68 122.66 1gof s LEU 447 Ca 0.30 0.50 0.21 0.00 -1.03 0.00 0.00 54.13 54.11 1gof s LEU 447 Cb -0.17 -3.35 1.23 0.00 0.03 0.00 0.00 46.19 43.93 1gof s LEU 447 CO 0.14 -0.89 1.95 -0.65 0.23 0.00 0.00 176.35 177.13 1gof h PRO 448 N 0.10 0.20 -0.04 1.29 0.11 -1.93 -1.09 132.00 130.64 1gof h PRO 448 Ca -0.46 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1gof h PRO 448 Cb 1.25 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1gof h PRO 448 CO 0.59 0.13 0.00 -0.40 -0.21 0.00 0.00 178.00 178.11 1gof n ASP 449 N -4.42 0.60 0.00 -2.05 5.68 -1.26 -4.67 116.55 110.43 1gof n ASP 449 Ca 0.13 -1.39 0.00 0.00 -0.50 0.00 0.00 54.79 53.03 1gof n ASP 449 Cb 0.59 -0.02 0.00 0.00 -1.14 0.00 0.00 41.12 40.55 1gof n ASP 449 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1gof n GLY 450 N 0.98 1.21 3.82 6.12 0.00 -0.41 -5.00 105.19 111.90 1gof n GLY 450 Ca 0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 1gof n GLY 450 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1gof s SER 451 N -3.04 6.37 -0.21 1.61 1.04 -1.26 -4.64 113.70 113.58 1gof s SER 451 Ca 0.00 1.72 -0.06 0.00 0.48 0.00 0.00 55.95 58.10 1gof s SER 451 Cb 0.00 -2.53 -0.03 0.00 0.10 0.00 0.00 66.02 63.56 1gof s SER 451 CO 0.00 -0.76 0.01 -0.89 0.98 0.00 0.00 173.24 172.58 1gof s THR 452 N -2.40 4.06 -0.17 2.02 2.01 -0.84 -0.19 115.64 120.14 1gof s THR 452 Ca 0.62 -0.27 -0.14 0.00 0.31 0.00 0.00 61.69 62.21 1gof s THR 452 Cb -0.13 -2.85 -0.05 0.00 0.01 0.00 0.00 72.50 69.49 1gof s THR 452 CO 0.28 0.42 0.29 0.12 -0.69 0.00 0.00 174.62 175.04 1gof s PHE 453 N 1.05 3.45 -0.11 4.92 5.36 0.13 -1.22 117.98 131.56 1gof s PHE 453 Ca 0.02 0.58 0.02 0.00 -0.96 0.00 0.00 56.93 56.59 1gof s PHE 453 Cb -0.14 -2.35 0.01 0.00 -0.34 0.00 0.00 43.02 40.20 1gof s PHE 453 CO 0.02 0.21 -0.16 0.42 -1.46 0.00 0.00 175.22 174.25 1gof s ILE 454 N 0.57 1.52 0.04 3.12 1.01 0.77 -1.15 121.20 127.08 1gof s ILE 454 Ca 0.16 -0.66 -0.08 0.00 0.00 0.00 0.00 60.65 60.07 1gof s ILE 454 Cb -0.13 -1.38 -0.00 0.00 0.01 0.00 0.00 42.46 40.96 1gof s ILE 454 CO 0.04 0.44 0.17 0.28 0.00 0.00 0.00 174.94 175.87 1gof s THR 455 N 0.91 0.12 0.00 2.92 -1.32 0.36 -1.15 115.64 117.48 1gof s THR 455 Ca -0.08 -0.97 0.00 0.00 -1.21 0.00 0.00 61.69 59.43 1gof s THR 455 Cb -0.15 -0.93 0.00 0.00 -1.51 0.00 0.00 72.50 69.90 1gof s THR 455 CO -0.01 -0.53 0.00 0.61 -2.21 0.00 0.00 174.62 172.48 1gof n GLY 456 N 0.66 -1.13 0.00 6.08 0.00 -1.26 -1.33 105.19 108.21 1gof n GLY 456 Ca -0.19 -1.24 0.00 0.00 0.00 0.00 0.00 46.02 44.60 1gof n GLY 456 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gof n GLY 457 N 0.00 -0.50 3.10 -0.02 0.00 0.19 -4.56 105.19 103.41 1gof n GLY 457 Ca 0.00 -1.80 -0.08 0.00 0.00 0.00 0.00 46.02 44.14 1gof n GLY 457 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1gof s GLN 458 N -1.04 0.61 0.23 1.61 -2.07 -0.93 -1.82 119.66 116.25 1gof s GLN 458 Ca 0.00 -1.04 0.09 0.00 -1.82 0.00 0.00 55.36 52.59 1gof s GLN 458 Cb 0.00 0.22 0.21 0.00 -1.09 0.00 0.00 33.01 32.35 1gof s GLN 458 CO 0.00 -0.13 1.53 -0.09 -1.32 0.00 0.00 175.29 175.27 1gof h ARG 459 N 3.34 0.01 -4.06 9.60 2.43 -1.36 -1.44 114.38 122.90 1gof h ARG 459 Ca -0.34 -0.01 -0.46 0.00 -0.81 0.00 0.00 59.98 58.37 1gof h ARG 459 Cb 1.16 0.00 -0.36 0.00 -0.42 0.00 0.00 29.97 30.36 1gof h ARG 459 CO 0.59 0.72 -0.78 0.50 -1.51 0.00 0.00 179.97 179.49 1gof s ARG 460 N -3.39 1.05 -0.36 0.20 3.52 -1.26 -0.71 118.95 117.99 1gof s ARG 460 Ca -0.01 -0.13 -0.29 0.00 -0.13 0.00 0.00 55.73 55.17 1gof s ARG 460 Cb 0.12 -1.11 0.00 0.00 -1.56 0.00 0.00 34.95 32.40 1gof s ARG 460 CO 0.78 -0.16 1.45 0.20 -0.81 0.00 0.00 175.30 176.76 1gof s GLY 461 N 1.31 1.14 -0.38 8.12 0.00 -1.02 -4.89 107.32 111.60 1gof s GLY 461 Ca -0.04 -0.00 0.01 0.00 0.00 0.00 0.00 44.72 44.68 1gof s GLY 461 CO -0.02 2.80 0.24 -0.42 0.00 0.00 0.00 173.10 175.70 1gof s ILE 462 N 5.33 0.37 0.07 0.90 1.01 -1.26 0.77 121.20 128.39 1gof s ILE 462 Ca 0.63 -2.01 -0.37 0.00 0.00 0.00 0.00 60.65 58.90 1gof s ILE 462 Cb -0.16 -1.27 -0.18 0.00 0.01 0.00 0.00 42.46 40.85 1gof s ILE 462 CO 0.30 -1.02 1.06 -2.65 0.00 0.00 0.00 174.94 172.64 1gof n PRO 463 N 3.74 0.42 -0.98 2.79 -0.02 -1.26 -1.54 135.00 138.14 1gof n PRO 463 Ca 0.15 0.15 0.00 0.00 -2.02 0.00 0.00 63.50 61.78 1gof n PRO 463 Cb 0.39 -1.61 0.00 0.00 -0.02 0.00 0.00 33.50 32.26 1gof n PRO 463 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1gof n PHE 464 N 1.50 0.00 -5.07 6.00 3.72 -1.26 -4.98 117.46 117.37 1gof n PHE 464 Ca 0.19 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.29 1gof n PHE 464 Cb 0.15 -0.39 -0.17 0.00 -0.94 0.00 0.00 39.48 38.14 1gof n PHE 464 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 176.76 174.71 1gof s GLU 465 N -0.37 2.65 -0.22 -1.08 2.12 -0.59 -4.71 118.70 116.50 1gof s GLU 465 Ca 0.00 -0.77 -0.02 0.00 0.36 0.00 0.00 54.97 54.55 1gof s GLU 465 Cb 0.00 -2.06 0.08 0.00 0.26 0.00 0.00 34.13 32.42 1gof s GLU 465 CO 0.00 0.17 2.29 -0.25 -0.54 0.00 0.00 175.26 176.93 1gof n ASP 466 N 3.51 6.04 -4.95 -1.70 8.00 -1.26 -4.79 116.55 121.40 1gof n ASP 466 Ca -0.20 -2.85 -0.23 0.00 0.71 0.00 0.00 54.79 52.22 1gof n ASP 466 Cb 0.53 -1.14 0.02 0.00 -0.02 0.00 0.00 41.12 40.51 1gof n ASP 466 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1gof s SER 467 N 0.88 5.67 -1.02 -2.24 1.04 -1.26 -4.40 113.70 112.38 1gof s SER 467 Ca 0.30 0.30 -0.03 0.00 0.48 0.00 0.00 55.95 57.00 1gof s SER 467 Cb 0.21 -1.43 0.00 0.00 0.10 0.00 0.00 66.02 64.90 1gof s SER 467 CO -0.03 -0.86 0.07 0.35 0.98 0.00 0.00 173.24 173.74 1gof n THR 468 N -2.23 -0.83 -2.43 2.02 -2.24 -1.26 -4.65 114.28 102.66 1gof n THR 468 Ca 0.03 -0.35 -0.36 0.00 -2.27 0.00 0.00 64.05 61.10 1gof n THR 468 Cb 0.58 -0.80 -0.03 0.00 -2.10 0.00 0.00 70.33 67.99 1gof n THR 468 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1gof s PRO 469 N -6.08 3.90 -0.32 -0.78 0.04 -1.26 -1.32 135.00 129.18 1gof s PRO 469 Ca 0.05 1.57 -0.07 0.00 0.04 0.00 0.00 61.00 62.59 1gof s PRO 469 Cb -0.03 -2.36 0.02 0.00 0.04 0.00 0.00 34.50 32.17 1gof s PRO 469 CO 0.68 -0.39 0.10 0.08 0.04 0.00 0.00 177.00 177.51 1gof s VAL 470 N -1.70 3.98 -0.78 -0.36 1.01 -0.76 -4.90 120.40 116.89 1gof s VAL 470 Ca 0.63 -0.84 0.23 0.00 0.00 0.00 0.00 61.98 62.00 1gof s VAL 470 Cb -0.23 -3.13 -0.13 0.00 0.00 0.00 0.00 36.38 32.89 1gof s VAL 470 CO 0.28 -0.03 1.05 0.49 0.00 0.00 0.00 175.10 176.89 1gof n PHE 471 N 4.86 0.12 -3.32 5.22 3.72 -1.26 -4.09 117.46 122.71 1gof n