#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1t3h s TYR 3 N 0.00 3.47 -0.32 -1.55 5.04 -1.25 -4.94 117.35 117.80 1t3h s TYR 3 Ca 0.00 1.44 -0.08 0.00 -2.44 0.00 0.00 57.07 55.98 1t3h s TYR 3 Cb 0.00 -3.31 0.01 0.00 0.35 0.00 0.00 41.96 39.01 1t3h s TYR 3 CO 0.00 -0.79 0.13 0.42 -1.34 0.00 0.00 175.55 173.97 1t3h s ILE 4 N 1.34 4.26 -0.33 3.14 1.01 -1.26 -1.35 121.20 128.01 1t3h s ILE 4 Ca 0.55 -0.68 -0.10 0.00 0.00 0.00 0.00 60.65 60.43 1t3h s ILE 4 Cb -0.25 -3.24 0.00 0.00 0.01 0.00 0.00 42.46 38.98 1t3h s ILE 4 CO 0.27 -0.01 0.16 -0.69 0.00 0.00 0.00 174.94 174.67 1t3h s VAL 5 N 1.54 4.53 0.07 2.92 1.01 -0.30 -1.30 120.40 128.87 1t3h s VAL 5 Ca 0.03 -0.57 -0.22 0.00 0.00 0.00 0.00 61.98 61.22 1t3h s VAL 5 Cb -0.18 -3.37 -0.07 0.00 0.00 0.00 0.00 36.38 32.77 1t3h s VAL 5 CO 0.04 -0.01 0.65 0.00 0.00 0.00 0.00 175.10 175.78 1t3h s ALA 6 N 1.58 3.51 -0.06 5.51 0.00 0.14 -1.13 121.76 131.32 1t3h s ALA 6 Ca 0.04 0.14 0.04 0.00 0.00 0.00 0.00 51.96 52.17 1t3h s ALA 6 Cb -0.18 -2.78 -0.02 0.00 0.00 0.00 0.00 23.12 20.14 1t3h s ALA 6 CO 0.06 0.28 -0.17 -1.17 0.00 0.00 0.00 175.76 174.76 1t3h s LEU 7 N -0.77 2.56 0.30 0.00 2.96 0.19 -0.46 118.68 123.47 1t3h s LEU 7 Ca 0.32 -0.29 -0.15 0.00 -0.22 0.00 0.00 54.13 53.80 1t3h s LEU 7 Cb -0.20 -1.51 0.02 0.00 0.50 0.00 0.00 46.19 45.00 1t3h s LEU 7 CO 0.21 0.31 0.63 0.28 -1.32 0.00 0.00 176.35 176.45 1t3h s THR 8 N -0.51 0.00 0.00 3.68 -1.32 -0.85 -0.57 115.64 116.07 1t3h s THR 8 Ca 0.07 -1.21 0.00 0.00 -1.21 0.00 0.00 61.69 59.34 1t3h s THR 8 Cb -0.12 -2.36 0.00 0.00 -1.51 0.00 0.00 72.50 68.51 1t3h s THR 8 CO 0.01 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.03 1t3h n GLY 9 N -0.47 1.59 3.63 6.08 0.00 -1.26 -1.58 105.19 113.18 1t3h n GLY 9 Ca -0.04 -0.79 -0.30 0.00 0.00 0.00 0.00 46.02 44.89 1t3h n GLY 9 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1t3h s GLY 10 N 0.00 1.62 0.12 -0.02 0.00 -1.26 -4.88 107.32 102.90 1t3h s GLY 10 Ca 0.00 -1.10 -0.31 0.00 0.00 0.00 0.00 44.72 43.31 1t3h s GLY 10 CO 0.00 -0.17 1.63 -1.50 0.00 0.00 0.00 173.10 173.06 1t3h s ILE 11 N -3.15 2.79 0.00 0.90 -1.16 -1.26 -2.19 121.20 117.13 1t3h s ILE 11 Ca 0.73 0.42 0.00 0.00 -0.51 0.00 0.00 60.65 61.28 1t3h s ILE 11 Cb -0.07 -3.27 0.00 0.00 0.61 0.00 0.00 42.46 39.73 1t3h s ILE 11 CO 0.55 0.01 0.00 0.61 -2.81 0.00 0.00 174.94 173.31 1t3h n GLY 12 N 3.91 0.47 0.02 1.50 0.00 -1.26 -4.68 105.19 105.15 1t3h n GLY 12 Ca 0.15 -0.56 0.13 0.00 0.00 0.00 0.00 46.02 45.74 1t3h n GLY 12 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1t3h n SER 13 N 1.02 0.22 -0.43 1.61 3.41 -0.93 -4.60 113.62 113.93 1t3h n SER 13 Ca 0.00 0.36 0.00 0.00 -0.26 0.00 0.00 58.87 58.97 1t3h n SER 13 Cb 0.00 -0.37 0.00 0.00 -0.26 0.00 0.00 64.21 63.58 1t3h n SER 13 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1t3h n GLY 14 N 1.47 0.90 0.22 5.00 0.00 -1.26 -4.81 105.19 106.71 1t3h n GLY 14 Ca 0.06 -0.68 -0.02 0.00 0.00 0.00 0.00 46.02 45.38 1t3h n GLY 14 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1t3h h LYS 15 N 0.00 0.45 -0.70 1.61 1.57 -1.91 -2.03 116.57 115.56 1t3h h LYS 15 Ca 0.00 -0.03 0.08 0.00 -1.87 0.00 0.00 60.65 58.83 1t3h h LYS 15 Cb 0.97 -0.10 -0.06 0.00 0.08 0.00 0.00 32.23 33.11 1t3h h LYS 15 CO 0.00 0.30 0.38 0.66 -0.57 0.00 0.00 179.45 180.22 1t3h h SER 16 N 0.47 0.53 -0.72 0.86 4.64 -1.99 -0.54 113.55 116.79 1t3h h SER 16 Ca 0.27 0.04 -0.03 0.00 -0.47 0.00 0.00 61.79 61.60 1t3h h SER 16 Cb 0.26 -0.05 -0.03 0.00 -0.31 0.00 0.00 62.40 62.26 1t3h h SER 16 CO -0.23 0.32 0.33 0.74 -0.87 0.00 0.00 176.83 177.12 1t3h h THR 17 N 0.67 1.24 -0.12 2.95 2.02 -1.77 -1.00 112.91 116.90 1t3h h THR 17 Ca 0.33 -0.70 -0.17 0.00 0.77 0.00 0.00 66.41 66.64 1t3h h THR 17 Cb 0.28 0.32 0.01 0.00 -1.74 0.00 0.00 68.15 67.02 1t3h h THR 17 CO -0.22 0.29 -0.60 0.58 0.37 0.00 0.00 175.52 175.94 1t3h h VAL 18 N 1.05 1.34 -0.55 3.16 2.07 -1.05 -3.04 116.25 119.23 1t3h h VAL 18 Ca 0.25 -1.88 0.04 0.00 0.82 0.00 0.00 66.70 65.94 1t3h h VAL 18 Cb 0.14 2.12 -0.05 0.00 -1.52 0.00 0.00 31.29 31.99 1t3h h VAL 18 CO -0.03 0.57 0.29 0.00 0.02 0.00 0.00 177.57 178.43 1t3h h ALA 19 N 0.50 0.72 -0.75 1.67 0.00 -0.91 -2.00 119.26 118.48 1t3h h ALA 19 Ca -0.04 0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.91 1t3h h ALA 19 Cb 1.24 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.89 1t3h h ALA 19 CO 0.12 -0.04 0.49 -0.91 0.00 0.00 0.00 179.25 178.92 1t3h h ASN 20 N 0.57 0.80 -0.33 0.00 2.35 -1.21 -0.32 115.58 117.43 1t3h h ASN 20 Ca 0.24 -0.01 -0.04 0.00 -0.55 0.00 0.00 56.30 55.94 1t3h h ASN 20 Cb 0.13 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.29 1t3h h ASN 20 CO -0.15 0.56 0.09 0.00 -1.65 0.00 0.00 177.43 176.27 1t3h h ALA 21 N 1.56 1.40 0.05 -0.83 0.00 -1.25 0.38 119.26 120.57 1t3h h ALA 21 Ca 0.29 -0.17 -0.23 0.00 0.00 0.00 0.00 54.91 54.81 1t3h h ALA 21 Cb 0.02 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1t3h h ALA 21 CO -0.08 0.43 -1.05 0.74 0.00 0.00 0.00 179.25 179.29 1t3h h PHE 22 N 0.59 0.29 -0.72 0.00 0.04 -1.17 -3.15 116.94 112.82 1t3h h PHE 22 Ca 0.14 -0.19 -0.00 0.00 2.80 0.00 0.00 57.97 60.71 1t3h h PHE 22 Cb 0.24 -0.02 -0.03 0.00 2.20 0.00 0.00 35.95 38.33 1t3h h PHE 22 CO 0.01 1.10 0.43 0.00 -0.60 0.00 0.00 178.31 179.25 1t3h h ALA 23 N 0.83 0.92 0.00 2.45 0.00 -0.22 -0.48 119.26 122.76 1t3h h ALA 23 Ca -0.07 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1t3h h ALA 23 Cb 1.76 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 19.26 1t3h h ALA 23 CO 0.16 0.39 0.00 -0.44 0.00 0.00 0.00 179.25 179.36 1t3h h ASP 24 N 0.98 0.00 -0.23 0.00 3.32 -0.97 -1.08 116.42 118.45 1t3h h ASP 24 Ca 0.26 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.31 1t3h h ASP 24 Cb -0.03 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.52 1t3h h ASP 24 CO -0.05 0.00 0.00 0.18 -1.72 0.00 0.00 179.24 177.65 1t3h n LEU 25 N -2.95 1.75 0.00 1.55 4.77 -0.23 -4.91 117.00 116.98 1t3h n LEU 25 Ca -0.00 -0.79 0.00 0.00 -0.03 0.00 0.00 56.01 55.19 1t3h n LEU 25 Cb 0.22 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 1t3h n LEU 25 CO 0.23 0.39 0.00 0.61 -1.33 0.00 0.00 177.39 177.30 1t3h n GLY 26 N 1.11 0.82 3.83 -0.72 0.00 -0.41 -5.08 105.19 104.75 1t3h n GLY 26 Ca 0.15 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.79 1t3h n GLY 