#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jpt s ILE 2 N 0.00 4.76 0.08 0.53 1.01 -1.26 -5.00 121.20 121.32 1jpt s ILE 2 Ca 0.00 1.70 -0.26 0.00 0.00 0.00 0.00 60.65 62.09 1jpt s ILE 2 Cb 0.00 -4.21 -0.06 0.00 0.01 0.00 0.00 42.46 38.20 1jpt s ILE 2 CO 0.00 -0.16 0.79 -1.10 0.00 0.00 0.00 174.94 174.48 1jpt s GLN 3 N 3.03 4.54 -0.20 2.79 -1.52 -1.26 -4.78 119.66 122.26 1jpt s GLN 3 Ca 0.38 1.14 -0.02 0.00 -1.95 0.00 0.00 55.36 54.92 1jpt s GLN 3 Cb -0.15 -3.34 0.00 0.00 -0.22 0.00 0.00 33.01 29.30 1jpt s GLN 3 CO 0.08 0.34 -0.10 -1.64 -0.25 0.00 0.00 175.29 173.72 1jpt s MET 4 N -0.31 3.24 -0.24 2.91 -1.94 -1.26 -1.03 119.30 120.67 1jpt s MET 4 Ca 0.39 -0.70 -0.01 0.00 -1.71 0.00 0.00 55.69 53.66 1jpt s MET 4 Cb -0.21 -2.83 0.03 0.00 2.01 0.00 0.00 34.83 33.83 1jpt s MET 4 CO 0.25 -0.17 -0.09 0.99 -0.01 0.00 0.00 175.02 175.99 1jpt s THR 5 N 1.32 2.70 0.21 2.05 2.01 -0.06 -4.11 115.64 119.76 1jpt s THR 5 Ca 0.04 -1.06 -0.03 0.00 0.31 0.00 0.00 61.69 60.95 1jpt s THR 5 Cb -0.14 -2.36 -0.05 0.00 0.01 0.00 0.00 72.50 69.97 1jpt s THR 5 CO -0.06 0.23 0.42 -1.10 -0.69 0.00 0.00 174.62 173.43 1jpt s GLN 6 N 1.30 3.57 -0.07 4.92 -0.21 -1.26 -0.52 119.66 127.38 1jpt s GLN 6 Ca 0.00 -0.21 -0.04 0.00 0.02 0.00 0.00 55.36 55.13 1jpt s GLN 6 Cb -0.16 -2.80 0.03 0.00 1.00 0.00 0.00 33.01 31.08 1jpt s GLN 6 CO -0.06 0.37 0.15 -1.12 -2.12 0.00 0.00 175.29 172.52 1jpt s SER 7 N -3.01 -0.13 0.66 5.90 0.01 -0.36 -4.57 113.70 112.20 1jpt s SER 7 Ca 0.40 0.32 -0.02 0.00 1.31 0.00 0.00 55.95 57.96 1jpt s SER 7 Cb -0.11 0.23 0.08 0.00 0.21 0.00 0.00 66.02 66.44 1jpt s SER 7 CO 0.28 -0.12 0.56 -0.81 0.41 0.00 0.00 173.24 173.55 1jpt n PRO 8 N 3.89 0.03 0.13 12.44 -0.04 -1.26 -0.68 135.00 149.51 1jpt n PRO 8 Ca -0.23 -1.33 0.03 0.00 -0.04 0.00 0.00 63.50 61.94 1jpt n PRO 8 Cb 0.54 -0.43 0.02 0.00 -0.04 0.00 0.00 33.50 33.59 1jpt n PRO 8 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1jpt h SER 9 N -0.44 0.00 -5.02 3.54 0.02 -1.84 -3.42 113.55 106.39 1jpt h SER 9 Ca -0.18 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.72 1jpt h SER 9 Cb 0.63 0.00 -0.15 0.00 0.14 0.00 0.00 62.40 63.02 1jpt h SER 9 CO 0.18 0.44 0.09 -0.94 -1.14 0.00 0.00 176.83 175.46 1jpt s SER 10 N -6.28 -0.48 0.17 3.07 1.04 -1.26 -1.51 113.70 108.44 1jpt s SER 10 Ca 0.03 0.17 -0.23 0.00 0.48 0.00 0.00 55.95 56.40 1jpt s SER 10 Cb 0.08 0.52 0.07 0.00 0.10 0.00 0.00 66.02 66.78 1jpt s SER 10 CO 0.75 -0.77 0.62 -1.48 0.98 0.00 0.00 173.24 173.34 1jpt s LEU 11 N -2.10 -0.53 0.02 2.42 0.05 -0.60 -4.92 118.68 113.01 1jpt s LEU 11 Ca -0.04 -0.06 0.02 0.00 0.05 0.00 0.00 54.13 54.10 1jpt s LEU 11 Cb -0.00 2.59 -0.01 0.00 -2.05 0.00 0.00 46.19 46.71 1jpt s LEU 11 CO -0.03 -0.99 -0.06 -0.94 -0.55 0.00 0.00 176.35 173.77 1jpt s SER 12 N -2.76 0.71 0.17 1.48 1.04 -1.26 -0.61 113.70 112.48 1jpt s SER 12 Ca 0.02 -0.30 -0.11 0.00 0.48 0.00 0.00 55.95 56.04 1jpt s SER 12 Cb -0.01 -0.02 0.00 0.00 0.10 0.00 0.00 66.02 66.09 1jpt s SER 12 CO -0.11 -0.06 0.35 0.00 0.98 0.00 0.00 173.24 174.40 1jpt s ALA 13 N -0.68 -0.27 0.51 5.32 0.00 -0.80 -4.89 121.76 120.94 1jpt s ALA 13 Ca -0.03 -0.69 -0.07 0.00 0.00 0.00 0.00 51.96 51.17 1jpt s ALA 13 Cb -0.06 0.84 -0.04 0.00 0.00 0.00 0.00 23.12 23.87 1jpt s ALA 13 CO 0.00 -0.68 0.84 -1.12 0.00 0.00 0.00 175.76 174.79 1jpt s SER 14 N -2.94 6.27 0.24 0.00 0.01 -1.26 0.36 113.70 116.39 1jpt s SER 14 Ca 0.14 1.04 -0.31 0.00 1.31 0.00 0.00 55.95 58.13 1jpt s SER 14 Cb 0.02 -2.30 -0.12 0.00 0.21 0.00 0.00 66.02 63.83 1jpt s SER 14 CO -0.01 -0.63 1.64 0.52 0.41 0.00 0.00 173.24 175.17 1jpt n VAL 15 N -2.30 0.50 0.00 3.43 0.31 -1.26 -1.20 118.33 117.80 1jpt n VAL 15 Ca 0.02 -0.12 0.00 0.00 -0.01 0.00 0.00 64.34 64.22 1jpt n VAL 15 Cb 0.55 -1.91 0.00 0.00 -0.91 0.00 0.00 33.84 31.57 1jpt n VAL 15 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1jpt n GLY 16 N 3.03 2.45 3.82 2.92 0.00 0.86 -4.91 105.19 113.36 1jpt n GLY 16 Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.84 1jpt n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1jpt s ASP 17 N -1.54 5.37 -0.05 1.61 1.01 -0.34 -4.32 116.67 118.41 1jpt s ASP 17 Ca 0.00 1.61 -0.18 0.00 0.71 0.00 0.00 52.55 54.70 1jpt s ASP 17 Cb 0.00 -2.49 -0.05 0.00 1.01 0.00 0.00 42.92 41.39 1jpt s ASP 17 CO 0.00 -1.45 0.49 -0.60 0.21 0.00 0.00 175.17 173.82 1jpt s ARG 18 N -5.05 4.21 -0.06 8.23 3.52 -1.24 -0.18 118.95 128.37 1jpt s ARG 18 Ca 0.58 0.51 0.06 0.00 -0.13 0.00 0.00 55.73 56.75 1jpt s ARG 18 Cb -0.14 -3.34 -0.01 0.00 -1.56 0.00 0.00 34.95 29.90 1jpt s ARG 18 CO 0.55 0.39 -0.24 0.08 -0.81 0.00 0.00 175.30 175.27 1jpt s VAL 19 N -0.16 1.98 -0.07 7.11 1.01 0.17 -4.99 120.40 125.45 1jpt s VAL 19 Ca 0.26 -1.02 0.04 0.00 0.00 0.00 0.00 61.98 61.26 1jpt s VAL 19 Cb -0.16 -1.68 0.00 0.00 0.00 0.00 0.00 36.38 34.53 1jpt s VAL 19 CO 0.13 0.55 -0.19 -0.89 0.00 0.00 0.00 175.10 174.70 1jpt s THR 20 N -0.06 1.63 -0.04 3.92 2.01 -1.26 -0.72 115.64 121.11 1jpt s THR 20 Ca -0.06 -0.79 0.03 0.00 0.31 0.00 0.00 61.69 61.17 1jpt s THR 20 Cb -0.14 -1.42 0.01 0.00 0.01 0.00 0.00 72.50 70.95 1jpt s THR 20 CO 0.04 0.46 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.69 1jpt s ILE 21 N 0.28 1.01 0.31 1.82 1.01 -0.40 -4.77 121.20 120.45 1jpt s ILE 21 Ca -0.12 -0.45 0.09 0.00 0.00 0.00 0.00 60.65 60.17 1jpt s ILE 21 Cb -0.15 -0.90 -0.05 0.00 0.01 0.00 0.00 42.46 41.37 1jpt s ILE 21 CO 0.05 0.31 0.01 0.42 0.00 0.00 0.00 174.94 175.74 1jpt s THR 22 N 0.36 3.01 -0.11 2.92 -4.23 0.14 -0.71 115.64 117.03 1jpt s THR 22 Ca -0.07 -1.93 -0.05 0.00 -1.18 0.00 0.00 61.69 58.45 1jpt s THR 22 Cb -0.12 -2.81 0.05 0.00 1.34 0.00 0.00 72.50 70.96 1jpt s THR 22 CO 0.02 -0.28 0.25 0.00 -0.54 0.00 0.00 174.62 174.06 1jpt s ARG 24 N 1.26 2.67 0.08 0.00 3.52 0.32 -0.99 118.95 125.81 1jpt s ARG 24 Ca -0.09 -0.75 -0.11 0.00 -0.13 0.00 0.00 55.73 54.65 1jpt s ARG 24 Cb -0.10 -2.07 -0.06 0.00 -1.56 0.00 0.00 34.95 31.16 1jpt s ARG 24 CO -0.09 0.11 0.43 0.00 -0.81 0.00 0.00 175.30 174.95 1jpt s ALA 25 N 0.49 3.69 0.45 6.12 0.00 0.09 -0.88 121.76 131.72 1jpt s ALA 25 Ca -0.16 -0.31 0.41 0.00 0.00 0.00 0.00 51.96 51.90 1jpt s ALA 25 Cb -0.17 -2.34 2.05 0.00 0.00 0.00 0.00 23.12 22.66 1jpt s ALA 25 CO 0.06 0.53 2.23 0.66 0.00 0.00 0.00 175.76 179.24 1jpt h SER 26 N 3.80 0.00 -5.10 0.00 4.64 -1.41 -3.44 113.55 112.04 1jpt h SER 26 Ca -0.49 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.82 1jpt h SER 26 Cb 1.20 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 63.20 1jpt h SER 26 CO 0.66 0.00 0.04 0.00 -0.87 0.00 0.00 176.83 176.66 1jpt s ARG 27 N -3.97 1.49 -0.17 4.77 1.70 -1.26 -4.98 118.95 116.52 1jpt s ARG 27 Ca -0.03 -0.95 -0.40 0.00 -0.47 0.00 0.00 55.73 53.88 1jpt s ARG 27 Cb 0.11 0.53 -0.17 0.00 -0.57 0.00 0.00 34.95 34.86 1jpt s ARG 27 CO 0.45 -0.64 1.57 -3.47 -1.08 0.00 0.00 175.30 172.13 1jpt n ASP 28 N -0.37 1.91 -0.45 -2.89 -0.08 -1.26 -4.72 116.55 108.68 1jpt n ASP 28 Ca -0.07 1.10 0.04 0.00 -1.51 0.00 0.00 54.79 54.35 1jpt n ASP 28 Cb 0.62 -1.12 0.09 0.00 2.34 0.00 0.00 41.12 43.05 1jpt