#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jji s THR 2 N 0.00 0.09 0.04 6.66 -4.23 -1.26 -1.56 115.64 115.38 2jji s THR 2 Ca 0.00 -1.46 -0.04 0.00 -1.18 0.00 0.00 61.69 59.01 2jji s THR 2 Cb 0.00 -1.77 -0.02 0.00 1.34 0.00 0.00 72.50 72.05 2jji s THR 2 CO 0.00 -0.42 0.06 -0.83 -0.54 0.00 0.00 174.62 172.90 2jji s GLY 3 N -2.96 0.22 -0.12 3.99 0.00 -0.39 -3.97 107.32 104.10 2jji s GLY 3 Ca 0.16 -0.65 -0.05 0.00 0.00 0.00 0.00 44.72 44.17 2jji s GLY 3 CO -0.02 -0.78 0.25 -0.45 0.00 0.00 0.00 173.10 172.10 2jji s SER 4 N -2.18 0.04 0.00 1.64 0.15 -0.79 -0.98 113.70 111.58 2jji s SER 4 Ca -0.04 0.55 0.03 0.00 0.70 0.00 0.00 55.95 57.19 2jji s SER 4 Cb -0.01 0.54 -0.01 0.00 -1.71 0.00 0.00 66.02 64.83 2jji s SER 4 CO -0.05 -0.20 -0.09 0.00 1.20 0.00 0.00 173.24 174.10 2jji s ALA 5 N 1.80 0.71 0.10 5.45 0.00 -0.40 -4.30 121.76 125.13 2jji s ALA 5 Ca -0.04 -0.44 -0.30 0.00 0.00 0.00 0.00 51.96 51.18 2jji s ALA 5 Cb -0.11 -0.15 -0.06 0.00 0.00 0.00 0.00 23.12 22.80 2jji s ALA 5 CO -0.08 0.15 0.96 0.99 0.00 0.00 0.00 175.76 177.77 2jji s THR 6 N -0.37 4.52 -0.04 0.00 2.01 -1.26 -1.15 115.64 119.35 2jji s THR 6 Ca 0.02 2.06 0.06 0.00 0.31 0.00 0.00 61.69 64.13 2jji s THR 6 Cb -0.04 -4.32 -0.02 0.00 0.01 0.00 0.00 72.50 68.13 2jji s THR 6 CO -0.00 0.31 -0.20 0.28 -0.69 0.00 0.00 174.62 174.32 2jji s THR 7 N 0.04 2.55 -0.02 -0.82 -1.32 0.03 -4.35 115.64 111.75 2jji s THR 7 Ca 0.47 -0.92 0.04 0.00 -1.21 0.00 0.00 61.69 60.08 2jji s THR 7 Cb -0.23 -1.95 -0.01 0.00 -1.51 0.00 0.00 72.50 68.80 2jji s THR 7 CO 0.30 0.58 -0.15 -0.89 -2.21 0.00 0.00 174.62 172.25 2jji s THR 8 N -0.62 1.24 0.44 5.08 2.01 -0.14 -0.32 115.64 123.33 2jji s THR 8 Ca 0.09 -0.65 -0.25 0.00 0.31 0.00 0.00 61.69 61.19 2jji s THR 8 Cb -0.11 -1.04 -0.08 0.00 0.01 0.00 0.00 72.50 71.28 2jji s THR 8 CO 0.00 0.35 1.36 -2.16 -0.69 0.00 0.00 174.62 173.49 2jji s PRO 9 N -0.23 3.76 0.27 4.92 0.04 -1.26 -0.55 135.00 141.94 2jji s PRO 9 Ca 0.03 2.28 0.26 0.00 0.04 0.00 0.00 61.00 63.61 2jji s PRO 9 Cb -0.07 -2.66 0.79 0.00 0.04 0.00 0.00 34.50 32.60 2jji s PRO 9 CO 0.00 -0.71 1.75 -0.84 0.04 0.00 0.00 177.00 177.24 2jji h ILE 10 N 2.29 0.00 -3.14 0.56 3.07 -1.34 -3.46 117.51 115.48 2jji h ILE 10 Ca -0.50 -0.52 -0.05 0.00 1.55 0.00 0.00 64.86 65.34 2jji h ILE 10 Cb 1.26 1.47 -0.01 0.00 -0.27 0.00 0.00 36.82 39.27 2jji h ILE 10 CO 0.61 0.00 0.21 1.51 -1.05 0.00 0.00 178.15 179.44 2jji s ASP 11 N -4.79 0.12 0.00 2.16 1.47 -1.26 -5.04 116.67 109.33 2jji s ASP 11 Ca 0.09 -1.18 0.20 0.00 1.18 0.00 0.00 52.55 52.84 2jji s ASP 11 Cb 0.11 0.83 0.93 0.00 -0.34 0.00 0.00 42.92 44.44 2jji s ASP 11 CO 0.57 -1.64 1.65 -1.54 0.68 0.00 0.00 175.17 174.89 2jji n SER 12 N -1.40 0.00 -0.52 2.11 3.41 -1.26 -2.79 113.62 113.17 2jji n SER 12 Ca -0.07 0.30 0.12 0.00 -0.26 0.00 0.00 58.87 58.96 2jji n SER 12 Cb 0.60 -0.42 0.09 0.00 -0.26 0.00 0.00 64.21 64.22 2jji n SER 12 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2jji n LEU 13 N -1.42 1.99 -2.79 1.04 4.77 -1.26 -4.94 117.00 114.40 2jji n LEU 13 Ca 0.07 -0.71 -0.20 0.00 -0.03 0.00 0.00 56.01 55.14 2jji n LEU 13 Cb 0.21 -0.02 0.04 0.00 -2.33 0.00 0.00 43.42 41.32 2jji n LEU 13 CO 0.18 0.36 0.03 0.47 -1.33 0.00 0.00 177.39 177.09 2jji n ASP 14 N 0.07 -5.72 -0.01 -1.43 8.00 -1.12 -4.89 116.55 111.45 2jji n ASP 14 Ca 0.11 -0.28 0.05 0.00 0.71 0.00 0.00 54.79 55.37 2jji n ASP 14 Cb 0.46 -4.53 0.43 0.00 -0.02 0.00 0.00 41.12 37.47 2jji n ASP 14 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 2jji h ASP 15 N -1.40 0.46 -5.03 -2.24 3.32 -1.93 -3.46 116.42 106.14 2jji h ASP 15 Ca -0.48 -0.01 0.09 0.00 0.02 0.00 0.00 57.03 56.65 2jji h ASP 15 Cb 1.33 -0.11 -0.09 0.00 0.22 0.00 0.00 39.33 40.67 2jji h ASP 15 CO 0.51 0.33 0.36 0.00 -1.72 0.00 0.00 179.24 178.72 2jji s ALA 16 N -5.48 -1.56 -0.01 3.45 0.00 -1.26 -4.47 121.76 112.42 2jji s ALA 16 Ca -0.08 0.26 0.07 0.00 0.00 0.00 0.00 51.96 52.21 2jji s ALA 16 Cb 0.18 0.70 -0.02 0.00 0.00 0.00 0.00 23.12 23.98 2jji s ALA 16 CO 0.73 -0.91 -0.22 0.71 0.00 0.00 0.00 175.76 176.06 2jji s TYR 17 N -3.52 2.01 0.12 0.00 1.51 -1.26 -0.83 117.35 115.38 2jji s TYR 17 Ca 0.08 -0.38 0.10 0.00 -1.01 0.00 0.00 57.07 55.86 2jji s TYR 17 Cb -0.02 -1.29 -0.04 0.00 -0.11 0.00 0.00 41.96 40.50 2jji s TYR 17 CO -0.02 -0.03 -0.23 0.96 -1.11 0.00 0.00 175.55 175.12 2jji s ILE 18 N -0.54 2.50 -0.04 2.71 -4.36 0.28 -4.24 121.20 117.51 2jji s ILE 18 Ca 0.09 -1.63 0.01 0.00 -0.26 0.00 0.00 60.65 58.86 2jji s ILE 18 Cb -0.09 -2.12 0.02 0.00 1.25 0.00 0.00 42.46 41.52 2jji s ILE 18 CO -0.01 0.11 -0.04 -0.89 0.24 0.00 0.00 174.94 174.35 2jji s THR 19 N -1.08 0.51 0.21 8.37 2.01 -0.34 -0.97 115.64 124.36 2jji s THR 19 Ca 0.15 -0.13 -0.30 0.00 0.31 0.00 0.00 61.69 61.73 2jji s THR 19 Cb -0.10 -0.52 -0.08 0.00 0.01 0.00 0.00 72.50 71.80 2jji s THR 19 CO 0.07 0.21 1.19 -2.16 -0.69 0.00 0.00 174.62 173.24 2jji s PRO 20 N 0.77 4.51 -0.06 4.92 0.04 -1.26 -1.32 135.00 142.60 2jji s PRO 20 Ca -0.10 1.89 0.02 0.00 0.04 0.00 0.00 61.00 62.85 2jji s PRO 20 Cb -0.13 -3.22 0.01 0.00 0.04 0.00 0.00 34.50 31.20 2jji s PRO 20 CO 0.00 -0.04 -0.13 0.08 0.04 0.00 0.00 177.00 176.95 2jji s VAL 21 N -0.33 1.16 -0.22 -0.36 1.01 0.34 -4.59 120.40 117.41 2jji s VAL 21 Ca 0.51 -0.50 -0.17 0.00 0.00 0.00 0.00 61.98 61.82 2jji s VAL 21 Cb -0.33 -1.05 -0.03 0.00 0.00 0.00 0.00 36.38 34.97 2jji s VAL 21 CO 0.39 0.36 0.47 -1.10 0.00 0.00 0.00 175.10 175.21 2jji s GLN 22 N 0.58 4.13 -0.10 2.72 1.11 -0.11 -1.43 119.66 126.56 2jji s GLN 22 Ca -0.13 0.28 0.03 0.00 0.01 0.00 0.00 55.36 55.56 2jji s GLN 22 Cb -0.15 -3.59 0.00 0.00 -1.01 0.00 0.00 33.01 28.27 2jji s GLN 22 CO 0.04 -0.18 -0.21 0.42 0.01 0.00 0.00 175.29 175.36 2jji s ILE 23 N 1.77 1.86 0.00 1.08 1.01 0.27 -0.67 121.20 126.51 2jji s ILE 23 Ca 0.21 -0.90 0.00 0.00 0.00 0.00 0.00 60.65 59.96 2jji s ILE 23 Cb -0.15 -1.63 0.00 0.00 0.01 0.00 0.00 42.46 40.68 2jji s ILE 23 CO 0.09 0.52 0.00 0.61 0.00 0.00 0.00 174.94 176.16 2jji n GLY 24 N 3.70 -3.17 2.79 6.18 0.00 0.84 -0.94 105.19 114.59 2jji n GLY 24 Ca -0.20 -1.79 -0.26 0.00 0.00 0.00 0.00 46.02 43.77 2jji n GLY 24 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jji s THR 25 N -0.97 0.62 0.84 2.61 2.01 -1.26 -3.05 115.64 116.44 2jji s THR 25 Ca 0.00 -0.33 -0.10 0.00 0.31 0.00 0.00 61.69 61.56 2jji s THR 25 Cb 0.00 -0.92 0.10 0.00 0.01 0.00 0.00 72.50 71.69 2jji s THR 25 CO 0.00 0.05 1.11 -2.84 -0.69 0.00 0.00 174.62 172.25 2jji s PRO 26 N 1.84 1.70 0.30 4.92 0.02 -1.26 -0.48 135.00 142.05 2jji s PRO 26 Ca 0.02 1.30 -0.29 0.00 0.02 0.00 0.00 61.00 62.05 2jji s PRO 26 Cb -0.15 -1.82 -0.10 0.00 0.02 0.00 0.00 34.50 32.45 2jji s PRO 26 CO -0.07 -2.07 1.32 0.00 -0.33 0.00 0.00 177.00 175.84 2jji s ALA 27 N -2.80 3.52 -0.22 -1.55 0.00 -1.17 -4.89 121.76 114.65 2jji s ALA 27 Ca 0.63 1.24 -0.08 0.00 0.00 0.00 0.00 51.96 53.76 2jji s ALA 27 Cb -0.19 -3.48 -0.04 0.00 0.00 0.00 0.00 23.12 19.41 2jji s ALA 27 CO 0.57 -0.63 0.07 -0.65 0.00 0.00 0.00 175.76 175.13 2jji s GLN 28 N -1.37 3.81 -0.27 0.00 -0.21 -0.11 -4.89 119.66 116.62 2jji s GLN 28 Ca 0.51 -0.41 -0.12 0.00 0.02 0.00 0.00 55.36 55.36 2jji s GLN 28 Cb -0.39 -3.29 -0.05 0.00 1.00 0.00 0.00 33.01 30.28 2jji s GLN 28 CO 0.49 0.02 0.24 0.99 -2.12 0.00 0.00 175.29 174.92 2jji s THR 29 N 1.07 5.28 0.11 -0.19 2.01 -1.26 -0.57 115.64 122.09 2jji s THR 29 Ca 0.04 0.31 0.11 0.00 0.31 0.00 0.00 61.69 62.46 2jji s THR 29 Cb -0.14 -3.58 -0.04 0.00 0.01 0.00 0.00 72.50 68.75 2jji s THR 29 CO 0.03 0.24 -0.27 -0.76 -0.69 0.00 0.00 174.62 173.18 2jji s LEU 30 N 1.69 2.28 -0.38 4.42 1.02 -0.51 -4.96 118.68 122.23 2jji s LEU 30 Ca 0.10 -0.71 -0.15 0.00 0.02 0.00 0.00 54.13 53.39 2jji s LEU 30 Cb -0.15 -1.23 0.01 0.00 0.02 0.00 0.00 46.19 44.83 2jji s LEU 30 CO 0.09 0.20 0.31 0.20 0.02 0.00 0.00 176.35 177.17 2jji s ASN 31 N -1.85 6.11 0.16 2.29 0.01 -1.26 -0.50 114.94 119.90 2jji s ASN 31 Ca 0.13 -0.66 0.08 0.00 -0.71 0.00 0.00 52.86 51.71 2jji s ASN 31 Cb -0.10 -2.17 -0.04 0.00 0.41 0.00 0.00 41.25 39.35 2jji s ASN 31 CO 0.05 -0.39 -0.09 -0.76 -1.51 0.00 0.00 177.10 174.40 2jji s LEU 32 N 1.78 3.02 -0.51 0.60 1.43 -0.44 -1.47 118.68 123.10 2jji s LEU 32 Ca 0.07 -0.51 -0.22 0.00 -1.03 0.00 0.00 54.13 52.44 2jji s LEU 32 Cb -0.18 -1.73 0.04 0.00 0.03 0.00 0.00 46.19 44.35 2jji s LEU 32 CO 0.11 0.12 0.76 -0.62 0.23 0.00 0.00 176.35 176.95 2jji s ASP 33 N -2.68 6.30 -0.21 2.29 -1.08 -0.44 -1.19 116.67 119.67 2jji s ASP 33 Ca 0.24 -0.54 -0.29 0.00 -0.52 0.00 0.00 52.55 51.44 2jji s ASP 33 Cb -0.09 -2.36 -0.01 0.00 -1.46 0.00 0.00 42.92 39.00 2jji s ASP 33 CO 0.15 -1.00 1.27 -0.36 0.52 0.00 0.00 175.17 175.76 2jji s PHE 34 N 3.20 2.80 -0.29 -5.34 0.40 -1.26 -0.84 117.98 116.65 2jji s PHE 34 Ca 0.23 0.98 0.02 0.00 -0.60 0.00 0.00 56.93 57.55 2jji s PHE 34 Cb -0.15 -3.62 0.09 0.00 0.51 0.00 0.00 43.02 39.84 2jji s PHE 34 CO 0.17 -1.68 0.03 0.34 0.70 0.00 0.00 175.22 174.77 2jji s ASP 35 N 2.22 4.25 0.00 1.36 2.15 -0.26 -4.23 116.67 122.16 2jji s ASP 35 Ca 0.55 -1.67 0.11 0.00 0.43 0.00 0.00 52.55 51.97 2jji s ASP 35 Cb -0.20 -1.26 0.63 0.00 -0.30 0.00 0.00 42.92 41.79 2jji s ASP 35 CO 0.17 -0.34 1.30 0.35 -0.17 0.00 0.00 175.17 176.48 2jji n THR 36 N 4.56 0.00 0.04 1.71 -2.24 -1.26 -0.55 114.28 116.54 2jji n THR 36 Ca -0.03 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.86 2jji n THR 36 Cb 0.43 -0.26 0.28 0.00 -2.10 0.00 0.00 70.33 68.68 2jji n THR 36 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jji n GLY 37 N 0.51 2.00 3.74 3.38 0.00 -1.26 -3.80 105.19 109.75 2jji n GLY 37 Ca 0.08 -0.74 -0.08 0.00 0.00 0.00 0.00 46.02 45.27 2jji n GLY 37 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2jji s SER 38 N -1.22 -0.08 -0.04 1.61 1.04 -1.19 -4.93 113.70 108.89 2jji s SER 38 Ca 0.43 -0.86 0.10 0.00 0.48 0.00 0.00 55.95 56.10 2jji s SER 38 Cb 0.24 0.70 0.17 0.00 0.10 0.00 0.00 66.02 67.23 2jji s SER 38 CO 0.32 -1.34 1.08 -1.20 0.98 0.00 0.00 173.24 173.08 2jji n SER 39 N -0.66 0.79 -4.40 7.02 7.64 -1.26 -0.74 113.62 122.01 2jji n SER 39 Ca -0.04 -2.36 -0.33 0.00 1.01 0.00 0.00 58.87 57.16 2jji n SER 39 Cb 0.60 -0.29 -0.14 0.00 -1.01 0.00 0.00 64.21 63.37 2jji n SER 39 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 2jji s ASP 40 N -1.73 3.89 -0.46 6.43 1.11 -1.26 -4.44 116.67 120.21 2jji s ASP 40 Ca 0.16 -0.30 -0.15 0.00 0.18 0.00 0.00 52.55 52.44 2jji s ASP 40 Cb 0.16 -1.19 0.06 0.00 1.07 0.00 0.00 42.92 43.02 2jji s ASP 40 CO -0.03 0.25 0.37 -0.22 1.18 0.00 0.00 175.17 176.72 2jji s LEU 41 N -0.17 5.51 0.06 1.23 0.20 -1.26 -1.67 118.68 122.59 2jji s LEU 41 Ca -0.01 -1.23 0.04 0.00 0.69 0.00 0.00 54.13 53.62 2jji s LEU 41 Cb -0.13 -2.18 -0.03 0.00 -0.43 0.00 0.00 46.19 43.42 2jji s LEU 41 CO 0.03 -0.60 -0.12 -1.66 -0.29 0.00 0.00 176.35 173.71 2jji s TRP 42 N 1.65 1.02 0.05 5.38 1.48 -0.51 -0.78 118.94 127.23 2jji s TRP 42 Ca 0.04 -0.47 0.02 0.00 -1.06 0.00 0.00 56.10 54.63 2jji s TRP 42 Cb -0.23 -0.58 -0.03 0.00 -1.16 0.00 