26 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1t3h s ILE 27 N -2.08 5.00 0.15 -0.61 1.09 -0.93 -4.59 121.20 119.24 1t3h s ILE 27 Ca 0.00 0.87 -0.30 0.00 -1.10 0.00 0.00 60.65 60.12 1t3h s ILE 27 Cb 0.00 -3.73 -0.07 0.00 -1.06 0.00 0.00 42.46 37.60 1t3h s ILE 27 CO 0.00 0.58 0.99 0.20 -0.10 0.00 0.00 174.94 176.60 1t3h s ASN 28 N -1.07 7.48 -0.19 3.58 -0.87 -1.26 -4.14 114.94 118.47 1t3h s ASN 28 Ca 0.24 1.89 -0.04 0.00 -1.57 0.00 0.00 52.86 53.38 1t3h s ASN 28 Cb -0.17 -2.60 -0.02 0.00 -0.02 0.00 0.00 41.25 38.44 1t3h s ASN 28 CO 0.14 -0.05 -0.02 -0.69 -2.57 0.00 0.00 177.10 173.90 1t3h s VAL 29 N -0.29 3.81 -0.45 1.60 1.01 -1.26 -2.15 120.40 122.68 1t3h s VAL 29 Ca 0.46 -0.37 -0.07 0.00 0.00 0.00 0.00 61.98 62.00 1t3h s VAL 29 Cb -0.25 -2.70 0.11 0.00 0.00 0.00 0.00 36.38 33.54 1t3h s VAL 29 CO 0.31 0.45 0.29 -0.63 0.00 0.00 0.00 175.10 175.53 1t3h s ILE 30 N 0.84 3.93 -0.07 2.22 -1.09 -0.22 -5.00 121.20 121.81 1t3h s ILE 30 Ca -0.00 -1.82 -0.25 0.00 -2.23 0.00 0.00 60.65 56.35 1t3h s ILE 30 Cb -0.14 -3.60 -0.03 0.00 -1.58 0.00 0.00 42.46 37.11 1t3h s ILE 30 CO 0.02 -0.72 0.77 -0.62 -1.23 0.00 0.00 174.94 173.16 1t3h s ASP 31 N 2.36 7.05 0.32 3.58 2.15 -1.26 -0.91 116.67 129.96 1t3h s ASP 31 Ca 0.06 1.27 0.02 0.00 0.43 0.00 0.00 52.55 54.33 1t3h s ASP 31 Cb -0.25 -2.45 0.54 0.00 -0.30 0.00 0.00 42.92 40.47 1t3h s ASP 31 CO -0.01 -0.19 1.88 0.00 -0.17 0.00 0.00 175.17 176.68 1t3h h ALA 32 N 6.86 1.35 -0.36 3.66 0.00 -0.79 -2.61 119.26 127.37 1t3h h ALA 32 Ca -0.39 -0.18 -0.10 0.00 0.00 0.00 0.00 54.91 54.24 1t3h h ALA 32 Cb 1.19 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 1t3h h ALA 32 CO 0.76 0.47 -0.19 -0.44 0.00 0.00 0.00 179.25 179.85 1t3h h ASP 33 N 0.65 0.78 -0.28 0.00 3.32 -1.94 -2.23 116.42 116.72 1t3h h ASP 33 Ca 0.15 -0.41 0.02 0.00 0.02 0.00 0.00 57.03 56.81 1t3h h ASP 33 Cb 0.25 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 1t3h h ASP 33 CO -0.00 1.02 0.13 0.40 -1.72 0.00 0.00 179.24 179.07 1t3h h ILE 34 N 0.54 0.98 -0.79 0.35 1.08 -1.92 -1.49 117.51 116.26 1t3h h ILE 34 Ca 0.08 -0.10 -0.00 0.00 -0.39 0.00 0.00 64.86 64.45 1t3h h ILE 34 Cb 0.73 0.67 -0.04 0.00 -3.07 0.00 0.00 36.82 35.12 1t3h h ILE 34 CO 0.06 0.05 0.48 0.40 -0.69 0.00 0.00 178.15 178.44 1t3h h ILE 35 N 0.28 1.22 0.00 -0.67 5.03 -1.42 -0.01 117.51 121.94 1t3h h ILE 35 Ca 0.12 -0.49 0.00 0.00 -0.12 0.00 0.00 64.86 64.37 1t3h h ILE 35 Cb 0.05 0.10 0.00 0.00 -3.03 0.00 0.00 36.82 33.94 1t3h h ILE 35 CO -0.09 0.23 0.00 0.00 -0.68 0.00 0.00 178.15 177.61 1t3h n ALA 36 N -2.42 1.53 -0.39 1.87 0.00 -0.84 -2.59 120.51 117.67 1t3h n ALA 36 Ca 0.08 0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.56 1t3h n ALA 36 Cb 0.07 -1.28 0.01 0.00 0.00 0.00 0.00 19.45 18.24 1t3h n ALA 36 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1t3h n ARG 37 N -1.87 1.95 0.05 0.00 1.74 -0.13 -4.00 116.66 114.40 1t3h n ARG 37 Ca 0.02 -1.22 -0.05 0.00 -0.77 0.00 0.00 57.85 55.83 1t3h n ARG 37 Cb 0.16 -0.85 -0.09 0.00 -1.02 0.00 0.00 32.46 30.65 1t3h n ARG 37 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 1t3h h GLN 38 N 0.00 0.00 0.00 5.56 4.20 -0.98 -3.15 115.11 120.74 1t3h h GLN 38 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1t3h h GLN 38 Cb 0.69 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.47 1t3h h GLN 38 CO 0.00 0.67 0.00 1.33 -0.67 0.00 0.00 178.83 180.16 1t3h n VAL 39 N -3.18 0.36 -0.26 -0.54 0.24 -1.11 -2.23 118.33 111.60 1t3h n VAL 39 Ca -0.05 0.09 0.00 0.00 -2.04 0.00 0.00 64.34 62.34 1t3h n VAL 39 Cb 0.92 -0.79 0.00 0.00 -1.47 0.00 0.00 33.84 32.49 1t3h n VAL 39 CO 0.00 0.00 0.00 1.33 -2.14 0.00 0.00 176.83 176.02 1t3h n VAL 40 N -1.22 0.63 -0.97 3.34 0.24 -1.24 -4.36 118.33 114.76 1t3h n VAL 40 Ca 0.10 -0.68 -0.35 0.00 -2.04 0.00 0.00 64.34 61.37 1t3h n VAL 40 Cb 0.13 0.73 0.08 0.00 -1.47 0.00 0.00 33.84 33.30 1t3h n VAL 40 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1t3h n GLU 41 N -0.31 -0.08 -1.80 7.34 1.02 -0.95 -4.71 120.64 121.15 1t3h n GLU 41 Ca 0.00 0.01 -0.42 0.00 -0.02 0.00 0.00 57.16 56.73 1t3h n GLU 41 Cb 0.28 -1.58 -0.03 0.00 -0.02 0.00 0.00 31.44 30.09 1t3h n GLU 41 CO 0.00 0.00 0.00 -2.14 1.18 0.00 0.00 177.13 176.17 1t3h s PRO 42 N -2.89 4.16 0.00 3.49 0.02 -1.26 -0.78 135.00 137.74 1t3h s PRO 42 Ca 0.54 2.50 0.00 0.00 0.02 0.00 0.00 61.00 64.06 1t3h s PRO 42 Cb -0.24 -3.36 0.00 0.00 0.02 0.00 0.00 34.50 30.91 1t3h s PRO 42 CO 0.70 -0.75 0.00 0.41 -0.33 0.00 0.00 177.00 177.03 1t3h n GLY 43 N 4.02 0.60 3.76 0.52 0.00 -1.26 -5.05 105.19 107.79 1t3h n GLY 43 Ca 0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 1t3h n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t3h s ALA 44 N -2.24 3.36 0.13 4.61 0.00 0.04 -4.96 121.76 122.71 1t3h s ALA 44 Ca 0.00 0.93 -0.32 0.00 0.00 0.00 0.00 51.96 52.56 1t3h s ALA 44 Cb 0.00 -3.34 -0.10 0.00 0.00 0.00 0.00 23.12 19.68 1t3h s ALA 44 CO 0.00 -0.25 1.55 -1.00 0.00 0.00 0.00 175.76 176.06 1t3h h PRO 45 N 3.52 -0.42 -1.03 0.00 0.13 -1.88 -1.22 132.00 131.10 1t3h h PRO 45 Ca -0.47 0.03 0.30 0.00 -0.87 0.00 0.00 66.00 64.98 1t3h h PRO 45 Cb 1.22 0.10 -0.04 0.00 0.13 0.00 0.00 31.00 32.40 1t3h h PRO 45 CO 0.66 -0.28 0.76 0.00 -0.23 0.00 0.00 178.00 178.91 1t3h h ALA 46 N -0.03 2.96 -0.47 -0.56 0.00 -1.93 0.14 119.26 119.37 1t3h h ALA 46 Ca 0.07 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 1t3h h ALA 46 Cb 0.62 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 1t3h h ALA 46 CO -0.55 -1.29 -0.06 1.25 0.00 0.00 0.00 179.25 178.61 1t3h h LEU 47 N 0.00 0.80 -0.48 0.00 6.46 -1.44 0.41 115.31 121.06 1t3h h LEU 47 Ca 0.49 -0.22 -0.14 0.00 -0.12 0.00 0.00 57.88 57.89 1t3h h LEU 47 Cb 2.00 -0.21 -0.01 0.00 -0.73 0.00 0.00 40.66 41.71 1t3h h LEU 47 CO -0.01 0.90 -0.30 -0.74 -0.62 0.00 0.00 178.44 177.67 1t3h h HIS 48 N 0.75 1.09 -0.88 1.25 2.76 -0.75 -2.57 115.15 116.80 1t3h h HIS 48 Ca 0.14 -0.29 0.07 0.00 -2.20 0.00 0.00 60.37 58.08 1t3h h HIS 48 Cb 0.53 -0.24 -0.07 0.00 1.55 0.00 0.00 27.41 29.19 1t3h h HIS 48 CO 0.03 1.11 0.54 0.00 -1.30 0.00 0.00 177.93 178.31 1t3h h ALA 49 N 0.86 1.23 -2.01 5.26 0.00 -0.90 -2.43 119.26 121.27 1t3h h ALA 49 Ca 0.08 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1t3h h ALA 49 Cb 0.88 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1t3h h ALA 49 