n ASP 28 CO 0.00 0.00 0.00 2.30 0.12 0.00 0.00 177.20 179.62 1jpt n ILE 29 N 3.73 0.70 -4.01 5.18 -5.35 -0.86 -4.99 119.36 113.75 1jpt n ILE 29 Ca 0.24 -0.85 -0.30 0.00 -0.27 0.00 0.00 62.75 61.57 1jpt n ILE 29 Cb 0.13 0.70 -0.00 0.00 -1.74 0.00 0.00 39.64 38.73 1jpt n ILE 29 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 1jpt n LYS 30 N 0.34 -4.11 -0.87 6.28 5.02 -1.25 -1.49 118.16 122.07 1jpt n LYS 30 Ca 0.08 0.48 0.00 0.00 -2.02 0.00 0.00 58.31 56.84 1jpt n LYS 30 Cb 0.33 -5.09 0.00 0.00 -0.02 0.00 0.00 35.03 30.26 1jpt n LYS 30 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1jpt n SER 31 N -2.83 -2.72 -4.11 4.39 7.64 -1.26 -4.89 113.62 109.84 1jpt n SER 31 Ca -0.07 0.00 -0.43 0.00 1.01 0.00 0.00 58.87 59.38 1jpt n SER 31 Cb 0.57 -1.99 0.00 0.00 -1.01 0.00 0.00 64.21 61.78 1jpt n SER 31 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1jpt n TYR 32 N -2.22 3.96 -3.82 1.43 4.01 -0.56 -2.67 117.16 117.30 1jpt n TYR 32 Ca 0.00 -2.96 -0.20 0.00 -0.16 0.00 0.00 57.90 54.59 1jpt n TYR 32 Cb 0.17 -2.42 -0.17 0.00 -0.31 0.00 0.00 39.34 36.61 1jpt n TYR 32 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 1jpt s LEU 33 N 2.27 0.72 0.21 7.72 1.98 -1.26 -1.35 118.68 128.98 1jpt s LEU 33 Ca 0.47 -0.02 0.10 0.00 -2.89 0.00 0.00 54.13 51.79 1jpt s LEU 33 Cb 0.08 -0.27 -0.04 0.00 0.66 0.00 0.00 46.19 46.61 1jpt s LEU 33 CO -0.01 -0.17 -0.12 0.20 -1.89 0.00 0.00 176.35 174.36 1jpt s ASN 34 N 1.62 4.05 -0.11 3.68 0.01 0.15 -0.44 114.94 123.90 1jpt s ASN 34 Ca -0.01 -0.71 0.03 0.00 -0.71 0.00 0.00 52.86 51.45 1jpt s ASN 34 Cb -0.13 -0.59 -0.00 0.00 0.41 0.00 0.00 41.25 40.94 1jpt s ASN 34 CO -0.03 0.08 -0.22 0.26 -1.51 0.00 0.00 177.10 175.68 1jpt s TRP 35 N -1.93 2.61 0.10 2.20 0.52 -0.55 -0.25 118.94 121.64 1jpt s TRP 35 Ca 0.26 -1.03 0.10 0.00 0.02 0.00 0.00 56.10 55.46 1jpt s TRP 35 Cb -0.08 -1.74 -0.04 0.00 -1.15 0.00 0.00 33.47 30.46 1jpt s TRP 35 CO 0.15 -0.41 -0.26 0.71 0.02 0.00 0.00 176.95 177.16 1jpt s TYR 36 N 0.40 2.34 -0.10 -1.98 1.51 -0.10 -0.58 117.35 118.84 1jpt s TYR 36 Ca -0.16 -0.37 0.02 0.00 -1.01 0.00 0.00 57.07 55.54 1jpt s TYR 36 Cb -0.17 -1.31 -0.02 0.00 -0.11 0.00 0.00 41.96 40.35 1jpt s TYR 36 CO 0.07 0.28 -0.15 -1.14 -1.11 0.00 0.00 175.55 173.49 1jpt s GLN 37 N -1.79 3.11 -0.11 -0.62 0.74 -0.05 -0.99 119.66 119.95 1jpt s GLN 37 Ca 0.14 -0.72 -0.00 0.00 0.05 0.00 0.00 55.36 54.82 1jpt s GLN 37 Cb -0.10 -2.51 0.02 0.00 1.10 0.00 0.00 33.01 31.52 1jpt s GLN 37 CO 0.05 0.31 -0.08 -1.14 -0.55 0.00 0.00 175.29 173.88 1jpt s GLN 38 N 0.09 1.49 0.31 1.67 0.74 0.47 -0.77 119.66 123.66 1jpt s GLN 38 Ca -0.07 -0.25 -0.04 0.00 0.05 0.00 0.00 55.36 55.05 1jpt s GLN 38 Cb -0.15 -1.54 -0.05 0.00 1.10 0.00 0.00 33.01 32.37 1jpt s GLN 38 CO 0.05 -0.25 0.58 0.15 -0.55 0.00 0.00 175.29 175.27 1jpt s LYS 39 N 1.65 3.61 0.15 1.67 1.02 -1.26 -1.36 119.74 125.22 1jpt s LYS 39 Ca 0.04 -0.01 -0.34 0.00 0.02 0.00 0.00 55.97 55.68 1jpt s LYS 39 Cb -0.13 -2.62 -0.15 0.00 -0.52 0.00 0.00 37.83 34.41 1jpt s LYS 39 CO -0.07 0.17 1.35 -2.30 -0.92 0.00 0.00 175.35 173.58 1jpt n PRO 40 N -1.14 1.49 -1.02 -1.68 -0.02 -1.26 -1.86 135.00 129.51 1jpt n PRO 40 Ca -0.02 0.54 -0.01 0.00 -2.02 0.00 0.00 63.50 61.99 1jpt n PRO 40 Cb 0.54 -2.17 -0.00 0.00 -0.02 0.00 0.00 33.50 31.85 1jpt n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1jpt n GLY 41 N 2.51 0.33 3.39 -1.23 0.00 -1.26 -5.00 105.19 103.93 1jpt n GLY 41 Ca 0.16 -0.04 -0.20 0.00 0.00 0.00 0.00 46.02 45.94 1jpt n GLY 41 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jpt s LYS 42 N -1.05 1.45 0.73 1.61 1.02 -0.78 -5.13 119.74 117.59 1jpt s LYS 42 Ca 0.00 -1.66 -0.13 0.00 0.02 0.00 0.00 55.97 54.21 1jpt s LYS 42 Cb 0.00 -1.32 0.04 0.00 -0.52 0.00 0.00 37.83 36.03 1jpt s LYS 42 CO 0.00 0.22 1.12 0.00 -0.92 0.00 0.00 175.35 175.77 1jpt s ALA 43 N -2.83 2.25 0.82 5.17 0.00 -1.26 -4.58 121.76 121.32 1jpt s ALA 43 Ca 0.25 0.49 -0.11 0.00 0.00 0.00 0.00 51.96 52.60 1jpt s ALA 43 Cb -0.02 -3.33 0.08 0.00 0.00 0.00 0.00 23.12 19.85 1jpt s ALA 43 CO 0.10 -1.67 1.10 -2.14 0.00 0.00 0.00 175.76 173.14 1jpt s PRO 44 N -4.42 1.89 -0.08 0.00 0.02 -1.26 -4.65 135.00 126.51 1jpt s PRO 44 Ca 0.66 1.14 0.01 0.00 0.02 0.00 0.00 61.00 62.83 1jpt s PRO 44 Cb -0.21 -1.86 0.02 0.00 0.02 0.00 0.00 34.50 32.48 1jpt s PRO 44 CO 0.49 -1.89 -0.09 0.21 -0.33 0.00 0.00 177.00 175.39 1jpt s LYS 45 N -4.88 1.43 0.52 5.54 2.20 0.05 -4.93 119.74 119.67 1jpt s LYS 45 Ca 0.62 -0.28 -0.21 0.00 -0.36 0.00 0.00 55.97 55.74 1jpt s LYS 45 Cb -0.18 -1.34 -0.06 0.00 -1.51 0.00 0.00 37.83 34.74 1jpt s LYS 45 CO 0.57 -0.10 1.21 0.54 -0.36 0.00 0.00 175.35 177.20 1jpt s VAL 46 N 1.09 2.81 -0.01 4.02 0.11 -1.26 -0.87 120.40 126.31 1jpt s VAL 46 Ca -0.07 0.57 -0.01 0.00 -2.93 0.00 0.00 61.98 59.54 1jpt s VAL 46 Cb -0.14 -3.27 -0.01 0.00 -1.53 0.00 0.00 36.38 31.43 1jpt s VAL 46 CO -0.01 -0.05 -0.03 0.18 -3.33 0.00 0.00 175.10 171.87 1jpt n LEU 47 N -0.94 0.29 -4.10 2.54 4.77 0.25 -4.85 117.00 114.97 1jpt n LEU 47 Ca 0.10 0.04 -0.22 0.00 -0.03 0.00 0.00 56.01 55.90 1jpt n LEU 47 Cb 0.48 -0.10 -0.15 0.00 -2.33 0.00 0.00 43.42 41.32 1jpt n LEU 47 CO 0.47 -0.07 -0.47 -0.63 -1.33 0.00 0.00 177.39 175.36 1jpt s ILE 48 N -2.04 1.06 0.14 -0.08 -1.09 -1.10 -0.91 121.20 117.19 1jpt s ILE 48 Ca -0.03 -0.57 0.06 0.00 -2.23 0.00 0.00 60.65 57.88 1jpt s ILE 48 Cb 0.01 -0.89 -0.04 0.00 -1.58 0.00 0.00 42.46 39.96 1jpt s ILE 48 CO 0.03 0.30 -0.13 -0.72 -1.23 0.00 0.00 174.94 173.20 1jpt s TYR 49 N -0.30 1.41 -1.46 3.97 1.13 -0.01 -1.48 117.35 120.61 1jpt s TYR 49 Ca 0.05 -0.62 -0.03 0.00 -1.41 0.00 0.00 57.07 55.06 1jpt s TYR 49 Cb -0.05 -0.71 0.03 0.00 -1.10 0.00 0.00 41.96 40.12 1jpt s TYR 49 CO -0.00 0.16 0.46 0.98 -2.51 0.00 0.00 175.55 174.64 1jpt n TYR 50 N 0.15 -1.65 0.00 -3.49 9.36 -1.17 -1.21 117.16 119.15 1jpt n TYR 50 Ca -0.13 0.75 0.00 0.00 3.32 0.00 0.00 57.90 61.84 1jpt n TYR 50 Cb 0.59 -3.56 0.00 0.00 -0.63 0.00 0.00 39.34 35.73 1jpt n TYR 50 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1jpt n ALA 51 N -4.42 0.00 -0.43 2.98 0.00 0.42 -4.13 120.51 114.93 1jpt n ALA 51 Ca -0.25 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.19 1jpt n ALA 51 Cb 0.65 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.10 1jpt n ALA 51 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1jpt n THR 52 N 0.00 0.00 -3.58 0.00 -2.24 -1.17 -3.05 114.28 104.23 1jpt n THR 52 Ca 0.00 -0.28 -0.37 0.00 -2.27 0.00 0.00 64.05 61.13 1jpt n THR 52 Cb 0.00 1.43 -0.06 0.00 -2.10 0.00 0.00 70.33 69.60 1jpt n THR 52 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1jpt s SER 53 N -0.01 6.58 -0.14 3.42 0.01 -0.35 -4.55 113.70 118.65 1jpt s SER 53 Ca 0.00 0.68 -0.26 0.00 1.31 0.00 0.00 55.95 57.68 1jpt s SER 53 Cb 0.00 -2.19 -0.02 0.00 0.21 0.00 0.00 66.02 64.02 1jpt s SER 53 CO 0.00 0.24 0.86 -0.22 0.41 0.00 0.00 173.24 174.53 1jpt s LEU 54 N -0.40 4.20 0.66 2.44 2.96 -1.26 -0.83 118.68 126.45 1jpt s LEU 54 Ca 0.19 1.25 -0.16 0.00 -0.22 0.00 0.00 54.13 55.19 1jpt s LEU 54 Cb -0.14 -3.29 0.00 0.00 0.50 