PHE 471 Ca -0.14 0.03 -0.41 0.00 -0.05 0.00 0.00 57.45 56.88 1gof n PHE 471 Cb 0.47 -0.27 -0.09 0.00 -0.94 0.00 0.00 39.48 38.65 1gof n PHE 471 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 1gof s THR 472 N -3.11 5.09 0.69 4.37 2.01 -1.26 -1.30 115.64 122.14 1gof s THR 472 Ca 0.06 0.07 -0.11 0.00 0.31 0.00 0.00 61.69 62.02 1gof s THR 472 Cb 0.16 -3.92 0.01 0.00 0.01 0.00 0.00 72.50 68.75 1gof s THR 472 CO 0.80 -0.22 1.06 -2.16 -0.69 0.00 0.00 174.62 173.42 1gof s PRO 473 N 2.19 2.97 0.05 4.92 0.04 -1.26 -4.81 135.00 139.09 1gof s PRO 473 Ca 0.14 0.75 0.03 0.00 0.04 0.00 0.00 61.00 61.96 1gof s PRO 473 Cb -0.16 -2.01 -0.03 0.00 0.04 0.00 0.00 34.50 32.34 1gof s PRO 473 CO 0.13 -1.02 -0.09 -1.21 0.04 0.00 0.00 177.00 174.85 1gof s GLU 474 N -5.16 0.59 -0.09 4.56 2.02 -0.30 -1.48 118.70 118.84 1gof s GLU 474 Ca 0.58 -0.84 0.04 0.00 0.02 0.00 0.00 54.97 54.77 1gof s GLU 474 Cb -0.13 -0.35 -0.00 0.00 0.10 0.00 0.00 34.13 33.75 1gof s GLU 474 CO 0.54 0.06 -0.24 0.42 0.02 0.00 0.00 175.26 176.06 1gof s ILE 475 N -1.57 2.10 -0.18 -1.63 1.01 -0.32 -0.16 121.20 120.46 1gof s ILE 475 Ca -0.07 -1.02 -0.14 0.00 0.00 0.00 0.00 60.65 59.43 1gof s ILE 475 Cb -0.09 -1.79 -0.05 0.00 0.01 0.00 0.00 42.46 40.55 1gof s ILE 475 CO 0.00 0.56 0.29 -0.47 0.00 0.00 0.00 174.94 175.32 1gof s TYR 476 N 0.21 3.43 -0.44 3.97 5.04 -0.36 -0.74 117.35 128.46 1gof s TYR 476 Ca -0.15 0.55 -0.08 0.00 -2.44 0.00 0.00 57.07 54.95 1gof s TYR 476 Cb -0.17 -2.35 0.11 0.00 0.35 0.00 0.00 41.96 39.90 1gof s TYR 476 CO 0.08 0.19 0.29 0.08 -1.34 0.00 0.00 175.55 174.85 1gof s VAL 477 N 0.64 3.99 0.24 3.14 1.01 0.12 -1.99 120.40 127.55 1gof s VAL 477 Ca 0.16 -1.77 -0.05 0.00 0.00 0.00 0.00 61.98 60.32 1gof s VAL 477 Cb -0.13 -3.61 0.22 0.00 0.00 0.00 0.00 36.38 32.86 1gof s VAL 477 CO 0.04 -0.69 1.86 1.55 0.00 0.00 0.00 175.10 177.85 1gof h PRO 478 N 8.35 0.97 -0.53 2.72 0.13 -1.85 0.11 132.00 141.90 1gof h PRO 478 Ca -0.20 -0.06 0.03 0.00 -0.87 0.00 0.00 66.00 64.91 1gof h PRO 478 Cb 1.07 -0.22 -0.03 0.00 0.13 0.00 0.00 31.00 31.95 1gof h PRO 478 CO 0.80 0.64 0.35 0.93 -0.23 0.00 0.00 178.00 180.49 1gof h GLU 479 N 0.99 0.59 -0.01 0.86 3.07 -1.95 -2.14 114.58 115.99 1gof h GLU 479 Ca 0.38 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 59.20 1gof h GLU 479 Cb 0.16 -0.13 0.00 0.00 -0.84 0.00 0.00 28.75 27.94 1gof h GLU 479 CO -0.17 0.39 -0.76 1.04 -1.40 0.00 0.00 179.01 178.11 1gof n GLN 480 N -4.47 0.46 -3.83 2.33 6.02 -0.81 -4.98 117.38 112.11 1gof n GLN 480 Ca 0.06 -0.37 -0.26 0.00 -0.01 0.00 0.00 57.00 56.42 1gof n GLN 480 Cb 0.15 -1.49 0.01 0.00 1.02 0.00 0.00 30.24 29.92 1gof n GLN 480 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 1gof n ASP 481 N -0.95 -1.65 -3.94 1.08 2.03 0.33 -4.97 116.55 108.48 1gof n ASP 481 Ca 0.06 -0.96 -0.12 0.00 0.52 0.00 0.00 54.79 54.29 1gof n ASP 481 Cb 0.38 -3.37 -0.13 0.00 -0.72 0.00 0.00 41.12 37.28 1gof n ASP 481 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 1gof s THR 482 N -3.78 0.17 -0.02 5.18 2.01 -1.07 -4.36 115.64 113.77 1gof s THR 482 Ca 0.11 -0.44 -0.05 0.00 0.31 0.00 0.00 61.69 61.62 1gof s THR 482 Cb -0.04 -0.21 -0.04 0.00 0.01 0.00 0.00 72.50 72.22 1gof s THR 482 CO 0.86 -0.18 0.21 -0.36 -0.69 0.00 0.00 174.62 174.47 1gof s PHE 483 N -0.62 3.57 -0.05 4.92 0.40 -1.26 -0.70 117.98 124.24 1gof s PHE 483 Ca -0.06 0.48 0.02 0.00 -0.60 0.00 0.00 56.93 56.77 1gof s PHE 483 Cb -0.05 -1.92 0.02 0.00 0.51 0.00 0.00 43.02 41.58 1gof s PHE 483 CO -0.00 0.65 -0.09 0.71 0.70 0.00 0.00 175.22 177.19 1gof s TYR 484 N -1.26 1.11 0.50 0.36 2.02 0.08 -4.95 117.35 115.20 1gof s TYR 484 Ca 0.25 -0.36 -0.21 0.00 -0.37 0.00 0.00 57.07 56.38 1gof s TYR 484 Cb -0.13 -0.85 -0.07 0.00 -0.40 0.00 0.00 41.96 40.51 1gof s TYR 484 CO 0.15 -0.22 1.12 0.15 -1.57 0.00 0.00 175.55 175.19 1gof s LYS 485 N 0.69 3.59 0.47 -0.62 1.02 -1.26 -1.17 119.74 122.45 1gof s LYS 485 Ca -0.12 1.61 0.05 0.00 0.02 0.00 0.00 55.97 57.53 1gof s LYS 485 Cb -0.14 -2.17 -0.03 0.00 -0.52 0.00 0.00 37.83 34.97 1gof s LYS 485 CO 0.02 -0.66 0.12 -0.65 -0.92 0.00 0.00 175.35 173.26 1gof s GLN 486 N -3.06 2.16 0.38 1.68 -1.52 -0.55 -4.90 119.66 113.85 1gof s GLN 486 Ca 0.68 -2.13 -0.26 0.00 -1.95 0.00 0.00 55.36 51.70 1gof s GLN 486 Cb -0.24 -1.77 -0.09 0.00 -0.22 0.00 0.00 33.01 30.69 1gof s GLN 486 CO 0.28 -0.28 1.24 -0.80 -0.25 0.00 0.00 175.29 175.49 1gof s ASN 487 N -3.92 6.54 0.54 5.90 0.01 -0.09 -4.43 114.94 119.48 1gof s ASN 487 Ca 0.26 2.53 -0.18 0.00 -0.71 0.00 0.00 52.86 54.76 1gof s ASN 487 Cb 0.03 -2.63 -0.06 0.00 0.41 0.00 0.00 41.25 39.00 1gof s ASN 487 CO 0.14 -0.68 1.04 -2.16 -1.51 0.00 0.00 177.10 173.93 1gof s PRO 488 N -2.12 3.61 0.53 -0.60 0.04 -1.26 -4.50 135.00 130.71 1gof s PRO 488 Ca 0.55 1.22 0.06 0.00 0.04 0.00 0.00 61.00 62.87 1gof s PRO 488 Cb -0.35 -2.07 0.06 0.00 0.04 0.00 0.00 34.50 32.17 1gof s PRO 488 CO 0.46 -0.57 0.50 0.27 0.04 0.00 0.00 177.00 177.70 1gof n ASN 489 N -1.53 2.46 0.00 6.66 6.94 -0.42 -4.90 115.26 124.47 1gof n ASN 489 Ca 0.09 -2.69 0.00 0.00 -0.02 0.00 0.00 54.58 51.96 1gof n ASN 489 Cb 0.53 -0.15 0.00 0.00 -2.36 0.00 0.00 39.78 37.80 1gof n ASN 489 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 1gof n SER 490 N -2.00 0.67 -4.52 0.53 7.64 -1.26 -4.83 113.62 109.83 1gof n SER 490 Ca 0.03 -0.88 -0.35 0.00 1.01 0.00 0.00 58.87 58.69 1gof n SER 490 Cb 0.58 0.18 -0.11 0.00 -1.01 0.00 0.00 64.21 63.85 1gof n SER 490 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1gof s ILE 491 N -0.18 4.38 0.16 0.44 1.01 -1.26 -4.96 121.20 120.79 1gof s ILE 491 Ca 0.00 -0.17 -0.31 0.00 0.00 0.00 0.00 60.65 60.17 1gof s ILE 491 Cb 0.00 -2.99 -0.09 0.00 0.01 0.00 0.00 42.46 39.39 1gof s ILE 491 CO 0.00 0.42 1.41 -0.69 0.00 0.00 0.00 174.94 176.08 1gof s VAL 492 N 0.87 3.06 -0.41 2.92 1.01 -1.26 -4.99 120.40 121.60 1gof s VAL 492 Ca 0.03 0.80 0.02 0.00 0.00 0.00 0.00 61.98 62.83 1gof s VAL 492 Cb -0.14 -3.51 0.12 0.00 0.00 0.00 0.00 36.38 32.85 1gof s VAL 492 CO 0.02 0.08 0.17 -0.13 0.00 0.00 0.00 175.10 175.25 1gof s ARG 493 N 0.62 1.38 0.00 2.72 1.81 -1.26 -4.93 118.95 119.29 1gof s ARG 493 Ca 0.63 -1.93 0.00 0.00 -1.72 0.00 0.00 55.73 52.71 1gof s ARG 493 Cb -0.39 -2.71 0.00 0.00 -0.45 0.00 0.00 34.95 31.40 1gof s ARG 493 CO 0.34 -1.06 0.00 1.33 -0.68 0.00 0.00 175.30 175.23 1gof n VAL 494 N 3.88 0.00 -1.67 3.52 0.24 -1.26 0.55 118.33 123.59 1gof n VAL 494 Ca 0.04 0.00 -0.45 0.00 -2.04 0.00 0.00 64.34 