CO 0.08 0.26 0.00 -0.89 0.00 0.00 0.00 179.25 178.70 1t3h n ILE 50 N -4.63 0.00 0.14 0.00 5.41 0.08 -2.56 119.36 117.80 1t3h n ILE 50 Ca 0.13 1.04 0.14 0.00 1.00 0.00 0.00 62.75 65.06 1t3h n ILE 50 Cb 0.21 -1.96 0.38 0.00 -0.71 0.00 0.00 39.64 37.55 1t3h n ILE 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1t3h h ALA 51 N -2.00 2.18 0.09 -1.39 0.00 -1.49 0.65 119.26 117.29 1t3h h ALA 51 Ca 0.00 -0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.71 1t3h h ALA 51 Cb 0.00 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1t3h h ALA 51 CO 0.00 -1.05 -0.94 -0.44 0.00 0.00 0.00 179.25 176.81 1t3h h ASP 52 N 0.00 0.28 1.03 0.00 3.45 -1.47 -1.24 116.42 118.48 1t3h h ASP 52 Ca 0.17 -0.87 -0.12 0.00 0.43 0.00 0.00 57.03 56.64 1t3h h ASP 52 Cb 1.91 -0.09 -0.02 0.00 -0.56 0.00 0.00 39.33 40.57 1t3h h ASP 52 CO -0.00 1.42 -1.03 -0.74 -1.57 0.00 0.00 179.24 177.31 1t3h h HIS 53 N -0.55 0.00 -0.01 4.55 2.76 -0.78 -3.37 115.15 117.76 1t3h h HIS 53 Ca -0.20 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.97 1t3h h HIS 53 Cb 1.52 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.48 1t3h h HIS 53 CO 0.17 0.46 -0.14 1.19 -1.30 0.00 0.00 177.93 178.32 1t3h n PHE 54 N -2.97 0.00 0.00 5.26 3.01 0.21 -5.09 117.46 117.88 1t3h n PHE 54 Ca -0.04 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.42 1t3h n PHE 54 Cb 0.76 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.23 1t3h n PHE 54 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1t3h n GLY 55 N 0.77 1.85 0.00 1.37 0.00 -0.72 -4.79 105.19 103.67 1t3h n GLY 55 Ca 0.04 -1.36 0.00 0.00 0.00 0.00 0.00 46.02 44.70 1t3h n GLY 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t3h n ALA 56 N 2.78 0.85 -0.10 4.61 0.00 -0.55 -4.44 120.51 123.67 1t3h n ALA 56 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1t3h n ALA 56 Cb 0.00 -0.70 0.00 0.00 0.00 0.00 0.00 19.45 18.75 1t3h n ALA 56 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1t3h n ASN 57 N -1.14 0.00 0.00 0.00 6.94 -1.26 -5.02 115.26 114.79 1t3h n ASN 57 Ca 0.00 0.22 0.00 0.00 -0.02 0.00 0.00 54.58 54.78 1t3h n ASN 57 Cb 0.09 -0.45 0.00 0.00 -2.36 0.00 0.00 39.78 37.06 1t3h n ASN 57 CO 0.00 0.00 0.00 -1.84 -1.03 0.00 0.00 177.26 174.39 1t3h n GLU 79 N -2.13 0.00 -3.05 -3.83 -0.00 -1.26 -5.16 120.64 105.21 1t3h n GLU 79 Ca 0.00 0.00 -0.24 0.00 -0.00 0.00 0.00 57.16 56.92 1t3h n GLU 79 Cb 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 31.44 31.40 1t3h n GLU 79 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 1t3h n GLU 80 N 0.00 2.46 -0.06 3.44 4.07 -1.26 -4.78 120.64 124.51 1t3h n GLU 80 Ca 0.00 -4.37 0.12 0.00 -0.06 0.00 0.00 57.16 52.85 1t3h n GLU 80 Cb 0.00 -2.06 0.36 0.00 -0.06 0.00 0.00 31.44 29.68 1t3h n GLU 80 CO 0.00 0.00 0.00 1.63 -0.06 0.00 0.00 177.13 178.70 1t3h n LYS 81 N 0.01 1.91 -0.86 5.31 5.02 -1.26 -4.22 118.16 124.07 1t3h n LYS 81 Ca 0.29 -1.34 -0.11 0.00 -2.02 0.00 0.00 58.31 55.12 1t3h n LYS 81 Cb 0.48 -1.45 -0.03 0.00 -0.02 0.00 0.00 35.03 34.01 1t3h n LYS 81 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1t3h n ASN 82 N 0.59 5.85 0.00 4.39 2.04 -1.26 -0.73 115.26 126.13 1t3h n ASN 82 Ca 0.17 -2.75 0.00 0.00 -0.44 0.00 0.00 54.58 51.57 1t3h n ASN 82 Cb 0.41 -1.18 0.00 0.00 -2.53 0.00 0.00 39.78 36.49 1t3h n ASN 82 CO 0.00 0.00 0.00 1.87 -0.44 0.00 0.00 177.26 178.69 1t3h n TRP 83 N 1.24 0.00 -0.06 -2.53 -0.00 -1.26 -4.61 117.44 110.21 1t3h n TRP 83 Ca 0.25 0.00 -0.07 0.00 -0.00 0.00 0.00 57.50 57.68 1t3h n TRP 83 Cb 0.61 0.00 -0.06 0.00 -0.00 0.00 0.00 31.31 31.86 1t3h n TRP 83 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 177.69 178.94 1t3h h LEU 84 N 0.00 0.00 -3.75 5.87 5.85 -1.22 -0.19 115.31 121.87 1t3h h LEU 84 Ca 0.00 -0.41 -0.20 0.00 0.84 0.00 0.00 57.88 58.11 1t3h h LEU 84 Cb 0.49 0.00 -0.08 0.00 0.37 0.00 0.00 40.66 41.45 1t3h h LEU 84 CO 0.00 0.78 -0.06 0.59 -0.34 0.00 0.00 178.44 179.41 1t3h n ASN 85 N -4.68 5.62 0.00 1.25 4.13 -0.87 0.11 115.26 120.83 1t3h n ASN 85 Ca -0.07 -2.65 0.00 0.00 1.68 0.00 0.00 54.58 53.54 1t3h n ASN 85 Cb 0.25 -1.27 0.00 0.00 -1.54 0.00 0.00 39.78 37.23 1t3h n ASN 85 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1t3h n ALA 86 N 1.70 0.00 -0.03 5.41 0.00 -1.22 -4.70 120.51 121.68 1t3h n ALA 86 Ca 0.31 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.72 1t3h n ALA 86 Cb 0.70 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 20.14 1t3h n ALA 86 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1t3h n LEU 87 N 0.00 0.62 -0.04 0.00 7.94 0.30 -4.69 117.00 121.13 1t3h n LEU 87 Ca 0.00 0.11 -0.12 0.00 -1.11 0.00 0.00 56.01 54.89 1t3h n LEU 87 Cb 0.05 -0.57 -0.06 0.00 0.53 0.00 0.00 43.42 43.37 1t3h n LEU 87 CO 0.00 -0.43 0.75 -0.07 -1.11 0.00 0.00 177.39 176.53 1t3h h LEU 88 N -0.32 0.21 -0.98 -1.96 3.38 -1.08 -3.35 115.31 111.22 1t3h h LEU 88 Ca 0.00 -0.29 0.17 0.00 0.09 0.00 0.00 57.88 57.84 1t3h h LEU 88 Cb 0.32 -0.06 -0.17 0.00 0.09 0.00 0.00 40.66 40.84 1t3h h LEU 88 CO 0.00 0.45 -0.34 -0.74 0.09 0.00 0.00 178.44 177.90 1t3h h HIS 89 N -0.04 -0.89 0.00 1.13 2.76 -1.84 0.68 115.15 116.95 1t3h h HIS 89 Ca 0.04 0.10 0.00 0.00 -2.20 0.00 0.00 60.37 58.31 1t3h h HIS 89 Cb 0.34 0.54 0.00 0.00 1.55 0.00 0.00 27.41 29.84 1t3h h HIS 89 CO 0.03 -0.41 0.00 -1.00 -1.30 0.00 0.00 177.93 175.25 1t3h h PRO 90 N -0.01 0.00 0.14 5.26 0.13 -1.84 -1.96 132.00 133.73 1t3h h PRO 90 Ca 0.39 0.00 -0.28 0.00 -0.87 0.00 0.00 66.00 65.24 1t3h h PRO 90 Cb 0.64 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.77 1t3h h PRO 90 CO -0.99 0.00 -1.36 -0.07 -0.23 0.00 0.00 178.00 175.35 1t3h h LEU 91 N 0.00 0.48 -0.50 1.56 3.38 0.08 -2.82 115.31 117.49 1t3h h LEU 91 Ca 0.00 -0.89 0.05 0.00 0.09 0.00 0.00 57.88 57.13 1t3h h LEU 91 Cb 0.46 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 41.01 1t3h h LEU 91 CO 0.00 1.61 0.24 0.40 0.09 0.00 0.00 178.44 180.78 1t3h h ILE 92 N -0.21 0.92 -0.58 1.22 1.08 -0.50 0.55 117.51 119.98 1t3h h ILE 92 Ca -0.28 -0.16 0.04 0.00 -0.39 0.00 0.00 64.86 64.08 1t3h h ILE 92 Cb 1.83 0.42 -0.04 0.00 -3.07 0.00 0.00 36.82 35.96 1t3h h ILE 92 CO 0.12 0.08 0.33 -0.61 -0.69 0.00 0.00 178.15 177.38 1t3h h GLN 93 N 0.46 0.62 -0.21 2.37 4.15 -1.47 0.64 115.11 121.67 1t3h h GLN 93 Ca 0.23 -0.04 -0.13 0.00 0.77 0.00 0.00 58.65 59.48 1t3h h GLN 93 Cb 0.17 