0.00 0.00 46.19 43.26 1jpt s LEU 54 CO 0.08 -0.38 1.18 0.00 -1.32 0.00 0.00 176.35 175.90 1jpt s ALA 55 N 1.98 2.37 0.42 5.97 0.00 -0.09 -4.94 121.76 127.48 1jpt s ALA 55 Ca 0.40 0.83 -0.26 0.00 0.00 0.00 0.00 51.96 52.93 1jpt s ALA 55 Cb -0.17 -3.42 -0.10 0.00 0.00 0.00 0.00 23.12 19.43 1jpt s ALA 55 CO 0.14 -1.44 1.40 -0.85 0.00 0.00 0.00 175.76 175.02 1jpt n GLU 56 N -2.21 2.29 0.00 0.00 0.28 -1.26 -2.34 120.64 117.40 1jpt n GLU 56 Ca 0.13 0.81 0.00 0.00 -0.16 0.00 0.00 57.16 57.94 1jpt n GLU 56 Cb 0.51 -2.57 0.00 0.00 1.43 0.00 0.00 31.44 30.81 1jpt n GLU 56 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1jpt n GLY 57 N 0.61 2.89 3.75 -1.84 0.00 -1.26 -5.01 105.19 104.33 1jpt n GLY 57 Ca 0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 1jpt n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1jpt s VAL 58 N -2.92 4.69 0.40 1.61 1.01 -0.99 -5.02 120.40 119.19 1jpt s VAL 58 Ca 0.00 1.58 -0.26 0.00 0.00 0.00 0.00 61.98 63.30 1jpt s VAL 58 Cb 0.00 -4.09 -0.10 0.00 0.00 0.00 0.00 36.38 32.19 1jpt s VAL 58 CO 0.00 0.40 1.28 -2.65 0.00 0.00 0.00 175.10 174.13 1jpt n PRO 59 N 2.55 1.99 0.00 2.72 -0.02 -1.26 -4.88 135.00 136.10 1jpt n PRO 59 Ca -0.04 0.71 0.05 0.00 -2.02 0.00 0.00 63.50 62.20 1jpt n PRO 59 Cb 0.50 -2.38 0.23 0.00 -0.02 0.00 0.00 33.50 31.83 1jpt n PRO 59 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1jpt n SER 60 N 0.32 0.00 0.08 2.55 3.41 -1.26 -2.11 113.62 116.61 1jpt n SER 60 Ca 0.06 0.30 0.10 0.00 -0.26 0.00 0.00 58.87 59.07 1jpt n SER 60 Cb 0.39 -0.38 0.43 0.00 -0.26 0.00 0.00 64.21 64.39 1jpt n SER 60 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 1jpt n ARG 61 N -1.38 0.12 -3.41 4.33 1.85 -1.26 -4.63 116.66 112.29 1jpt n ARG 61 Ca 0.04 0.32 -0.38 0.00 -1.00 0.00 0.00 57.85 56.83 1jpt n ARG 61 Cb 0.09 -1.72 -0.06 0.00 -1.05 0.00 0.00 32.46 29.73 1jpt n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1jpt s PHE 62 N -3.17 3.59 -0.00 2.89 0.08 -0.90 -0.61 117.98 119.86 1jpt s PHE 62 Ca 0.06 0.91 -0.15 0.00 0.12 0.00 0.00 56.93 57.87 1jpt s PHE 62 Cb 0.10 -2.43 0.02 0.00 -0.57 0.00 0.00 43.02 40.14 1jpt s PHE 62 CO 0.37 0.36 0.32 -1.54 -0.10 0.00 0.00 175.22 174.63 1jpt s SER 63 N -0.06 -0.19 0.10 1.36 1.04 -0.13 -4.95 113.70 110.86 1jpt s SER 63 Ca 0.24 0.04 0.08 0.00 0.48 0.00 0.00 55.95 56.79 1jpt s SER 63 Cb -0.16 0.33 -0.03 0.00 0.10 0.00 0.00 66.02 66.26 1jpt s SER 63 CO 0.11 -0.50 -0.21 -0.83 0.98 0.00 0.00 173.24 172.80 1jpt s GLY 64 N -1.51 1.21 0.18 7.32 0.00 -1.26 -0.17 107.32 113.09 1jpt s GLY 64 Ca -0.11 -1.22 -0.08 0.00 0.00 0.00 0.00 44.72 43.31 1jpt s GLY 64 CO 0.03 -1.22 0.28 -1.35 0.00 0.00 0.00 173.10 170.83 1jpt s SER 65 N -1.86 0.06 0.00 1.64 1.04 -0.38 -4.31 113.70 109.88 1jpt s SER 65 Ca 0.06 -1.00 0.00 0.00 0.48 0.00 0.00 55.95 55.49 1jpt s SER 65 Cb -0.10 0.45 0.00 0.00 0.10 0.00 0.00 66.02 66.47 1jpt s SER 65 CO 0.04 -0.92 0.00 0.61 0.98 0.00 0.00 173.24 173.95 1jpt n GLY 66 N -0.25 2.60 3.77 7.32 0.00 -1.26 -1.02 105.19 116.35 1jpt n GLY 66 Ca -0.04 -2.10 -0.03 0.00 0.00 0.00 0.00 46.02 43.85 1jpt n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1jpt s SER 67 N 0.00 -0.11 1.67 1.61 1.04 -1.00 -4.87 113.70 112.03 1jpt s SER 67 Ca 0.00 -0.43 0.00 0.00 0.48 0.00 0.00 55.95 56.00 1jpt s SER 67 Cb 0.00 0.44 0.00 0.00 0.10 0.00 0.00 66.02 66.56 1jpt s SER 67 CO 0.00 -0.83 0.00 0.61 0.98 0.00 0.00 173.24 174.00 1jpt n GLY 68 N -0.53 2.79 0.00 7.32 0.00 -1.26 -2.58 105.19 110.94 1jpt n GLY 68 Ca -0.06 0.04 0.06 0.00 0.00 0.00 0.00 46.02 46.07 1jpt n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1jpt n THR 69 N 0.00 0.00 -4.47 2.61 -2.24 -1.26 -2.03 114.28 106.89 1jpt n THR 69 Ca 0.00 -0.25 -0.34 0.00 -2.27 0.00 0.00 64.05 61.20 1jpt n THR 69 Cb 0.00 0.61 -0.13 0.00 -2.10 0.00 0.00 70.33 68.71 1jpt n THR 69 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1jpt s ASP 70 N -2.87 4.45 0.08 3.42 1.01 -1.06 -0.73 116.67 120.96 1jpt s ASP 70 Ca 0.00 -0.24 0.03 0.00 0.71 0.00 0.00 52.55 53.05 1jpt s ASP 70 Cb 0.09 -1.71 -0.03 0.00 1.01 0.00 0.00 42.92 42.27 1jpt s ASP 70 CO 0.54 0.14 -0.09 -0.31 0.21 0.00 0.00 175.17 175.67 1jpt s TYR 71 N 0.51 0.91 -0.01 4.23 2.02 -0.16 -2.38 117.35 122.47 1jpt s TYR 71 Ca -0.05 -0.65 0.00 0.00 -0.37 0.00 0.00 57.07 56.00 1jpt s TYR 71 Cb -0.15 -0.52 0.01 0.00 -0.40 0.00 0.00 41.96 40.90 1jpt s TYR 71 CO 0.03 -0.05 0.01 0.99 -1.57 0.00 0.00 175.55 174.95 1jpt s THR 72 N -2.29 0.01 -0.14 -0.71 2.01 -0.18 -1.15 115.64 113.19 1jpt s THR 72 Ca 0.01 0.06 -0.02 0.00 0.31 0.00 0.00 61.69 62.05 1jpt s THR 72 Cb -0.04 -0.06 -0.02 0.00 0.01 0.00 0.00 72.50 72.39 1jpt s THR 72 CO -0.01 0.04 -0.07 -0.22 -0.69 0.00 0.00 174.62 173.67 1jpt s LEU 73 N 0.35 3.05 -0.06 4.42 2.96 0.12 -1.25 118.68 128.26 1jpt s LEU 73 Ca -0.03 -0.19 0.05 0.00 -0.22 0.00 0.00 54.13 53.74 1jpt s LEU 73 Cb -0.04 -1.71 -0.01 0.00 0.50 0.00 0.00 46.19 44.93 1jpt s LEU 73 CO -0.01 0.18 -0.22 -0.89 -1.32 0.00 0.00 176.35 174.09 1jpt s THR 74 N 0.27 1.86 -0.28 3.68 2.01 0.75 -1.28 115.64 122.66 1jpt s THR 74 Ca -0.06 -0.95 -0.02 0.00 0.31 0.00 0.00 61.69 60.98 1jpt s THR 74 Cb -0.15 -1.59 0.04 0.00 0.01 0.00 0.00 72.50 70.81 1jpt s THR 74 CO 0.04 0.52 -0.02 -0.63 -0.69 0.00 0.00 174.62 173.84 1jpt s ILE 75 N 0.01 3.04 0.27 1.82 1.01 0.10 -0.96 121.20 126.49 1jpt s ILE 75 Ca -0.07 -1.18 0.02 0.00 0.00 0.00 0.00 60.65 59.43 1jpt s ILE 75 Cb -0.14 -2.65 0.05 0.00 0.01 0.00 0.00 42.46 39.73 1jpt s ILE 75 CO 0.04 0.03 1.69 0.77 0.00 0.00 0.00 174.94 177.48 1jpt h SER 76 N 8.03 0.47 -2.32 3.58 4.64 -1.14 0.52 113.55 127.33 1jpt h SER 76 Ca -0.27 -0.17 -0.46 0.00 -0.47 0.00 0.00 61.79 60.42 1jpt h SER 76 Cb 1.09 -0.13 -0.35 0.00 -0.31 0.00 0.00 62.40 62.69 1jpt h SER 76 CO 0.56 0.76 -0.75 -0.55 -0.87 0.00 0.00 176.83 175.97 1jpt s SER 77 N -6.83 2.20 0.27 4.97 0.15 -1.24 -3.71 113.70 109.51 1jpt s SER 77 Ca -0.07 -1.67 -0.30 0.00 0.70 0.00 0.00 55.95 54.61 1jpt s SER 77 Cb 0.13 0.08 -0.13 0.00 -1.71 0.00 0.00 66.02 64.40 1jpt s SER 77 CO 0.79 -0.32 1.39 -0.11 1.20 0.00 0.00 173.24 176.20 1jpt n LEU 78 N 4.42 3.36 -4.47 3.45 7.94 0.74 -4.55 117.00 127.90 1jpt n LEU 78 Ca 0.08 1.16 -0.26 0.00 -1.11 0.00 0.00 56.01 55.88 1jpt n LEU 78 Cb 0.42 -1.46 -0.11 0.00 0.53 0.00 0.00 43.42 42.80 1jpt n LEU 78 CO 0.09 -0.42 -0.49 -1.10 -1.11 0.00 0.00 177.39 174.36 1jpt s GLN 79 N -0.85 1.68 0.29 1.96 -1.52 -1.26 -0.10 119.66 119.87 1jpt s GLN 79 Ca 0.64 -1.53 0.04 0.00 -1.95 0.00 0.00 55.36 52.56 1jpt s GLN 79 Cb -0.61 -1.90 0.72 0.00 -0.22 0.00 0.00 33.01 31.01 1jpt s GLN 79 CO 0.53 0.39 1.74 -1.35 -0.25 0.00 0.00 175.29 176.35 1jpt h PRO 80 N 2.87 0.57 0.00 2.91 0.11 -1.90 0.29 132.00 136.85 1jpt h PRO 80 Ca -0.45 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1jpt h PRO 80 Cb 1.22 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1jpt h PRO 80 CO 0.52 0.37 0.00 -0.85 -0.21 0.00 0.00 178.00 177.84 1jpt n GLU 81 N -4.90 0.25 0.00 1.05 0.00 -1.05 -2.57 120.64 113.42 1jpt n GLU 81 Ca 0.22 0.12 0.15 0.00 0.00 0.00 0.00 57.16 57.66 1jpt n GLU 