0.00 33.47 31.47 2jji s TRP 42 CO 0.07 0.01 -0.07 0.14 -4.06 0.00 0.00 176.95 173.04 2jji s VAL 43 N -1.31 0.53 0.58 -0.66 -7.23 0.26 -1.60 120.40 110.96 2jji s VAL 43 Ca -0.05 -1.25 -0.20 0.00 -1.81 0.00 0.00 61.98 58.67 2jji s VAL 43 Cb -0.10 -0.81 -0.04 0.00 0.56 0.00 0.00 36.38 35.99 2jji s VAL 43 CO 0.02 -0.50 1.30 -0.36 -0.31 0.00 0.00 175.10 175.24 2jji s PHE 44 N -1.88 2.28 0.29 2.82 0.40 -0.57 -2.08 117.98 119.24 2jji s PHE 44 Ca -0.06 1.44 -0.17 0.00 -0.60 0.00 0.00 56.93 57.54 2jji s PHE 44 Cb -0.07 -3.69 0.02 0.00 0.51 0.00 0.00 43.02 39.80 2jji s PHE 44 CO -0.01 -2.70 0.66 -1.54 0.70 0.00 0.00 175.22 172.33 2jji s SER 45 N -1.23 -0.11 0.33 1.36 1.04 -1.26 -1.25 113.70 112.58 2jji s SER 45 Ca 0.76 -0.83 0.24 0.00 0.48 0.00 0.00 55.95 56.60 2jji s SER 45 Cb -0.37 0.71 1.21 0.00 0.10 0.00 0.00 66.02 67.67 2jji s SER 45 CO 0.42 -1.35 1.74 0.77 0.98 0.00 0.00 173.24 175.79 2jji h SER 46 N 2.07 0.00 1.44 7.02 4.64 -1.48 -1.34 113.55 125.90 2jji h SER 46 Ca -0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.09 2jji h SER 46 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 2jji h SER 46 CO 0.30 0.00 -0.22 -0.33 -0.87 0.00 0.00 176.83 175.71 2jji h GLU 47 N 0.00 0.00 -6.70 4.77 5.08 -1.85 -3.47 114.58 112.41 2jji h GLU 47 Ca 0.00 0.00 -0.52 0.00 -1.00 0.00 0.00 59.36 57.84 2jji h GLU 47 Cb 0.14 0.00 0.04 0.00 0.50 0.00 0.00 28.75 29.42 2jji h GLU 47 CO 0.00 0.00 0.65 0.99 -1.00 0.00 0.00 179.01 179.65 2jji s THR 48 N -3.16 3.17 -0.25 1.13 2.01 -0.51 -4.52 115.64 113.51 2jji s THR 48 Ca 0.08 0.98 -0.42 0.00 0.31 0.00 0.00 61.69 62.65 2jji s THR 48 Cb 0.10 -3.63 -0.18 0.00 0.01 0.00 0.00 72.50 68.81 2jji s THR 48 CO 0.66 0.16 1.53 0.41 -0.69 0.00 0.00 174.62 176.68 2jji n THR 49 N 2.42 0.11 -0.28 -0.82 -1.04 -0.46 -4.83 114.28 109.38 2jji n THR 49 Ca 0.05 -0.02 -0.02 0.00 -2.04 0.00 0.00 64.05 62.03 2jji n THR 49 Cb 0.43 -0.73 0.17 0.00 -1.82 0.00 0.00 70.33 68.37 2jji n THR 49 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2jji h ALA 50 N 5.42 1.32 0.00 2.41 0.00 -1.92 -0.38 119.26 126.10 2jji h ALA 50 Ca -0.47 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.35 2jji h ALA 50 Cb 1.36 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.81 2jji h ALA 50 CO 0.89 0.59 0.00 0.66 0.00 0.00 0.00 179.25 181.39 2jji h SER 51 N 1.15 0.00 -0.02 0.00 4.64 -2.02 -2.15 113.55 115.16 2jji h SER 51 Ca 0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.62 2jji h SER 51 Cb -0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.04 2jji h SER 51 CO -0.06 0.00 -0.15 -0.62 -0.87 0.00 0.00 176.83 175.13 2jji n GLU 52 N -2.56 1.90 -3.81 4.77 1.02 -0.16 -5.12 120.64 116.68 2jji n GLU 52 Ca -0.00 -1.54 -0.20 0.00 -0.02 0.00 0.00 57.16 55.39 2jji n GLU 52 Cb 0.14 -1.47 -0.02 0.00 -0.02 0.00 0.00 31.44 30.08 2jji n GLU 52 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2jji s VAL 53 N -2.16 4.85 0.00 2.62 1.01 -0.81 -4.39 120.40 121.52 2jji s VAL 53 Ca 0.26 -1.01 0.00 0.00 0.00 0.00 0.00 61.98 61.23 2jji s VAL 53 Cb 0.19 -3.70 0.00 0.00 0.00 0.00 0.00 36.38 32.87 2jji s VAL 53 CO 0.39 -0.27 0.00 0.00 0.00 0.00 0.00 175.10 175.22 2jji n GLN 56 N -1.48 0.00 -3.02 2.72 3.00 -1.26 -4.99 117.38 112.35 2jji n GLN 56 Ca -0.06 0.00 -0.40 0.00 -0.01 0.00 0.00 57.00 56.53 2jji n GLN 56 Cb 0.57 0.00 -0.05 0.00 0.00 0.00 0.00 30.24 30.77 2jji n GLN 56 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.06 178.05 2jji s THR 57 N -3.13 5.02 0.09 5.09 2.01 -1.26 -5.07 115.64 118.39 2jji s THR 57 Ca 0.00 1.48 0.04 0.00 0.31 0.00 0.00 61.69 63.51 2jji s THR 57 Cb 0.00 -4.06 -0.04 0.00 0.01 0.00 0.00 72.50 68.41 2jji s THR 57 CO 0.00 0.22 0.07 0.27 -0.69 0.00 0.00 174.62 174.48 2jji s ILE 58 N 1.00 4.42 -0.06 1.82 -4.36 -1.26 -4.69 121.20 118.07 2jji s ILE 58 Ca 0.38 -0.84 -0.23 0.00 -0.26 0.00 0.00 60.65 59.69 2jji s ILE 58 Cb -0.18 -3.14 -0.04 0.00 1.25 0.00 0.00 42.46 40.36 2jji s ILE 58 CO 0.18 0.10 0.70 -0.47 0.24 0.00 0.00 174.94 175.69 2jji s TYR 59 N -1.40 3.58 -0.40 1.37 5.04 -0.38 -4.89 117.35 120.27 2jji s TYR 59 Ca 0.29 1.26 -0.02 0.00 -2.44 0.00 0.00 57.07 56.16 2jji s TYR 59 Cb -0.12 -2.80 0.11 0.00 0.35 0.00 0.00 41.96 39.50 2jji s TYR 59 CO 0.21 0.10 0.19 0.99 -1.34 0.00 0.00 175.55 175.70 2jji s THR 60 N 0.76 3.15 0.47 4.34 2.01 -1.26 -1.15 115.64 123.95 2jji s THR 60 Ca 0.38 -2.13 0.12 0.00 0.31 0.00 0.00 61.69 60.37 2jji s THR 60 Cb -0.18 -3.18 0.28 0.00 0.01 0.00 0.00 72.50 69.43 2jji s THR 60 CO 0.18 -0.68 2.10 1.55 -0.69 0.00 0.00 174.62 177.08 2jji h PRO 61 N 7.96 0.26 0.00 4.92 0.13 -1.96 -2.15 132.00 141.14 2jji h PRO 61 Ca -0.11 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.00 2jji h PRO 61 Cb 1.04 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.11 2jji h PRO 61 CO 0.67 0.17 0.00 -1.13 -0.23 0.00 0.00 178.00 177.48 2jji n SER 62 N -4.50 0.00 -1.11 1.44 3.41 -1.26 -1.75 113.62 109.84 2jji n SER 62 Ca 0.01 0.10 0.11 0.00 -0.26 0.00 0.00 58.87 58.83 2jji n SER 62 Cb 0.11 -0.32 0.21 0.00 -0.26 0.00 0.00 64.21 63.94 2jji n SER 62 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2jji n LYS 63 N -1.32 2.46 -3.72 4.33 4.76 -0.81 -4.89 118.16 118.96 2jji n LYS 63 Ca 0.08 -2.26 -0.37 0.00 -2.87 0.00 0.00 58.31 52.89 2jji n LYS 63 Cb 0.16 -1.49 -0.12 0.00 -1.84 0.00 0.00 35.03 31.74 2jji n LYS 63 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2jji s SER 64 N -1.39 5.28 0.53 4.39 0.15 -0.72 -4.34 113.70 117.61 2jji s SER 64 Ca 0.37 -0.21 0.33 0.00 0.70 0.00 0.00 55.95 57.15 2jji s SER 64 Cb 0.22 -1.96 1.37 0.00 -1.71 0.00 0.00 66.02 63.94 2jji s SER 64 CO 0.30 -0.05 1.98 0.71 1.20 0.00 0.00 173.24 177.38 2jji h THR 65 N 5.53 0.00 -0.02 6.45 1.35 -1.07 -2.85 112.91 122.30 2jji h THR 65 Ca -0.37 -0.48 0.00 0.00 -0.55 0.00 0.00 66.41 65.01 2jji h THR 65 Cb 1.17 1.46 0.00 0.00 -1.73 0.00 0.00 68.15 69.05 2jji h THR 65 CO 0.58 0.00 -0.10 0.35 -0.25 0.00 0.00 175.52 176.10 2jji n THR 66 N -3.03 0.00 -2.43 6.82 -2.24 -1.26 -4.95 114.28 107.19 2jji n THR 66 Ca 0.01 -0.37 -0.41 0.00 -2.27 0.00 0.00 64.05 61.01 2jji n THR 66 Cb 0.29 1.12 -0.04 0.00 -2.10 0.00 0.00 70.33 69.60 2jji n THR 66 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2jji s ALA 67 N -2.12 3.42 -0.05 6.98 0.00 -1.08 -4.52 121.76 124.39 2jji s ALA 67 Ca 0.29 0.92 0.03 0.00 0.00 0.00 0.00 51.96 53.20 2jji s ALA 67 Cb 0.20 -3.36 0.01 0.00 0.00 0.00 0.00 23.12 19.96 2jji s ALA 67 CO 0.37 -0.26 -0.11 0.15 0.00 0.00 0.00 175.76 175.91 2jji s LYS 68 N -0.99 1.37 0.11 0.00 1.02 0.02 -4.97 119.74 116.31 2jji s LYS 68 Ca 0.48 -0.37 -0.30 0.00 0.02 0.00 0.00 55.97 55.79 2jji s LYS 68 Cb -0.32 -1.20 -0.07 0.00 -0.52 0.00 0.00 37.83 35.72 2jji s LYS 68 CO 0.40 0.08 1.21 -1.17 -0.92 0.00 0.00 175.35 174.95 2jji s LEU 69 N 0.43 4.40 -0.65 3.17 2.96 -1.26 0.14 118.68 127.88 2jji s LEU 69 Ca -0.09 2.12 -0.23 0.00 -0.22 0.00 0.00 54.13 55.72 2jji s LEU 69 Cb -0.13 -3.59 0.07 0.00 0.50 0.00 0.00 46.19 43.04 2jji s LEU 69 CO 0.02 -0.44 0.96 -0.22 -1.32 0.00 0.00 176.35 175.34 2jji s LEU 70 N 0.57 4.37 0.12 -0.68 2.96 -0.24 -4.86 118.68 120.92 2jji s LEU 70 Ca 0.57 -0.94 -0.32 0.00 -0.22 0.00 0.00 54.13 53.22 2jji s LEU 70 Cb -0.31 -2.45 -0.11 0.00 0.50 0.00 0.00 46.19 43.82 2jji s LEU 70 CO 0.32 -1.42 1.80 -0.24 -1.32 0.00 0.00 176.35 175.49 2jji n SER 71 N 7.67 3.89 -0.04 3.68 2.88 -1.26 -2.50 113.62 127.94 2jji n SER 71 Ca -0.04 1.00 -0.00 0.00 -1.33 0.00 0.00 58.87 58.50 2jji n SER 71 Cb 0.46 -1.52 -0.00 0.00 -0.75 0.00 0.00 64.21 62.39 2jji n SER 71 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2jji n GLY 72 N 4.14 0.47 3.85 0.46 0.00 -1.26 -5.02 105.19 107.83 2jji n GLY 72 Ca 0.18 -0.26 -0.37 0.00 0.00 0.00 0.00 46.02 45.57 2jji n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jji s ALA 73 N -1.95 3.80 0.24 4.61 0.00 -1.04 -4.54 121.76 122.89 2jji s ALA 73 Ca 0.00 -0.54 0.01 0.00 0.00 0.00 0.00 51.96 51.43 2jji s ALA 73 Cb 0.00 -2.11 -0.04 0.00 0.00 0.00 0.00 23.12 20.97 2jji s ALA 73 CO 0.00 0.51 0.12 0.95 0.00 0.00 0.00 175.76 177.34 2jji s THR 74 N -0.81 0.31 0.00 0.00 -4.23 -0.68 -3.93 115.64 106.29 2jji s THR 74 Ca 0.16 -2.00 -0.13 0.00 -1.18 0.00 0.00 61.69 58.55 2jji s THR 74 Cb -0.13 -2.57 0.02 0.00 1.34 0.00 0.00 72.50 71.16 2jji s THR 74 CO 0.05 0.00 0.26 -1.66 -0.54 0.00 0.00 174.62 172.74 2jji s TRP 75 N -3.89 -0.11 -0.19 3.99 1.48 -0.91 -0.81 118.94 118.50 2jji s TRP 75 Ca 0.38 0.10 -0.10 0.00 -1.06 0.00 0.00 56.10 55.42 2jji s TRP 75 Cb 0.07 0.05 0.06 0.00 -1.16 0.00 0.00 33.47 32.50 2jji s TRP 75 CO 0.14 -0.38 0.46 0.45 -4.06 0.00 0.00 176.95 173.55 2jji s SER 76 N -1.48 -0.59 0.03 -2.66 0.15 -1.26 -1.87 113.70 106.03 2jji s SER 76 Ca -0.12 1.01 0.02 0.00 0.70 0.00 0.00 55.95 57.56 2jji s SER 76 Cb -0.05 0.90 -0.02 0.00 -1.71 0.00 0.00 66.02 65.14 2jji s SER 76 CO 0.02 -0.20 -0.08 -0.51 1.20 0.00 0.00 173.24 173.67 2jji s ILE 77 N 1.48 0.54 0.05 6.45 2.07 -0.37 -4.86 121.20 126.56 2jji s ILE 77 Ca -0.09 -0.90 0.05 0.00 -1.41 0.00 0.00 60.65 58.30 2jji s ILE 77 Cb -0.08 -0.57 -0.02 0.00 0.13 0.00 0.00 42.46 41.91 2jji s ILE 77 CO -0.14 -0.26 -0.14 -0.94 -1.91 0.00 0.00 174.94 171.55 2jji s SER 78 N -1.26 1.69 0.43 4.50 1.04 -1.26 -2.07 113.70 116.77 2jji s SER 78 Ca -0.07 -0.49 0.07 0.00 0.48 0.00 0.00 55.95 55.94 2jji s SER 78 Cb -0.08 -0.10 -0.02 0.00 0.10 0.00 0.00 66.02 65.92 2jji s SER 78 CO 0.00 0.01 0.35 -0.31 0.98 0.00 0.00 173.24 174.28 2jji s TYR 79 N -0.93 2.56 0.45 5.02 2.02 0.24 -4.99 117.35 121.72 2jji s TYR 79 Ca 0.01 -0.55 0.20 0.00 -0.37 0.00 0.00 57.07 56.36 2jji s TYR 79 Cb -0.08 -2.11 1.24 0.00 -0.40 0.00 0.00 41.96 40.61 2jji s TYR 79 CO 0.01 -0.12 2.05 0.78 -1.57 0.00 0.00 175.55 176.71 2jji h GLY 80 N 1.06 0.00 0.18 0.71 0.00 -2.00 0.20 103.07 103.22 2jji h GLY 80 Ca -0.41 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.92 2jji h GLY 80 CO 0.59 0.00 0.00 2.09 0.00 0.00 0.00 176.54 179.22 2jji n ASP 81 N -4.06 0.53 0.00 0.19 5.68 -1.26 -4.91 116.55 112.73 2jji n ASP 81 Ca -0.02 -1.47 0.00 0.00 -0.50 0.00 0.00 54.79 52.80 2jji n ASP 81 Cb 0.22 -0.03 0.00 0.00 -1.14 0.00 0.00 41.12 40.17 2jji n ASP 81 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2jji n GLY 82 N 0.92 0.69 3.80 6.12 0.00 0.06 -5.06 105.19 111.72 2jji n GLY 82 Ca 0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.86 2jji n GLY 82 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2jji s SER 83 N -2.72 5.24 0.20 1.61 1.04 -1.26 -4.72 113.70 113.08 2jji s SER 83 Ca 0.00 1.75 -0.17 0.00 0.48 0.00 0.00 55.95 58.01 2jji s SER 83 Cb 0.00 -2.52 0.03 0.00 0.10 0.00 0.00 66.02 63.63 2jji s SER 83 CO 0.00 -1.54 0.52 -0.94 0.98 0.00 0.00 173.24 172.26 2jji s SER 84 N -3.34 -0.26 0.12 7.02 1.04 -1.26 -0.59 113.70 116.43 2jji s SER 84 Ca 0.61 -0.49 -0.25 0.00 0.48 0.00 0.00 55.95 56.30 2jji s SER 84 Cb -0.16 0.58 0.07 0.00 0.10 0.00 0.00 66.02 66.61 2jji s SER 84 CO 0.50 -1.06 0.79 -0.94 0.98 0.00 0.00 173.24 173.51 2jji s SER 85 N -2.88 -0.37 0.17 7.02 1.04 -0.88 -1.08 113.70 116.73 2jji s SER 85 Ca 0.09 -0.18 -0.22 0.00 0.48 0.00 0.00 55.95 56.13 2jji s SER 85 Cb -0.01 0.52 0.06 0.00 0.10 0.00 0.00 66.02 66.70 2jji s SER 85 CO -0.02 -0.89 0.60 -0.94 0.98 0.00 0.00 173.24 172.96 2jji s SER 86 N -2.72 -0.51 0.00 7.02 1.04 -0.99 -1.24 113.70 116.30 2jji s SER 86 Ca 0.06 -0.09 0.00 0.00 0.48 0.00 0.00 55.95 56.40 2jji s SER 86 Cb -0.02 0.60 0.00 0.00 0.10 0.00 0.00 66.02 66.71 2jji s SER 86 CO -0.05 -1.00 0.00 0.61 0.98 0.00 0.00 173.24 173.77 2jji n GLY 87 N -0.38 -0.69 2.61 7.32 0.00 -0.78 -0.16 105.19 113.11 2jji n GLY 87 Ca -0.16 -0.47 -0.23 0.00 0.00 0.00 0.00 46.02 45.17 2jji n GLY 87 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2jji n ASP 88 N 0.00 2.94 -3.93 1.61 5.68 -0.76 -2.15 116.55 119.94 2jji n ASP 88 Ca 0.00 -2.57 -0.20 0.00 -0.50 0.00 0.00 54.79 51.52 2jji n ASP 88 Cb 0.00 0.23 -0.16 0.00 -1.14 0.00 0.00 41.12 40.05 2jji n ASP 88 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 2jji s VAL 89 N -2.28 0.63 0.23 2.12 1.01 -1.25 -0.75 120.40 120.11 2jji s VAL 89 Ca 0.02 -0.20 0.10 0.00 0.00 0.00 0.00 61.98 61.90 2jji s VAL 89 Cb -0.00 -0.62 -0.04 0.00 0.00 0.00 0.00 36.38 35.71 2jji s VAL 89 CO 0.01 0.24 -0.12 -0.31 0.00 0.00 0.00 175.10 174.92 2jji s TYR 90 N 0.71 2.52 0.06 5.22 1.51 -0.67 -1.07 117.35 125.63 2jji s TYR 90 Ca -0.10 -0.27 0.02 0.00 -1.01 0.00 0.00 57.07 55.71 2jji s TYR 90 Cb -0.13 -1.17 -0.04 0.00 -0.11 0.00 0.00 41.96 40.51 2jji s TYR 90 CO 0.01 0.59 0.09 0.95 -1.11 0.00 0.00 175.55 176.08 2jji s THR 91 N -2.05 4.65 0.25 -0.71 -4.23 0.12 0.12 115.64 113.79 2jji s THR 91 Ca 0.27 -0.67 -0.22 0.00 -1.18 0.00 0.00 61.69 59.89 2jji s THR 91 Cb -0.07 -3.22 0.04 0.00 1.34 0.00 0.00 72.50 70.58 2jji s THR 91 CO 0.16 0.17 0.80 -0.62 -0.54 0.00 0.00 174.62 174.59 2jji s ASP 92 N -2.29 -0.21 0.03 3.99 -1.08 -0.14 -0.80 116.67 116.17 2jji s ASP 92 Ca 0.29 -0.58 -0.30 0.00 -0.52 0.00 0.00 52.55 51.44 2jji s ASP 92 Cb -0.12 0.66 -0.04 0.00 -1.46 0.00 0.00 42.92 41.95 2jji s ASP 92 CO 0.21 -1.23 1.10 -0.89 0.52 0.00 0.00 175.17 174.88 2jji s THR 93 N -3.60 4.43 -0.06 1.71 2.01 -1.26 -1.61 115.64 117.25 2jji s THR 93 Ca 0.12 1.74 0.02 0.00 0.31 0.00 0.00 61.69 63.89 2jji s THR 93 Cb -0.04 -4.12 0.01 0.00 0.01 0.00 0.00 72.50 68.36 2jji s THR 93 CO 0.06 0.13 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.30 2jji s VAL 94 N 1.07 1.17 -0.05 3.82 1.01 -0.32 -0.11 120.40 126.98 2jji s VAL 94 Ca 0.55 -0.51 0.04 0.00 0.00 0.00 0.00 61.98 62.07 2jji s VAL 94 Cb -0.25 -1.06 -0.00 0.00 0.00 0.00 0.00 36.38 35.06 2jji s VAL 94 CO 0.28 0.36 -0.18 -0.44 0.00 0.00 0.00 175.10 175.12 2jji s SER 95 N 0.59 2.31 -0.20 3.32 0.01 0.15 -0.87 113.70 119.01 2jji s SER 95 Ca -0.13 -0.38 0.01 0.00 1.31 0.00 0.00 55.95 56.75 2jji s SER 95 Cb -0.15 -0.67 0.04 0.00 0.21 0.00 0.00 66.02 65.45 2jji s SER 95 CO 0.04 0.16 -0.10 -0.69 0.41 0.00 0.00 173.24 173.06 2jji s VAL 96 N 0.05 1.64 -1.80 3.43 1.01 -0.37 -0.94 120.40 123.42 2jji s VAL 96 Ca -0.05 -1.03 0.00 0.00 0.00 0.00 0.00 61.98 60.91 2jji s VAL 96 Cb -0.12 -1.73 0.00 0.00 0.00 0.00 0.00 36.38 34.53 2jji s VAL 96 CO 0.03 0.15 0.00 0.61 0.00 0.00 0.00 175.10 175.89 2jji n GLY 97 N 4.68 0.42 0.52 4.51 0.00 -1.26 -1.08 105.19 112.98 2jji n GLY 97 Ca -0.14 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.80 2jji n GLY 97 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jji n GLY 98 N -0.87 0.54 3.59 -0.02 0.00 -1.26 -1.88 105.19 105.29 2jji n GLY 98 Ca -0.22 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.41 2jji n GLY 98 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2jji s LEU 99 N 0.00 4.11 -0.12 0.99 2.96 -0.24 -4.88 118.68 121.50 2jji s LEU 99 Ca 0.00 0.23 -0.02 0.00 -0.22 0.00 0.00 54.13 54.12 2jji s LEU 99 Cb 0.00 -2.46 -0.03 0.00 0.50 0.00 0.00 46.19 44.20 2jji s LEU 99 CO 0.00 -0.25 -0.04 -0.89 -1.32 0.00 0.00 176.35 173.85 2jji s THR 100 N 2.13 3.87 -0.13 3.68 2.01 -1.26 -1.23 115.64 124.71 2jji s THR 100 Ca 0.16 -0.39 0.03 0.00 0.31 0.00 0.00 61.69 61.80 2jji s THR 100 Cb -0.16 -2.65 0.01 0.00 0.01 0.00 0.00 72.50 69.71 2jji s THR 100 CO 0.10 0.55 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.68 2jji s VAL 101 N -0.21 1.97 0.21 3.82 1.01 -0.05 -5.00 120.40 122.16 2jji s VAL 101 Ca 0.04 -0.94 -0.07 0.00 0.00 0.00 0.00 61.98 61.01 2jji s VAL 101 Cb -0.13 -1.74 -0.06 0.00 0.00 0.00 0.00 36.38 34.45 2jji s VAL 101 CO 0.02 0.54 0.49 0.42 0.00 0.00 0.00 175.10 176.57 2jji s THR 102 N 0.74 5.03 -0.64 3.92 -4.23 -1.26 -1.18 115.64 118.01 2jji s THR 102 Ca -0.10 0.25 0.00 0.00 -1.18 0.00 0.00 61.69 60.67 2jji s THR 102 Cb -0.16 -3.64 0.00 0.00 1.34 0.00 0.00 72.50 70.04 2jji s THR 102 CO 0.00 -0.07 0.00 0.61 -0.54 0.00 0.00 174.62 174.63 2jji n GLY 103 N -0.18 0.84 3.73 3.99 0.00 -1.20 -4.95 105.19 107.43 2jji n GLY 103 Ca -0.01 -0.78 -0.41 0.00 0.00 0.00 0.00 46.02 44.81 2jji n GLY 103 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2jji s GLN 104 N -2.52 4.50 -0.13 1.61 2.00 -0.63 -4.69 119.66 119.79 2jji s GLN 104 Ca 0.00 1.77 -0.29 0.00 -2.00 0.00 0.00 55.36 54.84 2jji s GLN 104 Cb 0.00 -3.30 -0.04 0.00 0.80 0.00 0.00 33.01 30.46 2jji s GLN 104 CO 0.00 -0.10 1.70 0.00 -0.50 0.00 0.00 175.29 176.39 2jji s ALA 105 N 0.36 3.41 -0.32 1.58 0.00 -1.26 -0.96 121.76 124.56 2jji s ALA 105 Ca 0.54 0.75 -0.05 0.00 0.00 0.00 0.00 51.96 53.20 2jji s ALA 105 Cb -0.30 -3.82 0.04 0.00 0.00 0.00 0.00 23.12 19.04 2jji s ALA 105 CO 0.33 -1.74 0.07 0.08 0.00 0.00 0.00 175.76 174.49 2jji s VAL 106 N 4.86 3.54 -0.30 0.00 1.01 0.12 -4.66 120.40 124.97 2jji s VAL 106 Ca 0.75 -1.15 -0.25 0.00 0.00 0.00 0.00 61.98 61.33 2jji s VAL 106 Cb -0.30 -2.98 0.00 0.00 0.00 0.00 0.00 36.38 33.10 2jji s VAL 106 CO 0.30 -0.12 0.87 -1.61 0.00 0.00 0.00 175.10 174.54 2jji s GLU 107 N 1.37 4.02 -0.26 2.72 2.02 0.04 -1.68 118.70 126.94 2jji s GLU 107 Ca -0.02 0.76 -0.16 0.00 0.02 0.00 0.00 54.97 55.57 2jji s GLU 107 Cb -0.19 -3.72 -0.03 0.00 0.10 0.00 0.00 34.13 30.29 2jji s GLU 107 CO 0.01 -0.71 0.43 0.45 0.02 0.00 0.00 175.26 175.47 2jji s SER 108 N 1.58 6.35 -0.02 -0.19 0.15 0.07 -0.58 113.70 121.06 2jji s SER 108 Ca 0.36 0.41 -0.30 0.00 0.70 0.00 0.00 55.95 57.12 2jji s SER 108 Cb -0.14 -2.24 -0.05 0.00 -1.71 0.00 0.00 66.02 61.88 2jji s SER 108 CO 0.12 -0.21 1.37 0.00 1.20 0.00 0.00 173.24 175.72 2jji s ALA 109 N 2.07 3.57 -0.01 5.45 0.00 -0.88 -1.83 121.76 130.13 2jji s ALA 109 Ca 0.18 0.81 0.10 0.00 0.00 0.00 0.00 51.96 53.05 2jji s ALA 109 Cb -0.16 -3.59 -0.23 0.00 0.00 0.00 0.00 23.12 19.14 2jji s ALA 109 CO 0.09 -0.93 0.81 0.87 0.00 0.00 0.00 175.76 176.60 2jji h LYS 110 N 7.89 0.02 -3.59 0.00 1.57 -0.79 -2.68 116.57 118.99 2jji h LYS 110 Ca -0.36 -0.03 -0.18 0.00 -1.87 0.00 0.00 60.65 58.21 2jji h LYS 110 Cb 1.17 0.01 -0.24 0.00 0.08 0.00 0.00 32.23 33.25 2jji h LYS 110 CO 0.91 0.65 -0.59 0.15 -0.57 0.00 0.00 179.45 179.99 2jji s LYS 111 N -2.62 0.24 0.06 3.15 1.02 -1.12 -1.36 119.74 119.11 2jji s LYS 111 Ca -0.04 -0.13 0.03 0.00 0.02 0.00 0.00 55.97 55.85 2jji s LYS 111 Cb 0.08 0.10 -0.03 0.00 -0.52 0.00 0.00 37.83 37.47 2jji s LYS 111 CO 0.82 -0.05 -0.09 0.14 -0.92 0.00 0.00 175.35 175.26 2jji s VAL 112 N -0.57 0.68 0.85 3.17 -7.23 -1.26 -2.34 120.40 113.69 2jji s VAL 112 Ca -0.06 -1.26 -0.12 0.00 -1.81 0.00 0.00 61.98 58.72 2jji s VAL 112 Cb -0.04 -0.87 0.10 0.00 0.56 0.00 0.00 36.38 36.13 2jji s VAL 112 CO 0.00 -0.43 1.13 -0.94 -0.31 0.00 0.00 175.10 174.55 2jji s SER 113 N -1.85 4.10 0.31 4.85 1.04 -0.24 -4.83 113.70 117.08 2jji s SER 113 Ca -0.05 1.07 0.01 0.00 0.48 0.00 0.00 55.95 57.47 2jji s SER 113 Cb -0.08 -1.71 0.56 0.00 0.10 0.00 0.00 66.02 64.89 2jji s SER 113 CO 0.00 -2.19 1.92 0.28 0.98 0.00 0.00 173.24 174.23 2jji h SER 114 N -1.25 0.87 -0.90 7.02 0.02 -1.98 -1.85 113.55 115.49 2jji h SER 114 Ca -0.48 0.00 0.03 0.00 -0.84 0.00 0.00 61.79 60.50 2jji h SER 114 Cb 1.30 -0.18 -0.05 0.00 0.14 0.00 0.00 62.40 63.61 2jji h SER 114 CO 0.62 0.56 0.59 0.77 -1.14 0.00 0.00 176.83 178.23 2jji h SER 115 N 0.99 0.98 -0.02 3.07 4.64 -1.97 -0.49 113.55 120.75 2jji h SER 115 Ca 0.37 -0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.67 2jji h SER 115 Cb 0.19 -0.23 -0.00 0.00 -0.31 0.00 0.00 62.40 62.05 2jji h SER 115 CO -0.13 0.67 -0.01 -0.26 -0.87 0.00 0.00 176.83 176.23 2jji h PHE 116 N 1.13 0.05 -0.75 4.77 0.04 -1.72 -2.82 116.94 117.65 2jji h PHE 116 Ca 0.35 -0.01 0.13 0.00 2.80 0.00 0.00 57.97 61.24 2jji h PHE 116 Cb 0.00 -0.01 -0.09 0.00 2.20 0.00 0.00 35.95 38.05 2jji h PHE 116 CO -0.00 0.45 0.33 1.15 -0.60 0.00 0.00 178.31 179.64 2jji h THR 117 N -0.36 0.72 0.00 -1.55 2.02 -1.09 -2.59 112.91 110.07 2jji h THR 117 Ca 0.00 -0.17 0.00 0.00 0.77 0.00 0.00 66.41 67.01 2jji h THR 117 Cb 0.43 0.17 0.00 0.00 -1.74 0.00 0.00 68.15 67.01 2jji h THR 117 CO 0.00 0.09 0.00 -0.33 0.37 0.00 0.00 175.52 175.66 2jji h GLU 118 N 0.51 0.00 -3.94 6.66 5.08 -0.99 -3.40 114.58 118.49 2jji h GLU 118 Ca 0.40 0.00 -0.77 0.00 -1.00 0.00 0.00 59.36 57.99 2jji h GLU 118 Cb 0.56 0.00 -0.26 0.00 0.50 0.00 0.00 28.75 29.56 2jji h GLU 118 CO -0.36 0.00 -0.06 0.34 -1.00 0.00 0.00 179.01 177.93 2jji s ASP 119 N -4.71 6.45 0.24 1.42 2.15 -0.98 -4.92 116.67 116.33 2jji s ASP 119 Ca 0.05 -2.32 0.23 0.00 0.43 0.00 0.00 52.55 50.94 2jji s ASP 119 Cb 0.09 -2.19 0.96 0.00 -0.30 0.00 0.00 42.92 41.49 2jji s ASP 119 CO 0.48 -0.68 1.70 -1.54 -0.17 0.00 0.00 175.17 174.95 2jji n SER 120 N 4.49 0.63 0.03 -0.34 3.41 -1.26 -3.18 113.62 117.41 2jji n SER 120 Ca 0.02 0.66 0.12 0.00 -0.26 0.00 0.00 58.87 59.40 2jji n SER 120 Cb 0.44 -0.79 0.17 0.00 -0.26 0.00 0.00 64.21 63.76 2jji n SER 120 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2jji n THR 121 N -2.20 0.20 -3.89 6.66 -2.24 -1.26 -4.14 114.28 107.41 2jji n THR 121 Ca 0.02 -0.18 -0.35 0.00 -2.27 0.00 0.00 64.05 61.27 2jji n THR 121 Cb 0.23 0.07 -0.14 0.00 -2.10 0.00 0.00 70.33 68.39 2jji n THR 121 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2jji s ILE 122 N -3.12 3.38 -2.14 2.28 1.01 -1.19 -4.88 121.20 116.54 2jji s ILE 122 Ca 0.07 -0.67 0.25 0.00 0.00 0.00 0.00 60.65 60.30 2jji s ILE 122 Cb 0.15 -2.63 0.23 0.00 0.01 0.00 0.00 42.46 40.22 2jji s ILE 122 CO 0.73 0.29 1.42 0.47 0.00 0.00 0.00 174.94 177.85 2jji n ASP 123 N 4.78 1.67 0.00 3.58 8.00 -0.54 -4.94 116.55 129.10 2jji n ASP 123 Ca -0.17 -1.33 0.00 0.00 0.71 0.00 0.00 54.79 54.00 2jji n ASP 123 Cb 0.49 0.19 0.00 0.00 -0.02 0.00 0.00 41.12 41.78 2jji n ASP 123 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jji n GLY 124 N 1.33 -1.39 3.23 0.44 0.00 -1.25 -1.51 105.19 106.04 2jji n GLY 124 Ca 0.13 -1.35 -0.26 0.00 0.00 0.00 0.00 46.02 44.54 2jji n GLY 124 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jji s LEU 125 N 0.00 2.09 -0.29 0.99 1.02 -0.62 -1.33 118.68 120.55 2jji s LEU 125 Ca 0.00 -0.43 -0.00 0.00 0.02 0.00 0.00 54.13 53.72 2jji s LEU 125 Cb 0.00 -1.01 0.05 0.00 0.02 0.00 0.00 46.19 45.25 2jji s LEU 125 CO 0.00 0.21 -0.03 -0.22 0.02 0.00 0.00 