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 27.71 1t3h h GLN 93 CO -0.18 0.41 -0.43 0.37 -1.93 0.00 0.00 178.83 177.07 1t3h h GLN 94 N 0.64 0.50 0.01 1.69 4.15 -1.03 -2.63 115.11 118.44 1t3h h GLN 94 Ca 0.25 -0.26 -0.26 0.00 0.77 0.00 0.00 58.65 59.15 1t3h h GLN 94 Cb 0.10 0.01 0.02 0.00 0.21 0.00 0.00 27.48 27.81 1t3h h GLN 94 CO -0.14 0.84 -1.04 1.49 -1.93 0.00 0.00 178.83 178.05 1t3h h GLU 95 N 0.41 0.64 0.91 1.69 4.57 -0.51 -2.76 114.58 119.52 1t3h h GLU 95 Ca 0.03 -0.70 -0.04 0.00 -1.18 0.00 0.00 59.36 57.47 1t3h h GLU 95 Cb 0.92 0.20 0.01 0.00 -0.16 0.00 0.00 28.75 29.72 1t3h h GLU 95 CO 0.08 1.29 -0.44 1.15 -1.18 0.00 0.00 179.01 179.91 1t3h h THR 96 N 0.35 0.11 0.00 0.32 2.02 -0.86 -0.93 112.91 113.92 1t3h h THR 96 Ca -0.12 -0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.06 1t3h h THR 96 Cb 1.69 0.11 0.00 0.00 -1.74 0.00 0.00 68.15 68.21 1t3h h THR 96 CO 0.20 0.00 0.00 0.00 0.37 0.00 0.00 175.52 176.09 1t3h n GLN 97 N -5.62 0.37 -0.03 6.66 10.64 -0.99 -0.99 117.38 127.42 1t3h n GLN 97 Ca -0.16 0.05 -0.12 0.00 -1.83 0.00 0.00 57.00 54.94 1t3h n GLN 97 Cb 0.48 -1.50 -0.14 0.00 -0.86 0.00 0.00 30.24 28.22 1t3h n GLN 97 CO 0.00 0.00 0.00 1.58 -1.83 0.00 0.00 177.06 176.81 1t3h n HIS 98 N -1.09 0.89 0.09 2.61 -0.00 -0.82 -3.11 115.22 113.79 1t3h n HIS 98 Ca 0.09 0.28 -0.01 0.00 0.46 0.00 0.00 57.72 58.55 1t3h n HIS 98 Cb 0.07 -1.15 -0.04 0.00 -0.12 0.00 0.00 29.99 28.75 1t3h n HIS 98 CO 0.00 0.00 0.00 1.96 0.46 0.00 0.00 176.34 178.76 1t3h h GLN 99 N 0.01 0.00 0.00 1.57 4.20 0.25 -2.39 115.11 118.75 1t3h h GLN 99 Ca -0.36 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.26 1t3h h GLN 99 Cb 2.04 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.81 1t3h h GLN 99 CO 0.07 0.57 -0.42 0.82 -0.67 0.00 0.00 178.83 179.19 1t3h h ILE 100 N 0.00 1.04 0.00 2.54 1.08 -1.18 -2.29 117.51 118.69 1t3h h ILE 100 Ca -0.05 -1.61 -0.17 0.00 -0.39 0.00 0.00 64.86 62.64 1t3h h ILE 100 Cb 1.54 1.94 -0.03 0.00 -3.07 0.00 0.00 36.82 37.20 1t3h h ILE 100 CO 0.08 0.42 -0.90 1.56 -0.69 0.00 0.00 178.15 178.61 1t3h h GLN 101 N 0.00 0.00 -0.00 2.37 4.20 -1.48 -3.31 115.11 116.90 1t3h h GLN 101 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1t3h h GLN 101 Cb 0.91 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.69 1t3h h GLN 101 CO 0.06 0.69 -0.26 1.04 -0.67 0.00 0.00 178.83 179.68 1t3h n GLN 102 N -3.23 0.23 -2.47 1.46 1.13 -0.91 -4.90 117.38 108.69 1t3h n GLN 102 Ca -0.01 -0.10 -0.40 0.00 -1.94 0.00 0.00 57.00 54.55 1t3h n GLN 102 Cb 0.86 -1.50 -0.04 0.00 0.11 0.00 0.00 30.24 29.67 1t3h n GLN 102 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1t3h s ALA 103 N -2.84 3.36 -1.40 -1.58 0.00 -0.89 -4.97 121.76 113.44 1t3h s ALA 103 Ca 0.17 0.89 0.18 0.00 0.00 0.00 0.00 51.96 53.20 1t3h s ALA 103 Cb 0.19 -3.33 -0.07 0.00 0.00 0.00 0.00 23.12 19.91 1t3h s ALA 103 CO 0.59 -0.20 0.87 0.25 0.00 0.00 0.00 175.76 177.28 1t3h n THR 104 N 0.97 0.00 -1.81 0.00 -2.24 -1.26 -4.98 114.28 104.96 1t3h n THR 104 Ca -0.00 -0.23 -0.32 0.00 -2.27 0.00 0.00 64.05 61.23 1t3h n THR 104 Cb 0.45 1.14 0.03 0.00 -2.10 0.00 0.00 70.33 69.85 1t3h n THR 104 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1t3h s SER 105 N -2.29 5.71 0.25 3.42 1.04 -1.26 -4.93 113.70 115.63 1t3h s SER 105 Ca 0.12 1.64 -0.04 0.00 0.48 0.00 0.00 55.95 58.16 1t3h s SER 105 Cb 0.14 -2.50 0.43 0.00 0.10 0.00 0.00 66.02 64.19 1t3h s SER 105 CO 0.55 -1.22 1.80 -0.65 0.98 0.00 0.00 173.24 174.70 1t3h h PRO 106 N -0.22 0.72 -4.70 4.02 0.11 -1.93 -3.43 132.00 126.56 1t3h h PRO 106 Ca -0.45 -0.04 -0.25 0.00 0.11 0.00 0.00 66.00 65.37 1t3h h PRO 106 Cb 1.21 -0.16 -0.15 0.00 0.11 0.00 0.00 31.00 32.01 1t3h h PRO 106 CO 0.58 0.48 -0.68 1.52 -0.21 0.00 0.00 178.00 179.69 1t3h s TYR 107 N -6.02 1.05 0.10 0.65 1.13 -1.26 -3.80 117.35 109.20 1t3h s TYR 107 Ca -0.12 -1.00 0.10 0.00 -1.41 0.00 0.00 57.07 54.64 1t3h s TYR 107 Cb 0.20 -0.60 -0.04 0.00 -1.10 0.00 0.00 41.96 40.42 1t3h s TYR 107 CO 0.78 -0.21 -0.24 0.14 -2.51 0.00 0.00 175.55 173.51 1t3h s VAL 108 N -3.68 2.45 -0.42 -3.49 -7.23 -0.46 -4.42 120.40 103.15 1t3h s VAL 108 Ca 0.19 -1.57 -0.12 0.00 -1.81 0.00 0.00 61.98 58.66 1t3h s VAL 108 Cb 0.06 -2.07 0.05 0.00 0.56 0.00 0.00 36.38 34.98 1t3h s VAL 108 CO 0.00 0.16 0.28 -0.22 -0.31 0.00 0.00 175.10 175.02 1t3h s LEU 109 N -1.88 5.13 -0.43 1.32 2.96 -0.91 -1.15 118.68 123.71 1t3h s LEU 109 Ca 0.15 -1.20 -0.19 0.00 -0.22 0.00 0.00 54.13 52.67 1t3h s LEU 109 Cb -0.10 -2.08 0.02 0.00 0.50 0.00 0.00 46.19 44.54 1t3h s LEU 109 CO 0.06 -0.50 0.53 0.86 -1.32 0.00 0.00 176.35 175.98 1t3h s TRP 110 N 1.56 3.12 -0.35 5.38 -0.00 -0.28 -1.05 118.94 127.31 1t3h s TRP 110 Ca 0.03 -0.25 -0.21 0.00 -0.00 0.00 0.00 56.10 55.68 1t3h s TRP 110 Cb -0.21 -3.10 0.00 0.00 -0.00 0.00 0.00 33.47 30.16 1t3h s TRP 110 CO 0.06 -0.78 0.66 0.08 -0.00 0.00 0.00 176.95 176.97 1t3h s VAL 111 N 2.43 4.86 -0.36 5.86 1.01 -0.09 0.54 120.40 134.65 1t3h s VAL 111 Ca 0.17 0.66 0.01 0.00 0.00 0.00 0.00 61.98 62.81 1t3h s VAL 111 Cb -0.16 -4.10 0.11 0.00 0.00 0.00 0.00 36.38 32.24 1t3h s VAL 111 CO 0.16 -0.33 0.14 -0.69 0.00 0.00 0.00 175.10 174.38 1t3h s VAL 112 N 2.78 1.34 0.62 2.92 1.01 0.26 0.01 120.40 129.34 1t3h s VAL 112 Ca 0.26 -1.99 0.32 0.00 0.00 0.00 0.00 61.98 60.57 1t3h s VAL 112 Cb -0.14 -1.98 0.37 0.00 0.00 0.00 0.00 36.38 34.62 1t3h s VAL 112 CO 0.15 -0.74 2.14 -0.65 0.00 0.00 0.00 175.10 176.00 1t3h h PRO 113 N 7.53 0.00 -0.34 2.72 0.11 -1.90 -1.81 132.00 138.31 1t3h h PRO 113 Ca -0.08 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.03 1t3h h PRO 113 Cb 0.98 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.09 1t3h h PRO 113 CO 0.49 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 179.56 1t3h n LEU 114 N -3.53 3.63 -0.35 2.35 4.77 -1.26 -4.73 117.00 117.88 1t3h n LEU 114 Ca -0.00 -2.55 0.01 0.00 -0.03 0.00 0.00 56.01 53.43 1t3h n LEU 114 Cb 0.27 -0.43 0.07 0.00 -2.33 0.00 0.00 43.42 41.00 1t3h n LEU 114 CO 0.24 0.71 0.57 -0.11 -1.33 0.00 0.00 177.39 177.47 1t3h n LEU 115 N 0.08 -0.53 0.11 2.23 7.94 -0.68 -0.46 117.00 125.70 1t3h n LEU 115 Ca 0.18 1.63 -0.12 0.00 -1.11 0.00 0.00 56.01 56.59 1t3h n LEU 115 Cb 0.71 -0.41 -0.08 0.00 0.53 0.00 0.00 43.42 44.18 1t3h n LEU 115 CO 0.14 -1.50 0.47 0.58 -1.11 0.00 0.00 177.39 175.97 1t3h h