61.90 1gof n VAL 494 Cb 0.37 0.00 -0.02 0.00 -1.47 0.00 0.00 33.84 32.72 1gof n VAL 494 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1gof n TYR 495 N 0.00 2.10 -1.78 6.34 9.36 -1.26 -2.27 117.16 129.65 1gof n TYR 495 Ca 0.00 0.47 -0.07 0.00 3.32 0.00 0.00 57.90 61.61 1gof n TYR 495 Cb 0.00 -2.44 -0.01 0.00 -0.63 0.00 0.00 39.34 36.26 1gof n TYR 495 CO 0.00 0.00 0.00 0.72 0.22 0.00 0.00 176.86 177.80 1gof n HIS 496 N 1.68 -0.21 -3.17 2.98 8.25 -1.26 -1.45 115.22 122.04 1gof n HIS 496 Ca 0.11 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.35 1gof n HIS 496 Cb 0.31 -1.84 0.00 0.00 1.12 0.00 0.00 29.99 29.59 1gof n HIS 496 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1gof s SER 497 N -2.77 5.92 0.05 0.41 1.04 -0.96 -1.03 113.70 116.36 1gof s SER 497 Ca 0.00 0.16 -0.06 0.00 0.48 0.00 0.00 55.95 56.54 1gof s SER 497 Cb 0.00 -1.50 -0.01 0.00 0.10 0.00 0.00 66.02 64.61 1gof s SER 497 CO 0.00 -0.58 0.10 0.27 0.98 0.00 0.00 173.24 174.01 1gof s ILE 498 N -2.42 0.15 -0.03 -1.02 -5.25 -0.14 -4.42 121.20 108.06 1gof s ILE 498 Ca 0.46 -1.23 -0.03 0.00 -0.99 0.00 0.00 60.65 58.87 1gof s ILE 498 Cb -0.10 -1.11 0.01 0.00 2.95 0.00 0.00 42.46 44.22 1gof s ILE 498 CO 0.36 -0.68 0.09 -0.44 -1.79 0.00 0.00 174.94 172.48 1gof s SER 499 N -2.43 -0.09 0.02 4.36 0.01 -1.26 -0.60 113.70 113.71 1gof s SER 499 Ca -0.01 0.17 0.00 0.00 1.31 0.00 0.00 55.95 57.43 1gof s SER 499 Cb 0.02 0.17 -0.02 0.00 0.21 0.00 0.00 66.02 66.40 1gof s SER 499 CO -0.07 -0.04 -0.03 -0.76 0.41 0.00 0.00 173.24 172.76 1gof s LEU 500 N 0.13 2.18 -0.02 2.44 1.43 -0.21 -4.81 118.68 119.82 1gof s LEU 500 Ca -0.01 -0.38 -0.25 0.00 -1.03 0.00 0.00 54.13 52.46 1gof s LEU 500 Cb -0.01 0.06 -0.04 0.00 0.03 0.00 0.00 46.19 46.22 1gof s LEU 500 CO -0.00 -0.22 0.78 -0.22 0.23 0.00 0.00 176.35 176.91 1gof s LEU 501 N -1.11 4.36 0.32 1.79 2.96 -1.26 -0.86 118.68 124.88 1gof s LEU 501 Ca -0.12 1.35 -0.11 0.00 -0.22 0.00 0.00 54.13 55.04 1gof s LEU 501 Cb -0.08 -3.22 -0.07 0.00 0.50 0.00 0.00 46.19 43.32 1gof s LEU 501 CO -0.01 -0.11 0.67 -0.76 -1.32 0.00 0.00 176.35 174.82 1gof s LEU 502 N 0.63 4.02 0.63 -0.68 1.43 0.37 -4.88 118.68 120.20 1gof s LEU 502 Ca 0.41 1.06 0.33 0.00 -1.03 0.00 0.00 54.13 54.89 1gof s LEU 502 Cb -0.19 -3.87 1.77 0.00 0.03 0.00 0.00 46.19 43.93 1gof s LEU 502 CO 0.21 -0.23 1.99 -0.65 0.23 0.00 0.00 176.35 177.91 1gof h PRO 503 N 1.95 0.00 -0.01 1.29 0.11 -1.90 0.81 132.00 134.25 1gof h PRO 503 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1gof h PRO 503 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1gof h PRO 503 CO 0.66 0.00 -0.01 -0.40 -0.21 0.00 0.00 178.00 178.04 1gof n ASP 504 N -2.85 0.72 0.00 -2.05 5.68 -1.26 0.01 116.55 116.80 1gof n ASP 504 Ca -0.02 -1.17 0.00 0.00 -0.50 0.00 0.00 54.79 53.10 1gof n ASP 504 Cb 0.27 -0.01 0.00 0.00 -1.14 0.00 0.00 41.12 40.24 1gof n ASP 504 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1gof n GLY 505 N 1.11 0.73 3.96 6.12 0.00 0.28 -4.79 105.19 112.61 1gof n GLY 505 Ca 0.21 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.01 1gof n GLY 505 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1gof s ARG 506 N -0.54 3.04 -0.11 1.61 0.52 -1.25 -4.72 118.95 117.50 1gof s ARG 506 Ca 0.00 -0.62 -0.02 0.00 -0.52 0.00 0.00 55.73 54.57 1gof s ARG 506 Cb 0.00 -2.61 -0.03 0.00 0.52 0.00 0.00 34.95 32.83 1gof s ARG 506 CO 0.00 -0.22 -0.02 0.08 0.02 0.00 0.00 175.30 175.15 1gof s VAL 507 N -2.48 4.05 -0.30 3.52 1.01 -0.11 -0.48 120.40 125.62 1gof s VAL 507 Ca 0.48 -0.33 -0.10 0.00 0.00 0.00 0.00 61.98 62.04 1gof s VAL 507 Cb -0.10 -2.72 -0.02 0.00 0.00 0.00 0.00 36.38 33.54 1gof s VAL 507 CO 0.36 0.56 0.15 0.12 0.00 0.00 0.00 175.10 176.30 1gof s PHE 508 N -0.38 3.17 -0.11 5.22 5.36 -0.04 -1.35 117.98 129.85 1gof s PHE 508 Ca 0.07 -0.36 0.03 0.00 -0.96 0.00 0.00 56.93 55.71 1gof s PHE 508 Cb -0.12 -2.35 0.01 0.00 -0.34 0.00 0.00 43.02 40.21 1gof s PHE 508 CO 0.02 -0.36 -0.21 1.21 -1.46 0.00 0.00 175.22 174.42 1gof s ASN 509 N 1.66 2.91 0.00 6.13 3.04 -0.50 -1.04 114.94 127.13 1gof s ASN 509 Ca 0.06 -0.54 0.00 0.00 0.04 0.00 0.00 52.86 52.42 1gof s ASN 509 Cb -0.16 -1.34 0.00 0.00 -1.54 0.00 0.00 41.25 38.21 1gof s ASN 509 CO 0.07 0.10 0.00 0.61 -3.04 0.00 0.00 177.10 174.84 1gof n GLY 510 N 3.86 2.08 7.00 1.21 0.00 0.23 0.78 105.19 120.35 1gof n GLY 510 Ca -0.20 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 44.85 1gof n GLY 510 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gof n GLY 511 N 0.00 -1.80 0.00 -0.02 0.00 -0.52 -0.97 105.19 101.88 1gof n GLY 511 Ca 0.00 -1.37 0.00 0.00 0.00 0.00 0.00 46.02 44.65 1gof n GLY 511 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gof n GLY 512 N 0.00 2.93 0.00 -0.02 0.00 -0.20 -4.64 105.19 103.27 1gof n GLY 512 Ca 0.00 -1.37 0.00 0.00 0.00 0.00 0.00 46.02 44.65 1gof n GLY 512 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gof n GLY 513 N 1.34 0.57 1.05 -0.02 0.00 -0.53 -0.86 105.19 106.74 1gof n GLY 513 Ca 0.00 -1.49 0.00 0.00 0.00 0.00 0.00 46.02 44.53 1gof n GLY 513 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1gof n LEU 514 N 0.00 -1.81 -2.18 0.99 7.94 -1.26 -4.68 117.00 115.99 1gof n LEU 514 Ca 0.00 0.00 -0.08 0.00 -1.11 0.00 0.00 56.01 54.82 1gof n LEU 514 Cb 0.00 -0.45 0.05 0.00 0.53 0.00 0.00 43.42 43.55 1gof n LEU 514 CO 0.00 0.00 0.10 0.00 -1.11 0.00 0.00 177.39 176.38 1gof n GLY 516 N -0.58 1.35 0.00 0.00 0.00 0.06 -1.74 105.19 104.29 1gof n GLY 516 Ca 0.22 0.60 0.04 0.00 0.00 0.00 0.00 46.02 46.88 1gof n GLY 516 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1gof n ASP 517 N 6.29 0.00 -4.71 1.61 8.00 -1.26 -1.32 116.55 125.16 1gof n ASP 517 Ca 0.00 0.25 -0.31 0.00 0.71 0.00 0.00 54.79 55.44 1gof n ASP 517 Cb 0.00 -0.34 0.14 0.00 -0.02 0.00 0.00 41.12 40.90 1gof n ASP 517 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1gof n THR 519 N -3.94 1.89 -0.93 0.00 -2.24 -1.26 -0.44 114.28 107.36 1gof n THR 519 Ca 0.10 -1.18 0.08 0.00 -2.27 0.00 0.00 64.05 60.78 1gof n THR 519 Cb 0.53 0.07 0.32 0.00 -2.10 0.00 0.00 70.33 69.15 1gof n THR 519 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1gof n THR 520 N 1.07 2.44 -2.69 4.28 -2.24 -1.26 -3.81 114.28 112.07 1gof n THR 520 Ca 0.26 -1.65 -0.41 0.00 -2.27 0.00 0.00 64.05 59.97 1gof n THR 520 Cb 0.91 -0.24 -0.04 0.00 -2.10 0.00 0.00 70.33 68.86 1gof n THR 520 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 1gof s ASN 521 N -1.43 7.46 -0.28 