176.35 176.33 2jji s LEU 126 N -0.77 3.77 0.20 1.79 0.20 -0.02 -1.42 118.68 122.42 2jji s LEU 126 Ca 0.08 -1.32 -0.24 0.00 0.69 0.00 0.00 54.13 53.33 2jji s LEU 126 Cb -0.08 -1.66 -0.08 0.00 -0.43 0.00 0.00 46.19 43.93 2jji s LEU 126 CO 0.00 -0.24 0.78 -0.83 -0.29 0.00 0.00 176.35 175.78 2jji s GLY 127 N 1.21 2.83 -0.03 7.98 0.00 -0.67 -1.10 107.32 117.53 2jji s GLY 127 Ca -0.06 0.33 0.05 0.00 0.00 0.00 0.00 44.72 45.04 2jji s GLY 127 CO -0.02 0.79 0.94 1.04 0.00 0.00 0.00 173.10 175.85 2jji n LEU 128 N 1.23 0.85 0.00 0.66 4.77 0.29 -4.43 117.00 120.36 2jji n LEU 128 Ca -0.04 -1.47 0.00 0.00 -0.03 0.00 0.00 56.01 54.47 2jji n LEU 128 Cb 0.49 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.47 2jji n LEU 128 CO 0.45 0.35 0.00 0.00 -1.33 0.00 0.00 177.39 176.86 2jji n ALA 129 N -0.44 0.00 -1.93 -1.18 0.00 0.08 -4.76 120.51 112.29 2jji n ALA 129 Ca 0.04 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.16 2jji n ALA 129 Cb 0.59 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.99 2jji n ALA 129 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2jji s PHE 130 N -0.51 3.38 -0.54 0.00 0.08 -0.42 -4.80 117.98 115.17 2jji s PHE 130 Ca 0.00 1.42 0.21 0.00 0.12 0.00 0.00 56.93 58.69 2jji s PHE 130 Cb 0.00 -2.72 0.92 0.00 -0.57 0.00 0.00 43.02 40.65 2jji s PHE 130 CO 0.00 -0.15 1.65 0.43 -0.10 0.00 0.00 175.22 177.05 2jji n SER 131 N -0.94 0.54 0.24 1.36 7.64 -1.26 -1.77 113.62 119.42 2jji n SER 131 Ca 0.06 0.65 0.16 0.00 1.01 0.00 0.00 58.87 60.75 2jji n SER 131 Cb 0.54 -0.76 0.84 0.00 -1.01 0.00 0.00 64.21 63.82 2jji n SER 131 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jji h THR 132 N 0.00 0.00 -0.01 0.44 1.03 -1.91 -1.49 112.91 110.97 2jji h THR 132 Ca 0.00 -0.04 0.00 0.00 -0.01 0.00 0.00 66.41 66.36 2jji h THR 132 Cb 0.29 0.77 0.00 0.00 -1.07 0.00 0.00 68.15 68.14 2jji h THR 132 CO 0.00 0.00 -0.16 0.18 -0.01 0.00 0.00 175.52 175.53 2jji n LEU 133 N -2.63 1.65 -4.77 0.00 4.77 -0.73 -4.94 117.00 110.35 2jji n LEU 133 Ca -0.02 -0.53 -0.40 0.00 -0.03 0.00 0.00 56.01 55.03 2jji n LEU 133 Cb 0.07 -0.04 -0.01 0.00 -2.33 0.00 0.00 43.42 41.11 2jji n LEU 133 CO 0.15 0.29 1.03 0.21 -1.33 0.00 0.00 177.39 177.74 2jji s ASN 134 N -2.24 6.43 0.00 -1.43 2.47 -0.56 -4.62 114.94 114.99 2jji s ASN 134 Ca 0.29 2.82 0.23 0.00 0.42 0.00 0.00 52.86 56.62 2jji s ASN 134 Cb 0.20 -2.65 0.41 0.00 -1.45 0.00 0.00 41.25 37.76 2jji s ASN 134 CO 0.43 -0.78 1.39 0.35 -3.72 0.00 0.00 177.10 174.77 2jji n THR 135 N 0.43 0.39 -2.08 -5.21 -2.24 -1.26 -4.87 114.28 99.43 2jji n THR 135 Ca 0.02 -0.67 -0.41 0.00 -2.27 0.00 0.00 64.05 60.72 2jji n THR 135 Cb 0.41 1.04 -0.02 0.00 -2.10 0.00 0.00 70.33 69.66 2jji n THR 135 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2jji s VAL 136 N -1.61 2.75 0.06 2.28 1.01 -1.26 -4.05 120.40 119.57 2jji s VAL 136 Ca 0.37 0.68 0.06 0.00 0.00 0.00 0.00 61.98 63.09 2jji s VAL 136 Cb 0.22 -3.43 -0.03 0.00 0.00 0.00 0.00 36.38 33.14 2jji s VAL 136 CO 0.31 0.13 -0.17 -0.55 0.00 0.00 0.00 175.10 174.82 2jji s SER 137 N -0.03 2.08 0.40 3.32 0.15 0.00 -3.31 113.70 116.31 2jji s SER 137 Ca 0.54 -0.57 0.23 0.00 0.70 0.00 0.00 55.95 56.85 2jji s SER 137 Cb -0.40 -0.12 0.31 0.00 -1.71 0.00 0.00 66.02 64.10 2jji s SER 137 CO 0.47 0.04 1.54 1.55 1.20 0.00 0.00 173.24 178.04 2jji h PRO 138 N 4.54 0.00 -5.13 5.44 0.13 -1.86 -1.82 132.00 133.30 2jji h PRO 138 Ca -0.42 0.00 -0.65 0.00 -0.87 0.00 0.00 66.00 64.06 2jji h PRO 138 Cb 1.18 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 32.07 2jji h PRO 138 CO 0.42 0.00 -0.68 0.99 -0.23 0.00 0.00 178.00 178.50 2jji s THR 139 N -3.23 3.80 0.58 1.56 2.01 -1.26 -5.10 115.64 114.00 2jji s THR 139 Ca 0.06 -0.37 -0.19 0.00 0.31 0.00 0.00 61.69 61.51 2jji s THR 139 Cb 0.06 -2.71 -0.04 0.00 0.01 0.00 0.00 72.50 69.82 2jji s THR 139 CO 0.68 0.44 1.19 -1.10 -0.69 0.00 0.00 174.62 175.14 2jji s GLN 140 N 0.99 3.06 0.03 4.92 -0.21 -1.21 -4.76 119.66 122.48 2jji s GLN 140 Ca 0.01 1.78 0.01 0.00 0.02 0.00 0.00 55.36 57.18 2jji s GLN 140 Cb -0.14 -1.95 -0.04 0.00 1.00 0.00 0.00 33.01 31.88 2jji s GLN 140 CO 0.01 -1.12 0.06 -0.65 -2.12 0.00 0.00 175.29 171.47 2jji s GLN 141 N -3.32 2.92 0.43 2.91 -1.52 -1.26 -5.03 119.66 114.78 2jji s GLN 141 Ca 0.76 -0.60 -0.22 0.00 -1.95 0.00 0.00 55.36 53.35 2jji s GLN 141 Cb -0.29 -2.76 -0.09 0.00 -0.22 0.00 0.00 33.01 29.65 2jji s GLN 141 CO 0.32 0.61 1.03 0.15 -0.25 0.00 0.00 175.29 177.14 2jji s LYS 142 N -1.97 4.07 0.86 2.91 1.02 -1.26 -4.76 119.74 120.61 2jji s LYS 142 Ca 0.25 1.40 -0.12 0.00 0.02 0.00 0.00 55.97 57.52 2jji s LYS 142 Cb -0.12 -2.36 0.10 0.00 -0.52 0.00 0.00 37.83 34.93 2jji s LYS 142 CO 0.16 -0.20 1.10 0.95 -0.92 0.00 0.00 175.35 176.44 2jji s THR 143 N -1.83 2.74 0.26 2.17 -4.23 -1.26 -4.68 115.64 108.81 2jji s THR 143 Ca 0.61 0.24 -0.02 0.00 -1.18 0.00 0.00 61.69 61.34 2jji s THR 143 Cb -0.18 -2.89 0.24 0.00 1.34 0.00 0.00 72.50 71.01 2jji s THR 143 CO 0.23 -0.31 1.80 0.15 -0.54 0.00 0.00 174.62 175.94 2jji h PHE 144 N -1.34 0.90 -0.36 3.99 3.57 -1.94 -1.28 116.94 120.47 2jji h PHE 144 Ca -0.49 0.03 -0.08 0.00 3.53 0.00 0.00 57.97 60.97 2jji h PHE 144 Cb 1.29 -0.27 -0.01 0.00 2.79 0.00 0.00 35.95 39.75 2jji h PHE 144 CO 0.42 0.31 -0.07 0.35 -2.23 0.00 0.00 178.31 177.09 2jji h PHE 145 N 0.77 0.77 -0.59 0.41 3.57 -1.92 -1.59 116.94 118.36 2jji h PHE 145 Ca 0.45 -0.16 0.01 0.00 3.53 0.00 0.00 57.97 61.80 2jji h PHE 145 Cb 0.51 -0.19 -0.03 0.00 2.79 0.00 0.00 35.95 39.03 2jji h PHE 145 CO -0.06 0.83 0.38 -0.44 -2.23 0.00 0.00 178.31 176.79 2jji h ASP 146 N 0.49 0.64 0.76 0.41 5.19 -1.84 -1.74 116.42 120.33 2jji h ASP 146 Ca 0.09 -0.01 -0.07 0.00 -0.62 0.00 0.00 57.03 56.43 2jji h ASP 146 Cb 0.57 -0.15 -0.01 0.00 0.18 0.00 0.00 39.33 39.92 2jji h ASP 146 CO 0.03 0.46 -0.33 0.78 -3.12 0.00 0.00 179.24 177.06 2jji h ASN 147 N 0.76 0.00 1.40 6.45 -0.26 -1.01 -3.15 115.58 119.78 2jji h ASN 147 Ca 0.23 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.97 2jji h ASN 147 Cb -0.05 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.21 2jji h ASN 147 CO -0.07 0.33 -0.46 0.00 -1.06 0.00 0.00 177.43 176.16 2jji h ALA 148 N 1.67 0.75 -0.79 -0.83 0.00 -0.53 -3.39 119.26 116.15 2jji h ALA 148 Ca -0.00 0.00 0.07 0.00 0.00 0.00 0.00 54.91 54.97 2jji h ALA 148 Cb 0.79 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.53 2jji h ALA 148 CO 0.04 0.00 0.52 0.87 0.00 0.00 0.00 179.25 180.68 2jji h LYS 149 N 0.00 0.82 -0.05 0.00 1.57 -1.30 -0.94 116.57 116.68 2jji h LYS 149 Ca 0.00 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 2jji h LYS 149 Cb 0.93 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 33.05 2jji h LYS 149 CO 0.00 0.54 -0.05 0.00 -0.57 0.00 0.00 179.45 179.38 2jji h ALA 150 N 1.57 1.84 0.00 3.86 0.00 -1.80 -2.91 119.26 121.82 2jji h ALA 150 Ca 0.34 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 55.15 2jji h ALA 150 Cb 0.25 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 2jji h ALA 150 CO -0.12 0.13 -1.35 0.43 0.00 0.00 0.00 179.25 178.34 2jji n SER 151 N -4.44 0.60 -4.77 0.00 7.64 -0.42 -4.98 113.62 107.26 2jji n SER 151 Ca -0.02 0.24 -0.39 0.00 1.01 0.00 0.00 58.87 59.71 2jji n SER 151 Cb 0.15 0.85 -0.01 0.00 -1.01 0.00 0.00 64.21 64.19 2jji n SER 151 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2jji s LEU 152 N -5.18 4.17 0.38 -3.43 1.43 -0.82 0.05 118.68 115.28 2jji s LEU 152 Ca -0.03 2.51 0.08 0.00 -1.03 0.00 0.00 54.13 55.66 2jji s LEU 152 Cb 0.11 -4.00 0.81 0.00 0.03 0.00 0.00 46.19 43.14 2jji s LEU 152 CO 0.83 -0.83 1.96 0.44 0.23 0.00 0.00 176.35 178.97 2jji h ASP 153 N 2.53 0.59 -4.08 2.29 5.19 -1.42 -3.42 116.42 118.10 2jji h ASP 153 Ca -0.49 0.01 -0.15 0.00 -0.62 0.00 0.00 57.03 55.77 2jji h ASP 153 Cb 1.25 -0.12 -0.24 0.00 0.18 0.00 0.00 39.33 40.39 2jji h ASP 153 CO 0.62 0.37 -0.40 -0.55 -3.12 0.00 0.00 179.24 176.16 2jji s SER 154 N -6.21 -0.23 -1.49 6.45 0.15 -1.08 -5.00 113.70 106.28 2jji s SER 154 Ca -0.09 0.40 -0.12 0.00 0.70 0.00 0.00 55.95 56.84 2jji s SER 154 Cb 0.19 0.48 0.01 0.00 -1.71 0.00 0.00 66.02 65.00 2jji s SER 154 CO 0.77 -0.16 2.43 -0.81 1.20 0.00 0.00 173.24 176.66 2jji n PRO 155 N 2.59 3.23 -4.05 5.44 -0.04 -1.26 -4.11 135.00 136.80 2jji n PRO 155 Ca -0.15 -2.59 -0.09 0.00 -0.04 0.00 0.00 63.50 60.64 2jji n PRO 155 Cb 0.58 -3.09 -0.11 0.00 -0.04 0.00 0.00 33.50 30.84 2jji n PRO 155 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2jji s VAL 156 N 2.51 0.25 0.09 0.52 -7.23 -1.26 0.06 120.40 115.33 2jji s VAL 156 Ca 0.54 -1.36 0.03 0.00 -1.81 0.00 0.00 61.98 59.37 2jji s VAL 156 Cb 0.15 -0.90 -0.04 0.00 0.56 0.00 0.00 36.38 36.15 2jji s VAL 156 CO -0.07 -0.71 -0.08 0.72 -0.31 0.00 0.00 175.10 174.65 2jji s PHE 157 N -2.57 0.92 0.09 2.82 -0.12 -0.68 -0.75 117.98 117.70 2jji s PHE 157 Ca -0.04 -0.75 0.08 0.00 -0.05 0.00 0.00 56.93 56.17 2jji s PHE 157 Cb -0.02 -0.52 -0.03 0.00 -0.63 0.00 0.00 43.02 41.82 2jji s PHE 157 CO -0.05 -0.08 -0.21 0.95 -0.05 0.00 0.00 175.22 175.78 2jji s THR 158 N -2.85 1.73 -0.15 -4.49 -4.23 0.22 -0.39 115.64 105.48 2jji s THR 158 Ca 0.06 -1.47 0.01 0.00 -1.18 0.00 0.00 61.69 59.12 2jji s THR 158 Cb -0.00 -1.55 0.00 0.00 1.34 0.00 0.00 72.50 72.29 2jji s THR 158 CO -0.02 0.02 -0.18 0.00 -0.54 0.00 0.00 174.62 173.89 2jji s ALA 159 N -1.06 2.39 -0.57 3.99 0.00 0.47 -2.27 121.76 124.72 2jji s ALA 159 Ca 0.07 -1.05 0.04 0.00 0.00 0.00 0.00 51.96 51.02 2jji s ALA 159 Cb -0.10 -1.12 0.17 0.00 0.00 0.00 0.00 23.12 22.08 2jji s ALA 159 CO 0.04 -0.00 0.42 0.34 0.00 0.00 0.00 175.76 176.55 2jji s ASP 160 N 0.77 3.28 0.14 0.00 2.15 -0.46 -1.88 116.67 120.68 2jji s ASP 160 Ca -0.07 -3.47 -0.22 0.00 0.43 0.00 0.00 52.55 49.21 2jji s ASP 160 Cb -0.16 -1.09 -0.08 0.00 -0.30 0.00 0.00 42.92 41.30 2jji s ASP 160 CO -0.00 -0.13 0.69 -0.76 -0.17 0.00 0.00 175.17 174.81 2jji s LEU 161 N -0.74 4.54 0.29 -1.34 1.43 -1.26 -0.75 118.68 120.85 2jji s LEU 161 Ca 0.28 1.47 -0.02 0.00 -1.03 0.00 0.00 54.13 54.83 2jji s LEU 161 Cb -0.01 -3.19 -0.04 0.00 0.03 0.00 0.00 46.19 42.97 2jji s LEU 161 CO -0.18 0.21 0.52 -0.83 0.23 0.00 0.00 176.35 176.31 2jji s GLY 162 N -1.21 1.68 -0.50 -3.19 0.00 -1.24 -4.58 107.32 98.28 2jji s GLY 162 Ca 0.34 -0.72 -0.21 0.00 0.00 0.00 0.00 44.72 44.13 2jji s GLY 162 CO 0.23 -0.63 0.73 -0.47 0.00 0.00 0.00 173.10 172.95 2jji s TYR 163 N -2.13 2.98 -1.49 1.90 5.04 -1.26 -4.19 117.35 118.20 2jji s TYR 163 Ca 0.42 -0.23 -0.12 0.00 -2.44 0.00 0.00 57.07 54.69 2jji s TYR 163 Cb -0.10 -3.65 0.08 0.00 0.35 0.00 0.00 41.96 38.64 2jji s TYR 163 CO 0.32 -1.08 0.82 0.72 -1.34 0.00 0.00 175.55 175.00 2jji n HIS 164 N 6.58 -2.12 -3.44 4.97 8.25 -1.26 -4.92 115.22 123.28 2jji n HIS 164 Ca -0.02 0.76 -0.12 0.00 -0.26 0.00 0.00 57.72 58.08 2jji n HIS 164 Cb 0.47 -3.70 -0.02 0.00 1.12 0.00 0.00 29.99 27.85 2jji n HIS 164 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2jji s ALA 165 N -3.20 -1.64 0.79 -1.41 0.00 -1.26 -5.09 121.76 109.96 2jji s ALA 165 Ca 0.58 0.60 -0.12 0.00 