VAL 116 N 0.00 0.75 -0.70 1.96 2.07 -1.85 -1.22 116.25 117.26 1t3h h VAL 116 Ca 0.36 -0.84 0.15 0.00 0.82 0.00 0.00 66.70 67.19 1t3h h VAL 116 Cb 0.60 1.17 -0.11 0.00 -1.52 0.00 0.00 31.29 31.43 1t3h h VAL 116 CO -0.94 0.16 0.13 -0.33 0.02 0.00 0.00 177.57 176.61 1t3h h GLU 117 N -0.81 0.22 -0.30 1.57 3.07 -1.66 -1.13 114.58 115.54 1t3h h GLU 117 Ca -0.03 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.81 1t3h h GLU 117 Cb 0.51 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 28.37 1t3h h GLU 117 CO 0.05 0.15 0.00 0.09 -1.40 0.00 0.00 179.01 177.90 1t3h n ASN 118 N -5.19 2.57 -2.26 1.42 3.02 0.39 -4.93 115.26 110.28 1t3h n ASN 118 Ca 0.12 -1.87 -0.20 0.00 -0.03 0.00 0.00 54.58 52.61 1t3h n ASN 118 Cb 0.42 -0.19 -0.02 0.00 -0.61 0.00 0.00 39.78 39.38 1t3h n ASN 118 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1t3h n SER 119 N 0.91 -5.58 0.00 6.41 7.64 -0.43 -4.87 113.62 117.70 1t3h n SER 119 Ca 0.17 0.09 0.06 0.00 1.01 0.00 0.00 58.87 60.21 1t3h n SER 119 Cb 0.46 -4.70 0.26 0.00 -1.01 0.00 0.00 64.21 59.22 1t3h n SER 119 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1t3h n LEU 120 N -2.87 0.00 0.00 -3.43 4.77 -0.56 -2.64 117.00 112.27 1t3h n LEU 120 Ca -0.23 0.49 0.07 0.00 -0.03 0.00 0.00 56.01 56.31 1t3h n LEU 120 Cb 0.67 -0.49 0.35 0.00 -2.33 0.00 0.00 43.42 41.62 1t3h n LEU 120 CO 0.28 -0.29 0.68 0.00 -1.33 0.00 0.00 177.39 176.73 1t3h n TYR 121 N -1.49 0.00 0.76 -1.77 0.18 -1.25 -1.48 117.16 112.10 1t3h n TYR 121 Ca 0.03 0.00 0.13 0.00 1.88 0.00 0.00 57.90 59.94 1t3h n TYR 121 Cb 0.14 -0.29 0.50 0.00 -0.38 0.00 0.00 39.34 39.31 1t3h n TYR 121 CO 0.00 0.00 0.00 1.63 -2.08 0.00 0.00 176.86 176.41 1t3h n LYS 122 N -1.29 0.12 -0.22 -3.48 5.02 -1.08 -2.70 118.16 114.53 1t3h n LYS 122 Ca 0.06 0.14 0.08 0.00 -2.02 0.00 0.00 58.31 56.58 1t3h n LYS 122 Cb 0.11 -1.65 0.20 0.00 -0.02 0.00 0.00 35.03 33.67 1t3h n LYS 122 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1t3h n LYS 123 N -1.86 2.65 -4.23 1.97 4.76 -0.55 -4.98 118.16 115.92 1t3h n LYS 123 Ca 0.06 -2.19 -0.28 0.00 -2.87 0.00 0.00 58.31 53.02 1t3h n LYS 123 Cb 0.35 -1.37 -0.09 0.00 -1.84 0.00 0.00 35.03 32.08 1t3h n LYS 123 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1t3h s ALA 124 N -1.03 3.02 -0.19 7.82 0.00 -1.10 -4.97 121.76 125.31 1t3h s ALA 124 Ca 0.31 -1.33 0.20 0.00 0.00 0.00 0.00 51.96 51.14 1t3h s ALA 124 Cb 0.17 -0.88 -0.05 0.00 0.00 0.00 0.00 23.12 22.35 1t3h s ALA 124 CO 0.22 0.57 0.97 -0.91 0.00 0.00 0.00 175.76 176.61 1t3h h ASN 125 N 3.23 0.00 -4.13 0.00 4.21 -1.51 -3.47 115.58 113.91 1t3h h ASN 125 Ca -0.48 0.00 -0.11 0.00 1.21 0.00 0.00 56.30 56.92 1t3h h ASN 125 Cb 1.18 0.00 -0.23 0.00 -1.12 0.00 0.00 38.32 38.16 1t3h h ASN 125 CO 0.54 0.27 -0.18 -0.60 -1.29 0.00 0.00 177.43 176.17 1t3h s ARG 126 N -3.15 0.58 -0.15 0.81 6.06 -1.01 -5.02 118.95 117.08 1t3h s ARG 126 Ca -0.01 0.47 0.01 0.00 -2.50 0.00 0.00 55.73 53.70 1t3h s ARG 126 Cb 0.09 0.28 0.02 0.00 0.06 0.00 0.00 34.95 35.39 1t3h s ARG 126 CO 0.80 -0.10 -0.18 0.08 -2.50 0.00 0.00 175.30 173.39 1t3h s VAL 127 N -0.09 1.84 -0.19 7.11 1.01 -1.26 0.26 120.40 129.07 1t3h s VAL 127 Ca -0.03 -0.83 -0.03 0.00 0.00 0.00 0.00 61.98 61.09 1t3h s VAL 127 Cb -0.03 -1.66 -0.01 0.00 0.00 0.00 0.00 36.38 34.67 1t3h s VAL 127 CO 0.02 0.51 -0.06 -0.22 0.00 0.00 0.00 175.10 175.35 1t3h s LEU 128 N 1.11 2.92 -0.18 3.92 2.96 0.39 -0.27 118.68 129.53 1t3h s LEU 128 Ca -0.01 -0.34 -0.03 0.00 -0.22 0.00 0.00 54.13 53.52 1t3h s LEU 128 Cb -0.14 -1.72 -0.02 0.00 0.50 0.00 0.00 46.19 44.80 1t3h s LEU 128 CO -0.07 0.04 -0.05 -0.69 -1.32 0.00 0.00 176.35 174.27 1t3h s VAL 129 N 1.11 3.63 -0.51 1.68 1.01 -0.30 -2.01 120.40 125.01 1t3h s VAL 129 Ca 0.01 -0.43 -0.20 0.00 0.00 0.00 0.00 61.98 61.36 1t3h s VAL 129 Cb -0.15 -2.61 0.05 0.00 0.00 0.00 0.00 36.38 33.68 1t3h s VAL 129 CO -0.01 0.46 0.68 0.54 0.00 0.00 0.00 175.10 176.78 1t3h s VAL 130 N 0.80 4.79 0.08 2.92 0.11 -0.62 -0.64 120.40 127.84 1t3h s VAL 130 Ca -0.01 -0.33 -0.04 0.00 -2.93 0.00 0.00 61.98 58.67 1t3h s VAL 130 Cb -0.15 -4.34 -0.05 0.00 -1.53 0.00 0.00 36.38 30.32 1t3h s VAL 130 CO 0.02 -0.85 0.30 -0.62 -3.33 0.00 0.00 175.10 170.62 1t3h s ASP 131 N 2.69 6.46 0.22 3.54 2.15 -0.14 -4.48 116.67 127.11 1t3h s ASP 131 Ca 0.18 0.50 -0.13 0.00 0.43 0.00 0.00 52.55 53.52 1t3h s ASP 131 Cb -0.18 -2.06 0.00 0.00 -0.30 0.00 0.00 42.92 40.39 1t3h s ASP 131 CO 0.13 0.14 0.47 0.68 -0.17 0.00 0.00 175.17 176.43 1t3h s VAL 132 N -1.51 0.02 0.56 1.11 -7.23 -1.26 -0.83 120.40 111.25 1t3h s VAL 132 Ca 0.35 -1.26 -0.15 0.00 -1.81 0.00 0.00 61.98 59.12 1t3h s VAL 132 Cb -0.13 -2.01 -0.06 0.00 0.56 0.00 0.00 36.38 34.75 1t3h s VAL 132 CO 0.23 -0.07 1.01 -0.94 -0.31 0.00 0.00 175.10 175.01 1t3h s SER 133 N -2.98 6.37 0.37 4.85 1.04 -1.26 -4.91 113.70 117.18 1t3h s SER 133 Ca 0.18 1.56 0.04 0.00 0.48 0.00 0.00 55.95 58.21 1t3h s SER 133 Cb -0.00 -2.50 0.70 0.00 0.10 0.00 0.00 66.02 64.32 1t3h s SER 133 CO 0.05 -0.76 2.02 -0.65 0.98 0.00 0.00 173.24 174.88 1t3h h PRO 134 N 0.47 0.75 -0.50 4.02 0.11 -2.00 -1.07 132.00 133.77 1t3h h PRO 134 Ca -0.46 -0.05 0.08 0.00 0.11 0.00 0.00 66.00 65.69 1t3h h PRO 134 Cb 1.19 -0.17 -0.07 0.00 0.11 0.00 0.00 31.00 32.06 1t3h h PRO 134 CO 0.61 0.50 0.10 1.49 -0.21 0.00 0.00 178.00 180.49 1t3h h GLU 135 N 0.77 0.23 -0.54 1.05 4.57 -2.00 0.12 114.58 118.78 1t3h h GLU 135 Ca 0.21 -0.01 -0.07 0.00 -1.18 0.00 0.00 59.36 58.30 1t3h h GLU 135 Cb -0.08 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 28.43 1t3h h GLU 135 CO -0.04 0.15 0.05 1.15 -1.18 0.00 0.00 179.01 179.14 1t3h h THR 136 N 0.24 1.25 -0.35 0.32 2.02 -1.68 -0.60 112.91 114.11 1t3h h THR 136 Ca 0.25 -0.99 -0.01 0.00 0.77 0.00 0.00 66.41 66.43 1t3h h THR 136 Cb 0.33 0.78 -0.02 0.00 -1.74 0.00 0.00 68.15 67.50 1t3h h THR 136 CO -0.32 0.36 0.18 1.56 0.37 0.00 0.00 175.52 177.67 1t3h h GLN 137 N 0.84 0.47 0.00 6.66 4.20 0.35 -1.23 115.11 126.40 1t3h h GLN 137 Ca 0.17 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.83 1t3h h GLN 137 Cb 0.43 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.11 1t3h h GLN 137 CO 0.02 0.36 -0.00 -0.07 -0.67 0.00 0.00 178.83 178.46 1t3h h LEU 138 N 0.48 -0.01 0.09 1.46 3.38 -0.30 -3.20 115.31 117.22 1t3h h LEU 138 Ca 0.13 -0.83 0.01 0.00 0.09 0.00 0.00 57.88 57.28 1t3h