81 Cb 0.60 -1.50 0.77 0.00 0.00 0.00 0.00 31.44 31.31 1jpt n GLU 81 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1jpt n ASP 82 N -1.22 0.61 -4.69 -1.84 8.00 0.10 -4.83 116.55 112.68 1jpt n ASP 82 Ca 0.07 -1.17 -0.42 0.00 0.71 0.00 0.00 54.79 53.98 1jpt n ASP 82 Cb 0.10 -0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.16 1jpt n ASP 82 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1jpt s PHE 83 N -2.02 2.24 -1.14 1.24 5.36 -1.06 -4.87 117.98 117.72 1jpt s PHE 83 Ca 0.43 0.03 0.00 0.00 -0.96 0.00 0.00 56.93 56.43 1jpt s PHE 83 Cb 0.22 -4.17 0.00 0.00 -0.34 0.00 0.00 43.02 38.73 1jpt s PHE 83 CO 0.36 -4.76 0.00 0.00 -1.46 0.00 0.00 175.22 169.36 1jpt n ALA 84 N 5.50 0.00 -2.98 11.12 0.00 -1.19 -4.78 120.51 128.17 1jpt n ALA 84 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.29 1jpt n ALA 84 Cb 0.38 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.69 1jpt n ALA 84 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1jpt s THR 85 N -2.16 3.06 -0.12 0.00 2.01 -0.46 -1.20 115.64 116.77 1jpt s THR 85 Ca 0.00 -0.67 -0.04 0.00 0.31 0.00 0.00 61.69 61.29 1jpt s THR 85 Cb 0.00 -2.27 -0.03 0.00 0.01 0.00 0.00 72.50 70.20 1jpt s THR 85 CO 0.00 0.54 0.02 -0.31 -0.69 0.00 0.00 174.62 174.18 1jpt s TYR 86 N 0.17 3.20 -0.02 4.92 1.51 -0.06 -0.39 117.35 126.68 1jpt s TYR 86 Ca -0.07 0.12 0.04 0.00 -1.01 0.00 0.00 57.07 56.15 1jpt s TYR 86 Cb -0.15 -1.90 -0.01 0.00 -0.11 0.00 0.00 41.96 39.79 1jpt s TYR 86 CO 0.05 0.34 -0.15 0.71 -1.11 0.00 0.00 175.55 175.39 1jpt s TYR 87 N -0.41 1.39 0.21 2.71 2.02 -0.17 -1.02 117.35 122.08 1jpt s TYR 87 Ca 0.08 -0.30 0.01 0.00 -0.37 0.00 0.00 57.07 56.49 1jpt s TYR 87 Cb -0.12 -0.91 -0.04 0.00 -0.40 0.00 0.00 41.96 40.49 1jpt s TYR 87 CO 0.02 -0.06 0.38 0.00 -1.57 0.00 0.00 175.55 174.32 1jpt s LEU 89 N -3.46 0.26 -0.10 0.00 2.96 0.66 -1.04 118.68 117.96 1jpt s LEU 89 Ca 0.37 0.25 -0.11 0.00 -0.22 0.00 0.00 54.13 54.42 1jpt s LEU 89 Cb -0.11 0.19 -0.05 0.00 0.50 0.00 0.00 46.19 46.72 1jpt s LEU 89 CO 0.29 -0.21 0.26 0.00 -1.32 0.00 0.00 176.35 175.38 1jpt s GLN 90 N 1.90 3.84 -0.18 1.98 1.03 -0.41 -0.67 119.66 127.14 1jpt s GLN 90 Ca -0.01 0.09 0.20 0.00 0.04 0.00 0.00 55.36 55.69 1jpt s GLN 90 Cb -0.12 -3.27 0.47 0.00 0.03 0.00 0.00 33.01 30.11 1jpt s GLN 90 CO -0.05 0.59 1.15 -2.39 -2.54 0.00 0.00 175.29 172.05 1jpt n HIS 91 N 2.42 0.98 0.08 9.60 1.44 -0.45 -2.64 115.22 126.65 1jpt n HIS 91 Ca -0.16 -1.59 -0.10 0.00 -2.01 0.00 0.00 57.72 53.86 1jpt n HIS 91 Cb 0.53 -0.23 -0.09 0.00 0.12 0.00 0.00 29.99 30.32 1jpt n HIS 91 CO 0.00 0.00 0.00 0.78 -2.81 0.00 0.00 176.34 174.31 1jpt h GLY 92 N 1.87 0.16 -2.80 -1.39 0.00 -1.81 -3.48 103.07 95.62 1jpt h GLY 92 Ca -0.07 -0.36 -0.01 0.00 0.00 0.00 0.00 47.33 46.89 1jpt h GLY 92 CO 0.23 0.32 0.13 -1.83 0.00 0.00 0.00 176.54 175.39 1jpt s GLU 93 N -2.83 1.33 0.23 4.80 -1.05 -1.26 -5.09 118.70 114.83 1jpt s GLU 93 Ca -0.02 -0.66 -0.20 0.00 -0.15 0.00 0.00 54.97 53.95 1jpt s GLU 93 Cb 0.09 0.56 -0.08 0.00 -0.44 0.00 0.00 34.13 34.26 1jpt s GLU 93 CO 0.84 -0.58 0.73 -1.12 0.95 0.00 0.00 175.26 176.09 1jpt s SER 94 N -2.81 7.05 0.48 0.83 0.01 -1.26 -3.64 113.70 114.37 1jpt s SER 94 Ca 0.04 1.43 -0.19 0.00 1.31 0.00 0.00 55.95 58.54 1jpt s SER 94 Cb -0.01 -2.42 -0.09 0.00 0.21 0.00 0.00 66.02 63.71 1jpt s SER 94 CO -0.08 0.01 0.99 -2.16 0.41 0.00 0.00 173.24 172.42 1jpt s PRO 95 N -2.03 3.95 0.36 12.44 0.04 -1.26 -4.97 135.00 143.52 1jpt s PRO 95 Ca 0.44 1.16 -0.27 0.00 0.04 0.00 0.00 61.00 62.37 1jpt s PRO 95 Cb -0.16 -2.13 -0.09 0.00 0.04 0.00 0.00 34.50 32.16 1jpt s PRO 95 CO 0.21 -0.28 1.15 -1.58 0.04 0.00 0.00 177.00 176.54 1jpt s TRP 96 N -2.25 3.24 0.01 0.56 0.52 -1.24 -4.71 118.94 115.07 1jpt s TRP 96 Ca 0.63 1.59 0.03 0.00 0.02 0.00 0.00 56.10 58.37 1jpt s TRP 96 Cb -0.12 -3.36 -0.01 0.00 -1.15 0.00 0.00 33.47 28.83 1jpt s TRP 96 CO 0.22 -1.07 -0.09 0.95 0.02 0.00 0.00 176.95 176.98 1jpt s THR 97 N -1.34 0.66 0.10 2.01 -4.23 -1.08 -4.99 115.64 106.77 1jpt s THR 97 Ca 0.52 -0.58 0.04 0.00 -1.18 0.00 0.00 61.69 60.49 1jpt s THR 97 Cb -0.31 -0.60 -0.04 0.00 1.34 0.00 0.00 72.50 72.89 1jpt s THR 97 CO 0.40 0.03 0.09 -0.36 -0.54 0.00 0.00 174.62 174.24 1jpt s PHE 98 N -0.52 3.18 0.98 3.99 0.08 -1.26 -1.29 117.98 123.14 1jpt s PHE 98 Ca 0.00 0.05 -0.13 0.00 0.12 0.00 0.00 56.93 56.97 1jpt s PHE 98 Cb -0.05 -1.59 0.18 0.00 -0.57 0.00 0.00 43.02 40.99 1jpt s PHE 98 CO 0.00 0.52 1.13 0.20 -0.10 0.00 0.00 175.22 176.97 1jpt s GLY 99 N -2.58 1.58 0.08 4.36 0.00 -0.21 -4.53 107.32 106.03 1jpt s GLY 99 Ca 0.30 -0.55 0.22 0.00 0.00 0.00 0.00 44.72 44.68 1jpt s GLY 99 CO 0.22 0.07 1.67 0.61 0.00 0.00 0.00 173.10 175.68 1jpt n GLN 100 N -4.04 0.07 0.00 2.90 0.00 -1.26 -4.71 117.38 110.34 1jpt n GLN 100 Ca 0.07 0.22 0.00 0.00 0.00 0.00 0.00 57.00 57.29 1jpt n GLN 100 Cb 0.59 -1.62 0.00 0.00 0.00 0.00 0.00 30.24 29.21 1jpt n GLN 100 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1jpt n GLY 101 N 0.54 2.22 2.85 2.61 0.00 -1.26 -5.04 105.19 107.11 1jpt n GLY 101 Ca 0.04 -1.69 -0.26 0.00 0.00 0.00 0.00 46.02 44.11 1jpt n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jpt s THR 102 N -1.72 0.86 -0.18 2.61 2.01 -0.19 -4.71 115.64 114.31 1jpt s THR 102 Ca 0.00 -0.32 -0.22 0.00 0.31 0.00 0.00 61.69 61.47 1jpt s THR 102 Cb 0.00 -1.00 -0.02 0.00 0.01 0.00 0.00 72.50 71.49 1jpt s THR 102 CO 0.00 0.22 0.66 -0.75 -0.69 0.00 0.00 174.62 174.06 1jpt s LYS 103 N 1.76 4.24 -0.30 4.92 2.47 -0.57 -0.88 119.74 131.38 1jpt s LYS 103 Ca 0.03 0.69 -0.08 0.00 -1.56 0.00 0.00 55.97 55.05 1jpt s LYS 103 Cb -0.14 -3.57 -0.01 0.00 -1.46 0.00 0.00 37.83 32.66 1jpt s LYS 103 CO -0.07 -0.23 0.12 0.08 0.16 0.00 0.00 175.35 175.40 1jpt s VAL 104 N 1.86 4.35 0.13 4.02 1.01 -0.34 -1.56 120.40 129.87 1jpt s VAL 104 Ca 0.31 -0.47 0.04 0.00 0.00 0.00 0.00 61.98 61.86 1jpt s VAL 104 Cb -0.16 -3.19 -0.04 0.00 0.00 0.00 0.00 36.38 32.99 1jpt s VAL 104 CO 0.11 0.12 0.12 -1.61 0.00 0.00 0.00 175.10 173.84 1jpt s GLU 105 N 1.58 2.93 -0.03 2.72 0.41 0.22 -3.20 118.70 123.33 1jpt s GLU 105 Ca 0.04 -0.78 -0.15 0.00 -0.41 0.00 0.00 54.97 53.67 1jpt s GLU 105 Cb -0.17 -2.70 -0.05 0.00 -1.78 0.00 0.00 34.13 29.43 1jpt s GLU 105 CO 0.05 0.52 0.42 0.42 -0.49 0.00 0.00 175.26 176.17 1jpt s ILE 106 N -1.60 5.06 -0.21 -1.63 -1.09 -1.26 -1.91 121.20 118.57 1jpt s ILE 106 Ca 0.30 0.85 -0.12 0.00 -2.23 0.00 0.00 60.65 59.46 1jpt s ILE 106 Cb -0.11 -3.73 -0.05 0.00 -1.58 0.00 0.00 42.46 36.99 1jpt s ILE 106 CO 0.23 0.52 0.22 -0.75 -1.23 0.00 0.00 174.94 173.94 1jpt s LYS 107 N -0.69 4.16 0.30 2.79 2.20 0.16 -4.83 119.74 123.83 1jpt s LYS 107 Ca 0.24 -0.10 0.06 0.00 -0.36 0.00 0.00 55.97 55.81 1jpt s LYS 107 Cb -0.16 -3.49 -0.02 0.00 -1.51 0.00 0.00 37.83 32.65 1jpt s LYS 107 CO 0.12 0.14 0.20 2.89 -0.36 0.00 0.00 175.35 178.35 1jpt n ARG 108 N 3.98 0.43 -1.73 4.03 1.85 -1.26 -4.09 116.66 119.88 1jpt n ARG 108 Ca -0.13 -2.87 -0.33 0.00 -1.00 0.00 0.00 57.85 53.51 1jpt n ARG 108 Cb 0.52 2.10 0.05 0.00 -1.05 0.00 0.00 32.46 34.08 1jpt n ARG 108 CO 0.00 0.00 0.00 0.95 -0.01 0.00 0.00 177.63 178.57 1jpt s THR 109 N -3.06 3.37 0.39 8.89 -4.23 -1.26 -4.94 115.64 114.79 1jpt s THR 109 Ca 0.29 0.60 -0.27 0.00 -1.18 0.00 0.00 61.69 61.13 1jpt s THR 109 Cb 0.01 -3.13 -0.10 0.00 1.34 0.00 0.00 72.50 70.62 1jpt s THR 109 CO 0.20 -0.43 1.43 -0.69 -0.54 0.00 0.00 174.62 174.60 1jpt s VAL 110 N -2.45 2.21 -0.04 2.29 1.01 -1.26 -4.79 120.40 117.36 1jpt s VAL 110 Ca 0.65 0.21 -0.02 0.00 0.00 0.00 0.00 61.98 62.82 1jpt s VAL 110 Cb -0.19 -3.13 0.03 0.00 0.00 0.00 0.00 36.38 33.09 1jpt s VAL 110 CO 0.43 0.04 0.07 0.00 0.00 0.00 0.00 175.10 175.65 1jpt s ALA 111 N -1.15 0.16 0.38 5.51 0.00 -0.08 -4.92 121.76 121.65 1jpt s ALA 111 Ca 0.54 0.25 -0.25 0.00 0.00 0.00 0.00 51.96 52.51 1jpt s ALA 111 Cb -0.44 -0.61 -0.09 0.00 0.00 0.00 0.00 23.12 21.97 1jpt s ALA 111 CO 0.59 -0.46 1.04 0.00 0.00 0.00 0.00 175.76 176.92 1jpt s ALA 112 N 2.08 3.13 0.59 0.00 0.00 -1.26 -1.21 121.76 125.10 1jpt s ALA 112 Ca 0.03 0.70 -0.17 0.00 0.00 0.00 0.00 51.96 52.52 1jpt s ALA 112 Cb -0.12 -3.27 -0.03 0.00 0.00 0.00 0.00 23.12 19.70 1jpt s ALA 112 CO -0.03 -0.15 1.11 -1.25 0.00 0.00 0.00 175.76 175.43 1jpt s PRO 113 N -2.34 3.15 -0.16 0.00 0.04 -1.26 -4.61 135.00 129.82 1jpt s PRO 113 Ca 0.55 1.47 -0.12 0.00 0.04 0.00 0.00 61.00 62.95 1jpt s PRO 113 Cb -0.22 -1.99 -0.05 0.00 0.04 0.00 0.00 34.50 32.28 1jpt s PRO 113 CO 0.28 -0.98 0.22 -1.12 0.04 0.00 0.00 177.00 175.44 1jpt s SER 114 N -2.21 6.37 -0.07 6.66 0.01 -0.55 -4.83 113.70 119.08 1jpt s SER 114 Ca 0.69 0.43 0.02 0.00 1.31 0.00 0.00 55.95 58.40 1jpt s SER 114 Cb -0.21 -2.14 -0.03 0.00 0.21 0.00 0.00 66.02 63.85 1jpt s SER 114 CO 0.33 0.18 -0.12 -0.69 0.41 0.00 0.00 173.24 173.36 1jpt s VAL 115 N 0.14 3.26 0.01 3.43 1.01 -1.26 -0.32 120.40 126.67 1jpt s VAL 115 Ca 0.14 -0.64 0.00 0.00 0.00 0.00 0.00 61.98 61.48 1jpt s VAL 115 Cb -0.12 -2.31 -0.01 0.00 0.00 0.00 0.00 36.38 33.93 1jpt s VAL 115 CO 0.02 0.58 -0.03 -0.36 0.00 0.00 0.00 175.10 175.31 1jpt s PHE 116 N -0.54 0.26 -0.01 5.22 0.40 -0.43 -4.98 117.98 117.90 1jpt s PHE 116 Ca 0.08 -0.31 0.06 0.00 -0.60 0.00 0.00 56.93 56.16 1jpt s PHE 116 Cb -0.12 -0.17 -0.02 0.00 0.51 0.00 0.00 43.02 43.22 1jpt s PHE 116 CO 0.02 -0.09 -0.20 -1.50 0.70 0.00 0.00 175.22 174.14 1jpt s ILE 117 N -0.84 1.58 -0.10 0.64 2.07 -1.26 -0.52 121.20 122.77 1jpt s ILE 117 Ca -0.08 -0.90 0.03 0.00 -1.41 0.00 0.00 60.65 58.28 1jpt s ILE 117 Cb -0.06 -1.32 0.01 0.00 0.13 0.00 0.00 42.46 41.22 1jpt s ILE 117 CO -0.00 0.41 -0.18 -0.36 -1.91 0.00 0.00 174.94 172.89 1jpt s PHE 118 N -0.52 2.12 0.83 3.50 0.40 0.12 -5.00 117.98 119.43 1jpt s PHE 118 Ca 0.08 -0.93 -0.12 0.00 -0.60 0.00 0.00 56.93 55.35 1jpt s PHE 118 Cb -0.08 -1.48 0.09 0.00 0.51 0.00 0.00 43.02 42.07 1jpt s PHE 118 CO -0.00 -0.44 1.19 -2.14 0.70 0.00 0.00 175.22 174.53 1jpt s PRO 119 N 0.71 1.79 0.54 0.24 0.02 -1.26 -1.89 135.00 135.15 1jpt s PRO 119 Ca -0.12 0.09 -0.19 0.00 0.02 0.00 0.00 61.00 60.79 1jpt s PRO 119 Cb -0.16 -1.93 -0.06 0.00 0.02 0.00 0.00 34.50 32.37 1jpt s PRO 119 CO 0.03 -1.71 1.13 -1.25 -0.33 0.00 0.00 177.00 174.86 1jpt s PRO 120 N -5.58 3.36 0.63 5.54 0.04 -1.17 -4.82 135.00 133.00 1jpt s PRO 120 Ca 0.63 1.61 -0.12 0.00 0.04 0.00 0.00 61.00 63.16 1jpt s PRO 120 Cb -0.11 -2.01 -0.03 0.00 0.04 0.00 0.00 34.50 32.40 1jpt s PRO 120 CO 0.50 -0.85 1.04 -1.54 0.04 0.00 0.00 177.00 176.19 1jpt s SER 121 N -1.78 6.00 0.21 6.66 1.04 -1.26 -4.94 113.70 119.63 1jpt s SER 121 Ca 0.73 1.51 -0.07 0.00 0.48 0.00 0.00 55.95 58.60 1jpt s SER 121 Cb -0.24 -2.48 0.17 0.00 0.10 0.00 0.00 66.02 63.57 1jpt s SER 121 CO 0.27 -1.03 1.72 0.44 0.98 0.00 0.00 173.24 175.63 1jpt h ASP 122 N -0.29 1.00 -0.57 7.02 3.32 -1.98 -2.04 116.42 122.88 1jpt h ASP 122 Ca -0.44 -0.23 0.07 0.00 0.02 0.00 0.00 57.03 56.46 1jpt h ASP 122 Cb 1.20 -0.27 -0.06 0.00 0.22 0.00 0.00 39.33 40.42 1jpt h ASP 122 CO 0.60 0.99 0.24 -0.08 -1.72 0.00 0.00 179.24 179.27 1jpt h GLU 123 N 0.99 0.44 -0.67 3.56 4.81 -2.02 -2.13 114.58 119.55 1jpt h GLU 123 Ca 0.20 -0.03 -0.08 0.00 -0.13 0.00 0.00 59.36 59.33 1jpt h GLU 123 Cb 0.41 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.66 1jpt h GLU 123 CO 0.01 0.29 0.11 0.37 -0.73 0.00 0.00 179.01 179.06 1jpt h GLN 124 N 0.45 1.11 0.00 1.92 4.15 -1.82 -2.67 115.11 118.25 1jpt h GLN 124 Ca 0.28 -0.30 0.00 0.00 0.77 0.00 0.00 58.65 59.40 1jpt h GLN 124 Cb 0.28 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 27.84 1jpt h GLN 124 CO -0.25 1.02 0.00 1.28 -1.93 0.00 0.00 178.83 178.95 1jpt n LEU 125 N -4.22 0.00 0.22 -2.39 4.77 -0.80 -0.95 117.00 113.63 1jpt n LEU 125 Ca 0.04 0.32 0.15 0.00 -0.03 0.00 0.00 56.01 56.50 1jpt n LEU 125 Cb 0.29 -0.32 0.58 0.00 -2.33 0.00 0.00 43.42 41.64 1jpt n LEU 125 CO 0.43 -0.28 0.94 0.11 -1.33 0.00 0.00 177.39 177.25 1jpt h LYS 126 N 0.00 0.00 0.00 3.23 1.57 -1.26 -3.45 116.57 116.66 1jpt h LYS 126 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1jpt h LYS 126 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.35 1jpt h LYS 126 CO 0.00 0.00 0.00 0.43 -0.57 0.00 0.00 179.45 179.31 1jpt n SER 127 N -2.81 0.45 -0.35 0.86 7.64 -0.13 -5.03 113.62 114.26 1jpt n SER 127 Ca 0.02 -0.60 0.11 0.00 1.01 0.00 0.00 58.87 59.41 1jpt n SER 127 Cb 0.31 0.00 0.50 0.00 -1.01 0.00 0.00 64.21 64.01 1jpt n SER 127 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1jpt n GLY 128 N 5.00 -0.22 3.31 0.23 0.00 -1.26 -4.68 105.19 107.57 1jpt n GLY 128 Ca 0.00 -0.33 -0.21 0.00 0.00 0.00 0.00 46.02 45.49 1jpt n GLY 128 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jpt s THR 129 N -1.90 1.68 -0.03 2.61 2.01 -1.26 -0.05 115.64 118.69 1jpt s THR 129 Ca 0.34 -1.87 0.02 0.00 0.31 0.00 0.00 61.69 60.49 1jpt s THR 129 Cb 0.17 -1.76 0.01 0.00 0.01 0.00 0.00 72.50 70.93 1jpt s THR 129 CO 0.27 -0.35 -0.07 0.00 -0.69 0.00 0.00 174.62 173.79 1jpt s ALA 130 N -2.10 0.74 -0.08 7.40 0.00 -0.54 -4.23 121.76 122.94 1jpt s ALA 130 Ca 0.14 -0.19 0.05 0.00 0.00 0.00 0.00 51.96 51.95 1jpt s ALA 130 Cb -0.05 -0.34 -0.01 0.00 0.00 0.00 0.00 23.12 22.72 1jpt s ALA 130 CO 0.06 0.07 -0.23 -1.12 0.00 0.00 0.00 175.76 174.54 1jpt s SER 131 N 0.48 3.20 -0.10 0.00 0.01 -1.26 -2.03 113.70 114.00 1jpt s SER 131 Ca -0.07 -0.50 0.02 0.00 1.31 0.00 0.00 55.95 56.72 1jpt s SER 131 Cb -0.11 -1.10 -0.01 0.00 0.21 0.00 0.00 66.02 65.01 1jpt s SER 131 CO 0.00 0.21 -0.18 -0.69 0.41 0.00 0.00 173.24 173.00 1jpt s VAL 132 N 0.02 2.68 -0.02 3.43 1.01 -0.39 -3.03 120.40 124.10 1jpt s VAL 132 Ca -0.09 -0.81 0.08 0.00 0.00 0.00 0.00 61.98 61.15 1jpt s VAL 132 Cb -0.15 -2.07 -0.02 0.00 0.00 0.00 0.00 36.38 34.14 1jpt s VAL 132 CO 0.05 0.55 -0.25 -0.69 0.00 0.00 0.00 175.10 174.77 1jpt s VAL 133 N 0.08 1.95 -0.08 2.92 1.01 -0.79 -0.52 120.40 124.96 1jpt s VAL 133 Ca -0.08 -1.05 0.04 0.00 0.00 0.00 0.00 61.98 60.89 1jpt s VAL 133 Cb -0.15 -1.62 0.00 0.00 0.00 0.00 0.00 36.38 34.61 1jpt s VAL 133 CO 0.05 0.55 -0.19 0.00 0.00 0.00 0.00 175.10 175.51 1jpt s LEU 135 N 0.39 3.10 -0.29 0.00 2.96 0.32 -0.64 118.68 124.53 1jpt s LEU 135 Ca -0.15 -0.20 -0.04 0.00 -0.22 0.00 0.00 54.13 