3.42 0.01 -1.24 -3.83 114.94 119.05 1gof s ASN 521 Ca 0.47 1.84 0.03 0.00 -0.71 0.00 0.00 52.86 54.50 1gof s ASN 521 Cb 0.37 -2.59 0.07 0.00 0.41 0.00 0.00 41.25 39.51 1gof s ASN 521 CO 0.12 -0.09 -0.06 -1.00 -1.51 0.00 0.00 177.10 174.56 1gof s HIS 522 N -0.04 3.40 -0.49 2.20 3.76 -0.04 -4.54 115.29 119.55 1gof s HIS 522 Ca 0.47 -2.50 -0.04 0.00 -0.15 0.00 0.00 55.06 52.84 1gof s HIS 522 Cb -0.24 -2.20 0.05 0.00 1.11 0.00 0.00 32.58 31.30 1gof s HIS 522 CO 0.31 -0.90 2.78 1.19 -0.85 0.00 0.00 174.74 177.27 1gof n PHE 523 N 4.39 1.60 -3.74 1.40 3.01 -1.26 -4.17 117.46 118.68 1gof n PHE 523 Ca -0.09 -1.97 -0.09 0.00 1.01 0.00 0.00 57.45 56.31 1gof n PHE 523 Cb 0.42 -1.41 0.01 0.00 -0.01 0.00 0.00 39.48 38.49 1gof n PHE 523 CO 0.00 0.00 0.00 -0.40 1.01 0.00 0.00 176.76 177.37 1gof n ASP 524 N 0.97 -1.65 -3.73 4.37 5.68 -1.26 -0.64 116.55 120.28 1gof n ASP 524 Ca 0.49 -2.37 -0.11 0.00 -0.50 0.00 0.00 54.79 52.30 1gof n ASP 524 Cb 0.55 2.82 -0.07 0.00 -1.14 0.00 0.00 41.12 43.28 1gof n ASP 524 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1gof s ALA 525 N -2.08 -0.74 0.26 2.12 0.00 -0.74 -1.44 121.76 119.14 1gof s ALA 525 Ca 0.16 0.02 0.07 0.00 0.00 0.00 0.00 51.96 52.21 1gof s ALA 525 Cb -0.03 0.37 -0.05 0.00 0.00 0.00 0.00 23.12 23.41 1gof s ALA 525 CO 0.12 -0.45 -0.10 -0.65 0.00 0.00 0.00 175.76 174.68 1gof s GLN 526 N -2.75 1.50 -0.10 0.00 -0.21 0.23 -0.75 119.66 117.58 1gof s GLN 526 Ca -0.04 -1.72 -0.02 0.00 0.02 0.00 0.00 55.36 53.60 1gof s GLN 526 Cb -0.00 -1.21 -0.03 0.00 1.00 0.00 0.00 33.01 32.77 1gof s GLN 526 CO -0.05 0.11 -0.01 0.42 -2.12 0.00 0.00 175.29 173.65 1gof s ILE 527 N -2.95 4.19 -0.14 1.08 -1.09 -0.98 -1.42 121.20 119.88 1gof s ILE 527 Ca 0.27 -0.28 -0.01 0.00 -2.23 0.00 0.00 60.65 58.40 1gof s ILE 527 Cb 0.02 -2.78 -0.01 0.00 -1.58 0.00 0.00 42.46 38.11 1gof s ILE 527 CO 0.11 0.57 -0.12 0.12 -1.23 0.00 0.00 174.94 174.39 1gof s PHE 528 N -0.54 2.83 -0.33 3.97 5.36 -0.46 0.35 117.98 129.16 1gof s PHE 528 Ca 0.09 -0.72 -0.06 0.00 -0.96 0.00 0.00 56.93 55.28 1gof s PHE 528 Cb -0.12 -1.88 0.04 0.00 -0.34 0.00 0.00 43.02 40.72 1gof s PHE 528 CO 0.02 -0.28 0.10 0.99 -1.46 0.00 0.00 175.22 174.59 1gof s THR 529 N 0.54 3.75 0.65 0.12 2.01 0.76 -0.93 115.64 122.53 1gof s THR 529 Ca -0.08 -1.12 -0.17 0.00 0.31 0.00 0.00 61.69 60.64 1gof s THR 529 Cb -0.16 -3.11 -0.01 0.00 0.01 0.00 0.00 72.50 69.24 1gof s THR 529 CO 0.04 -0.16 1.17 -2.84 -0.69 0.00 0.00 174.62 172.14 1gof s PRO 530 N 1.40 2.72 0.64 4.92 0.02 -1.26 -1.06 135.00 142.38 1gof s PRO 530 Ca -0.02 1.65 0.37 0.00 0.02 0.00 0.00 61.00 63.02 1gof s PRO 530 Cb -0.19 -1.92 2.05 0.00 0.02 0.00 0.00 34.50 34.46 1gof s PRO 530 CO 0.03 -1.36 2.22 -0.97 -0.33 0.00 0.00 177.00 176.59 1gof h ASN 531 N 0.32 0.00 0.20 2.53 -1.24 -1.89 -2.33 115.58 113.17 1gof h ASN 531 Ca -0.48 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.53 1gof h ASN 531 Cb 1.28 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.33 1gof h ASN 531 CO 0.53 0.00 0.00 0.00 -1.29 0.00 0.00 177.43 176.67 1gof n TYR 532 N -3.30 0.00 1.19 0.67 0.18 -1.26 -2.21 117.16 112.43 1gof n TYR 532 Ca -0.02 0.00 0.13 0.00 1.88 0.00 0.00 57.90 59.89 1gof n TYR 532 Cb 0.18 -0.48 0.26 0.00 -0.38 0.00 0.00 39.34 38.92 1gof n TYR 532 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 1gof n LEU 533 N -1.48 2.43 -4.47 -3.48 4.77 -0.88 -4.26 117.00 109.64 1gof n LEU 533 Ca 0.02 -0.81 -0.28 0.00 -0.03 0.00 0.00 56.01 54.91 1gof n LEU 533 Cb 0.07 -0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.04 1gof n LEU 533 CO 0.05 0.41 -0.50 -0.31 -1.33 0.00 0.00 177.39 175.71 1gof s TYR 534 N -2.00 2.43 0.53 -1.77 2.02 -0.94 -0.44 117.35 117.18 1gof s TYR 534 Ca 0.32 -0.31 0.08 0.00 -0.37 0.00 0.00 57.07 56.79 1gof s TYR 534 Cb 0.20 -1.23 0.05 0.00 -0.40 0.00 0.00 41.96 40.58 1gof s TYR 534 CO 0.31 0.45 0.62 0.54 -1.57 0.00 0.00 175.55 175.91 1gof s ASN 535 N -2.50 5.06 0.43 2.29 2.20 0.13 -4.60 114.94 117.95 1gof s ASN 535 Ca 0.20 -0.87 0.28 0.00 -0.94 0.00 0.00 52.86 51.53 1gof s ASN 535 Cb -0.09 0.10 1.37 0.00 -2.00 0.00 0.00 41.25 40.63 1gof s ASN 535 CO 0.10 -1.13 1.66 0.28 -2.94 0.00 0.00 177.10 175.07 1gof h SER 536 N 0.47 0.28 0.14 3.54 0.02 -1.97 -0.42 113.55 115.60 1gof h SER 536 Ca -0.34 0.12 0.00 0.00 -0.84 0.00 0.00 61.79 60.73 1gof h SER 536 Cb 1.29 0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.93 1gof h SER 536 CO 0.47 -0.12 0.00 0.59 -1.14 0.00 0.00 176.83 176.63 1gof n ASN 537 N -4.66 0.00 0.00 3.07 5.03 -1.26 -4.88 115.26 112.56 1gof n ASN 537 Ca 0.34 -0.63 0.00 0.00 0.87 0.00 0.00 54.58 55.17 1gof n ASN 537 Cb 1.32 -0.08 0.00 0.00 -1.02 0.00 0.00 39.78 40.00 1gof n ASN 537 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1gof n GLY 538 N 0.76 1.59 3.94 7.41 0.00 -0.17 -5.01 105.19 113.71 1gof n GLY 538 Ca 0.18 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.96 1gof n GLY 538 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1gof s ASN 539 N -3.28 5.64 0.22 1.61 0.01 -1.26 -4.83 114.94 113.05 1gof s ASN 539 Ca 0.00 0.46 -0.30 0.00 -0.71 0.00 0.00 52.86 52.30 1gof s ASN 539 Cb 0.00 -1.54 -0.10 0.00 0.41 0.00 0.00 41.25 40.03 1gof s ASN 539 CO 0.00 -0.93 1.43 -0.76 -1.51 0.00 0.00 177.10 175.33 1gof s LEU 540 N -4.79 4.39 0.59 0.60 1.43 -1.26 0.19 118.68 119.82 1gof s LEU 540 Ca 0.52 2.59 -0.15 0.00 -1.03 0.00 0.00 54.13 56.06 1gof s LEU 540 Cb -0.10 -3.61 -0.04 0.00 0.03 0.00 0.00 46.19 42.46 1gof s LEU 540 CO 0.41 -0.69 1.04 0.00 0.23 0.00 0.00 176.35 177.35 1gof s ALA 541 N 0.25 2.80 0.05 4.21 0.00 0.41 -4.67 121.76 124.81 1gof s ALA 541 Ca 0.61 0.32 -0.30 0.00 0.00 0.00 0.00 51.96 52.59 1gof s ALA 541 Cb -0.41 -3.20 -0.05 0.00 0.00 0.00 0.00 23.12 19.46 1gof s ALA 541 CO 0.40 -0.74 1.04 0.99 0.00 0.00 0.00 175.76 177.45 1gof s THR 542 N -2.55 4.51 -0.03 0.00 2.01 -1.26 -4.92 115.64 113.40 1gof s THR 542 Ca 0.62 1.88 -0.02 0.00 0.31 0.00 0.00 61.69 64.48 1gof s THR 542 Cb -0.15 -4.20 -0.04 0.00 0.01 0.00 0.00 72.50 68.12 1gof s THR 542 CO 0.38 0.19 0.10 -0.13 -0.69 0.00 0.00 174.62 174.47 1gof s ARG 543 N 0.71 3.20 0.72 4.92 0.52 -1.26 -4.94 118.95 122.83 1gof s ARG 543 Ca 0.52 -0.38 -0.13 0.00 -0.52 0.00 0.00 55.73 55.22 1gof s ARG 543 Cb -0.24 -2.96 0.04 0.00 0.52 0.00 0.00 34.95 32.30 1gof s ARG 543 CO 0.29 0.68 1.13 -1.25 0.02 0.00 0.00 175.30 176.17 1gof s PRO 544 N -1.56 2.36 0.03 3.54 0.04 -1.26 -4.95 135.00 133.20 1gof s PRO 544 Ca 0.21 1.43 0.07 