h LEU 138 Cb 0.02 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.73 1t3h h LEU 138 CO -0.02 0.84 -0.54 0.11 0.09 0.00 0.00 178.44 178.92 1t3h h LYS 139 N -0.86 -0.71 -0.72 1.13 1.57 -0.81 -2.95 116.57 113.22 1t3h h LYS 139 Ca -0.00 0.05 0.01 0.00 -1.87 0.00 0.00 60.65 58.84 1t3h h LYS 139 Cb 0.83 0.16 -0.04 0.00 0.08 0.00 0.00 32.23 33.26 1t3h h LYS 139 CO 0.00 -0.47 0.47 0.00 -0.57 0.00 0.00 179.45 178.88 1t3h h ARG 140 N -0.74 0.92 -1.94 3.15 3.08 -1.41 -2.96 114.38 114.48 1t3h h ARG 140 Ca -0.00 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.99 1t3h h ARG 140 Cb 0.75 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 30.60 1t3h h ARG 140 CO -0.31 0.61 0.00 2.41 -1.07 0.00 0.00 179.97 181.61 1t3h n THR 141 N -4.60 0.90 0.00 2.04 -1.04 -1.12 -1.06 114.28 109.40 1t3h n THR 141 Ca 0.07 -0.21 0.00 0.00 -2.04 0.00 0.00 64.05 61.87 1t3h n THR 141 Cb 0.04 -1.18 0.00 0.00 -1.82 0.00 0.00 70.33 67.37 1t3h n THR 141 CO 0.00 0.00 0.00 1.67 -0.64 0.00 0.00 175.07 176.10 1t3h n GLN 143 N 1.64 0.00 0.00 -2.82 7.27 -1.12 -2.29 117.38 120.06 1t3h n GLN 143 Ca 0.00 0.00 0.04 0.00 0.07 0.00 0.00 57.00 57.11 1t3h n GLN 143 Cb 0.24 0.00 0.22 0.00 2.41 0.00 0.00 30.24 33.11 1t3h n GLN 143 CO 0.00 0.00 0.00 -2.13 0.07 0.00 0.00 177.06 175.00 1t3h n ARG 144 N 0.00 0.14 0.00 3.69 0.63 -0.22 -2.62 116.66 118.28 1t3h n ARG 144 Ca 0.00 0.18 0.00 0.00 -0.92 0.00 0.00 57.85 57.11 1t3h n ARG 144 Cb 0.00 -1.50 0.00 0.00 0.45 0.00 0.00 32.46 31.41 1t3h n ARG 144 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1t3h n ASP 145 N -1.25 0.10 -3.93 6.15 8.00 -0.97 -5.05 116.55 119.60 1t3h n ASP 145 Ca 0.04 -1.04 -0.38 0.00 0.71 0.00 0.00 54.79 54.12 1t3h n ASP 145 Cb 0.06 0.00 0.02 0.00 -0.02 0.00 0.00 41.12 41.18 1t3h n ASP 145 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1t3h n ASP 146 N -0.02 -4.58 -4.33 -2.24 4.64 -1.08 -4.97 116.55 103.98 1t3h n ASP 146 Ca 0.00 -1.15 -0.17 0.00 -1.38 0.00 0.00 54.79 52.09 1t3h n ASP 146 Cb 0.42 -1.96 -0.10 0.00 -1.04 0.00 0.00 41.12 38.44 1t3h n ASP 146 CO 0.00 0.00 0.00 0.68 -0.82 0.00 0.00 177.20 177.06 1t3h s VAL 147 N -3.36 1.32 0.66 5.18 -7.23 -1.26 -5.04 120.40 110.68 1t3h s VAL 147 Ca 0.34 -2.09 -0.14 0.00 -1.81 0.00 0.00 61.98 58.28 1t3h s VAL 147 Cb -0.18 -2.16 -0.01 0.00 0.56 0.00 0.00 36.38 34.60 1t3h s VAL 147 CO 0.93 -0.50 1.08 0.28 -0.31 0.00 0.00 175.10 176.58 1t3h s THR 148 N -3.23 3.65 0.13 5.32 -1.32 -1.26 -4.79 115.64 114.13 1t3h s THR 148 Ca 0.24 0.69 -0.24 0.00 -1.21 0.00 0.00 61.69 61.17 1t3h s THR 148 Cb 0.03 -3.25 -0.04 0.00 -1.51 0.00 0.00 72.50 67.74 1t3h s THR 148 CO 0.06 -0.55 1.66 -0.09 -2.21 0.00 0.00 174.62 173.49 1t3h h ARG 149 N -0.12 -0.26 -0.30 7.08 2.43 -2.00 -0.67 114.38 120.54 1t3h h ARG 149 Ca -0.46 0.02 0.09 0.00 -0.81 0.00 0.00 59.98 58.82 1t3h h ARG 149 Cb 1.23 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.82 1t3h h ARG 149 CO 0.56 -0.17 0.30 1.05 -1.51 0.00 0.00 179.97 180.19 1t3h h GLU 150 N -0.27 0.00 -0.39 0.20 4.11 -1.98 0.10 114.58 116.35 1t3h h GLU 150 Ca 0.08 0.00 -0.12 0.00 0.07 0.00 0.00 59.36 59.39 1t3h h GLU 150 Cb 0.38 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 1t3h h GLU 150 CO -0.23 0.00 -0.25 1.25 0.07 0.00 0.00 179.01 179.86 1t3h h HIS 151 N 0.00 0.93 0.09 2.06 2.76 -1.48 -0.25 115.15 119.25 1t3h h HIS 151 Ca 0.14 -0.22 -0.28 0.00 -2.20 0.00 0.00 60.37 57.81 1t3h h HIS 151 Cb 0.74 -0.22 0.03 0.00 1.55 0.00 0.00 27.41 29.51 1t3h h HIS 151 CO 0.00 0.97 -1.14 0.28 -1.30 0.00 0.00 177.93 176.75 1t3h h VAL 152 N 0.70 1.30 -0.90 5.26 2.07 -0.69 -2.89 116.25 121.09 1t3h h VAL 152 Ca 0.09 -2.39 0.03 0.00 0.82 0.00 0.00 66.70 65.25 1t3h h VAL 152 Cb 0.78 2.65 -0.05 0.00 -1.52 0.00 0.00 31.29 33.15 1t3h h VAL 152 CO 0.06 0.72 0.59 -0.33 0.02 0.00 0.00 177.57 178.64 1t3h h GLU 153 N 0.24 1.11 -0.71 1.57 5.08 -1.04 0.11 114.58 120.94 1t3h h GLU 153 Ca -0.17 -0.07 0.02 0.00 -1.00 0.00 0.00 59.36 58.14 1t3h h GLU 153 Cb 1.81 -0.25 -0.04 0.00 0.50 0.00 0.00 28.75 30.78 1t3h h GLU 153 CO 0.22 0.74 0.47 0.37 -1.00 0.00 0.00 179.01 179.80 1t3h h GLN 154 N 1.15 0.89 -0.17 2.33 4.15 -0.99 -1.59 115.11 120.87 1t3h h GLN 154 Ca 0.35 -0.05 -0.09 0.00 0.77 0.00 0.00 58.65 59.63 1t3h h GLN 154 Cb -0.02 -0.20 -0.00 0.00 0.21 0.00 0.00 27.48 27.47 1t3h h GLN 154 CO -0.10 0.59 -0.24 0.82 -1.93 0.00 0.00 178.83 177.97 1t3h h ILE 155 N 0.92 1.35 -0.06 2.39 1.08 -0.71 -3.06 117.51 119.42 1t3h h ILE 155 Ca 0.27 -1.45 0.02 0.00 -0.39 0.00 0.00 64.86 63.30 1t3h h ILE 155 Cb -0.05 1.89 -0.00 0.00 -3.07 0.00 0.00 36.82 35.59 1t3h h ILE 155 CO -0.07 0.44 0.08 -0.07 -0.69 0.00 0.00 178.15 177.84 1t3h h LEU 156 N 0.11 0.00 0.00 1.44 3.38 -0.09 0.32 115.31 120.46 1t3h h LEU 156 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1t3h h LEU 156 Cb 0.81 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.56 1t3h h LEU 156 CO 0.06 0.00 -0.12 0.00 0.09 0.00 0.00 178.44 178.47 1t3h n ALA 157 N -2.29 2.61 -0.09 1.53 0.00 -0.68 -3.84 120.51 117.75 1t3h n ALA 157 Ca -0.01 -0.15 -0.21 0.00 0.00 0.00 0.00 53.44 53.06 1t3h n ALA 157 Cb 0.18 -1.39 -0.12 0.00 0.00 0.00 0.00 19.45 18.11 1t3h n ALA 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1t3h n ALA 158 N -1.51 1.19 -1.66 0.00 0.00 0.11 -4.98 120.51 113.64 1t3h n ALA 158 Ca 0.07 -0.90 -0.29 0.00 0.00 0.00 0.00 53.44 52.32 1t3h n ALA 158 Cb 0.34 -0.29 0.13 0.00 0.00 0.00 0.00 19.45 19.64 1t3h n ALA 158 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1t3h s GLN 159 N -2.52 1.26 0.73 0.00 -0.21 -0.79 -5.02 119.66 113.12 1t3h s GLN 159 Ca -0.31 0.17 -0.14 0.00 0.02 0.00 0.00 55.36 55.09 1t3h s GLN 159 Cb 0.09 -1.86 0.04 0.00 1.00 0.00 0.00 33.01 32.27 1t3h s GLN 159 CO 0.64 -2.09 1.17 0.00 -2.12 0.00 0.00 175.29 172.89 1t3h s ALA 160 N -3.41 2.15 0.71 6.09 0.00 -1.26 -4.95 121.76 121.09 1t3h s ALA 160 Ca 0.64 0.74 -0.11 0.00 0.00 0.00 0.00 51.96 53.23 1t3h s ALA 160 Cb -0.13 -3.42 0.02 0.00 0.00 0.00 0.00 23.12 19.59 1t3h s ALA 160 CO 0.52 -1.81 1.08 0.95 0.00 0.00 0.00 175.76 176.50 1t3h s THR 161 N -2.17 3.65 0.19 0.00 -4.23 -1.26 -4.91 115.64 106.90 1t3h s THR 161 Ca 0.71 0.54 -0.11 0.00 -1.18 0.00 0.00 61.69 61.64 1t3h s THR 161 Cb -0.26 -3.43 0.11 0.00 1.34 0.00 0.00 72.50 70.26 1t3h s THR 161 CO 0.46 -0.70 1.83 -0.09 -0.54 0.00 0.00 174.62 175.58 1t3h