0.00 0.00 0.00 51.96 53.03 2jji s ALA 165 Cb -0.29 0.78 0.07 0.00 0.00 0.00 0.00 23.12 23.67 2jji s ALA 165 CO 0.72 -0.73 1.13 -2.14 0.00 0.00 0.00 175.76 174.73 2jji s PRO 166 N -3.51 1.94 0.00 0.00 0.02 -1.26 -3.70 135.00 128.49 2jji s PRO 166 Ca 0.01 1.40 0.00 0.00 0.02 0.00 0.00 61.00 62.43 2jji s PRO 166 Cb -0.01 -1.84 0.00 0.00 0.02 0.00 0.00 34.50 32.67 2jji s PRO 166 CO -0.11 -1.92 0.00 0.41 -0.33 0.00 0.00 177.00 175.05 2jji n GLY 167 N -0.44 4.81 2.85 0.52 0.00 0.57 -4.18 105.19 109.31 2jji n GLY 167 Ca 0.11 -1.50 -0.13 0.00 0.00 0.00 0.00 46.02 44.49 2jji n GLY 167 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jji s THR 168 N -1.32 0.00 -0.23 2.61 2.01 0.07 -0.79 115.64 117.99 2jji s THR 168 Ca 0.00 0.04 -0.07 0.00 0.31 0.00 0.00 61.69 61.97 2jji s THR 168 Cb 0.00 -0.04 -0.03 0.00 0.01 0.00 0.00 72.50 72.45 2jji s THR 168 CO 0.00 0.02 0.05 -0.31 -0.69 0.00 0.00 174.62 173.70 2jji s TYR 169 N 0.23 3.09 -0.05 4.92 2.02 -0.30 -1.35 117.35 125.91 2jji s TYR 169 Ca -0.02 -0.38 0.03 0.00 -0.37 0.00 0.00 57.07 56.34 2jji s TYR 169 Cb -0.03 -2.19 -0.03 0.00 -0.40 0.00 0.00 41.96 39.32 2jji s TYR 169 CO -0.01 -0.28 -0.14 -0.80 -1.57 0.00 0.00 175.55 172.76 2jji s ASN 170 N 1.34 4.09 -0.18 2.29 0.02 -0.96 -1.27 114.94 120.28 2jji s ASN 170 Ca 0.05 -0.18 0.01 0.00 -1.02 0.00 0.00 52.86 51.71 2jji s ASN 170 Cb -0.15 -0.88 0.02 0.00 0.02 0.00 0.00 41.25 40.27 2jji s ASN 170 CO 0.03 0.34 -0.20 -0.36 0.02 0.00 0.00 177.10 176.94 2jji s PHE 171 N -0.75 2.77 0.00 2.20 0.40 -0.15 -0.61 117.98 121.84 2jji s PHE 171 Ca 0.12 -1.59 0.00 0.00 -0.60 0.00 0.00 56.93 54.86 2jji s PHE 171 Cb -0.11 -1.91 0.00 0.00 0.51 0.00 0.00 43.02 41.51 2jji s PHE 171 CO 0.01 -0.78 0.00 0.41 0.70 0.00 0.00 175.22 175.56 2jji n GLY 172 N 4.56 0.63 3.43 4.36 0.00 0.07 -1.26 105.19 116.98 2jji n GLY 172 Ca -0.21 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.67 2jji n GLY 172 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2jji s PHE 173 N -2.36 -0.51 -0.26 1.61 -0.71 -1.26 -2.64 117.98 111.85 2jji s PHE 173 Ca 0.00 0.52 -0.06 0.00 -1.04 0.00 0.00 56.93 56.34 2jji s PHE 173 Cb 0.00 0.45 -0.01 0.00 -1.21 0.00 0.00 43.02 42.25 2jji s PHE 173 CO 0.00 -0.73 0.04 0.42 -1.34 0.00 0.00 175.22 173.61 2jji s ILE 174 N -2.84 3.91 -0.67 -4.49 1.01 -1.26 -4.74 121.20 112.12 2jji s ILE 174 Ca -0.03 -0.48 -0.27 0.00 0.00 0.00 0.00 60.65 59.86 2jji s ILE 174 Cb -0.00 -2.90 0.03 0.00 0.01 0.00 0.00 42.46 39.59 2jji s ILE 174 CO -0.05 0.25 1.29 -0.62 0.00 0.00 0.00 174.94 175.81 2jji s ASP 175 N 1.53 6.21 0.07 3.58 2.15 -1.26 -4.89 116.67 124.06 2jji s ASP 175 Ca 0.05 -0.18 0.17 0.00 0.43 0.00 0.00 52.55 53.02 2jji s ASP 175 Cb -0.16 -2.56 0.72 0.00 -0.30 0.00 0.00 42.92 40.63 2jji s ASP 175 CO 0.01 -1.74 1.53 0.35 -0.17 0.00 0.00 175.17 175.16 2jji n THR 176 N 6.55 0.96 0.87 1.71 -2.24 -1.26 -1.98 114.28 118.89 2jji n THR 176 Ca 0.06 0.25 0.13 0.00 -2.27 0.00 0.00 64.05 62.22 2jji n THR 176 Cb 0.49 -1.05 0.42 0.00 -2.10 0.00 0.00 70.33 68.10 2jji n THR 176 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2jji n THR 177 N -1.71 0.16 1.33 4.28 -2.24 -1.26 -4.11 114.28 110.72 2jji n THR 177 Ca 0.03 -0.09 0.13 0.00 -2.27 0.00 0.00 64.05 61.85 2jji n THR 177 Cb 0.19 -0.27 0.45 0.00 -2.10 0.00 0.00 70.33 68.59 2jji n THR 177 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2jji n ALA 178 N -1.60 2.92 -2.23 6.98 0.00 -0.84 -4.91 120.51 120.83 2jji n ALA 178 Ca 0.06 -0.39 -0.12 0.00 0.00 0.00 0.00 53.44 52.98 2jji n ALA 178 Cb 0.37 -1.17 -0.10 0.00 0.00 0.00 0.00 19.45 18.55 2jji n ALA 178 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 2jji s TYR 179 N -2.38 1.17 0.22 0.00 1.13 -1.26 -4.82 117.35 111.41 2jji s TYR 179 Ca 0.28 -1.38 0.09 0.00 -1.41 0.00 0.00 57.07 54.66 2jji s TYR 179 Cb 0.20 -0.55 -0.04 0.00 -1.10 0.00 0.00 41.96 40.47 2jji s TYR 179 CO 0.47 -0.66 -0.04 0.95 -2.51 0.00 0.00 175.55 173.75 2jji s THR 180 N -4.12 3.37 0.00 -3.49 -4.23 -0.40 -4.98 115.64 101.79 2jji s THR 180 Ca 0.39 -1.74 0.00 0.00 -1.18 0.00 0.00 61.69 59.15 2jji s THR 180 Cb 0.07 -2.73 0.00 0.00 1.34 0.00 0.00 72.50 71.17 2jji s THR 180 CO 0.13 -0.23 0.00 0.61 -0.54 0.00 0.00 174.62 174.59 2jji n GLY 181 N -0.39 1.41 3.49 3.99 0.00 -1.26 -4.08 105.19 108.36 2jji n GLY 181 Ca -0.09 -0.64 -0.25 0.00 0.00 0.00 0.00 46.02 45.05 2jji n GLY 181 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2jji s SER 182 N -4.00 3.62 0.02 1.61 1.04 -1.26 -5.05 113.70 109.69 2jji s SER 182 Ca 0.00 -1.09 -0.27 0.00 0.48 0.00 0.00 55.95 55.07 2jji s SER 182 Cb 0.00 -0.31 -0.04 0.00 0.10 0.00 0.00 66.02 65.76 2jji s SER 182 CO 0.00 -0.05 0.85 -0.63 0.98 0.00 0.00 173.24 174.39 2jji s ILE 183 N -2.55 4.79 -0.21 -1.02 1.01 -1.26 -4.61 121.20 117.35 2jji s ILE 183 Ca 0.31 1.80 -0.08 0.00 0.00 0.00 0.00 60.65 62.68 2jji s ILE 183 Cb -0.02 -4.20 -0.04 0.00 0.01 0.00 0.00 42.46 38.21 2jji s ILE 183 CO 0.15 0.27 0.07 -0.89 0.00 0.00 0.00 174.94 174.55 2jji s THR 184 N 0.43 4.72 0.04 2.92 2.01 -0.27 -4.90 115.64 120.58 2jji s THR 184 Ca 0.44 -0.05 -0.01 0.00 0.31 0.00 0.00 61.69 62.38 2jji s THR 184 Cb -0.21 -3.15 -0.04 0.00 0.01 0.00 0.00 72.50 69.11 2jji s THR 184 CO 0.25 0.42 0.18 -0.31 -0.69 0.00 0.00 174.62 174.46 2jji s TYR 185 N 0.77 3.47 0.02 4.92 2.02 -1.26 -1.01 117.35 126.28 2jji s TYR 185 Ca 0.04 0.26 -0.01 0.00 -0.37 0.00 0.00 57.07 56.99 2jji s TYR 185 Cb -0.13 -1.76 -0.02 0.00 -0.40 0.00 0.00 41.96 39.65 2jji s TYR 185 CO 0.02 0.60 -0.00 -0.08 -1.57 0.00 0.00 175.55 174.51 2jji s THR 186 N -1.41 0.10 0.46 -0.71 -1.32 0.39 -4.87 115.64 108.28 2jji s THR 186 Ca 0.31 -0.84 -0.24 0.00 -1.21 0.00 0.00 61.69 59.72 2jji s THR 186 Cb -0.13 -0.27 -0.07 0.00 -1.51 0.00 0.00 72.50 70.52 2jji s THR 186 CO 0.23 -0.46 1.28 0.00 -2.21 0.00 0.00 174.62 173.47 2jji s ALA 187 N -1.38 3.06 -0.08 11.08 0.00 -1.26 -1.35 121.76 131.82 2jji s ALA 187 Ca -0.15 1.18 0.01 0.00 0.00 0.00 0.00 51.96 53.00 2jji s ALA 187 Cb -0.09 -3.48 -0.03 0.00 0.00 0.00 0.00 23.12 19.52 2jji s ALA 187 CO -0.01 -0.94 -0.10 0.08 0.00 0.00 0.00 175.76 174.79 2jji s VAL 188 N -1.35 3.38 -0.24 0.00 1.01 -1.23 -4.47 120.40 117.50 2jji s VAL 188 Ca 0.63 -0.58 -0.10 0.00 0.00 0.00 0.00 61.98 61.92 2jji s VAL 188 Cb -0.36 -2.38 -0.05 0.00 0.00 0.00 0.00 36.38 33.59 2jji s VAL 188 CO 0.45 0.57 0.16 -0.55 0.00 0.00 0.00 175.10 175.72 2jji s SER 189 N -0.41 6.09 -0.02 3.32 0.15 0.20 -4.82 113.70 118.21 2jji s SER 189 Ca 0.05 0.10 0.19 0.00 0.70 0.00 0.00 55.95 56.99 2jji s SER 189 Cb -0.12 -2.10 0.57 0.00 -1.71 0.00 0.00 66.02 62.65 2jji s SER 189 CO 0.02 0.06 1.48 0.35 1.20 0.00 0.00 173.24 176.35 2jji n THR 190 N 4.31 1.16 0.26 6.45 -2.24 -1.26 -3.53 114.28 119.43 2jji n THR 190 Ca -0.15 -1.06 0.08 0.00 -2.27 0.00 0.00 64.05 60.66 2jji n THR 190 Cb 0.52 0.42 0.64 0.00 -2.10 0.00 0.00 70.33 69.82 2jji n THR 190 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 2jji h LYS 191 N 3.59 0.00 -0.10 -0.78 3.64 -1.94 -0.98 116.57 120.01 2jji h LYS 191 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2jji h LYS 191 Cb 1.00 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.82 2jji h LYS 191 CO 0.04 0.03 0.00 1.04 -2.27 0.00 0.00 179.45 178.29 2jji n GLN 192 N -4.43 1.77 -0.52 1.90 6.02 -1.26 -4.98 117.38 115.87 2jji n GLN 192 Ca -0.03 -1.73 0.00 0.00 -0.01 0.00 0.00 57.00 55.23 2jji n GLN 192 Cb 0.12 -1.37 0.00 0.00 1.02 0.00 0.00 30.24 30.00 2jji n GLN 192 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2jji n GLY 193 N 1.08 0.76 3.89 1.08 0.00 -0.37 -4.96 105.19 106.67 2jji n GLY 193 Ca 0.12 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.93 2jji n GLY 193 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2jji s PHE 194 N -2.90 3.14 -1.28 1.61 0.08 -1.26 -1.30 117.98 116.06 2jji s PHE 194 Ca 0.00 -0.15 -0.18 0.00 0.12 0.00 0.00 56.93 56.71 2jji s PHE 194 Cb 0.00 -1.63 0.02 0.00 -0.57 0.00 0.00 43.02 40.84 2jji s PHE 194 CO 0.00 0.33 1.91 0.91 -0.10 0.00 0.00 175.22 178.28 2jji n TRP 195 N -1.35 3.85 -3.70 0.36 7.02 -1.26 -4.45 117.44 117.90 2jji n TRP 195 Ca -0.05 -2.58 -0.36 0.00 -1.02 0.00 0.00 57.50 53.49 2jji n TRP 195 Cb 0.58 -2.54 -0.07 0.00 -2.42 0.00 0.00 31.31 26.86 2jji n TRP 195 CO 0.00 0.00 0.00 -2.00 -2.02 0.00 0.00 177.69 173.67 2jji s GLU 196 N 4.37 4.01 0.24 -0.99 2.12 -1.23 -1.41 118.70 125.81 2jji s GLU 196 Ca 0.55 -0.08 -0.06 0.00 0.36 0.00 0.00 54.97 55.73 2jji s GLU 196 Cb 0.07 -3.36 -0.02 0.00 0.26 0.00 0.00 34.13 31.08 2jji s GLU 196 CO 0.05 0.42 0.33 1.67 -0.54 0.00 0.00 175.26 177.19 2jji s TRP 197 N -0.02 0.80 -0.19 5.30 1.48 -0.12 -0.62 118.94 125.56 2jji s TRP 197 Ca 0.13 -1.07 0.01 0.00 -1.06 0.00 0.00 56.10 54.10 2jji s TRP 197 Cb -0.12 -0.16 0.03 0.00 -1.16 0.00 0.00 33.47 32.06 2jji s TRP 197 CO 0.02 -0.87 -0.15 0.99 -4.06 0.00 0.00 176.95 172.88 2jji s THR 198 N -3.95 1.85 0.37 0.66 2.01 -1.26 -1.52 115.64 113.80 2jji s THR 198 Ca 0.30 -0.97 -0.26 0.00 0.31 0.00 0.00 61.69 61.07 2jji s THR 198 Cb 0.02 -1.78 -0.09 0.00 0.01 0.00 0.00 72.50 70.66 2jji s THR 198 CO 0.12 0.36 1.13 -0.55 -0.69 0.00 0.00 174.62 174.98 2jji s SER 199 N 1.34 6.77 0.00 3.53 0.15 -0.09 -4.78 113.70 120.62 2jji s SER 199 Ca 0.02 2.27 0.28 0.00 0.70 0.00 0.00 55.95 59.21 2jji s SER 199 Cb -0.15 -2.61 0.99 0.00 -1.71 0.00 0.00 66.02 62.54 2jji s SER 199 CO -0.10 -0.50 1.71 0.35 1.20 0.00 0.00 173.24 175.90 2jji n THR 200 N 0.34 0.00 -2.59 6.45 -2.24 -0.94 -1.48 114.28 113.81 2jji n THR 200 Ca 0.03 -0.13 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 2jji n THR 200 Cb 0.47 0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.96 2jji n THR 200 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jji n GLY 201 N 1.27 -1.76 3.32 3.38 0.00 -1.15 -2.44 105.19 107.82 2jji n GLY 201 Ca 0.15 -1.29 -0.09 0.00 0.00 0.00 0.00 46.02 44.78 2jji n GLY 201 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2jji s TYR 202 N -2.63 0.19 0.02 1.61 1.13 -1.00 -1.01 117.35 115.66 2jji s TYR 202 Ca 0.00 -0.57 -0.02 0.00 -1.41 0.00 0.00 57.07 55.07 2jji s TYR 202 Cb 0.00 0.04 -0.02 0.00 -1.10 0.00 0.00 41.96 40.88 2jji s TYR 202 CO 0.00 -0.70 0.01 0.00 -2.51 0.00 0.00 175.55 172.36 2jji s ALA 203 N -3.91 0.02 -0.20 9.51 0.00 -0.52 -1.01 121.76 125.65 2jji s ALA 203 Ca 0.11 -0.50 -0.04 0.00 0.00 0.00 0.00 51.96 51.53 2jji s ALA 203 Cb 0.03 0.15 -0.02 0.00 0.00 0.00 0.00 23.12 23.28 2jji s ALA 203 CO -0.05 -0.18 -0.02 0.08 0.00 0.00 0.00 175.76 175.60 2jji s VAL 204 N -1.54 3.79 0.00 0.00 1.01 -1.26 -1.16 120.40 121.24 2jji s VAL 204 Ca -0.15 -0.37 0.00 0.00 0.00 0.00 0.00 61.98 61.46 2jji s VAL 204 Cb -0.09 -2.71 0.00 0.00 0.00 0.00 0.00 36.38 33.58 2jji s VAL 204 CO -0.01 0.43 0.00 0.61 0.00 0.00 0.00 175.10 176.14 2jji n GLY 205 N 4.30 3.04 1.51 4.51 0.00 0.60 -1.67 105.19 117.47 2jji n GLY 205 Ca -0.17 -0.12 0.06 0.00 0.00 0.00 0.00 46.02 45.78 2jji n GLY 205 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2jji n SER 206 N 2.71 4.45 -2.11 1.61 3.41 -1.26 -4.85 113.62 117.57 2jji n SER 206 Ca 0.00 -2.61 -0.01 0.00 -0.26 0.00 0.00 58.87 55.98 2jji n SER 206 Cb 0.00 -0.61 0.01 0.00 -0.26 0.00 0.00 64.21 63.35 2jji n SER 206 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jji n GLY 207 N 0.63 -0.64 3.80 5.00 0.00 -0.67 -5.06 105.19 108.24 2jji n GLY 207 Ca 0.21 -1.75 -0.35 0.00 0.00 0.00 0.00 46.02 44.13 2jji n GLY 207 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2jji s THR 208 N -0.83 4.16 -0.23 2.61 -4.23 -1.26 -4.72 115.64 111.13 2jji s THR 208 Ca 0.04 1.54 -0.26 0.00 -1.18 0.00 0.00 61.69 61.83 2jji s THR 208 Cb -0.00 -3.74 -0.00 0.00 1.34 0.00 0.00 72.50 70.10 2jji s THR 208 CO 0.03 -0.10 0.88 0.12 -0.54 0.00 0.00 174.62 175.01 2jji s PHE 209 N -1.88 3.34 -0.26 3.99 5.36 -1.26 -4.49 117.98 122.78 2jji s PHE 209 Ca 0.58 1.24 -0.10 0.00 -0.96 0.00 0.00 56.93 57.69 2jji s PHE 209 Cb -0.15 -3.10 -0.04 0.00 -0.34 0.00 0.00 43.02 39.38 2jji s PHE 209 CO 0.20 -0.39 0.15 0.15 -1.46 0.00 0.00 175.22 173.87 2jji s LYS 210 N 2.81 3.91 -0.30 10.12 -0.14 -0.18 -4.95 119.74 131.01 2jji s LYS 210 Ca 0.38 -0.35 -0.27 0.00 -1.36 0.00 0.00 55.97 54.37 2jji s LYS 210 Cb -0.15 -3.54 0.01 0.00 -1.68 0.00 0.00 37.83 32.46 2jji s LYS 210 CO 0.08 -0.11 0.96 -1.54 -0.76 0.00 0.00 175.35 173.98 2jji s SER 211 N 1.52 6.86 -0.25 2.83 1.04 -1.26 -2.39 113.70 122.05 2jji s SER 211 Ca 0.07 0.96 -0.12 0.00 0.48 0.00 0.00 55.95 57.34 2jji s SER 211 Cb -0.15 -2.49 0.09 0.00 0.10 0.00 0.00 66.02 63.56 2jji s SER 211 CO 0.08 -0.75 0.58 0.28 0.98 0.00 0.00 173.24 174.41 2jji s THR 212 N 3.32 -0.28 0.07 2.02 -1.32 -1.02 -4.96 115.64 113.47 2jji s THR 212 Ca 0.40 0.04 -0.31 0.00 -1.21 0.00 0.00 61.69 60.62 2jji s THR 212 Cb -0.13 -0.86 -0.06 0.00 -1.51 0.00 0.00 72.50 69.93 2jji s THR 212 CO 0.13 0.02 1.28 -0.44 -2.21 0.00 0.00 174.62 173.39 2jji s SER 213 N 1.95 6.98 -0.29 8.08 0.01 -1.26 -2.96 113.70 126.21 2jji s SER 213 Ca -0.08 2.12 0.02 0.00 1.31 0.00 0.00 55.95 59.32 2jji s SER 213 Cb -0.08 -2.58 0.08 0.00 0.21 0.00 0.00 66.02 63.65 2jji s SER 213 CO -0.17 -0.55 0.01 -0.63 0.41 0.00 0.00 173.24 172.30 2jji s ILE 214 N 1.21 1.81 -0.04 1.44 1.01 -0.55 -4.96 121.20 121.13 2jji s ILE 214 Ca 0.61 -1.77 -0.30 0.00 0.00 0.00 0.00 60.65 59.19 2jji s ILE 214 Cb -0.32 -2.20 -0.03 0.00 0.01 0.00 0.00 42.46 39.91 2jji s ILE 214 CO 0.29 -0.39 1.11 -0.62 0.00 0.00 0.00 174.94 175.33 2jji s ASP 215 N 1.19 7.16 0.30 3.58 -1.08 -1.26 -0.92 116.67 125.64 2jji s ASP 215 Ca 0.03 1.76 -0.18 0.00 -0.52 0.00 0.00 52.55 53.63 2jji s ASP 215 Cb -0.19 -2.56 0.07 0.00 -1.46 0.00 0.00 42.92 38.78 2jji s ASP 215 CO -0.10 -0.47 0.92 -0.83 0.52 0.00 0.00 175.17 175.21 2jji s GLY 216 N 1.22 0.29 0.05 2.66 0.00 -0.58 -4.00 107.32 106.96 2jji s GLY 216 Ca 0.54 -0.60 0.07 0.00 0.00 0.00 0.00 44.72 44.72 2jji s GLY 216 CO 0.23 1.19 -0.17 -0.26 0.00 0.00 0.00 173.10 174.10 2jji s ILE 217 N -2.09 2.88 -0.42 0.90 -4.36 -0.54 -0.94 121.20 116.62 2jji s ILE 217 Ca 0.19 -1.18 -0.23 0.00 -0.26 0.00 0.00 60.65 59.17 2jji s ILE 217 Cb -0.04 -2.23 0.02 0.00 1.25 0.00 0.00 42.46 41.46 2jji s ILE 217 CO 0.09 0.32 0.79 0.00 0.24 0.00 0.00 174.94 176.38 2jji s ALA 218 N -0.96 3.33 -0.34 2.27 0.00 -0.50 -0.30 121.76 125.26 2jji s ALA 218 Ca 0.15 -0.88 0.01 0.00 0.00 0.00 0.00 51.96 51.24 2jji s ALA 218 Cb -0.11 -3.45 0.11 0.00 0.00 0.00 0.00 23.12 19.67 2jji s ALA 218 CO 0.06 -1.79 0.12 0.34 0.00 0.00 0.00 175.76 174.49 2jji s ASP 219 N 2.05 4.06 0.62 0.00 -1.08 -0.40 -4.63 116.67 117.30 2jji s ASP 219 Ca 0.31 -1.93 0.40 0.00 -0.52 0.00 0.00 52.55 50.81 2jji s ASP 219 Cb -0.12 -1.02 2.05 0.00 -1.46 0.00 0.00 42.92 42.38 2jji s ASP 219 CO 0.21 -0.38 2.24 0.71 0.52 0.00 0.00 175.17 178.47 2jji h THR 220 N 6.24 0.04 -0.39 1.71 1.35 -1.85 -2.69 112.91 117.32 2jji h THR 220 Ca -0.09 -0.18 0.00 0.00 -0.55 0.00 0.00 66.41 65.58 2jji h THR 220 Cb 1.00 1.17 0.00 0.00 -1.73 0.00 0.00 68.15 68.59 2jji h THR 220 CO 0.48 0.01 0.00 0.61 -0.25 0.00 0.00 175.52 176.37 2jji n GLY 221 N -0.72 0.97 3.29 5.82 0.00 -1.26 -4.70 105.19 108.58 2jji n GLY 221 Ca -0.02 -0.48 -0.31 0.00 0.00 0.00 0.00 46.02 45.20 2jji n GLY 221 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jji s THR 222 N -1.48 2.10 -0.04 2.61 2.01 -1.01 -5.04 115.64 114.78 2jji s THR 222 Ca 0.31 -1.06 -0.26 0.00 0.31 0.00 0.00 61.69 60.98 2jji s THR 222 Cb 0.16 -1.75 -0.21 0.00 0.01 0.00 0.00 72.50 70.72 2jji s THR 222 CO 0.22 0.57 1.15 0.74 -0.69 0.00 0.00 174.62 176.62 2jji h THR 223 N 4.91 1.37 -0.73 -0.82 2.02 -1.87 0.39 112.91 118.18 2jji h THR 223 Ca -0.35 -1.30 -0.50 0.00 0.77 0.00 0.00 66.41 65.04 2jji h THR 223 Cb 1.16 2.23 0.03 0.00 -1.74 0.00 0.00 68.15 69.83 2jji h THR 223 CO 0.47 0.33 -0.10 -0.76 0.37 0.00 0.00 175.52 175.83 2jji s LEU 224 N -9.07 3.04 -0.36 2.58 1.43 -1.26 -1.63 118.68 113.41 2jji s LEU 224 Ca -0.16 -0.90 -0.11 0.00 -1.03 0.00 0.00 54.13 51.93 2jji s LEU 224 Cb 0.01 -1.53 0.02 0.00 0.03 0.00 0.00 46.19 44.71 2jji s LEU 224 CO 0.65 -1.37 0.21 -0.22 0.23 0.00 0.00 176.35 175.85 2jji s LEU 225 N -4.67 4.62 -0.25 1.79 2.96 -0.75 -2.66 118.68 119.72 2jji s LEU 225 Ca 0.61 -0.84 -0.06 0.00 -0.22 0.00 0.00 54.13 53.63 2jji s LEU 225 Cb -0.05 -2.05 -0.01 0.00 0.50 0.00 0.00 46.19 44.59 2jji s LEU 225 CO 0.38 -0.34 0.03 -0.31 -1.32 0.00 0.00 176.35 174.79 2jji s TYR 226 N 1.60 3.06 0.24 5.38 2.02 -0.34 -1.15 117.35 128.16 2jji s TYR 226 Ca 0.03 -0.84 0.04 0.00 -0.37 0.00 0.00 57.07 55.93 2jji s TYR 226 Cb -0.19 -2.19 -0.05 0.00 -0.40 0.00 0.00 41.96 39.13 2jji s TYR 226 CO 0.07 -0.51 -0.01 -0.51 -1.57 0.00 0.00 175.55 173.02 2jji s LEU 227 N 1.52 2.22 0.51 -1.29 1.43 -0.55 -1.13 118.68 121.39 2jji s LEU 227 Ca 0.05 -1.22 -0.22 0.00 -1.03 0.00 0.00 54.13 51.71 2jji s LEU 227 Cb -0.16 -0.31 -0.07 0.00 0.03 0.00 0.00 46.19 45.69 2jji s LEU 227 CO 0.01 -0.50 1.15 -2.65 0.23 0.00 0.00 176.35 174.59 2jji n PRO 228 N -0.44 1.42 -0.28 1.29 -0.02 -1.26 -0.44 135.00 135.28 2jji n PRO 228 Ca -0.05 0.52 0.09 0.00 -2.02 0.00 0.00 63.50 62.04 2jji n PRO 228 Cb 0.64 -2.31 0.32 0.00 -0.02 0.00 0.00 33.50 32.13 2jji n PRO 228 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2jji h ALA 229 N 1.28 1.69 0.00 3.55 0.00 -1.94 -0.93 119.26 122.92 2jji h ALA 229 Ca -0.48 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.35 2jji h ALA 229 Cb 1.33 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 2jji h ALA 229 CO 0.56 0.10 -0.39 1.79 0.00 0.00 0.00 179.25 181.31 2jji h THR 230 N 0.82 0.80 -0.09 0.00 1.35 -2.00 -1.35 112.91 112.44 2jji h THR 230 Ca 0.43 -1.68 -0.06 0.00 -0.55 0.00 0.00 66.41 64.54 2jji h THR 230 Cb 0.51 2.07 0.00 0.00 -1.73 0.00 0.00 68.15 69.00 2jji h THR 230 CO -0.19 0.38 -0.19 0.58 -0.25 0.00 0.00 175.52 175.85 2jji h VAL 231 N 0.00 1.40 -0.86 6.82 2.07 -1.57 -2.72 116.25 121.39 2jji h VAL 231 Ca -0.00 -1.49 -0.00 0.00 0.82 0.00 0.00 66.70 66.03 2jji h VAL 231 Cb 1.04 2.14 -0.04 0.00 -1.52 0.00 0.00 31.29 32.91 2jji h VAL 231 CO 0.05 0.43 0.53 0.58 0.02 0.00 0.00 177.57 179.17 2jji h VAL 232 N -0.16 1.24 -0.49 2.57 2.07 -1.17 -1.98 116.25 118.34 2jji h VAL 232 Ca 0.00 -0.50 -0.04 0.00 0.82 0.00 0.00 66.70 66.98 2jji h VAL 232 Cb 0.78 0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 30.55 2jji h VAL 232 CO 0.04 0.24 0.12 0.28 0.02 0.00 0.00 177.57 178.28 2jji h SER 233 N 1.18 0.68 -0.55 0.57 0.02 -1.29 -1.77 113.55 112.38 2jji h SER 233 Ca 0.31 -0.11 -0.06 0.00 -0.84 0.00 0.00 61.79 61.09 2jji h SER 233 Cb -0.06 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 62.28 2jji h SER 233 CO -0.06 0.66 0.14 0.00 -1.14 0.00 0.00 176.83 176.43 2jji h ALA 234 N 1.43 1.13 0.46 3.77 0.00 -1.07 -1.13 119.26 123.84 2jji h ALA 234 Ca 0.16 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 2jji h ALA 234 Cb 0.25 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2jji h ALA 234 CO -0.00 0.59 -0.22 -0.92 0.00 0.00 0.00 179.25 178.69 2jji h TYR 235 N 0.89 -0.57 0.00 0.00 3.20 -0.88 -3.24 116.97 116.37 2jji h TYR 235 Ca 0.19 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.05 2jji h TYR 235 Cb 0.33 0.19 0.00 0.00 1.54 0.00 0.00 36.73 38.79 2jji h TYR 235 CO 0.02 -0.27 0.00 -1.49 -1.64 0.00 0.00 178.16 174.78 2jji h TRP 236 N -0.79 0.00 0.00 -3.82 4.06 -1.21 -1.84 115.95 112.35 2jji h TRP 236 Ca -0.06 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 60.89 2jji h TRP 236 Cb 0.55 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.71 2jji h TRP 236 CO -0.01 0.00 -0.01 0.00 -3.56 0.00 0.00 178.44 174.87 2jji h ALA 237 N 2.28 1.25 -0.25 1.49 0.00 -1.23 -1.66 119.26 121.15 2jji h ALA 237 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2jji h ALA 237 Cb 0.52 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.31 2jji h ALA 237 CO 0.00 0.01 0.00 1.04 0.00 0.00 0.00 179.25 180.30 2jji n GLN 238 N -3.45 1.76 -4.03 0.00 1.13 -0.69 -4.72 117.38 107.37 2jji n GLN 238 Ca -0.03 -1.17 -0.32 0.00 -1.94 0.00 0.00 57.00 53.54 2jji n GLN 238 Cb 0.09 -1.34 -0.15 0.00 0.11 0.00 0.00 30.24 28.95 2jji n GLN 238 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 2jji s VAL 239 N -1.67 2.34 0.32 5.09 1.01 -0.62 -4.89 120.40 121.97 2jji s VAL 239 Ca 0.28 -1.66 0.00 0.00 0.00 0.00 0.00 61.98 60.61 2jji s VAL 239 Cb 0.15 -2.40 0.24 0.00 0.00 0.00 0.00 36.38 34.36 2jji s VAL 239 CO 0.22 -0.10 1.95 0.77 0.00 0.00 0.00 175.10 177.94 2jji h SER 240 N 7.80 0.80 -0.39 3.32 4.64 -1.84 -2.26 113.55 125.62 2jji h SER 240 Ca -0.18 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.09 2jji h SER 240 Cb 1.04 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.93 2jji h SER 240 CO 0.48 0.63 0.00 0.61 -0.87 0.00 0.00 176.83 177.68 2jji n GLY 241 N -1.28 1.25 3.77 -0.77 0.00 -1.26 -4.95 105.19 101.95 2jji n GLY 241 Ca 0.07 -0.59 -0.39 0.00 0.00 0.00 0.00 46.02 45.10 2jji n GLY 241 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jji s ALA 242 N -1.49 3.40 0.05 4.61 0.00 -0.85 -4.36 121.76 123.11 2jji s ALA 242 Ca 0.36 0.42 -0.07 0.00 0.00 0.00 0.00 51.96 52.67 2jji s ALA 242 Cb 0.20 -3.03 -0.01 0.00 0.00 0.00 0.00 23.12 20.29 2jji s ALA 242 CO 0.27 0.27 0.14 -1.59 0.00 0.00 0.00 175.76 174.85 2jji s LYS 243 N -1.29 0.66 -0.21 0.00 -2.85 -0.39 -4.99 119.74 110.67 2jji s LYS 243 Ca 0.39 -0.76 -0.27 0.00 -1.00 0.00 0.00 55.97 54.33 2jji s LYS 243 Cb -0.23 0.27 -0.00 0.00 -2.06 0.00 0.00 37.83 35.80 2jji s LYS 243 CO 0.27 -0.18 0.93 0.45 0.10 0.00 0.00 175.35 176.92 2jji s SER 244 N -2.24 7.00 -0.26 0.03 0.15 -1.26 -0.77 113.70 116.34 2jji s SER 244 Ca -0.03 1.24 -0.08 0.00 0.70 0.00 0.00 55.95 57.78 2jji s SER 244 Cb 0.00 -2.49 -0.03 0.00 -1.71 0.00 0.00 66.02 61.79 2jji s SER 244 CO -0.05 -0.54 0.10 -0.55 1.20 0.00 0.00 173.24 173.39 2jji s SER 245 N 1.23 5.35 0.25 5.45 0.15 -0.33 -4.96 113.70 120.83 2jji s SER 245 Ca 0.40 -0.16 0.03 0.00 0.70 0.00 0.00 55.95 56.93 2jji s SER 245 Cb -0.16 -1.97 0.29 0.00 -1.71 0.00 0.00 66.02 62.48 2jji s SER 245 CO 0.09 -0.04 1.61 -1.28 1.20 0.00 0.00 173.24 174.82 2jji h SER 