0.00 0.04 0.00 0.00 61.00 62.76 1gof s PRO 544 Cb -0.12 -1.89 -0.02 0.00 0.04 0.00 0.00 34.50 32.50 1gof s PRO 544 CO 0.12 -1.60 -0.20 0.15 0.04 0.00 0.00 177.00 175.51 1gof s LYS 545 N -4.29 1.39 -0.46 4.56 1.02 -1.26 -4.15 119.74 116.54 1gof s LYS 545 Ca 0.67 -0.89 -0.16 0.00 0.02 0.00 0.00 55.97 55.61 1gof s LYS 545 Cb -0.22 -1.47 0.06 0.00 -0.52 0.00 0.00 37.83 35.69 1gof s LYS 545 CO 0.47 0.38 0.40 0.42 -0.92 0.00 0.00 175.35 176.10 1gof s ILE 546 N -0.76 5.21 -0.07 2.17 1.01 -1.26 -1.86 121.20 125.64 1gof s ILE 546 Ca 0.07 -0.95 0.13 0.00 0.00 0.00 0.00 60.65 59.90 1gof s ILE 546 Cb -0.09 -4.11 -0.08 0.00 0.01 0.00 0.00 42.46 38.20 1gof s ILE 546 CO 0.01 -0.55 1.17 0.71 0.00 0.00 0.00 174.94 176.29 1gof h THR 547 N 5.74 0.97 -3.14 2.92 1.35 -1.06 -3.48 112.91 116.21 1gof h THR 547 Ca -0.28 -2.49 -0.11 0.00 -0.55 0.00 0.00 66.41 62.98 1gof h THR 547 Cb 1.11 2.42 -0.19 0.00 -1.73 0.00 0.00 68.15 69.77 1gof h THR 547 CO 0.86 0.55 -0.26 -0.60 -0.25 0.00 0.00 175.52 175.82 1gof s ARG 548 N -2.86 0.73 -0.06 4.72 3.52 -0.97 -4.94 118.95 119.10 1gof s ARG 548 Ca 0.01 -0.32 -0.00 0.00 -0.13 0.00 0.00 55.73 55.29 1gof s ARG 548 Cb 0.08 0.32 0.03 0.00 -1.56 0.00 0.00 34.95 33.82 1gof s ARG 548 CO 0.79 -0.22 -0.02 0.95 -0.81 0.00 0.00 175.30 175.99 1gof s THR 549 N -1.83 0.42 0.53 4.11 -4.23 -1.26 -1.61 115.64 111.78 1gof s THR 549 Ca -0.10 0.02 0.23 0.00 -1.18 0.00 0.00 61.69 60.65 1gof s THR 549 Cb -0.03 -0.52 0.35 0.00 1.34 0.00 0.00 72.50 73.64 1gof s THR 549 CO 0.01 0.23 2.06 0.77 -0.54 0.00 0.00 174.62 177.16 1gof h SER 550 N 7.74 0.00 -4.83 3.99 4.64 -0.69 -3.44 113.55 120.96 1gof h SER 550 Ca -0.30 0.00 0.03 0.00 -0.47 0.00 0.00 61.79 61.06 1gof h SER 550 Cb 1.14 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.09 1gof h SER 550 CO 0.37 0.00 0.33 0.28 -0.87 0.00 0.00 176.83 176.95 1gof s THR 551 N -4.98 0.00 -0.24 2.95 -1.32 -1.26 -5.01 115.64 105.78 1gof s THR 551 Ca -0.05 0.00 0.02 0.00 -1.21 0.00 0.00 61.69 60.45 1gof s THR 551 Cb 0.18 -1.00 0.04 0.00 -1.51 0.00 0.00 72.50 70.21 1gof s THR 551 CO 0.69 0.00 0.80 0.00 -2.21 0.00 0.00 174.62 173.89 1gof n GLN 552 N -0.23 1.03 -3.77 7.08 6.02 -1.26 -4.95 117.38 121.29 1gof n GLN 552 Ca -0.14 -1.09 -0.25 0.00 -0.01 0.00 0.00 57.00 55.52 1gof n GLN 552 Cb 0.63 -1.05 -0.17 0.00 1.02 0.00 0.00 30.24 30.67 1gof n GLN 552 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 1gof s SER 553 N -0.57 2.02 0.04 1.08 0.15 -1.26 -1.55 113.70 113.61 1gof s SER 553 Ca 0.04 -0.32 0.03 0.00 0.70 0.00 0.00 55.95 56.40 1gof s SER 553 Cb 0.02 -0.51 -0.02 0.00 -1.71 0.00 0.00 66.02 63.80 1gof s SER 553 CO 0.03 -0.22 -0.10 0.54 1.20 0.00 0.00 173.24 174.69 1gof s VAL 554 N 1.92 0.71 0.23 4.45 0.11 -0.37 -4.97 120.40 122.48 1gof s VAL 554 Ca 0.03 -1.01 -0.13 0.00 -2.93 0.00 0.00 61.98 57.94 1gof s VAL 554 Cb -0.14 -0.72 -0.08 0.00 -1.53 0.00 0.00 36.38 33.92 1gof s VAL 554 CO -0.06 -0.24 0.61 -0.54 -3.33 0.00 0.00 175.10 171.53 1gof s LYS 555 N -1.37 3.94 0.36 1.54 1.02 -1.26 -0.55 119.74 123.41 1gof s LYS 555 Ca -0.05 0.48 -0.27 0.00 0.02 0.00 0.00 55.97 56.14 1gof s LYS 555 Cb -0.09 -2.70 -0.12 0.00 -0.52 0.00 0.00 37.83 34.41 1gof s LYS 555 CO 0.01 0.33 1.26 1.33 -0.92 0.00 0.00 175.35 177.36 1gof n VAL 556 N 0.15 2.11 0.00 3.17 0.24 -0.58 -0.45 118.33 122.97 1gof n VAL 556 Ca -0.01 -0.50 0.00 0.00 -2.04 0.00 0.00 64.34 61.79 1gof n VAL 556 Cb 0.52 -1.53 0.00 0.00 -1.47 0.00 0.00 33.84 31.36 1gof n VAL 556 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1gof n GLY 557 N 0.81 3.19 3.80 7.63 0.00 -0.64 -4.81 105.19 115.17 1gof n GLY 557 Ca 0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 1gof n GLY 557 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1gof s GLY 558 N -2.44 1.76 0.03 -0.02 0.00 0.40 -4.65 107.32 102.40 1gof s GLY 558 Ca 0.00 0.20 0.05 0.00 0.00 0.00 0.00 44.72 44.97 1gof s GLY 558 CO 0.00 0.52 -0.12 0.50 0.00 0.00 0.00 173.10 174.00 1gof s ARG 559 N -4.82 2.31 -0.02 2.90 0.52 -1.26 -0.26 118.95 118.32 1gof s ARG 559 Ca 0.60 -0.86 0.03 0.00 -0.52 0.00 0.00 55.73 54.98 1gof s ARG 559 Cb -0.15 -2.35 -0.00 0.00 0.52 0.00 0.00 34.95 32.96 1gof s ARG 559 CO 0.52 0.57 -0.11 0.42 0.02 0.00 0.00 175.30 176.71 1gof s ILE 560 N -0.99 0.96 -0.09 1.52 1.01 -0.45 -4.96 121.20 118.19 1gof s ILE 560 Ca 0.17 -0.47 0.04 0.00 0.00 0.00 0.00 60.65 60.38 1gof s ILE 560 Cb -0.11 -0.83 -0.01 0.00 0.01 0.00 0.00 42.46 41.53 1gof s ILE 560 CO 0.07 0.28 -0.22 -0.89 0.00 0.00 0.00 174.94 174.19 1gof s THR 561 N 0.03 2.30 0.19 2.92 2.01 -1.26 -0.78 115.64 121.04 1gof s THR 561 Ca -0.01 -0.95 0.06 0.00 0.31 0.00 0.00 61.69 61.10 1gof s THR 561 Cb -0.08 -1.88 -0.05 0.00 0.01 0.00 0.00 72.50 70.50 1gof s THR 561 CO 0.00 0.56 -0.11 0.27 -0.69 0.00 0.00 174.62 174.65 1gof s ILE 562 N 0.12 1.49 0.04 1.82 -4.36 0.18 0.14 121.20 120.62 1gof s ILE 562 Ca -0.11 -2.14 0.06 0.00 -0.26 0.00 0.00 60.65 58.20 1gof s ILE 562 Cb -0.16 -2.04 -0.02 0.00 1.25 0.00 0.00 42.46 41.49 1gof s ILE 562 CO 0.06 -0.60 -0.18 -0.94 0.24 0.00 0.00 174.94 173.53 1gof s SER 563 N -3.28 2.13 0.43 4.36 1.04 -0.63 -0.36 113.70 117.39 1gof s SER 563 Ca 0.22 -0.49 0.04 0.00 0.48 0.00 0.00 55.95 56.19 1gof s SER 563 Cb 0.01 -0.17 -0.04 0.00 0.10 0.00 0.00 66.02 65.93 1gof s SER 563 CO 0.05 0.11 0.04 0.42 0.98 0.00 0.00 173.24 174.84 1gof s THR 564 N -0.80 1.25 -2.77 2.02 -4.23 -0.83 -0.45 115.64 109.83 1gof s THR 564 Ca 0.05 -2.00 0.23 0.00 -1.18 0.00 0.00 61.69 58.80 1gof s THR 564 Cb -0.08 -2.51 0.15 0.00 1.34 0.00 0.00 72.50 71.39 1gof s THR 564 CO 0.01 0.00 1.22 -0.90 -0.54 0.00 0.00 174.62 174.41 1gof n ASP 565 N -1.11 2.77 -3.56 3.99 5.75 -0.78 -4.77 116.55 118.84 1gof n ASP 565 Ca -0.10 -1.89 -0.11 0.00 -0.01 0.00 0.00 54.79 52.68 1gof n ASP 565 Cb 0.66 0.10 -0.03 0.00 -1.03 0.00 0.00 41.12 40.83 1gof n ASP 565 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 1gof s SER 566 N -2.09 -0.41 0.21 -1.12 1.04 -1.26 -4.99 113.70 105.08 1gof s SER 566 Ca 0.26 -0.21 -0.30 0.00 0.48 0.00 0.00 55.95 56.18 1gof s SER 566 Cb 0.19 0.58 -0.09 0.00 0.10 0.00 0.00 66.02 66.80 1gof s SER 566 CO 0.36 -0.99 1.25 -0.94 0.98 0.00 0.00 173.24 173.90 1gof s SER 567 N -2.80 7.00 0.08 7.02 1.04 -1.26 -4.92 113.70 119.85 1gof s SER 567 Ca 0.04 2.34 0.07 0.00 0.48 0.00 0.00 55.95 58.88 1gof s SER 567 Cb -0.01 -2.61 -0.04 0.00 0.10 0.00 0.00 66.02 63.46 1gof s SER 567 CO -0.09 -0.43 -0.16 0.27 0.98 0.00 0.00 173.24 173.81 1gof s ILE 