53.51 1jpt s LEU 135 Cb -0.16 -1.74 0.03 0.00 0.50 0.00 0.00 46.19 44.81 1jpt s LEU 135 CO 0.06 0.14 0.03 -0.76 -1.32 0.00 0.00 176.35 174.50 1jpt s LEU 136 N 0.51 3.76 -0.09 -0.68 1.02 -0.09 -1.31 118.68 121.79 1jpt s LEU 136 Ca -0.04 -0.96 0.00 0.00 0.02 0.00 0.00 54.13 53.15 1jpt s LEU 136 Cb -0.15 -1.78 -0.03 0.00 0.02 0.00 0.00 46.19 44.26 1jpt s LEU 136 CO 0.03 -0.21 -0.08 0.21 0.02 0.00 0.00 176.35 176.31 1jpt s ASN 137 N 1.38 4.49 -0.84 2.29 2.47 0.57 -0.31 114.94 124.99 1jpt s ASN 137 Ca -0.01 -0.12 -0.03 0.00 0.42 0.00 0.00 52.86 53.13 1jpt s ASN 137 Cb -0.18 -1.33 0.00 0.00 -1.45 0.00 0.00 41.25 38.29 1jpt s ASN 137 CO -0.00 0.29 0.65 0.59 -3.72 0.00 0.00 177.10 174.90 1jpt n ASN 138 N 2.73 -5.72 -4.48 -4.21 3.02 -0.92 -1.48 115.26 104.19 1jpt n ASN 138 Ca -0.18 -0.73 -0.23 0.00 -0.03 0.00 0.00 54.58 53.42 1jpt n ASN 138 Cb 0.53 -2.86 -0.11 0.00 -0.61 0.00 0.00 39.78 36.73 1jpt n ASN 138 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 1jpt s PHE 139 N -3.05 2.11 -0.24 3.10 -0.12 0.26 -4.62 117.98 115.42 1jpt s PHE 139 Ca 0.06 -0.74 -0.22 0.00 -0.05 0.00 0.00 56.93 55.97 1jpt s PHE 139 Cb -0.02 -1.32 0.06 0.00 -0.63 0.00 0.00 43.02 41.11 1jpt s PHE 139 CO 0.85 0.27 0.64 -0.47 -0.05 0.00 0.00 175.22 176.47 1jpt s TYR 140 N -2.99 -0.72 1.09 3.49 6.14 -0.35 -0.90 117.35 123.11 1jpt s TYR 140 Ca 0.33 1.73 -0.15 0.00 0.64 0.00 0.00 57.07 59.62 1jpt s TYR 140 Cb 0.06 0.25 0.23 0.00 0.42 0.00 0.00 41.96 42.93 1jpt s TYR 140 CO 0.15 -0.35 1.11 -1.25 0.64 0.00 0.00 175.55 175.85 1jpt s PRO 141 N 0.39 -0.28 0.53 4.97 0.04 -1.26 -0.90 135.00 138.48 1jpt s PRO 141 Ca -0.00 0.22 0.17 0.00 0.04 0.00 0.00 61.00 61.42 1jpt s PRO 141 Cb -0.05 -1.68 1.32 0.00 0.04 0.00 0.00 34.50 34.14 1jpt s PRO 141 CO 0.00 -3.15 2.16 -0.09 0.04 0.00 0.00 177.00 175.97 1jpt h ARG 142 N -2.18 0.00 -6.49 4.56 2.43 -1.98 -3.44 114.38 107.28 1jpt h ARG 142 Ca -0.50 0.00 -0.53 0.00 -0.81 0.00 0.00 59.98 58.13 1jpt h ARG 142 Cb 1.31 0.00 0.02 0.00 -0.42 0.00 0.00 29.97 30.88 1jpt h ARG 142 CO 0.48 0.00 0.77 -1.21 -1.51 0.00 0.00 179.97 178.50 1jpt s GLU 143 N -5.03 4.30 0.04 0.20 8.01 -1.26 -5.00 118.70 119.96 1jpt s GLU 143 Ca -0.05 2.06 -0.25 0.00 0.01 0.00 0.00 54.97 56.74 1jpt s GLU 143 Cb 0.17 -3.36 0.06 0.00 -4.31 0.00 0.00 34.13 26.69 1jpt s GLU 143 CO 0.66 -0.49 0.57 0.00 0.01 0.00 0.00 175.26 176.01 1jpt s ALA 144 N 1.56 -1.48 -0.03 5.21 0.00 -1.26 -4.66 121.76 121.10 1jpt s ALA 144 Ca 0.65 0.78 0.05 0.00 0.00 0.00 0.00 51.96 53.44 1jpt s ALA 144 Cb -0.36 0.35 -0.01 0.00 0.00 0.00 0.00 23.12 23.10 1jpt s ALA 144 CO 0.29 -0.50 -0.18 0.21 0.00 0.00 0.00 175.76 175.58 1jpt s LYS 145 N -2.26 1.70 -0.06 0.00 2.20 -0.56 -5.01 119.74 115.75 1jpt s LYS 145 Ca -0.06 -0.64 0.03 0.00 -0.36 0.00 0.00 55.97 54.94 1jpt s LYS 145 Cb -0.01 -1.53 0.01 0.00 -1.51 0.00 0.00 37.83 34.79 1jpt s LYS 145 CO 0.00 0.31 -0.14 0.08 -0.36 0.00 0.00 175.35 175.24 1jpt s VAL 146 N -0.16 1.25 -0.00 4.02 1.01 -1.26 -1.13 120.40 124.12 1jpt s VAL 146 Ca 0.01 -0.58 0.04 0.00 0.00 0.00 0.00 61.98 61.45 1jpt s VAL 146 Cb -0.10 -1.11 -0.01 0.00 0.00 0.00 0.00 36.38 35.16 1jpt s VAL 146 CO 0.01 0.37 -0.13 -1.10 0.00 0.00 0.00 175.10 174.26 1jpt s GLN 147 N 0.38 1.01 -0.01 2.72 -1.52 -0.03 -4.96 119.66 117.24 1jpt s GLN 147 Ca -0.10 -0.49 -0.02 0.00 -1.95 0.00 0.00 55.36 52.80 1jpt s GLN 147 Cb -0.14 -0.98 -0.04 0.00 -0.22 0.00 0.00 33.01 31.63 1jpt s GLN 147 CO 0.03 0.27 0.13 -1.58 -0.25 0.00 0.00 175.29 173.89 1jpt s TRP 148 N -0.37 3.43 -0.04 0.91 0.52 -1.26 -0.45 118.94 121.69 1jpt s TRP 148 Ca 0.04 0.30 0.02 0.00 0.02 0.00 0.00 56.10 56.49 1jpt s TRP 148 Cb -0.05 -1.79 0.01 0.00 -1.15 0.00 0.00 33.47 30.48 1jpt s TRP 148 CO -0.00 0.61 -0.10 0.15 0.02 0.00 0.00 176.95 177.63 1jpt s LYS 149 N -1.78 1.14 -0.14 4.98 1.02 -0.08 -0.66 119.74 124.22 1jpt s LYS 149 Ca 0.24 -0.33 0.02 0.00 0.02 0.00 0.00 55.97 55.92 1jpt s LYS 149 Cb -0.12 -1.03 0.02 0.00 -0.52 0.00 0.00 37.83 36.17 1jpt s LYS 149 CO 0.15 0.09 -0.19 0.08 -0.92 0.00 0.00 175.35 174.57 1jpt s VAL 150 N 0.33 1.85 -1.47 3.17 1.01 -0.76 -1.41 120.40 123.13 1jpt s VAL 150 Ca -0.06 -0.84 -0.09 0.00 0.00 0.00 0.00 61.98 60.99 1jpt s VAL 150 Cb -0.11 -1.67 0.06 0.00 0.00 0.00 0.00 36.38 34.66 1jpt s VAL 150 CO 0.01 0.51 0.83 0.47 0.00 0.00 0.00 175.10 176.92 1jpt n ASP 151 N 4.33 -3.15 -0.38 3.32 8.00 0.63 -1.50 116.55 127.79 1jpt n ASP 151 Ca -0.19 -0.83 -0.05 0.00 0.71 0.00 0.00 54.79 54.42 1jpt n ASP 151 Cb 0.51 -3.76 -0.02 0.00 -0.02 0.00 0.00 41.12 37.83 1jpt n ASP 151 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1jpt n ASN 152 N -2.90 -5.18 -4.52 -2.24 5.15 -1.26 -4.99 115.26 99.32 1jpt n ASN 152 Ca -0.09 0.12 -0.36 0.00 -0.60 0.00 0.00 54.58 53.66 1jpt n ASN 152 Cb 0.58 -3.12 -0.11 0.00 -0.53 0.00 0.00 39.78 36.60 1jpt n ASN 152 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1jpt s ALA 153 N -1.66 3.25 0.29 5.20 0.00 -0.56 -5.03 121.76 123.25 1jpt s ALA 153 Ca 0.00 -0.97 -0.30 0.00 0.00 0.00 0.00 51.96 50.69 1jpt s ALA 153 Cb 0.00 -2.00 -0.12 0.00 0.00 0.00 0.00 23.12 20.99 1jpt s ALA 153 CO 0.00 -0.20 1.46 1.28 0.00 0.00 0.00 175.76 178.29 1jpt n LEU 154 N 4.34 3.80 -4.84 0.00 4.77 -1.26 -1.82 117.00 121.98 1jpt n LEU 154 Ca -0.16 1.17 -0.30 0.00 -0.03 0.00 0.00 56.01 56.68 1jpt n LEU 154 Cb 0.52 -1.52 -0.05 0.00 -2.33 0.00 0.00 43.42 40.04 1jpt n LEU 154 CO 0.33 -0.20 -0.21 -1.10 -1.33 0.00 0.00 177.39 174.88 1jpt s GLN 155 N -0.91 3.14 -0.00 3.23 -1.52 0.16 -4.93 119.66 118.83 1jpt s GLN 155 Ca 0.63 -0.60 0.00 0.00 -1.95 0.00 0.00 55.36 53.44 1jpt s GLN 155 Cb -0.56 -2.86 0.01 0.00 -0.22 0.00 0.00 33.01 29.37 1jpt s GLN 155 CO 0.53 0.57 0.00 -1.12 -0.25 0.00 0.00 175.29 175.03 1jpt s SER 156 N -2.54 0.03 0.00 5.90 0.01 -1.26 -4.64 113.70 111.20 1jpt s SER 156 Ca 0.32 0.00 0.00 0.00 1.31 0.00 0.00 55.95 57.58 1jpt s SER 156 Cb -0.12 -0.01 0.00 0.00 0.21 0.00 0.00 66.02 66.09 1jpt s SER 156 CO 0.25 -0.02 0.00 0.61 0.41 0.00 0.00 173.24 174.49 1jpt n GLY 157 N 3.27 0.39 0.17 3.44 0.00 -1.26 -4.88 105.19 106.31 1jpt n GLY 157 Ca -0.15 0.00 0.10 0.00 0.00 0.00 0.00 46.02 45.97 1jpt n GLY 157 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1jpt n ASN 158 N -0.28 2.53 -4.24 1.61 6.94 -1.26 -5.02 115.26 115.53 1jpt n ASN 158 Ca 0.00 -3.08 -0.15 0.00 -0.02 0.00 0.00 54.58 51.33 1jpt n ASN 158 Cb 0.14 -0.44 -0.10 0.00 -2.36 0.00 0.00 39.78 37.01 1jpt n ASN 158 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 1jpt s SER 159 N -2.77 1.82 0.01 0.53 1.04 -1.26 -1.14 113.70 111.92 1jpt s SER 159 Ca 0.33 -0.96 -0.02 0.00 0.48 0.00 0.00 55.95 55.79 1jpt s SER 159 Cb 0.29 -0.02 -0.01 0.00 0.10 0.00 0.00 66.02 66.38 1jpt s SER 159 CO 0.04 -0.28 0.03 -1.10 0.98 0.00 0.00 173.24 172.90 1jpt s GLN 160 N -3.45 0.28 0.12 4.02 -0.21 -0.52 -4.97 119.66 114.93 1jpt s GLN 160 Ca 0.14 -0.38 0.01 0.00 0.02 0.00 0.00 55.36 55.15 1jpt s GLN 160 Cb 0.01 0.11 -0.04 0.00 1.00 0.00 0.00 33.01 34.08 1jpt s GLN 160 CO 0.01 -0.05 -0.02 -1.83 -2.12 0.00 0.00 175.29 171.28 1jpt s GLU 161 N -1.05 0.90 