246 N 8.25 0.36 0.56 5.45 0.87 -1.96 -1.10 113.55 125.99 2jji h SER 246 Ca -0.38 -0.18 -0.14 0.00 -1.23 0.00 0.00 61.79 59.87 2jji h SER 246 Cb 1.18 -0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 63.02 2jji h SER 246 CO 0.57 0.80 -0.63 0.77 -0.53 0.00 0.00 176.83 177.82 2jji h SER 247 N 0.26 0.08 0.62 6.23 4.64 -1.95 -3.22 113.55 120.21 2jji h SER 247 Ca 0.01 -0.05 -0.08 0.00 -0.47 0.00 0.00 61.79 61.21 2jji h SER 247 Cb 0.97 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 63.03 2jji h SER 247 CO 0.08 0.68 -1.44 0.52 -0.87 0.00 0.00 176.83 175.81 2jji n VAL 248 N -3.81 0.72 -0.19 0.95 0.31 -1.18 -4.99 118.33 110.14 2jji n VAL 248 Ca -0.02 -0.60 0.00 0.00 -0.01 0.00 0.00 64.34 63.71 2jji n VAL 248 Cb 0.63 -0.40 0.00 0.00 -0.91 0.00 0.00 33.84 33.16 2jji n VAL 248 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2jji n GLY 249 N 1.30 0.88 0.00 2.92 0.00 -0.45 -5.05 105.19 104.80 2jji n GLY 249 Ca -0.06 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.76 2jji n GLY 249 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jji n GLY 250 N -2.19 -0.89 3.73 -0.02 0.00 -0.99 -5.01 105.19 99.83 2jji n GLY 250 Ca 0.00 -0.91 -0.41 0.00 0.00 0.00 0.00 46.02 44.70 2jji n GLY 250 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2jji s TYR 251 N -3.00 3.60 0.19 1.61 2.02 -1.26 -1.19 117.35 119.33 2jji s TYR 251 Ca 0.00 1.59 0.09 0.00 -0.37 0.00 0.00 57.07 58.38 2jji s TYR 251 Cb 0.00 -3.26 -0.04 0.00 -0.40 0.00 0.00 41.96 38.26 2jji s TYR 251 CO 0.00 -0.56 -0.19 0.14 -1.57 0.00 0.00 175.55 173.37 2jji s VAL 252 N 0.03 1.98 0.14 0.71 -7.23 0.05 -1.59 120.40 114.50 2jji s VAL 252 Ca 0.50 -2.03 -0.14 0.00 -1.81 0.00 0.00 61.98 58.50 2jji s VAL 252 Cb -0.28 -1.97 0.02 0.00 0.56 0.00 0.00 36.38 34.71 2jji s VAL 252 CO 0.33 -0.32 0.38 0.72 -0.31 0.00 0.00 175.10 175.90 2jji s PHE 253 N -2.15 -0.04 0.15 2.82 -0.71 -0.44 -1.26 117.98 116.34 2jji s PHE 253 Ca 0.19 -0.30 -0.31 0.00 -1.04 0.00 0.00 56.93 55.46 2jji s PHE 253 Cb -0.05 0.20 -0.10 0.00 -1.21 0.00 0.00 43.02 41.85 2jji s PHE 253 CO 0.08 -0.73 1.64 -2.14 -1.34 0.00 0.00 175.22 172.73 2jji s PRO 254 N -3.85 4.19 0.57 1.99 0.02 -1.26 -0.11 135.00 136.54 2jji s PRO 254 Ca 0.07 2.43 0.26 0.00 0.02 0.00 0.00 61.00 63.78 2jji s PRO 254 Cb 0.02 -3.26 1.64 0.00 0.02 0.00 0.00 34.50 32.91 2jji s PRO 254 CO -0.08 -0.68 2.18 0.00 -0.33 0.00 0.00 177.00 178.09 2jji n SER 256 N -4.01 0.25 -4.77 0.00 3.41 -1.26 -4.85 113.62 102.39 2jji n SER 256 Ca -0.01 0.55 -0.37 0.00 -0.26 0.00 0.00 58.87 58.77 2jji n SER 256 Cb 0.18 -0.61 -0.00 0.00 -0.26 0.00 0.00 64.21 63.52 2jji n SER 256 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2jji s ALA 257 N -3.09 2.98 -0.31 7.33 0.00 -0.55 -5.01 121.76 123.12 2jji s ALA 257 Ca 0.08 1.01 -0.16 0.00 0.00 0.00 0.00 51.96 52.88 2jji s ALA 257 Cb 0.11 -3.41 -0.02 0.00 0.00 0.00 0.00 23.12 19.80 2jji s ALA 257 CO 0.38 -0.75 0.42 0.99 0.00 0.00 0.00 175.76 176.80 2jji s THR 258 N -1.49 5.12 0.25 0.00 2.01 -1.26 -5.07 115.64 115.21 2jji s THR 258 Ca 0.64 0.43 -0.16 0.00 0.31 0.00 0.00 61.69 62.91 2jji s THR 258 Cb -0.31 -3.81 -0.08 0.00 0.01 0.00 0.00 72.50 68.31 2jji s THR 258 CO 0.37 -0.00 0.69 -0.76 -0.69 0.00 0.00 174.62 174.23 2jji s LEU 259 N 2.17 4.21 0.59 4.42 1.43 -1.26 -5.06 118.68 125.19 2jji s LEU 259 Ca 0.16 1.27 -0.17 0.00 -1.03 0.00 0.00 54.13 54.36 2jji s LEU 259 Cb -0.16 -3.75 -0.03 0.00 0.03 0.00 0.00 46.19 42.28 2jji s LEU 259 CO 0.11 -0.06 1.09 -2.16 0.23 0.00 0.00 176.35 175.56 2jji s PRO 260 N -2.45 3.19 1.01 1.29 0.04 -1.26 -4.18 135.00 132.64 2jji s PRO 260 Ca 0.47 1.38 -0.12 0.00 0.04 0.00 0.00 61.00 62.77 2jji s PRO 260 Cb -0.13 -2.00 0.19 0.00 0.04 0.00 0.00 34.50 32.60 2jji s PRO 260 CO 0.19 -0.94 1.08 -1.54 0.04 0.00 0.00 177.00 175.83 2jji s SER 261 N -2.39 2.46 -0.05 6.66 1.04 -1.26 -4.05 113.70 116.11 2jji s SER 261 Ca 0.67 1.40 0.01 0.00 0.48 0.00 0.00 55.95 58.51 2jji s SER 261 Cb -0.19 -2.09 0.02 0.00 0.10 0.00 0.00 66.02 63.86 2jji s SER 261 CO 0.34 -3.26 -0.04 0.12 0.98 0.00 0.00 173.24 171.38 2jji s PHE 262 N -2.82 0.80 -0.11 5.02 5.36 -0.61 -0.29 117.98 125.33 2jji s PHE 262 Ca 0.66 -0.24 -0.02 0.00 -0.96 0.00 0.00 56.93 56.37 2jji s PHE 262 Cb -0.20 -0.74 -0.03 0.00 -0.34 0.00 0.00 43.02 41.71 2jji s PHE 262 CO 0.59 -0.24 -0.04 0.99 -1.46 0.00 0.00 175.22 175.06 2jji s THR 263 N 1.16 3.90 0.13 0.12 2.01 -0.31 -0.55 115.64 122.09 2jji s THR 263 Ca -0.07 -0.38 0.10 0.00 0.31 0.00 0.00 61.69 61.64 2jji s THR 263 Cb -0.14 -2.65 -0.04 0.00 0.01 0.00 0.00 72.50 69.68 2jji s THR 263 CO -0.01 0.56 -0.23 0.72 -0.69 0.00 0.00 174.62 174.96 2jji s PHE 264 N -0.34 2.05 0.04 4.92 -0.71 -0.74 -1.44 117.98 121.75 2jji s PHE 264 Ca 0.06 -0.40 -0.19 0.00 -1.04 0.00 0.00 56.93 55.36 2jji s PHE 264 Cb -0.12 -1.10 -0.06 0.00 -1.21 0.00 0.00 43.02 40.53 2jji s PHE 264 CO 0.02 0.29 0.54 0.20 -1.34 0.00 0.00 175.22 174.93 2jji s GLY 265 N -2.09 2.61 -0.34 1.99 0.00 -0.18 -1.01 107.32 108.30 2jji s GLY 265 Ca 0.11 -0.03 0.02 0.00 0.00 0.00 0.00 44.72 44.83 2jji s GLY 265 CO 0.06 0.45 0.09 0.14 0.00 0.00 0.00 173.10 173.84 2jji s VAL 266 N -0.89 1.68 0.00 1.40 1.01 -0.60 -2.21 120.40 120.80 2jji s VAL 266 Ca 0.28 -2.04 0.00 0.00 0.00 0.00 0.00 61.98 60.22 2jji s VAL 266 Cb -0.19 -2.25 0.00 0.00 0.00 0.00 0.00 36.38 33.95 2jji s VAL 266 CO 0.17 -0.66 0.00 0.61 0.00 0.00 0.00 175.10 175.22 2jji n GLY 267 N 4.38 3.04 0.03 4.51 0.00 -1.26 -0.41 105.19 115.48 2jji n GLY 267 Ca 0.02 -0.16 0.15 0.00 0.00 0.00 0.00 46.02 46.02 2jji n GLY 267 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2jji n SER 268 N 2.58 0.14 -4.96 1.61 7.64 -1.26 -4.75 113.62 114.61 2jji n SER 268 Ca 0.00 -0.35 -0.22 0.00 1.01 0.00 0.00 58.87 59.31 2jji n SER 268 Cb 0.00 -0.20 0.02 0.00 -1.01 0.00 0.00 64.21 63.03 2jji n SER 268 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jji s ALA 269 N -2.49 3.79 -0.06 -0.43 0.00 0.45 -5.09 121.76 117.93 2jji s ALA 269 Ca 0.30 -1.16 0.01 0.00 0.00 0.00 0.00 51.96 51.11 2jji s ALA 269 Cb 0.20 -2.14 0.02 0.00 0.00 0.00 0.00 23.12 21.21 2jji s ALA 269 CO 0.46 -0.57 -0.08 1.03 0.00 0.00 0.00 175.76 176.60 2jji s ARG 270 N -4.67 1.21 -0.18 0.00 1.81 -1.26 -1.56 118.95 114.30 2jji s ARG 270 Ca 0.53 -0.23 -0.05 0.00 -1.72 0.00 0.00 55.73 54.26 2jji s ARG 270 Cb -0.10 -1.12 -0.03 0.00 -0.45 0.00 0.00 34.95 33.24 2jji s ARG 270 CO 0.38 -0.06 0.00 0.42 -0.68 0.00 0.00 175.30 175.36 2jji s ILE 271 N 0.93 4.13 -0.29 1.52 -1.09 -0.18 -4.91 121.20 121.31 2jji s ILE 271 Ca -0.10 -0.26 -0.09 0.00 -2.23 0.00 0.00 60.65 57.97 2jji s ILE 271 Cb -0.15 -2.84 -0.01 0.00 -1.58 0.00 0.00 42.46 37.88 2jji s ILE 271 CO 0.01 0.46 0.12 -0.69 -1.23 0.00 0.00 174.94 173.61 2jji s VAL 272 N 0.59 4.46 -0.34 2.92 1.01 -1.26 -1.79 120.40 125.99 2jji s VAL 272 Ca -0.01 -0.36 -0.21 0.00 0.00 0.00 0.00 61.98 61.40 2jji s VAL 272 Cb -0.14 -3.22 -0.00 0.00 0.00 0.00 0.00 36.38 33.03 2jji s VAL 272 CO 0.02 0.16 0.67 -0.63 0.00 0.00 0.00 175.10 175.32 2jji s ILE 273 N 1.60 4.87 0.56 2.22 1.01 0.29 -4.94 121.20 126.80 2jji s ILE 273 Ca 0.05 0.78 -0.21 0.00 0.00 0.00 0.00 60.65 61.26 2jji s ILE 273 Cb -0.16 -4.08 -0.04 0.00 0.01 0.00 0.00 42.46 38.18 2jji s ILE 273 CO 0.05 -0.27 1.35 -2.84 0.00 0.00 0.00 174.94 173.23 2jji s PRO 274 N 2.76 3.08 0.28 2.79 0.02 -1.26 -1.58 135.00 141.10 2jji s PRO 274 Ca 0.26 2.22 0.01 0.00 0.02 0.00 0.00 61.00 63.52 2jji s PRO 274 Cb -0.14 -2.22 0.58 0.00 0.02 0.00 0.00 34.50 32.74 2jji s PRO 274 CO 0.14 -1.23 1.80 0.78 -0.33 0.00 0.00 177.00 178.16 2jji h GLY 275 N 1.37 1.59 1.69 0.52 0.00 -1.73 -0.79 103.07 105.72 2jji h GLY 275 Ca -0.51 -0.36 0.04 0.00 0.00 0.00 0.00 47.33 46.50 2jji h GLY 275 CO 0.57 0.05 0.11 -0.55 0.00 0.00 0.00 176.54 176.72 2jji h ASP 276 N 0.83 0.00 1.05 0.19 3.32 -1.90 0.13 116.42 120.04 2jji h ASP 276 Ca 0.50 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.55 2jji h ASP 276 Cb 0.62 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.17 2jji h ASP 276 CO -0.32 0.00 0.00 1.88 -1.72 0.00 0.00 179.24 179.08 2jji h TYR 277 N 0.00 0.00 0.00 4.55 -1.99 -1.50 -2.85 116.97 115.18 2jji h TYR 277 Ca 0.07 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.80 2jji h TYR 277 Cb 0.30 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.03 2jji h TYR 277 CO 0.00 0.00 -0.49 -0.89 -0.00 0.00 0.00 178.16 176.78 2jji n ILE 278 N -3.05 0.10 -2.58 -2.88 5.41 0.03 -4.56 119.36 111.83 2jji n ILE 278 Ca 0.01 -0.08 -0.41 0.00 1.00 0.00 0.00 62.75 63.26 2jji n ILE 278 Cb 0.31 0.06 -0.03 0.00 -0.71 0.00 0.00 39.64 39.27 2jji n ILE 278 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 2jji s ASP 279 N -3.36 6.17 0.09 4.38 2.15 -1.08 -0.40 116.67 124.62 2jji s ASP 279 Ca 0.10 -0.48 0.02 0.00 0.43 0.00 0.00 52.55 52.61 2jji s ASP 279 Cb 0.16 -2.55 -0.24 0.00 -0.30 0.00 0.00 42.92 39.99 2jji s ASP 279 CO 0.69 -1.78 1.18 0.15 -0.17 0.00 0.00 175.17 175.23 2jji h PHE 280 N 9.96 0.23 0.00 -5.34 3.57 -1.53 -3.48 116.94 120.35 2jji h PHE 280 Ca -0.28 -0.17 0.00 0.00 3.53 0.00 0.00 57.97 61.05 2jji h PHE 280 Cb 1.05 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.78 2jji h PHE 280 CO 1.11 1.14 0.00 0.41 -2.23 0.00 0.00 178.31 178.74 2jji n GLY 281 N 1.45 0.93 3.77 2.40 0.00 -1.24 -4.84 105.19 107.66 2jji n GLY 281 Ca -0.05 -1.45 -0.39 0.00 0.00 0.00 0.00 46.02 44.13 2jji n GLY 281 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2jji s PRO 282 N -1.80 3.81 0.52 1.61 0.02 -1.26 -0.25 135.00 137.65 2jji s PRO 282 Ca 0.00 2.14 0.29 0.00 0.02 0.00 0.00 61.00 63.45 2jji s PRO 282 Cb 0.00 -2.64 1.40 0.00 0.02 0.00 0.00 34.50 33.28 2jji s PRO 282 CO 0.00 -0.62 2.03 -0.84 -0.33 0.00 0.00 177.00 177.24 2jji h ILE 283 N 2.25 0.46 -2.79 2.83 3.07 -1.50 -3.43 117.51 118.40 2jji h ILE 283 Ca -0.50 -0.62 -0.06 0.00 1.55 0.00 0.00 64.86 65.23 2jji h ILE 283 Cb 1.25 1.43 -0.16 0.00 -0.27 0.00 0.00 36.82 39.07 2jji h ILE 283 CO 0.61 0.12 0.03 -0.94 -1.05 0.00 0.00 178.15 176.92 2jji s SER 284 N -6.04 -0.43 0.08 2.16 1.04 -1.26 -5.07 113.70 104.19 2jji s SER 284 Ca -0.02 0.16 -0.34 0.00 0.48 0.00 0.00 55.95 56.23 2jji s SER 284 Cb 0.12 0.49 -0.13 0.00 0.10 0.00 0.00 66.02 66.60 2jji s SER 284 CO 0.58 -0.72 1.66 0.41 0.98 0.00 0.00 173.24 176.15 2jji n THR 285 N 0.40 0.18 -0.71 2.02 -1.04 -1.26 -1.10 114.28 112.77 2jji n THR 285 Ca -0.18 -0.03 0.00 0.00 -2.04 0.00 0.00 64.05 61.80 2jji n THR 285 Cb 0.60 -1.62 0.00 0.00 -1.82 0.00 0.00 70.33 67.49 2jji n THR 285 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2jji n GLY 286 N 3.69 0.85 3.75 3.41 0.00 -1.26 -5.04 105.19 110.59 2jji n GLY 286 Ca 0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 2jji n GLY 286 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2jji s SER 287 N -2.98 4.52 0.00 1.61 0.15 -0.26 -4.94 113.70 111.80 2jji s SER 287 Ca 0.00 2.04 0.24 0.00 0.70 0.00 0.00 55.95 58.92 2jji s SER 287 Cb 0.00 -2.55 0.27 0.00 -1.71 0.00 0.00 66.02 62.03 2jji s SER 287 CO 0.00 -2.03 1.25 -1.54 1.20 