h ARG 162 N -0.72 0.70 -0.75 3.99 2.43 -1.97 -2.10 114.38 115.96 1t3h h ARG 162 Ca -0.45 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 58.62 1t3h h ARG 162 Cb 1.24 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 30.60 1t3h h ARG 162 CO 0.61 0.46 0.26 0.93 -1.51 0.00 0.00 179.97 180.72 1t3h h GLU 163 N 0.72 1.14 -0.72 0.20 3.07 -1.98 -1.21 114.58 115.79 1t3h h GLU 163 Ca 0.25 -0.23 0.04 0.00 -0.50 0.00 0.00 59.36 58.92 1t3h h GLU 163 Cb 0.05 -0.17 -0.05 0.00 -0.84 0.00 0.00 28.75 27.74 1t3h h GLU 163 CO -0.12 0.95 0.44 0.00 -1.40 0.00 0.00 179.01 178.89 1t3h h ALA 164 N 1.18 0.95 0.03 3.43 0.00 -1.79 0.26 119.26 123.32 1t3h h ALA 164 Ca 0.24 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 1t3h h ALA 164 Cb 0.27 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1t3h h ALA 164 CO -0.01 0.20 -0.02 0.00 0.00 0.00 0.00 179.25 179.42 1t3h h ARG 165 N 0.85 -0.04 -0.43 0.00 3.08 -0.98 -2.72 114.38 114.14 1t3h h ARG 165 Ca 0.30 0.00 0.09 0.00 0.07 0.00 0.00 59.98 60.44 1t3h h ARG 165 Cb 0.06 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.10 1t3h h ARG 165 CO -0.13 0.15 0.30 -0.07 -1.07 0.00 0.00 179.97 179.15 1t3h h LEU 166 N -0.23 0.15 -2.19 3.04 3.38 -0.55 -1.30 115.31 117.61 1t3h h LEU 166 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1t3h h LEU 166 Cb 0.21 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 1t3h h LEU 166 CO 0.01 0.09 -0.05 0.00 0.09 0.00 0.00 178.44 178.58 1t3h h ALA 167 N 1.78 1.16 -0.11 1.53 0.00 -0.17 -2.42 119.26 121.03 1t3h h ALA 167 Ca 0.20 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1t3h h ALA 167 Cb 0.57 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1t3h h ALA 167 CO -0.03 0.06 0.00 1.33 0.00 0.00 0.00 179.25 180.61 1t3h n VAL 168 N -3.38 0.34 -2.73 0.00 0.24 -0.52 -5.02 118.33 107.27 1t3h n VAL 168 Ca -0.02 -0.67 -0.41 0.00 -2.04 0.00 0.00 64.34 61.20 1t3h n VAL 168 Cb 0.19 0.96 -0.04 0.00 -1.47 0.00 0.00 33.84 33.48 1t3h n VAL 168 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1t3h s ALA 169 N -0.87 3.22 -0.11 2.33 0.00 -0.91 -4.72 121.76 120.69 1t3h s ALA 169 Ca 0.14 0.56 -0.03 0.00 0.00 0.00 0.00 51.96 52.63 1t3h s ALA 169 Cb 0.09 -3.29 -0.25 0.00 0.00 0.00 0.00 23.12 19.67 1t3h s ALA 169 CO 0.13 -0.08 0.38 -0.25 0.00 0.00 0.00 175.76 175.94 1t3h n ASP 170 N 3.09 1.90 -4.19 0.00 8.00 0.62 -4.93 116.55 121.05 1t3h n ASP 170 Ca 0.03 0.22 -0.17 0.00 0.71 0.00 0.00 54.79 55.59 1t3h n ASP 170 Cb 0.50 -0.70 -0.11 0.00 -0.02 0.00 0.00 41.12 40.78 1t3h n ASP 170 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1t3h s ASP 171 N -6.85 1.67 -0.06 -2.24 1.01 -0.21 -5.00 116.67 104.99 1t3h s ASP 171 Ca -0.20 -0.72 -0.01 0.00 0.71 0.00 0.00 52.55 52.33 1t3h s ASP 171 Cb 0.07 -0.03 0.03 0.00 1.01 0.00 0.00 42.92 43.99 1t3h s ASP 171 CO 0.77 -0.15 -0.00 -0.69 0.21 0.00 0.00 175.17 175.31 1t3h s VAL 172 N -1.85 0.33 -0.20 -1.27 1.01 -1.26 -1.15 120.40 116.00 1t3h s VAL 172 Ca 0.03 0.10 -0.02 0.00 0.00 0.00 0.00 61.98 62.09 1t3h s VAL 172 Cb -0.07 -0.46 -0.00 0.00 0.00 0.00 0.00 36.38 35.85 1t3h s VAL 172 CO 0.02 0.23 -0.09 -0.51 0.00 0.00 0.00 175.10 174.75 1t3h s ILE 173 N 1.65 3.10 -0.05 2.22 2.07 0.19 -4.95 121.20 125.44 1t3h s ILE 173 Ca -0.00 -0.60 -0.30 0.00 -1.41 0.00 0.00 60.65 58.34 1t3h s ILE 173 Cb -0.13 -2.38 -0.04 0.00 0.13 0.00 0.00 42.46 40.04 1t3h s ILE 173 CO -0.04 0.46 1.41 -0.62 -1.91 0.00 0.00 174.94 174.24 1t3h s ASP 174 N 1.22 6.85 -0.11 4.50 -1.08 -1.26 -0.96 116.67 125.83 1t3h s ASP 174 Ca 0.02 2.02 0.20 0.00 -0.52 0.00 0.00 52.55 54.28 1t3h s ASP 174 Cb -0.14 -2.55 0.44 0.00 -1.46 0.00 0.00 42.92 39.20 1t3h s ASP 174 CO -0.03 -0.76 1.18 -3.20 0.52 0.00 0.00 175.17 172.88 1t3h n ASN 175 N 5.98 1.53 -1.68 -0.34 5.15 -0.01 -4.79 115.26 121.10 1t3h n ASN 175 Ca 0.14 -2.71 -0.09 0.00 -0.60 0.00 0.00 54.58 51.32 1t3h n ASN 175 Cb 0.44 -0.39 0.17 0.00 -0.53 0.00 0.00 39.78 39.46 1t3h n ASN 175 CO 0.00 0.00 0.00 -0.46 1.40 0.00 0.00 177.26 178.20 1t3h n ASN 176 N -0.20 3.70 -2.86 1.20 2.04 -1.26 -4.86 115.26 113.03 1t3h n ASN 176 Ca 0.13 -2.91 -0.14 0.00 -0.44 0.00 0.00 54.58 51.22 1t3h n ASN 176 Cb 0.96 -0.69 -0.04 0.00 -2.53 0.00 0.00 39.78 37.48 1t3h n ASN 176 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1t3h n GLY 177 N -0.25 3.73 3.65 4.83 0.00 -1.26 -5.02 105.19 110.87 1t3h n GLY 177 Ca 0.32 -2.09 -0.42 0.00 0.00 0.00 0.00 46.02 43.84 1t3h n GLY 177 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t3h n ALA 178 N -2.07 0.70 -0.70 4.61 0.00 -1.26 -4.78 120.51 117.00 1t3h n ALA 178 Ca -0.09 0.27 -0.15 0.00 0.00 0.00 0.00 53.44 53.48 1t3h n ALA 178 Cb 0.31 -2.17 -0.07 0.00 0.00 0.00 0.00 19.45 17.53 1t3h n ALA 178 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1t3h n PRO 179 N 0.20 1.70 0.00 0.00 -0.04 -1.26 -2.16 135.00 133.43 1t3h n PRO 179 Ca 0.08 -1.03 0.00 0.00 -0.04 0.00 0.00 63.50 62.51 1t3h n PRO 179 Cb 0.38 -2.11 0.00 0.00 -0.04 0.00 0.00 33.50 31.73 1t3h n PRO 179 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1t3h n ASP 180 N 3.33 0.00 0.00 3.54 8.00 -1.26 -4.80 116.55 125.36 1t3h n ASP 180 Ca 0.36 0.00 0.06 0.00 0.71 0.00 0.00 54.79 55.92 1t3h n ASP 180 Cb 0.38 0.00 0.35 0.00 -0.02 0.00 0.00 41.12 41.83 1t3h n ASP 180 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1t3h n ALA 181 N -0.61 2.32 0.13 2.24 0.00 -0.92 -2.83 120.51 120.84 1t3h n ALA 181 Ca 0.00 -0.07 -0.24 0.00 0.00 0.00 0.00 53.44 53.12 1t3h n ALA 181 Cb 0.00 -1.19 -0.16 0.00 0.00 0.00 0.00 19.45 18.10 1t3h n ALA 181 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1t3h h ILE 182 N 0.00 1.24 -0.89 0.00 1.08 -1.87 -3.38 117.51 113.69 1t3h h ILE 182 Ca 0.00 -2.66 0.25 0.00 -0.39 0.00 0.00 64.86 62.07 1t3h h ILE 182 Cb 0.00 3.01 -0.17 0.00 -3.07 0.00 0.00 36.82 36.60 1t3h h ILE 182 CO 0.00 0.81 0.04 0.00 -0.69 0.00 0.00 178.15 178.31 1t3h n ALA 183 N -2.74 0.48 0.24 1.87 0.00 -1.13 -0.33 120.51 118.90 1t3h n ALA 183 Ca -0.18 0.95 0.07 0.00 0.00 0.00 0.00 53.44 54.29 1t3h n ALA 183 Cb 1.08 -0.71 0.58 0.00 0.00 0.00 0.00 19.45 20.40 1t3h n ALA 183 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1t3h h SER 184 N 0.00 0.00 0.14 0.00 0.87 -1.82 -1.88 113.55 110.86 1t3h h SER 184 Ca 0.55 0.00 -0.35 0.00 -1.23 0.00 0.00 61.79 60.76 1t3h h SER 184 Cb 1.17 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.12 