0.03 2.91 -1.05 -1.26 -0.49 118.70 118.69 1jpt s GLU 161 Ca -0.11 -1.40 -0.13 0.00 -0.15 0.00 0.00 54.97 53.18 1jpt s GLU 161 Cb -0.07 -0.08 0.02 0.00 -0.44 0.00 0.00 34.13 33.56 1jpt s GLU 161 CO -0.00 -0.11 0.27 -1.54 0.95 0.00 0.00 175.26 174.83 1jpt s SER 162 N -3.07 -0.10 -0.01 0.83 1.04 -0.34 -4.99 113.70 107.06 1jpt s SER 162 Ca 0.17 -0.16 0.06 0.00 0.48 0.00 0.00 55.95 56.50 1jpt s SER 162 Cb 0.06 0.32 -0.02 0.00 0.10 0.00 0.00 66.02 66.49 1jpt s SER 162 CO -0.02 -0.55 -0.20 -0.69 0.98 0.00 0.00 173.24 172.76 1jpt s VAL 163 N -2.19 1.62 0.71 5.02 1.01 -1.26 -0.80 120.40 124.50 1jpt s VAL 163 Ca -0.08 -0.91 -0.11 0.00 0.00 0.00 0.00 61.98 60.88 1jpt s VAL 163 Cb -0.02 -1.35 0.02 0.00 0.00 0.00 0.00 36.38 35.02 1jpt s VAL 163 CO -0.01 0.42 1.07 0.42 0.00 0.00 0.00 175.10 177.00 1jpt s THR 164 N -0.52 3.82 0.63 3.92 -4.23 -0.66 -5.00 115.64 113.60 1jpt s THR 164 Ca 0.08 0.59 -0.14 0.00 -1.18 0.00 0.00 61.69 61.04 1jpt s THR 164 Cb -0.08 -3.40 -0.02 0.00 1.34 0.00 0.00 72.50 70.34 1jpt s THR 164 CO -0.00 -0.77 1.07 -1.61 -0.54 0.00 0.00 174.62 172.76 1jpt s GLU 165 N -5.13 3.11 0.28 3.99 0.41 -1.26 -4.59 118.70 115.50 1jpt s GLU 165 Ca 0.58 1.18 -0.29 0.00 -0.41 0.00 0.00 54.97 56.03 1jpt s GLU 165 Cb -0.13 -2.00 -0.14 0.00 -1.78 0.00 0.00 34.13 30.08 1jpt s GLU 165 CO 0.54 -0.98 1.20 0.94 -0.49 0.00 0.00 175.26 176.48 1jpt n GLN 166 N -2.38 1.72 -2.14 1.61 7.27 -1.26 -4.84 117.38 117.36 1jpt n GLN 166 Ca 0.09 0.61 -0.42 0.00 0.07 0.00 0.00 57.00 57.35 1jpt n GLN 166 Cb 0.53 -2.12 -0.03 0.00 2.41 0.00 0.00 30.24 31.03 1jpt n GLN 166 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 1jpt s ASP 167 N -0.22 6.81 0.16 1.69 2.15 0.50 -4.91 116.67 122.84 1jpt s ASP 167 Ca 0.62 2.44 0.22 0.00 0.43 0.00 0.00 52.55 56.26 1jpt s ASP 167 Cb -0.67 -2.60 0.89 0.00 -0.30 0.00 0.00 42.92 40.23 1jpt s ASP 167 CO 0.57 -0.62 1.68 -1.54 -0.17 0.00 0.00 175.17 175.09 1jpt n SER 168 N 3.07 0.46 -0.10 -0.34 3.41 -1.26 -1.38 113.62 117.47 1jpt n SER 168 Ca 0.08 0.59 -0.20 0.00 -0.26 0.00 0.00 58.87 59.09 1jpt n SER 168 Cb 0.42 -0.70 -0.08 0.00 -0.26 0.00 0.00 64.21 63.59 1jpt n SER 168 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1jpt n LYS 169 N -1.99 0.47 -0.11 4.33 5.02 -1.26 -2.53 118.16 122.09 1jpt n LYS 169 Ca 0.03 0.17 0.06 0.00 -2.02 0.00 0.00 58.31 56.55 1jpt n LYS 169 Cb 0.26 -1.30 0.11 0.00 -0.02 0.00 0.00 35.03 34.08 1jpt n LYS 169 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1jpt n ASP 170 N -3.66 2.54 -2.09 4.39 5.68 -1.25 -4.89 116.55 117.27 1jpt n ASP 170 Ca -0.40 -1.79 -0.16 0.00 -0.50 0.00 0.00 54.79 51.95 1jpt n ASP 170 Cb 0.82 -0.14 -0.03 0.00 -1.14 0.00 0.00 41.12 40.63 1jpt n ASP 170 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1jpt n SER 171 N 0.57 -4.58 -5.01 -1.12 7.64 -0.48 -4.95 113.62 105.69 1jpt n SER 171 Ca 0.10 0.21 -0.19 0.00 1.01 0.00 0.00 58.87 59.99 1jpt n SER 171 Cb 0.37 -3.95 0.03 0.00 -1.01 0.00 0.00 64.21 59.65 1jpt n SER 171 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1jpt s THR 172 N -2.64 2.54 0.25 0.44 -4.23 -1.26 -4.63 115.64 106.10 1jpt s THR 172 Ca 0.00 -1.03 0.10 0.00 -1.18 0.00 0.00 61.69 59.57 1jpt s THR 172 Cb 0.00 -2.57 -0.05 0.00 1.34 0.00 0.00 72.50 71.22 1jpt s THR 172 CO 0.00 0.00 -0.16 -0.31 -0.54 0.00 0.00 174.62 173.61 1jpt s TYR 173 N -2.52 1.99 0.10 3.99 1.51 -0.08 -0.37 117.35 121.97 1jpt s TYR 173 Ca 0.57 -0.48 0.04 0.00 -1.01 0.00 0.00 57.07 56.20 1jpt s TYR 173 Cb -0.07 -0.92 -0.04 0.00 -0.11 0.00 0.00 41.96 40.82 1jpt s TYR 173 CO 0.35 0.51 -0.10 -1.12 -1.11 0.00 0.00 175.55 174.08 1jpt s SER 174 N -3.42 1.49 0.01 2.29 0.01 -1.26 -0.57 113.70 112.25 1jpt s SER 174 Ca 0.26 -0.82 0.00 0.00 1.31 0.00 0.00 55.95 56.70 1jpt s SER 174 Cb -0.02 0.00 -0.01 0.00 0.21 0.00 0.00 66.02 66.21 1jpt s SER 174 CO 0.11 -0.26 -0.01 -0.22 0.41 0.00 0.00 173.24 173.27 1jpt s LEU 175 N -2.48 2.09 -0.06 2.44 0.20 0.58 -1.66 118.68 119.79 1jpt s LEU 175 Ca 0.06 -0.19 0.05 0.00 0.69 0.00 0.00 54.13 54.74 1jpt s LEU 175 Cb -0.03 0.03 -0.00 0.00 -0.43 0.00 0.00 46.19 45.76 1jpt s LEU 175 CO 0.00 -0.11 -0.21 -0.55 -0.29 0.00 0.00 176.35 175.19 1jpt s SER 176 N -0.55 2.64 -0.06 3.68 0.15 0.02 -0.92 113.70 118.67 1jpt s SER 176 Ca -0.06 -0.45 0.05 0.00 0.70 0.00 0.00 55.95 56.19 1jpt s SER 176 Cb -0.04 -0.86 -0.00 0.00 -1.71 0.00 0.00 66.02 63.41 1jpt s SER 176 CO -0.00 0.18 -0.20 -0.55 1.20 0.00 0.00 173.24 173.86 1jpt s SER 177 N 0.07 2.54 -0.14 5.45 0.15 0.19 -1.20 113.70 120.76 1jpt s SER 177 Ca -0.07 -0.43 0.02 0.00 0.70 0.00 0.00 55.95 56.17 1jpt s SER 177 Cb -0.14 -0.78 0.01 0.00 -1.71 0.00 0.00 66.02 63.40 1jpt s SER 177 CO 0.04 0.18 -0.22 -0.89 1.20 0.00 0.00 173.24 173.55 1jpt s THR 178 N 0.04 2.03 -0.20 6.45 2.01 0.35 -0.69 115.64 125.63 1jpt s THR 178 Ca -0.06 -0.96 -0.11 0.00 0.31 0.00 0.00 61.69 60.87 1jpt s THR 178 Cb -0.13 -1.80 -0.05 0.00 0.01 0.00 0.00 72.50 70.53 1jpt s THR 178 CO 0.04 0.54 0.17 -0.22 -0.69 0.00 0.00 174.62 174.46 1jpt s LEU 179 N 0.85 4.19 -0.13 4.42 2.96 0.32 -1.44 118.68 129.84 1jpt s LEU 179 Ca -0.06 0.25 -0.00 0.00 -0.22 0.00 0.00 54.13 54.10 1jpt s LEU 179 Cb -0.15 -2.15 -0.01 0.00 0.50 0.00 0.00 46.19 44.37 1jpt s LEU 179 CO -0.03 0.13 -0.13 -0.89 -1.32 0.00 0.00 176.35 174.11 1jpt s THR 180 N 0.60 3.00 0.17 3.68 2.01 -0.30 -1.26 115.64 123.54 1jpt s THR 180 Ca 0.10 -0.68 0.00 0.00 0.31 0.00 0.00 61.69 61.42 1jpt s THR 180 Cb -0.12 -2.26 -0.04 0.00 0.01 0.00 0.00 72.50 70.09 1jpt s THR 180 CO 0.01 0.52 0.05 -0.76 -0.69 0.00 0.00 174.62 173.75 1jpt s LEU 181 N 0.40 1.83 0.63 4.42 1.43 -0.86 -4.89 118.68 121.64 1jpt s LEU 181 Ca -0.10 -1.23 -0.13 0.00 -1.03 0.00 0.00 54.13 51.63 1jpt s LEU 181 Cb -0.16 0.14 -0.02 0.00 0.03 0.00 0.00 46.19 46.18 1jpt s LEU 181 CO 0.05 -0.68 1.05 -0.94 0.23 0.00 0.00 176.35 176.06 1jpt s SER 182 N -3.14 5.78 0.36 2.29 1.04 -1.26 -1.47 113.70 117.30 1jpt s SER 182 Ca 0.27 1.64 0.06 0.00 0.48 0.00 0.00 55.95 58.40 1jpt s SER 182 Cb 0.07 -2.50 0.68 0.00 0.10 0.00 0.00 66.02 64.37 1jpt s SER 182 CO 0.05 -1.17 1.92 0.50 0.98 0.00 0.00 173.24 175.52 1jpt h LYS 183 N -0.11 0.50 -0.34 4.02 3.64 -0.71 -1.38 116.57 122.18 1jpt h LYS 183 Ca -0.45 -0.09 -0.02 0.00 -1.27 0.00 0.00 60.65 58.82 1jpt h LYS 183 Cb 1.21 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.93 1jpt h LYS 183 CO 0.58 0.49 0.14 0.00 -2.27 0.00 0.00 179.45 178.39 1jpt h ALA 184 N 1.58 0.44 -0.69 5.00 0.00 -1.91 -2.00 119.26 121.68 1jpt h ALA 184 Ca 0.11 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 1jpt h ALA 184 Cb 0.24 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 1jpt h ALA 184 CO 0.00 0.04 0.23 -0.44 0.00 0.00 0.00 179.25 179.08 1jpt h ASP 185 N 0.41 0.99 -0.58 0.00 3.32 -1.83 -2.45 116.42 116.28 1jpt h ASP 185 Ca 0.11 -0.20 0.00 0.00 0.02 0.00 0.00 57.03 56.97 1jpt h ASP 185 Cb 0.18 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.45 1jpt h ASP 185 CO -0.01 0.93 0.37 0.22 -1.72 0.00 0.00 179.24 179.03 1jpt h TYR 186 N 1.00 0.74 0.00 4.55 3.20 -1.12 -1.94 116.97 123.40 1jpt h TYR 186 