568 N -0.14 2.99 -0.14 -1.02 -4.36 -1.26 -4.47 121.20 112.80 1gof s ILE 568 Ca 0.54 -1.27 0.14 0.00 -0.26 0.00 0.00 60.65 59.79 1gof s ILE 568 Cb -0.35 -2.33 -0.19 0.00 1.25 0.00 0.00 42.46 40.84 1gof s ILE 568 CO 0.39 0.22 0.08 -1.54 0.24 0.00 0.00 174.94 174.33 1gof n SER 569 N 1.14 1.27 -3.91 4.36 3.41 0.44 -4.93 113.62 115.39 1gof n SER 569 Ca -0.15 0.00 -0.08 0.00 -0.26 0.00 0.00 58.87 58.37 1gof n SER 569 Cb 0.52 0.97 -0.08 0.00 -0.26 0.00 0.00 64.21 65.36 1gof n SER 569 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1gof s LYS 570 N -2.45 0.79 0.02 4.33 1.02 -1.11 -4.99 119.74 117.35 1gof s LYS 570 Ca -0.07 -1.01 -0.13 0.00 0.02 0.00 0.00 55.97 54.77 1gof s LYS 570 Cb 0.05 0.31 0.02 0.00 -0.52 0.00 0.00 37.83 37.69 1gof s LYS 570 CO 0.63 -0.23 0.28 0.00 -0.92 0.00 0.00 175.35 175.11 1gof s ALA 571 N -3.84 -0.65 0.04 5.17 0.00 -1.26 -0.25 121.76 120.96 1gof s ALA 571 Ca 0.05 0.07 -0.10 0.00 0.00 0.00 0.00 51.96 51.98 1gof s ALA 571 Cb 0.05 0.22 0.01 0.00 0.00 0.00 0.00 23.12 23.40 1gof s ALA 571 CO -0.11 -0.34 0.21 -1.54 0.00 0.00 0.00 175.76 173.98 1gof s SER 572 N -1.78 0.02 -0.15 0.00 1.04 -0.26 -1.39 113.70 111.18 1gof s SER 572 Ca -0.08 -0.35 -0.01 0.00 0.48 0.00 0.00 55.95 55.98 1gof s SER 572 Cb -0.03 0.30 -0.02 0.00 0.10 0.00 0.00 66.02 66.37 1gof s SER 572 CO -0.00 -0.57 -0.10 -0.76 0.98 0.00 0.00 173.24 172.79 1gof s LEU 573 N -2.09 2.83 -0.19 2.42 1.43 -0.10 -1.49 118.68 121.49 1gof s LEU 573 Ca -0.05 -0.30 0.01 0.00 -1.03 0.00 0.00 54.13 52.76 1gof s LEU 573 Cb -0.01 -1.66 0.03 0.00 0.03 0.00 0.00 46.19 44.58 1gof s LEU 573 CO -0.04 0.14 -0.15 -0.63 0.23 0.00 0.00 176.35 175.90 1gof s ILE 574 N 0.49 1.87 0.37 -0.59 1.01 0.84 0.44 121.20 125.63 1gof s ILE 574 Ca -0.07 -0.97 -0.26 0.00 0.00 0.00 0.00 60.65 59.35 1gof s ILE 574 Cb -0.15 -1.79 -0.09 0.00 0.01 0.00 0.00 42.46 40.44 1gof s ILE 574 CO 0.04 0.37 1.15 -0.60 0.00 0.00 0.00 174.94 175.90 1gof s ARG 575 N 1.34 4.21 0.34 2.79 3.52 -0.38 0.06 118.95 130.82 1gof s ARG 575 Ca 0.02 1.82 -0.29 0.00 -0.13 0.00 0.00 55.73 57.15 1gof s ARG 575 Cb -0.14 -2.79 -0.11 0.00 -1.56 0.00 0.00 34.95 30.35 1gof s ARG 575 CO -0.10 -0.18 1.47 0.71 -0.81 0.00 0.00 175.30 176.39 1gof s TYR 576 N -1.38 2.74 0.36 5.12 2.02 -1.05 -4.03 117.35 121.13 1gof s TYR 576 Ca 0.54 1.12 0.04 0.00 -0.37 0.00 0.00 57.07 58.41 1gof s TYR 576 Cb -0.30 -3.95 -0.01 0.00 -0.40 0.00 0.00 41.96 37.29 1gof s TYR 576 CO 0.39 -2.88 0.53 0.20 -1.57 0.00 0.00 175.55 172.21 1gof s GLY 577 N -0.04 1.55 0.02 0.71 0.00 -1.26 -3.88 107.32 104.42 1gof s GLY 577 Ca 0.55 -1.30 -0.01 0.00 0.00 0.00 0.00 44.72 43.96 1gof s GLY 577 CO 0.57 -1.20 -0.02 -0.51 0.00 0.00 0.00 173.10 171.94 1gof s THR 578 N -2.28 0.11 -0.10 0.90 -4.23 -1.26 -2.83 115.64 105.95 1gof s THR 578 Ca 0.45 -0.93 -0.21 0.00 -1.18 0.00 0.00 61.69 59.81 1gof s THR 578 Cb -0.10 -0.33 0.05 0.00 1.34 0.00 0.00 72.50 73.47 1gof s THR 578 CO 0.33 -0.51 0.52 0.00 -0.54 0.00 0.00 174.62 174.42 1gof s ALA 579 N -1.56 -1.31 -0.28 3.99 0.00 0.57 -4.28 121.76 118.89 1gof s ALA 579 Ca -0.15 1.12 -0.26 0.00 0.00 0.00 0.00 51.96 52.67 1gof s ALA 579 Cb -0.09 -0.33 0.16 0.00 0.00 0.00 0.00 23.12 22.86 1gof s ALA 579 CO -0.01 -0.29 1.23 -0.08 0.00 0.00 0.00 175.76 176.61 1gof s THR 580 N -0.64 0.00 -1.27 0.00 -1.32 -0.79 -1.46 115.64 110.16 1gof s THR 580 Ca -0.07 0.00 -0.07 0.00 -1.21 0.00 0.00 61.69 60.34 1gof s THR 580 Cb -0.03 -1.00 0.05 0.00 -1.51 0.00 0.00 72.50 70.01 1gof s THR 580 CO 0.05 0.00 0.42 1.41 -2.21 0.00 0.00 174.62 174.28 1gof n HIS 581 N 1.69 -1.75 -0.15 9.09 8.25 -1.26 -0.94 115.22 130.14 1gof n HIS 581 Ca -0.10 0.39 0.00 0.00 -0.26 0.00 0.00 57.72 57.75 1gof n HIS 581 Cb 0.57 -3.11 0.00 0.00 1.12 0.00 0.00 29.99 28.57 1gof n HIS 581 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1gof n THR 582 N -3.91 0.00 -3.28 1.59 -2.24 -1.26 -4.93 114.28 100.25 1gof n THR 582 Ca -0.05 0.00 -0.38 0.00 -2.27 0.00 0.00 64.05 61.35 1gof n THR 582 Cb 0.56 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.74 1gof n THR 582 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1gof s VAL 583 N -3.00 5.08 -0.33 2.28 1.01 -0.12 -4.80 120.40 120.52 1gof s VAL 583 Ca 0.00 1.07 -0.01 0.00 0.00 0.00 0.00 61.98 63.04 1gof s VAL 583 Cb 0.00 -3.86 0.13 0.00 0.00 0.00 0.00 36.38 32.65 1gof s VAL 583 CO 0.00 0.37 0.23 0.21 0.00 0.00 0.00 175.10 175.91 1gof s ASN 584 N 0.24 2.60 0.00 3.32 3.84 -1.26 -1.89 114.94 121.80 1gof s ASN 584 Ca 0.28 -1.61 0.26 0.00 0.21 0.00 0.00 52.86 52.00 1gof s ASN 584 Cb -0.16 -0.07 0.71 0.00 -0.55 0.00 0.00 41.25 41.17 1gof s ASN 584 CO 0.13 -0.35 1.54 0.35 -2.79 0.00 0.00 177.10 175.99 1gof n THR 585 N 4.61 0.00 -0.06 -5.21 -2.24 -1.26 -4.30 114.28 105.81 1gof n THR 585 Ca 0.05 -0.26 -0.12 0.00 -2.27 0.00 0.00 64.05 61.45 1gof n THR 585 Cb 0.41 0.71 -0.14 0.00 -2.10 0.00 0.00 70.33 69.21 1gof n THR 585 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1gof n ASP 586 N 0.10 0.88 -4.79 3.42 8.00 -1.26 -4.72 116.55 118.17 1gof n ASP 586 Ca 0.15 0.14 -0.34 0.00 0.71 0.00 0.00 54.79 55.45 1gof n ASP 586 Cb 0.41 0.18 -0.02 0.00 -0.02 0.00 0.00 41.12 41.67 1gof n ASP 586 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1gof s GLN 587 N -2.54 3.63 -0.22 -1.24 -2.07 -1.25 -4.58 119.66 111.40 1gof s GLN 587 Ca -0.14 1.45 -0.35 0.00 -1.82 0.00 0.00 55.36 54.51 1gof s GLN 587 Cb 0.07 -2.06 0.15 0.00 -1.09 0.00 0.00 33.01 30.08 1gof s GLN 587 CO 0.78 -0.59 1.24 -0.98 -1.32 0.00 0.00 175.29 174.43 1gof s ARG 588 N -3.26 0.25 0.02 9.60 1.70 -1.26 -4.62 118.95 121.38 1gof s ARG 588 Ca 0.69 -0.07 0.06 0.00 -0.47 0.00 0.00 55.73 55.95 1gof s ARG 588 Cb -0.19 0.11 -0.02 0.00 -0.57 0.00 0.00 34.95 34.28 1gof s ARG 588 CO 0.23 -0.10 -0.19 0.50 -1.08 0.00 0.00 175.30 174.65 1gof s ARG 589 N -2.09 1.37 -0.18 3.89 3.52 -0.88 -1.25 118.95 123.32 1gof s ARG 589 Ca 0.09 -0.81 0.01 0.00 -0.13 0.00 0.00 55.73 54.89 1gof s ARG 589 Cb -0.01 -1.41 0.02 0.00 -1.56 0.00 0.00 34.95 32.00 1gof s ARG 589 CO -0.04 0.37 -0.18 0.42 -0.81 0.00 0.00 175.30 175.06 1gof s ILE 590 N -0.66 1.98 0.28 4.11 1.01 0.17 -0.35 121.20 127.74 1gof s ILE 590 Ca 0.07 -0.96 -0.29 0.00 0.00 0.00 0.00 60.65 59.46 1gof s ILE 590 Cb -0.08 -1.84 -0.09 0.00 0.01 0.00 0.00 42.46 40.46 1gof s ILE 590 CO 0.01 0.46 1.05 -2.16 0.00 0.00 0.00 174.94 174.29 1gof s PRO 591 N 1.31 4.66 0.07 2.79 0.04 -1.26 -0.93 135.00 141.68 1gof s PRO 591 Ca 0.03 1.68 0.03 0.00 0.04 0.00 0.00 