1t3h h SER 184 CO -0.83 0.15 -1.88 0.44 -0.53 0.00 0.00 176.83 174.18 1t3h h ASP 185 N 0.00 0.46 -0.45 6.23 3.32 -0.93 -3.21 116.42 121.84 1t3h h ASP 185 Ca -0.00 -0.94 0.02 0.00 0.02 0.00 0.00 57.03 56.13 1t3h h ASP 185 Cb 0.28 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.65 1t3h h ASP 185 CO 0.02 1.82 0.28 0.58 -1.72 0.00 0.00 179.24 180.22 1t3h h VAL 186 N 0.03 1.07 -0.68 -1.35 2.07 -1.31 0.16 116.25 116.24 1t3h h VAL 186 Ca -0.39 -0.19 -0.03 0.00 0.82 0.00 0.00 66.70 66.91 1t3h h VAL 186 Cb 2.02 0.46 -0.03 0.00 -1.52 0.00 0.00 31.29 32.21 1t3h h VAL 186 CO 0.10 0.10 0.32 0.00 0.02 0.00 0.00 177.57 178.12 1t3h h ALA 187 N 1.19 1.28 -0.22 1.67 0.00 -1.49 0.43 119.26 122.11 1t3h h ALA 187 Ca 0.18 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 1t3h h ALA 187 Cb -0.01 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 1t3h h ALA 187 CO -0.07 0.55 -0.04 -0.09 0.00 0.00 0.00 179.25 179.60 1t3h h ARG 188 N 0.97 0.43 -0.27 0.00 2.43 -1.40 -2.71 114.38 113.82 1t3h h ARG 188 Ca 0.24 -0.16 -0.03 0.00 -0.81 0.00 0.00 59.98 59.21 1t3h h ARG 188 Cb 0.11 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.62 1t3h h ARG 188 CO -0.03 0.65 0.04 -0.07 -1.51 0.00 0.00 179.97 179.05 1t3h h LEU 189 N 0.16 0.44 -0.81 3.80 3.38 -0.61 -2.79 115.31 118.88 1t3h h LEU 189 Ca 0.06 -0.27 0.07 0.00 0.09 0.00 0.00 57.88 57.83 1t3h h LEU 189 Cb 0.49 -0.12 -0.06 0.00 0.09 0.00 0.00 40.66 41.06 1t3h h LEU 189 CO 0.02 0.59 0.48 -0.74 0.09 0.00 0.00 178.44 178.88 1t3h h HIS 190 N 0.26 0.89 -0.40 1.13 2.76 -0.20 0.43 115.15 120.03 1t3h h HIS 190 Ca 0.08 0.03 -0.03 0.00 -2.20 0.00 0.00 60.37 58.25 1t3h h HIS 190 Cb 0.34 -0.28 -0.02 0.00 1.55 0.00 0.00 27.41 29.01 1t3h h HIS 190 CO 0.02 0.43 0.14 0.00 -1.30 0.00 0.00 177.93 177.22 1t3h h ALA 191 N 1.40 0.52 -0.61 5.26 0.00 -1.42 -1.76 119.26 122.64 1t3h h ALA 191 Ca 0.36 -0.15 -0.09 0.00 0.00 0.00 0.00 54.91 55.03 1t3h h ALA 191 Cb 0.21 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1t3h h ALA 191 CO -0.19 0.14 0.04 1.25 0.00 0.00 0.00 179.25 180.49 1t3h h HIS 192 N 0.49 1.14 -0.63 0.00 6.17 -1.08 -2.49 115.15 118.76 1t3h h HIS 192 Ca 0.13 -0.18 -0.04 0.00 0.71 0.00 0.00 60.37 60.99 1t3h h HIS 192 Cb 0.22 -0.30 -0.03 0.00 2.52 0.00 0.00 27.41 29.82 1t3h h HIS 192 CO 0.00 0.99 0.23 1.88 0.71 0.00 0.00 177.93 181.75 1t3h h TYR 193 N 0.96 0.94 -0.69 5.26 0.05 0.11 -0.31 116.97 123.30 1t3h h TYR 193 Ca 0.18 -0.07 -0.06 0.00 0.05 0.00 0.00 58.73 58.84 1t3h h TYR 193 Cb 0.51 -0.28 -0.03 0.00 1.01 0.00 0.00 36.73 37.94 1t3h h TYR 193 CO 0.04 0.74 0.21 -0.07 -1.05 0.00 0.00 178.16 178.02 1t3h h LEU 194 N 0.91 1.02 0.05 3.88 3.38 -1.18 0.35 115.31 123.71 1t3h h LEU 194 Ca 0.21 -0.21 0.01 0.00 0.09 0.00 0.00 57.88 57.97 1t3h h LEU 194 Cb 0.21 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1t3h h LEU 194 CO -0.01 0.96 -0.06 -0.61 0.09 0.00 0.00 178.44 178.80 1t3h h GLN 195 N 1.02 -0.13 0.34 1.13 4.15 -0.93 -0.64 115.11 120.06 1t3h h GLN 195 Ca 0.22 0.01 -0.02 0.00 0.77 0.00 0.00 58.65 59.63 1t3h h GLN 195 Cb 0.31 0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.03 1t3h h GLN 195 CO -0.01 -0.09 -0.16 -0.07 -1.93 0.00 0.00 178.83 176.57 1t3h h LEU 196 N -0.14 -0.39 -0.95 -2.39 3.38 -0.80 -3.01 115.31 111.01 1t3h h LEU 196 Ca 0.01 -0.02 0.17 0.00 0.09 0.00 0.00 57.88 58.14 1t3h h LEU 196 Cb 0.14 0.10 -0.10 0.00 0.09 0.00 0.00 40.66 40.89 1t3h h LEU 196 CO -0.03 -0.24 0.54 0.00 0.09 0.00 0.00 178.44 178.80 1t3h h ALA 197 N 0.14 1.52 0.00 1.53 0.00 -0.11 -0.14 119.26 122.20 1t3h h ALA 197 Ca -0.05 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1t3h h ALA 197 Cb 0.38 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1t3h h ALA 197 CO 0.08 -0.06 0.00 -1.13 0.00 0.00 0.00 179.25 178.14 1t3h n SER 198 N -4.81 0.00 0.00 0.00 3.41 -0.26 -3.86 113.62 108.10 1t3h n SER 198 Ca 0.21 0.06 0.00 0.00 -0.26 0.00 0.00 58.87 58.88 1t3h n SER 198 Cb 0.52 -0.34 0.00 0.00 -0.26 0.00 0.00 64.21 64.13 1t3h n SER 198 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1t3h n GLN 199 N -1.34 2.94 0.08 4.33 10.64 -0.44 -4.84 117.38 128.75 1t3h n GLN 199 Ca 0.11 0.00 0.05 0.00 -1.83 0.00 0.00 57.00 55.32 1t3h n GLN 199 Cb 0.22 -0.71 0.48 0.00 -0.86 0.00 0.00 30.24 29.37 1t3h n GLN 199 CO 0.00 0.00 0.00 0.27 -1.83 0.00 0.00 177.06 175.50 1t3h h PHE 200 N 0.00 0.35 -0.29 2.61 -5.15 -1.19 -2.03 116.94 111.24 1t3h h PHE 200 Ca 0.00 0.00 -0.12 0.00 -0.20 0.00 0.00 57.97 57.65 1t3h h PHE 200 Cb 0.00 -0.12 -0.01 0.00 0.22 0.00 0.00 35.95 36.04 1t3h h PHE 200 CO 0.00 0.25 -0.33 0.28 -2.00 0.00 0.00 178.31 176.51 1t3h h VAL 201 N 0.38 1.28 -0.16 0.88 2.07 -1.87 -3.29 116.25 115.55 1t3h h VAL 201 Ca 0.10 -1.46 -0.06 0.00 0.82 0.00 0.00 66.70 66.10 1t3h h VAL 201 Cb -0.00 1.42 -0.04 0.00 -1.52 0.00 0.00 31.29 31.15 1t3h h VAL 201 CO -0.02 0.47 -0.19 -1.20 0.02 0.00 0.00 177.57 176.66 1t3h n SER 202 N -4.07 2.40 -4.58 0.57 7.64 -1.13 -5.00 113.62 109.45 1t3h n SER 202 Ca -0.01 -3.58 -0.43 0.00 1.01 0.00 0.00 58.87 55.86 1t3h n SER 202 Cb 0.48 -0.55 -0.03 0.00 -1.01 0.00 0.00 64.21 63.10 1t3h n SER 202 CO 0.00 0.00 0.00 -1.58 -3.01 0.00 0.00 175.04 170.45 1t3h s GLN 203 N -3.12 3.63 0.38 1.43 0.74 -0.78 -4.93 119.66 117.00 1t3h s GLN 203 Ca 0.40 0.37 0.06 0.00 0.05 0.00 0.00 55.36 56.24 1t3h s GLN 203 Cb 0.36 -3.92 0.74 0.00 1.10 0.00 0.00 33.01 31.29 1t3h s GLN 203 CO -0.01 -1.33 1.96 1.49 -0.55 0.00 0.00 175.29 176.85 1t3h h GLU 204 N 9.19 0.50 -5.21 1.67 4.57 -1.94 -3.44 114.58 119.92 1t3h h GLU 204 Ca -0.24 -0.07 -0.45 0.00 -1.18 0.00 0.00 59.36 57.42 1t3h h GLU 204 Cb 1.07 -0.09 -0.27 0.00 -0.16 0.00 0.00 28.75 29.29 1t3h h GLU 204 CO 1.09 0.44 -0.80 0.15 -1.18 0.00 0.00 179.01 178.71 1t3h s LYS 205 N -5.17 1.00 0.33 1.92 1.02 -1.26 -5.13 119.74 112.45 1t3h s LYS 205 Ca -0.08 -0.57 -0.28 0.00 0.02 0.00 0.00 55.97 55.07 1t3h s LYS 205 Cb 0.16 -0.98 -0.13 0.00 -0.52 0.00 0.00 37.83 36.37 1t3h s LYS 205 CO 0.75 0.26 1.22 -2.30 -0.92 0.00 0.00 175.35 174.36 1t3h n PRO 206 N 2.45 1.93 -0.54 -1.68 -0.02 -1.26 -5.17 135.00 130.70 1t3h n PRO 206 Ca -0.15 0.68 0.00 0.00 -2.02 0.00 0.00 63.50 62.00 1t3h n PRO 206 Cb 0.55 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.83 1t3h n PRO 206 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87