Ca 0.22 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.10 1jpt h TYR 186 Cb 0.28 -0.25 0.00 0.00 1.54 0.00 0.00 36.73 38.31 1jpt h TYR 186 CO 0.02 0.48 0.00 0.93 -1.64 0.00 0.00 178.16 177.95 1jpt h GLU 187 N 0.78 0.00 0.15 1.82 4.39 -1.20 -3.07 114.58 117.45 1jpt h GLU 187 Ca 0.21 0.00 -0.22 0.00 0.34 0.00 0.00 59.36 59.69 1jpt h GLU 187 Cb -0.07 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 28.60 1jpt h GLU 187 CO -0.04 0.00 -0.99 0.87 -1.16 0.00 0.00 179.01 177.69 1jpt h LYS 188 N 0.00 0.32 -7.19 2.33 1.57 -0.88 -3.47 116.57 109.25 1jpt h LYS 188 Ca 0.00 -0.55 -0.46 0.00 -1.87 0.00 0.00 60.65 57.77 1jpt h LYS 188 Cb 0.44 0.21 0.07 0.00 0.08 0.00 0.00 32.23 33.02 1jpt h LYS 188 CO 0.00 1.27 0.18 -1.01 -0.57 0.00 0.00 179.45 179.32 1jpt s HIS 189 N -2.46 3.01 0.00 -1.35 3.76 -0.96 -5.07 115.29 112.23 1jpt s HIS 189 Ca -0.14 0.45 -0.03 0.00 -0.15 0.00 0.00 55.06 55.20 1jpt s HIS 189 Cb 0.02 -3.00 -0.01 0.00 1.11 0.00 0.00 32.58 30.69 1jpt s HIS 189 CO 0.84 -1.16 -0.06 1.17 -0.85 0.00 0.00 174.74 174.68 1jpt n LYS 190 N -2.75 0.09 -3.31 1.40 3.00 -1.26 -4.75 118.16 110.58 1jpt n LYS 190 Ca 0.07 0.04 -0.39 0.00 -0.00 0.00 0.00 58.31 58.03 1jpt n LYS 190 Cb 0.59 -0.66 -0.07 0.00 0.00 0.00 0.00 35.03 34.90 1jpt n LYS 190 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 1jpt s VAL 191 N -2.11 5.15 -0.11 3.15 1.01 -1.26 -0.64 120.40 125.59 1jpt s VAL 191 Ca -0.06 0.86 0.02 0.00 0.00 0.00 0.00 61.98 62.80 1jpt s VAL 191 Cb 0.02 -3.80 0.01 0.00 0.00 0.00 0.00 36.38 32.61 1jpt s VAL 191 CO 0.08 0.22 -0.17 -0.31 0.00 0.00 0.00 175.10 174.92 1jpt s TYR 192 N 1.38 2.10 -0.00 5.22 2.02 -0.47 -0.27 117.35 127.33 1jpt s TYR 192 Ca 0.22 -0.96 -0.09 0.00 -0.37 0.00 0.00 57.07 55.87 1jpt s TYR 192 Cb -0.15 -1.48 0.01 0.00 -0.40 0.00 0.00 41.96 39.93 1jpt s TYR 192 CO 0.09 -0.47 0.18 0.00 -1.57 0.00 0.00 175.55 173.78 1jpt s ALA 193 N 0.84 -0.44 -0.05 3.71 0.00 -0.50 -0.64 121.76 124.66 1jpt s ALA 193 Ca -0.09 -0.01 0.06 0.00 0.00 0.00 0.00 51.96 51.91 1jpt s ALA 193 Cb -0.15 0.10 -0.01 0.00 0.00 0.00 0.00 23.12 23.05 1jpt s ALA 193 CO 0.00 -0.22 -0.24 0.00 0.00 0.00 0.00 175.76 175.31 1jpt s GLU 195 N -0.13 3.36 -0.09 0.00 2.12 0.41 -1.80 118.70 122.57 1jpt s GLU 195 Ca -0.04 -0.70 0.04 0.00 0.36 0.00 0.00 54.97 54.63 1jpt s GLU 195 Cb -0.13 -2.61 -0.01 0.00 0.26 0.00 0.00 34.13 31.64 1jpt s GLU 195 CO 0.03 0.20 -0.22 0.08 -0.54 0.00 0.00 175.26 174.82 1jpt s VAL 196 N 0.38 2.31 -0.06 3.70 1.01 0.40 -0.85 120.40 127.29 1jpt s VAL 196 Ca -0.11 -0.95 0.05 0.00 0.00 0.00 0.00 61.98 60.97 1jpt s VAL 196 Cb -0.16 -1.89 -0.02 0.00 0.00 0.00 0.00 36.38 34.32 1jpt s VAL 196 CO 0.06 0.56 -0.21 -0.89 0.00 0.00 0.00 175.10 174.61 1jpt s THR 197 N 0.12 2.39 -0.04 3.92 2.01 -0.29 -1.13 115.64 122.63 1jpt s THR 197 Ca -0.11 -0.95 -0.30 0.00 0.31 0.00 0.00 61.69 60.64 1jpt s THR 197 Cb -0.16 -1.89 0.08 0.00 0.01 0.00 0.00 72.50 70.53 1jpt s THR 197 CO 0.06 0.57 0.71 -2.28 -0.69 0.00 0.00 174.62 172.99 1jpt s HIS 198 N -0.32 -0.61 0.46 4.92 2.46 -1.26 -1.50 115.29 119.44 1jpt s HIS 198 Ca 0.02 0.96 0.22 0.00 0.47 0.00 0.00 55.06 56.73 1jpt s HIS 198 Cb -0.13 0.43 1.22 0.00 -0.13 0.00 0.00 32.58 33.98 1jpt s HIS 198 CO 0.02 -0.61 1.88 0.37 -2.47 0.00 0.00 174.74 173.94 1jpt h GLN 199 N 2.81 0.25 -0.04 2.88 4.15 -1.93 0.30 115.11 123.54 1jpt h GLN 199 Ca -0.27 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.14 1jpt h GLN 199 Cb 1.16 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 28.80 1jpt h GLN 199 CO 0.38 0.17 0.00 0.41 -1.93 0.00 0.00 178.83 177.85 1jpt n GLY 200 N -1.58 -0.43 3.34 2.39 0.00 -1.26 -4.77 105.19 102.88 1jpt n GLY 200 Ca 0.18 -0.30 -0.34 0.00 0.00 0.00 0.00 46.02 45.56 1jpt n GLY 200 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jpt s LEU 201 N -1.82 2.79 0.26 0.99 1.43 0.11 -4.57 118.68 117.86 1jpt s LEU 201 Ca 0.37 -0.36 0.02 0.00 -1.03 0.00 0.00 54.13 53.14 1jpt s LEU 201 Cb 0.19 -1.66 0.34 0.00 0.03 0.00 0.00 46.19 45.08 1jpt s LEU 201 CO 0.30 0.09 1.66 0.77 0.23 0.00 0.00 176.35 179.40 1jpt h SER 202 N 7.31 0.47 -5.18 2.29 4.64 -1.86 -3.42 113.55 117.80 1jpt h SER 202 Ca -0.33 -0.19 -0.11 0.00 -0.47 0.00 0.00 61.79 60.68 1jpt h SER 202 Cb 1.19 -0.13 -0.15 0.00 -0.31 0.00 0.00 62.40 62.99 1jpt h SER 202 CO 0.59 0.80 -0.58 -0.94 -0.87 0.00 0.00 176.83 175.82 1jpt s SER 203 N -6.85 0.33 0.52 4.97 1.04 -1.26 -5.11 113.70 107.34 1jpt s SER 203 Ca -0.06 -0.81 -0.22 0.00 0.48 0.00 0.00 55.95 55.34 1jpt s SER 203 Cb 0.13 0.23 -0.07 0.00 0.10 0.00 0.00 66.02 66.42 1jpt s SER 203 CO 0.80 -0.60 1.15 -2.65 0.98 0.00 0.00 173.24 172.92 1jpt n PRO 204 N 0.25 1.41 -4.55 4.02 -0.02 -1.26 -4.93 135.00 129.92 1jpt n PRO 204 Ca -0.16 0.52 -0.33 0.00 -2.02 0.00 0.00 63.50 61.51 1jpt n PRO 204 Cb 0.61 -2.31 -0.13 0.00 -0.02 0.00 0.00 33.50 31.64 1jpt n PRO 204 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1jpt s VAL 205 N -1.34 3.60 -0.09 -1.45 1.01 -0.28 -4.91 120.40 116.94 1jpt s VAL 205 Ca 0.70 -0.47 0.04 0.00 0.00 0.00 0.00 61.98 62.25 1jpt s VAL 205 Cb -0.46 -2.55 -0.01 0.00 0.00 0.00 0.00 36.38 33.37 1jpt s VAL 205 CO 0.51 0.52 -0.22 -0.89 0.00 0.00 0.00 175.10 175.02 1jpt s THR 206 N 0.20 2.23 -0.03 3.92 2.01 -1.26 -0.45 115.64 122.26 1jpt s THR 206 Ca -0.04 -0.97 0.07 0.00 0.31 0.00 0.00 61.69 61.06 1jpt s THR 206 Cb -0.14 -1.85 -0.02 0.00 0.01 0.00 0.00 72.50 70.49 1jpt s THR 206 CO 0.04 0.56 -0.24 -0.54 -0.69 0.00 0.00 174.62 173.75 1jpt s LYS 207 N 0.14 2.20 0.23 4.92 -0.14 -0.74 -4.98 119.74 121.37 1jpt s LYS 207 Ca -0.12 -0.88 -0.15 0.00 -1.36 0.00 0.00 55.97 53.46 1jpt s LYS 207 Cb -0.16 -2.11 0.01 0.00 -1.68 0.00 0.00 37.83 33.88 1jpt s LYS 207 CO 0.07 0.57 0.50 -1.54 -0.76 0.00 0.00 175.35 174.18 1jpt s SER 208 N -0.62 -0.14 0.09 2.83 1.04 -1.26 -1.37 113.70 114.27 1jpt s SER 208 Ca 0.10 -0.77 -0.11 0.00 0.48 0.00 0.00 55.95 55.64 1jpt s SER 208 Cb -0.10 0.59 0.01 0.00 0.10 0.00 0.00 66.02 66.62 1jpt s SER 208 CO -0.01 -1.12 0.26 0.72 0.98 0.00 0.00 173.24 174.07 1jpt s PHE 209 N -3.96 0.02 -0.18 5.02 -0.71 0.18 -5.00 117.98 113.35 1jpt s PHE 209 Ca 0.17 -0.37 -0.04 0.00 -1.04 0.00 0.00 56.93 55.65 1jpt s PHE 209 Cb -0.01 0.05 -0.02 0.00 -1.21 0.00 0.00 43.02 41.82 1jpt s PHE 209 CO 0.05 -0.57 -0.03 -0.80 -1.34 0.00 0.00 175.22 172.53 1jpt s ASN 210 N -2.69 4.71 0.40 1.98 0.01 -1.26 -1.37 114.94 116.72 1jpt s ASN 210 Ca 0.02 -0.19 -0.26 0.00 -0.71 0.00 0.00 52.86 51.72 1jpt s ASN 210 Cb 0.03 -1.78 -0.11 0.00 0.41 0.00 0.00 41.25 39.80 1jpt s ASN 210 CO -0.10 0.11 1.29 -1.14 -1.51 0.00 0.00 177.10 175.75 1jpt n ARG 211 N 3.93 2.03 0.00 -0.60 0.63 0.19 -2.59 116.66 120.25 1jpt n ARG 211 Ca -0.17 0.72 0.00 0.00 -0.92 0.00 0.00 57.85 57.48 1jpt n ARG 211 Cb 0.52 -2.39 0.00 0.00 0.45 0.00 0.00 32.46 31.04 1jpt n ARG 211 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1jpt n GLY 212 N 0.78 2.42 0.00 5.14 0.00 -1.26 -4.99 105.19 107.28 1jpt n GLY 212 Ca 0.06 -0.49 0.08 0.00 0.00 0.00 0.00 46.02 45.67 1jpt n GLY 212 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50