61.00 62.78 1gof s PRO 591 Cb -0.14 -3.15 -0.04 0.00 0.04 0.00 0.00 34.50 31.21 1gof s PRO 591 CO -0.12 0.27 0.07 -0.51 0.04 0.00 0.00 177.00 176.75 1gof s LEU 592 N -1.48 3.76 -0.19 -3.56 1.43 -0.49 -4.94 118.68 113.22 1gof s LEU 592 Ca 0.45 -0.01 -0.05 0.00 -1.03 0.00 0.00 54.13 53.48 1gof s LEU 592 Cb -0.29 -2.41 -0.03 0.00 0.03 0.00 0.00 46.19 43.49 1gof s LEU 592 CO 0.37 0.19 0.01 0.42 0.23 0.00 0.00 176.35 177.57 1gof s THR 593 N -1.34 4.16 -0.12 5.49 -4.23 -1.26 -4.49 115.64 113.84 1gof s THR 593 Ca 0.28 -0.25 -0.07 0.00 -1.18 0.00 0.00 61.69 60.47 1gof s THR 593 Cb -0.12 -2.87 -0.04 0.00 1.34 0.00 0.00 72.50 70.81 1gof s THR 593 CO 0.20 0.45 0.14 -0.76 -0.54 0.00 0.00 174.62 174.11 1gof s LEU 594 N 0.71 4.37 -0.25 4.79 1.43 -1.26 -4.42 118.68 124.05 1gof s LEU 594 Ca 0.00 0.46 -0.09 0.00 -1.03 0.00 0.00 54.13 53.47 1gof s LEU 594 Cb -0.14 -2.07 -0.04 0.00 0.03 0.00 0.00 46.19 43.98 1gof s LEU 594 CO 0.02 0.40 0.11 -0.89 0.23 0.00 0.00 176.35 176.22 1gof s THR 595 N -0.96 4.69 -0.35 5.49 2.01 0.15 -4.97 115.64 121.70 1gof s THR 595 Ca 0.15 -0.05 -0.25 0.00 0.31 0.00 0.00 61.69 61.85 1gof s THR 595 Cb -0.12 -3.20 0.01 0.00 0.01 0.00 0.00 72.50 69.20 1gof s THR 595 CO 0.04 0.32 0.87 0.21 -0.69 0.00 0.00 174.62 175.37 1gof s ASN 596 N 1.52 6.66 0.00 3.53 2.47 -1.26 -1.88 114.94 125.97 1gof s ASN 596 Ca 0.06 0.58 0.20 0.00 0.42 0.00 0.00 52.86 54.12 1gof s ASN 596 Cb -0.15 -2.44 0.71 0.00 -1.45 0.00 0.00 41.25 37.92 1gof s ASN 596 CO 0.06 -0.77 1.52 0.59 -3.72 0.00 0.00 177.10 174.78 1gof n ASN 597 N 6.55 1.71 -0.54 -4.21 5.03 0.08 -5.02 115.26 118.86 1gof n ASN 597 Ca 0.06 -1.74 0.02 0.00 0.87 0.00 0.00 54.58 53.79 1gof n ASN 597 Cb 0.48 -0.12 -0.01 0.00 -1.02 0.00 0.00 39.78 39.11 1gof n ASN 597 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1gof n GLY 598 N 1.13 -3.13 2.19 7.41 0.00 -1.24 -4.84 105.19 106.71 1gof n GLY 598 Ca 0.16 -1.20 -0.08 0.00 0.00 0.00 0.00 46.02 44.90 1gof n GLY 598 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gof n GLY 599 N -2.20 0.45 3.40 -0.02 0.00 -1.26 -3.16 105.19 102.40 1gof n GLY 599 Ca -0.01 -0.60 -0.21 0.00 0.00 0.00 0.00 46.02 45.20 1gof n GLY 599 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1gof n ASN 600 N 0.54 -5.65 -4.16 1.61 5.03 -1.26 -4.89 115.26 106.48 1gof n ASN 600 Ca -0.09 -0.50 -0.29 0.00 0.87 0.00 0.00 54.58 54.57 1gof n ASN 600 Cb 0.44 -4.66 -0.17 0.00 -1.02 0.00 0.00 39.78 34.38 1gof n ASN 600 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 1gof s SER 601 N -3.38 2.53 -0.00 6.41 0.15 -1.19 -1.97 113.70 116.25 1gof s SER 601 Ca 0.49 -0.43 -0.09 0.00 0.70 0.00 0.00 55.95 56.62 1gof s SER 601 Cb -0.22 -0.93 0.01 0.00 -1.71 0.00 0.00 66.02 63.17 1gof s SER 601 CO 0.67 0.15 0.17 -0.31 1.20 0.00 0.00 173.24 175.12 1gof s TYR 602 N 0.22 -0.01 0.13 3.44 1.51 0.51 -0.74 117.35 122.40 1gof s TYR 602 Ca -0.11 -0.04 0.05 0.00 -1.01 0.00 0.00 57.07 55.97 1gof s TYR 602 Cb -0.15 -0.02 -0.04 0.00 -0.11 0.00 0.00 41.96 41.65 1gof s TYR 602 CO 0.05 -0.30 -0.13 -1.12 -1.11 0.00 0.00 175.55 172.94 1gof s SER 603 N -1.34 1.92 0.12 2.29 0.01 -0.79 0.47 113.70 116.38 1gof s SER 603 Ca -0.14 -0.86 -0.21 0.00 1.31 0.00 0.00 55.95 56.05 1gof s SER 603 Cb -0.07 -0.05 0.06 0.00 0.21 0.00 0.00 66.02 66.16 1gof s SER 603 CO 0.02 -0.20 0.53 0.72 0.41 0.00 0.00 173.24 174.72 1gof s PHE 604 N -2.45 -0.42 -0.09 2.43 -0.12 0.04 -0.67 117.98 116.69 1gof s PHE 604 Ca 0.11 0.25 -0.01 0.00 -0.05 0.00 0.00 56.93 57.23 1gof s PHE 604 Cb -0.03 0.42 -0.03 0.00 -0.63 0.00 0.00 43.02 42.75 1gof s PHE 604 CO 0.02 -0.76 -0.05 -1.14 -0.05 0.00 0.00 175.22 173.25 1gof s GLN 605 N -3.43 2.98 0.22 1.99 0.74 -1.26 -1.34 119.66 119.55 1gof s GLN 605 Ca -0.00 -0.51 -0.28 0.00 0.05 0.00 0.00 55.36 54.62 1gof s GLN 605 Cb -0.00 -2.70 -0.09 0.00 1.10 0.00 0.00 33.01 31.33 1gof s GLN 605 CO -0.10 0.59 0.88 0.08 -0.55 0.00 0.00 175.29 176.19 1gof s VAL 606 N -0.60 4.20 0.45 1.34 1.01 0.64 -4.82 120.40 122.61 1gof s VAL 606 Ca 0.09 1.91 -0.23 0.00 0.00 0.00 0.00 61.98 63.76 1gof s VAL 606 Cb -0.12 -4.22 -0.11 0.00 0.00 0.00 0.00 36.38 31.94 1gof s VAL 606 CO 0.02 0.47 0.81 -2.65 0.00 0.00 0.00 175.10 173.75 1gof n PRO 607 N 1.42 0.97 0.05 2.72 -0.02 -1.26 -1.62 135.00 137.26 1gof n PRO 607 Ca -0.03 0.35 0.13 0.00 -2.02 0.00 0.00 63.50 61.93 1gof n PRO 607 Cb 0.48 -1.84 0.43 0.00 -0.02 0.00 0.00 33.50 32.55 1gof n PRO 607 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1gof n SER 608 N 0.66 0.50 -4.61 2.55 3.41 -1.26 -2.41 113.62 112.46 1gof n SER 608 Ca 0.11 0.41 -0.41 0.00 -0.26 0.00 0.00 58.87 58.72 1gof n SER 608 Cb 0.40 -0.47 -0.06 0.00 -0.26 0.00 0.00 64.21 63.83 1gof n SER 608 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1gof s ASP 609 N -3.84 6.54 0.00 4.04 -1.08 -1.26 -4.52 116.67 116.55 1gof s ASP 609 Ca 0.11 0.54 0.21 0.00 -0.52 0.00 0.00 52.55 52.89 1gof s ASP 609 Cb 0.15 -2.34 1.05 0.00 -1.46 0.00 0.00 42.92 40.32 1gof s ASP 609 CO 0.60 -0.46 1.66 -1.54 0.52 0.00 0.00 175.17 175.95 1gof n SER 610 N 5.86 0.00 0.15 -0.34 3.41 -1.26 -1.23 113.62 120.21 1gof n SER 610 Ca -0.00 -0.03 0.12 0.00 -0.26 0.00 0.00 58.87 58.69 1gof n SER 610 Cb 0.49 -0.27 0.18 0.00 -0.26 0.00 0.00 64.21 64.34 1gof n SER 610 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1gof h GLY 611 N 3.41 0.00 0.00 5.00 0.00 -1.82 -3.02 103.07 106.64 1gof h GLY 611 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1gof h GLY 611 CO 0.00 0.00 -0.18 -2.08 0.00 0.00 0.00 176.54 174.28 1gof h VAL 612 N 0.00 0.00 -0.82 4.60 2.07 -1.71 -3.37 116.25 117.02 1gof h VAL 612 Ca 0.00 -0.39 -0.73 0.00 0.82 0.00 0.00 66.70 66.40 1gof h VAL 612 Cb 0.91 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 30.58 1gof h VAL 612 CO 0.00 0.00 2.58 0.00 0.02 0.00 0.00 177.57 180.17 1gof n ALA 613 N -2.74 5.84 -1.64 1.67 0.00 -0.36 -4.96 120.51 118.31 1gof n ALA 613 Ca -0.02 -4.08 -0.45 0.00 0.00 0.00 0.00 53.44 48.88 1gof n ALA 613 Cb 0.09 -3.15 -0.03 0.00 0.00 0.00 0.00 19.45 16.37 1gof n ALA 613 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1gof n LEU 614 N 4.17 2.65 -4.73 0.00 4.77 -1.14 -4.48 117.00 118.24 1gof n LEU 614 Ca 0.50 1.16 -0.36 0.00 -0.03 0.00 0.00 56.01 57.27 1gof n LEU 614 Cb 0.34 -1.37 0.07 0.00 -2.33 0.00 0.00 43.42 40.13 1gof n LEU 614 CO 0.83 -0.78 0.89 -2.16 -1.33 0.00 0.00 177.39 174.83 1gof s PRO 615 N -0.76 2.50 0.00 3.23 0.04 -1.26 -4.86 135.00 133.89 1gof s PRO 615 Ca 0.66 2.01 0.00 