0.00 0.00 173.24 172.13 2jji n SER 288 N -2.99 1.31 -4.57 5.45 3.41 -1.26 -4.89 113.62 110.07 2jji n SER 288 Ca 0.11 -1.04 -0.34 0.00 -0.26 0.00 0.00 58.87 57.33 2jji n SER 288 Cb 0.52 0.43 -0.11 0.00 -0.26 0.00 0.00 64.21 64.79 2jji n SER 288 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2jji s SER 289 N -2.65 4.93 0.19 4.04 0.01 -1.26 -1.30 113.70 117.66 2jji s SER 289 Ca 0.17 -0.02 0.11 0.00 1.31 0.00 0.00 55.95 57.53 2jji s SER 289 Cb 0.18 -1.58 -0.04 0.00 0.21 0.00 0.00 66.02 64.79 2jji s SER 289 CO 0.63 0.27 -0.24 0.00 0.41 0.00 0.00 173.24 174.31 2jji s PHE 291 N -1.68 3.66 0.40 0.00 5.36 0.66 -1.33 117.98 125.04 2jji s PHE 291 Ca 0.20 0.87 -0.24 0.00 -0.96 0.00 0.00 56.93 56.81 2jji s PHE 291 Cb -0.08 -2.27 -0.09 0.00 -0.34 0.00 0.00 43.02 40.24 2jji s PHE 291 CO 0.10 0.57 1.01 0.20 -1.46 0.00 0.00 175.22 175.64 2jji s GLY 292 N -0.74 2.68 0.00 13.12 0.00 -0.62 -1.58 107.32 120.19 2jji s GLY 292 Ca 0.22 0.62 0.25 0.00 0.00 0.00 0.00 44.72 45.81 2jji s GLY 292 CO 0.11 1.02 1.45 0.61 0.00 0.00 0.00 173.10 176.29 2jji n GLY 293 N 0.20 -1.04 3.33 0.20 0.00 0.47 -4.70 105.19 103.65 2jji n GLY 293 Ca 0.05 -0.37 -0.34 0.00 0.00 0.00 0.00 46.02 45.36 2jji n GLY 293 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jji s ILE 294 N -2.84 3.22 0.15 -0.61 1.01 -1.26 -1.81 121.20 119.06 2jji s ILE 294 Ca 0.15 -0.57 0.01 0.00 0.00 0.00 0.00 60.65 60.24 2jji s ILE 294 Cb 0.18 -2.42 -0.04 0.00 0.01 0.00 0.00 42.46 40.19 2jji s ILE 294 CO 0.65 0.47 0.02 -1.10 0.00 0.00 0.00 174.94 174.97 2jji s GLN 295 N 1.01 1.01 0.22 2.79 -1.52 -0.30 -4.82 119.66 118.05 2jji s GLN 295 Ca -0.00 -1.48 -0.30 0.00 -1.95 0.00 0.00 55.36 51.63 2jji s GLN 295 Cb -0.15 -0.07 -0.09 0.00 -0.22 0.00 0.00 33.01 32.49 2jji s GLN 295 CO -0.01 -0.17 1.16 0.45 -0.25 0.00 0.00 175.29 176.47 2jji s SER 296 N -3.11 7.15 0.00 5.90 0.15 -1.26 -1.48 113.70 121.04 2jji s SER 296 Ca 0.23 2.25 0.27 0.00 0.70 0.00 0.00 55.95 59.40 2jji s SER 296 Cb 0.07 -2.61 1.18 0.00 -1.71 0.00 0.00 66.02 62.94 2jji s SER 296 CO 0.02 -0.29 1.81 -1.54 1.20 0.00 0.00 173.24 174.44 2jji n SER 297 N 1.99 1.18 -0.14 5.45 3.41 0.42 -4.48 113.62 121.44 2jji n SER 297 Ca 0.02 -1.43 0.07 0.00 -0.26 0.00 0.00 58.87 57.27 2jji n SER 297 Cb 0.45 -0.01 0.38 0.00 -0.26 0.00 0.00 64.21 64.77 2jji n SER 297 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2jji h ALA 298 N 4.22 1.75 0.00 7.33 0.00 -1.92 -0.40 119.26 130.24 2jji h ALA 298 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2jji h ALA 298 Cb 0.38 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2jji h ALA 298 CO 0.00 0.14 0.00 0.78 0.00 0.00 0.00 179.25 180.17 2jji h GLY 299 N 0.68 0.00 0.74 0.00 0.00 -1.98 -3.31 103.07 99.20 2jji h GLY 299 Ca 0.29 0.00 -0.36 0.00 0.00 0.00 0.00 47.33 47.26 2jji h GLY 299 CO -0.09 0.00 -1.89 -2.22 0.00 0.00 0.00 176.54 172.34 2jji h ILE 300 N 0.00 0.76 0.00 2.60 2.04 -1.40 -3.48 117.51 118.03 2jji h ILE 300 Ca 0.00 -2.41 0.00 0.00 1.00 0.00 0.00 64.86 63.45 2jji h ILE 300 Cb 0.77 2.62 0.00 0.00 -0.74 0.00 0.00 36.82 39.48 2jji h ILE 300 CO 0.00 0.89 0.00 0.61 0.00 0.00 0.00 178.15 179.65 2jji n GLY 301 N 1.94 0.44 3.25 5.37 0.00 -0.82 -5.05 105.19 110.32 2jji n GLY 301 Ca -0.29 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.60 2jji n GLY 301 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2jji s ILE 302 N -2.15 0.02 0.19 -0.61 1.10 -1.26 -5.09 121.20 113.40 2jji s ILE 302 Ca 0.00 -0.13 -0.30 0.00 -0.51 0.00 0.00 60.65 59.71 2jji s ILE 302 Cb 0.00 -0.54 -0.08 0.00 0.15 0.00 0.00 42.46 41.99 2jji s ILE 302 CO 0.00 -0.07 1.01 0.20 -2.11 0.00 0.00 174.94 173.97 2jji s ASN 303 N -0.23 7.45 -0.18 4.50 -0.87 -1.26 -4.84 114.94 119.51 2jji s ASN 303 Ca -0.04 1.99 0.00 0.00 -1.57 0.00 0.00 52.86 53.24 2jji s ASN 303 Cb -0.03 -2.60 0.04 0.00 -0.02 0.00 0.00 41.25 38.64 2jji s ASN 303 CO 0.02 -0.05 -0.08 -0.63 -2.57 0.00 0.00 177.10 173.79 2jji s ILE 304 N -0.59 1.40 -1.07 0.60 1.01 -0.29 -1.47 121.20 120.80 2jji s ILE 304 Ca 0.45 -0.83 -0.17 0.00 0.00 0.00 0.00 60.65 60.10 2jji s ILE 304 Cb -0.27 -1.52 0.13 0.00 0.01 0.00 0.00 42.46 40.81 2jji s ILE 304 CO 0.33 0.15 1.32 -0.36 0.00 0.00 0.00 174.94 176.39 2jji s PHE 305 N 1.50 3.16 0.00 3.97 0.08 0.59 -1.20 117.98 126.08 2jji s PHE 305 Ca -0.00 -1.61 0.00 0.00 0.12 0.00 0.00 56.93 55.44 2jji s PHE 305 Cb -0.16 -4.38 0.00 0.00 -0.57 0.00 0.00 43.02 37.91 2jji s PHE 305 CO -0.08 -1.54 0.00 0.41 -0.10 0.00 0.00 175.22 173.91 2jji n GLY 306 N 5.17 -0.38 0.29 4.36 0.00 -1.09 -1.27 105.19 112.27 2jji n GLY 306 Ca 0.32 -1.76 0.06 0.00 0.00 0.00 0.00 46.02 44.63 2jji n GLY 306 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2jji h ASP 307 N 0.00 0.28 -1.01 1.61 3.32 0.23 -1.43 116.42 119.42 2jji h ASP 307 Ca 0.00 -0.01 0.09 0.00 0.02 0.00 0.00 57.03 57.13 2jji h ASP 307 Cb 0.00 -0.07 -0.07 0.00 0.22 0.00 0.00 39.33 39.41 2jji h ASP 307 CO 0.00 0.20 0.65 0.58 -1.72 0.00 0.00 179.24 178.94 2jji h VAL 308 N 0.32 1.02 0.13 -1.35 2.07 -1.55 -0.51 116.25 116.39 2jji h VAL 308 Ca 0.10 -0.38 -0.22 0.00 0.82 0.00 0.00 66.70 67.02 2jji h VAL 308 Cb 0.01 -0.19 0.01 0.00 -1.52 0.00 0.00 31.29 29.61 2jji h VAL 308 CO -0.02 0.20 -1.05 0.00 0.02 0.00 0.00 177.57 176.72 2jji h ALA 309 N 1.49 0.01 -0.01 1.67 0.00 -1.63 -3.38 119.26 117.41 2jji h ALA 309 Ca 0.46 -0.85 -0.09 0.00 0.00 0.00 0.00 54.91 54.43 2jji h ALA 309 Cb 0.29 0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2jji h ALA 309 CO -0.21 0.55 -0.40 -0.07 0.00 0.00 0.00 179.25 179.11 2jji h LEU 310 N -0.35 0.03 0.00 0.00 3.38 -1.08 -2.57 115.31 114.72 2jji h LEU 310 Ca -0.21 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.75 2jji h LEU 310 Cb 1.69 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.43 2jji h LEU 310 CO 0.11 0.43 0.00 2.29 0.09 0.00 0.00 178.44 181.37 2jji n LYS 311 N -4.05 0.02 0.00 1.13 2.85 -0.22 -1.82 118.16 116.07 2jji n LYS 311 Ca -0.02 0.14 0.15 0.00 -1.05 0.00 0.00 58.31 57.53 2jji n LYS 311 Cb 0.44 -1.50 0.71 0.00 -0.65 0.00 0.00 35.03 34.03 2jji n LYS 311 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2jji n ALA 312 N -1.49 2.68 -2.20 0.58 0.00 -0.97 -4.70 120.51 114.42 2jji n ALA 312 Ca 0.05 -0.28 -0.12 0.00 0.00 0.00 0.00 53.44 53.09 2jji n ALA 312 Cb 0.24 -1.36 -0.10 0.00 0.00 0.00 0.00 19.45 18.23 2jji n ALA 312 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jji s ALA 313 N -2.20 1.14 -0.26 0.00 0.00 -0.76 -4.32 121.76 115.36 2jji s ALA 313 Ca 0.37 -1.50 -0.15 0.00 0.00 0.00 0.00 51.96 50.69 2jji s ALA 313 Cb 0.21 0.49 -0.04 0.00 0.00 0.00 0.00 23.12 23.78 2jji s ALA 313 CO 0.41 -0.33 0.39 0.12 0.00 0.00 0.00 175.76 176.35 2jji s PHE 314 N -3.72 3.26 -0.13 0.00 5.36 0.39 -4.57 117.98 118.57 2jji s PHE 314 Ca 0.20 0.46 0.02 0.00 -0.96 0.00 0.00 56.93 56.66 2jji s PHE 314 Cb 0.06 -2.59 0.00 0.00 -0.34 0.00 0.00 43.02 40.16 2jji s PHE 314 CO 0.01 -0.21 -0.20 0.08 -1.46 0.00 0.00 175.22 173.43 2jji s VAL 315 N 2.02 2.30 -0.28 3.12 1.01 -0.79 -1.43 120.40 126.36 2jji s VAL 315 Ca 0.16 -0.91 -0.07 0.00 0.00 0.00 0.00 61.98 61.16 2jji s VAL 315 Cb -0.16 -1.92 -0.00 0.00 0.00 0.00 0.00 36.38 34.30 2jji s VAL 315 CO 0.10 0.54 0.08 -0.69 0.00 0.00 0.00 175.10 175.12 2jji s VAL 316 N 0.59 4.03 -0.59 2.92 1.01 -0.09 -0.39 120.40 127.88 2jji s VAL 316 Ca -0.11 -0.57 -0.17 0.00 0.00 0.00 0.00 61.98 61.13 2jji s VAL 316 Cb -0.16 -3.03 0.12 0.00 0.00 0.00 0.00 36.38 33.31 2jji s VAL 316 CO 0.03 0.15 0.62 -0.36 0.00 0.00 0.00 175.10 175.54 2jji s PHE 317 N 1.53 3.17 -0.45 5.22 0.40 0.48 -0.83 117.98 127.49 2jji s PHE 317 Ca 0.04 -1.19 -0.22 0.00 -0.60 0.00 0.00 56.93 54.96 2jji s PHE 317 Cb -0.17 -3.90 0.03 0.00 0.51 0.00 0.00 43.02 39.49 2jji s PHE 317 CO 0.02 -1.15 0.71 1.21 0.70 0.00 0.00 175.22 176.72 2jji s ASN 318 N 3.53 6.36 -0.15 1.36 2.47 -0.33 -1.68 114.94 126.49 2jji s ASN 318 Ca 0.08 -0.27 0.08 0.00 0.42 0.00 0.00 52.86 53.17 2jji s ASN 318 Cb -0.26 -2.35 0.51 0.00 -1.45 0.00 0.00 41.25 37.70 2jji s ASN 318 CO 0.03 -0.86 1.29 0.61 -3.72 0.00 0.00 177.10 174.45 2jji n GLY 319 N 5.02 2.47 3.61 1.21 0.00 0.11 -2.20 105.19 115.41 2jji n GLY 319 Ca -0.00 -0.58 -0.28 0.00 0.00 0.00 0.00 46.02 45.16 2jji n GLY 319 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jji s ALA 320 N -2.09 0.42 0.31 4.61 0.00 -1.24 -4.89 121.76 118.87 2jji s ALA 320 Ca 0.34 -0.34 0.06 0.00 0.00 0.00 0.00 51.96 52.02 2jji s ALA 320 Cb 0.26 -3.14 0.74 0.00 0.00 0.00 0.00 23.12 20.98 2jji s ALA 320 CO 0.10 -3.23 1.80 1.15 0.00 0.00 0.00 175.76 175.58 2jji h THR 321 N -2.18 0.76 -3.24 0.00 2.02 -1.97 -2.90 112.91 105.40 2jji h THR 321 Ca -0.57 -0.27 -0.74 0.00 0.77 0.00 0.00 66.41 65.60 2jji h THR 321 Cb 1.34 -0.09 -0.25 0.00 -1.74 0.00 0.00 68.15 67.41 2jji h THR 321 CO 0.55 0.14 -0.31 -0.89 0.37 0.00 0.00 175.52 175.38 2jji s THR 322 N -5.82 4.94 0.57 3.16 2.01 -1.26 -5.10 115.64 114.13 2jji s THR 322 Ca -0.11 -1.39 -0.16 0.00 0.31 0.00 0.00 61.69 60.34 2jji s THR 322 Cb 0.24 -4.09 -0.05 0.00 0.01 0.00 0.00 72.50 68.61 2jji s THR 322 CO 0.80 -0.72 1.04 -2.16 -0.69 0.00 0.00 174.62 172.89 2jji s PRO 323 N 1.55 3.51 0.11 4.92 0.04 -1.10 -4.93 135.00 139.11 2jji s PRO 323 Ca 0.04 1.13 -0.02 0.00 0.04 0.00 0.00 61.00 62.19 2jji s PRO 323 Cb -0.27 -2.06 -0.04 0.00 0.04 0.00 0.00 34.50 32.17 2jji s PRO 323 CO 0.03 -0.65 0.05 0.95 0.04 0.00 0.00 177.00 177.43 2jji s THR 324 N -2.51 0.13 -0.10 1.26 -4.23 -0.94 -3.47 115.64 105.78 2jji s THR 324 Ca 0.62 -1.83 0.01 0.00 -1.18 0.00 0.00 61.69 59.31 2jji s THR 324 Cb -0.14 -1.87 -0.02 0.00 1.34 0.00 0.00 72.50 71.81 2jji s THR 324 CO 0.35 -0.60 -0.14 -0.22 -0.54 0.00 0.00 174.62 173.48 2jji s LEU 325 N -3.00 2.72 -0.05 4.79 2.96 -0.46 -1.19 118.68 124.45 2jji s LEU 325 Ca 0.19 -0.29 0.05 0.00 -0.22 0.00 0.00 54.13 53.86 2jji s LEU 325 Cb 0.07 -1.59 -0.02 0.00 0.50 0.00 0.00 46.19 45.15 2jji s LEU 325 CO -0.02 0.22 -0.20 -0.83 -1.32 0.00 0.00 176.35 174.21 2jji s GLY 326 N 0.02 1.41 0.01 7.98 0.00 -0.01 -0.46 107.32 116.26 2jji s GLY 326 Ca -0.04 -1.03 0.07 0.00 0.00 0.00 0.00 44.72 43.72 2jji s GLY 326 CO 0.04 -0.75 -0.21 -1.36 0.00 0.00 0.00 173.10 170.82 2jji s PHE 327 N -0.51 1.87 0.03 1.90 0.40 -0.18 -0.91 117.98 120.58 2jji s PHE 327 Ca 0.07 -0.36 0.01 0.00 -0.60 0.00 0.00 56.93 56.05 2jji s PHE 327 Cb -0.11 -1.17 -0.02 0.00 0.51 0.00 0.00 43.02 42.23 2jji s PHE 327 CO 0.01 0.02 -0.06 0.00 0.70 0.00 0.00 175.22 175.89 2jji s ALA 328 N -0.61 0.39 0.81 5.36 0.00 -0.51 -1.11 121.76 126.09 2jji s ALA 328 Ca 0.08 -0.60 -0.10 0.00 0.00 0.00 0.00 51.96 51.34 2jji s ALA 328 Cb -0.08 0.05 0.08 0.00 0.00 0.00 0.00 23.12 23.17 2jji s ALA 328 CO 0.00 -0.04 1.11 -1.12 0.00 0.00 0.00 175.76 175.71 2jji s SER 329 N -1.26 4.06 0.00 0.00 0.01 -1.26 -0.46 113.70 114.79 2jji s SER 329 Ca -0.10 1.94 0.00 0.00 1.31 0.00 0.00 55.95 59.10 2jji s SER 329 Cb -0.08 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.61 2jji s SER 329 CO -0.00 -2.34 0.00 2.29 0.41 0.00 0.00 173.24 173.60