0.00 0.04 0.00 0.00 61.00 63.71 1gof s PRO 615 Cb -0.69 -1.85 0.00 0.00 0.04 0.00 0.00 34.50 32.01 1gof s PRO 615 CO 0.53 -1.62 0.00 0.41 0.04 0.00 0.00 177.00 176.36 1gof n GLY 616 N 0.81 0.86 3.86 0.56 0.00 -0.26 -4.48 105.19 106.53 1gof n GLY 616 Ca 0.15 -1.94 -0.35 0.00 0.00 0.00 0.00 46.02 43.88 1gof n GLY 616 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1gof s TYR 617 N -2.42 3.61 0.07 1.61 2.02 -1.26 -0.68 117.35 120.30 1gof s TYR 617 Ca 0.00 0.87 0.01 0.00 -0.37 0.00 0.00 57.07 57.58 1gof s TYR 617 Cb 0.00 -2.22 -0.04 0.00 -0.40 0.00 0.00 41.96 39.31 1gof s TYR 617 CO 0.00 0.53 -0.06 -1.58 -1.57 0.00 0.00 175.55 172.87 1gof s TRP 618 N -1.35 0.75 -0.18 2.71 0.52 0.83 -2.54 118.94 119.68 1gof s TRP 618 Ca 0.32 -0.86 -0.06 0.00 0.02 0.00 0.00 56.10 55.52 1gof s TRP 618 Cb -0.15 -0.45 -0.04 0.00 -1.15 0.00 0.00 33.47 31.68 1gof s TRP 618 CO 0.17 -0.19 0.03 -1.64 0.02 0.00 0.00 176.95 175.35 1gof s MET 619 N -3.36 3.84 -0.24 4.98 -1.94 0.11 0.23 119.30 122.92 1gof s MET 619 Ca 0.06 -0.41 -0.10 0.00 -1.71 0.00 0.00 55.69 53.52 1gof s MET 619 Cb 0.03 -3.13 -0.05 0.00 2.01 0.00 0.00 34.83 33.69 1gof s MET 619 CO -0.05 0.21 0.14 -1.17 -0.01 0.00 0.00 175.02 174.15 1gof s LEU 620 N 0.51 4.00 -0.03 -0.03 2.96 0.16 -0.11 118.68 126.14 1gof s LEU 620 Ca 0.01 0.06 0.07 0.00 -0.22 0.00 0.00 54.13 54.05 1gof s LEU 620 Cb -0.13 -2.07 -0.02 0.00 0.50 0.00 0.00 46.19 44.47 1gof s LEU 620 CO 0.02 0.05 -0.25 -0.36 -1.32 0.00 0.00 176.35 174.48 1gof s PHE 621 N 1.14 2.37 0.09 5.38 0.08 -0.55 -1.24 117.98 125.25 1gof s PHE 621 Ca 0.07 -0.54 0.09 0.00 0.12 0.00 0.00 56.93 56.67 1gof s PHE 621 Cb -0.14 -1.54 -0.04 0.00 -0.57 0.00 0.00 43.02 40.74 1gof s PHE 621 CO 0.05 -0.10 -0.21 0.14 -0.10 0.00 0.00 175.22 175.00 1gof s VAL 622 N -0.45 2.62 0.01 -0.44 -7.23 -1.26 -1.10 120.40 112.54 1gof s VAL 622 Ca 0.05 -1.46 0.07 0.00 -1.81 0.00 0.00 61.98 58.83 1gof s VAL 622 Cb -0.11 -2.15 -0.02 0.00 0.56 0.00 0.00 36.38 34.66 1gof s VAL 622 CO 0.01 0.19 -0.23 -0.04 -0.31 0.00 0.00 175.10 174.72 1gof s MET 623 N -1.83 1.71 0.78 4.82 -1.94 0.65 -1.35 119.30 122.15 1gof s MET 623 Ca 0.15 -0.88 -0.06 0.00 -1.71 0.00 0.00 55.69 53.20 1gof s MET 623 Cb -0.10 -1.73 0.14 0.00 2.01 0.00 0.00 34.83 35.15 1gof s MET 623 CO 0.07 0.46 1.08 0.54 -0.01 0.00 0.00 175.02 177.17 1gof s ASN 624 N -0.78 4.07 0.54 3.03 2.20 -0.87 -0.42 114.94 122.71 1gof s ASN 624 Ca 0.09 -0.09 0.20 0.00 -0.94 0.00 0.00 52.86 52.12 1gof s ASN 624 Cb -0.09 -0.24 1.42 0.00 -2.00 0.00 0.00 41.25 40.35 1gof s ASN 624 CO 0.00 -2.06 2.16 0.77 -2.94 0.00 0.00 177.10 175.03 1gof h SER 625 N -0.84 0.00 0.81 3.54 4.64 -1.92 0.74 113.55 120.53 1gof h SER 625 Ca -0.40 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 60.92 1gof h SER 625 Cb 1.26 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.35 1gof h SER 625 CO 0.42 0.00 -0.01 0.00 -0.87 0.00 0.00 176.83 176.37 1gof h ALA 626 N 1.97 1.01 0.00 5.18 0.00 -1.96 -3.47 119.26 121.99 1gof h ALA 626 Ca 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1gof h ALA 626 Cb 0.10 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1gof h ALA 626 CO -0.00 0.01 0.00 0.41 0.00 0.00 0.00 179.25 179.67 1gof n GLY 627 N -0.19 0.90 3.69 0.00 0.00 0.25 -5.05 105.19 104.79 1gof n GLY 627 Ca -0.00 -0.04 -0.41 0.00 0.00 0.00 0.00 46.02 45.57 1gof n GLY 627 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1gof s VAL 628 N -2.00 4.91 0.37 1.61 1.01 -1.26 -4.75 120.40 120.29 1gof s VAL 628 Ca 0.00 1.67 -0.12 0.00 0.00 0.00 0.00 61.98 63.54 1gof s VAL 628 Cb 0.00 -4.15 -0.07 0.00 0.00 0.00 0.00 36.38 32.16 1gof s VAL 628 CO 0.00 0.09 0.74 -2.16 0.00 0.00 0.00 175.10 173.78 1gof s PRO 629 N 1.69 3.85 0.97 2.72 0.04 -1.26 -2.04 135.00 140.97 1gof s PRO 629 Ca 0.41 0.52 -0.14 0.00 0.04 0.00 0.00 61.00 61.82 1gof s PRO 629 Cb -0.17 -2.42 0.17 0.00 0.04 0.00 0.00 34.50 32.12 1gof s PRO 629 CO 0.16 0.05 1.17 -1.54 0.04 0.00 0.00 177.00 176.88 1gof s SER 630 N -2.84 3.02 0.50 6.66 1.04 -0.46 -4.57 113.70 117.06 1gof s SER 630 Ca 0.52 0.76 -0.17 0.00 0.48 0.00 0.00 55.95 57.53 1gof s SER 630 Cb -0.10 -1.16 -0.08 0.00 0.10 0.00 0.00 66.02 64.77 1gof s SER 630 CO 0.26 -2.84 0.98 0.68 0.98 0.00 0.00 173.24 173.31 1gof s VAL 631 N -3.37 4.50 0.72 5.02 -7.23 -1.26 -4.74 120.40 114.05 1gof s VAL 631 Ca 0.67 1.25 -0.12 0.00 -1.81 0.00 0.00 61.98 61.98 1gof s VAL 631 Cb -0.12 -3.70 0.03 0.00 0.56 0.00 0.00 36.38 33.16 1gof s VAL 631 CO 0.54 -0.63 1.08 0.00 -0.31 0.00 0.00 175.10 175.78 1gof s ALA 632 N -2.56 2.43 -0.11 1.32 0.00 0.10 -4.81 121.76 118.13 1gof s ALA 632 Ca 0.59 0.27 -0.02 0.00 0.00 0.00 0.00 51.96 52.80 1gof s ALA 632 Cb -0.10 -3.25 -0.03 0.00 0.00 0.00 0.00 23.12 19.74 1gof s ALA 632 CO 0.29 -1.49 -0.02 -1.12 0.00 0.00 0.00 175.76 173.41 1gof s SER 633 N -3.34 5.01 -0.12 0.00 0.01 -0.37 -4.85 113.70 110.03 1gof s SER 633 Ca 0.61 0.02 -0.17 0.00 1.31 0.00 0.00 55.95 57.72 1gof s SER 633 Cb -0.17 -1.56 -0.04 0.00 0.21 0.00 0.00 66.02 64.46 1gof s SER 633 CO 0.52 0.29 0.44 -0.89 0.41 0.00 0.00 173.24 174.01 1gof s THR 634 N -0.36 5.20 -0.03 1.44 2.01 -1.26 0.36 115.64 123.00 1gof s THR 634 Ca 0.06 0.87 0.05 0.00 0.31 0.00 0.00 61.69 62.98 1gof s THR 634 Cb -0.12 -3.77 -0.01 0.00 0.01 0.00 0.00 72.50 68.61 1gof s THR 634 CO 0.02 0.35 -0.18 -0.63 -0.69 0.00 0.00 174.62 173.49 1gof s ILE 635 N 0.51 1.46 -0.23 1.82 -1.09 0.14 -4.88 121.20 118.92 1gof s ILE 635 Ca 0.24 -0.75 -0.12 0.00 -2.23 0.00 0.00 60.65 57.78 1gof s ILE 635 Cb -0.15 -1.24 -0.05 0.00 -1.58 0.00 0.00 42.46 39.45 1gof s ILE 635 CO 0.09 0.42 0.24 -0.60 -1.23 0.00 0.00 174.94 173.86 1gof s ARG 636 N -0.13 4.09 -0.25 2.79 3.52 -0.60 -0.12 118.95 128.26 1gof s ARG 636 Ca -0.00 -0.13 -0.08 0.00 -0.13 0.00 0.00 55.73 55.39 1gof s ARG 636 Cb -0.10 -3.55 -0.03 0.00 -1.56 0.00 0.00 34.95 29.70 1gof s ARG 636 CO 0.01 0.00 0.10 0.08 -0.81 0.00 0.00 175.30 174.68 1gof s VAL 637 N 1.22 4.59 0.28 7.11 1.01 0.14 -1.23 120.40 133.51 1gof s VAL 637 Ca 0.11 -0.08 0.10 0.00 0.00 0.00 0.00 61.98 62.11 1gof s VAL 637 Cb -0.14 -3.15 -0.05 0.00 0.00 0.00 0.00 36.38 33.05 1gof s VAL 637 CO 0.06 0.33 -0.07 0.42 0.00 0.00 0.00 175.10 175.85 1gof s THR 638 N 1.49 3.06 -2.68 3.92 -4.23 0.29 -1.10 115.64 116.39 1gof s THR 638 Ca 0.06 -2.09 0.27 0.00 -1.18 0.00 0.00 61.69 58.75 1gof s THR 638 Cb -0.15 -2.66 0.42 0.00 1.34 0.00 0.00 72.50 71.45 1gof s THR 638 CO 0.05 -0.37 1.57 0.00 -0.54 0.00 0.00 174.62 175.33