#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n3t n SER 2 N 0.00 0.00 0.00 3.54 2.88 -1.26 -5.16 113.62 113.62 1n3t n SER 2 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1n3t n SER 2 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1n3t n SER 2 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1n3t n LEU 3 N -0.55 0.00 -3.79 2.46 4.77 -1.26 -4.94 117.00 113.69 1n3t n LEU 3 Ca 0.00 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.85 1n3t n LEU 3 Cb 0.00 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.00 1n3t n LEU 3 CO 0.00 0.00 -0.04 -0.94 -1.33 0.00 0.00 177.39 175.08 1n3t s SER 4 N 1.00 -0.14 0.17 -1.43 1.04 -1.26 -5.06 113.70 108.02 1n3t s SER 4 Ca 0.00 0.07 -0.22 0.00 0.48 0.00 0.00 55.95 56.28 1n3t s SER 4 Cb 0.00 0.32 0.07 0.00 0.10 0.00 0.00 66.02 66.51 1n3t s SER 4 CO 0.00 -0.38 1.60 0.11 0.98 0.00 0.00 173.24 175.56 1n3t h LYS 5 N 4.24 -0.22 -0.55 4.02 1.57 -2.02 -2.00 116.57 121.60 1n3t h LYS 5 Ca -0.29 0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.48 1n3t h LYS 5 Cb 1.18 0.05 -0.03 0.00 0.08 0.00 0.00 32.23 33.52 1n3t h LYS 5 CO 0.39 -0.15 0.26 0.93 -0.57 0.00 0.00 179.45 180.32 1n3t h GLU 6 N -0.23 0.80 -0.68 3.15 3.07 -1.98 -2.14 114.58 116.58 1n3t h GLU 6 Ca 0.18 -0.12 0.13 0.00 -0.50 0.00 0.00 59.36 59.05 1n3t h GLU 6 Cb 0.52 -0.14 -0.09 0.00 -0.84 0.00 0.00 28.75 28.19 1n3t h GLU 6 CO -0.53 0.66 0.20 0.00 -1.40 0.00 0.00 179.01 177.94 1n3t h ALA 7 N 1.10 0.88 0.76 3.43 0.00 -1.78 -0.21 119.26 123.44 1n3t h ALA 7 Ca 0.19 0.13 -0.04 0.00 0.00 0.00 0.00 54.91 55.19 1n3t h ALA 7 Cb 0.12 0.15 0.01 0.00 0.00 0.00 0.00 17.79 18.07 1n3t h ALA 7 CO -0.02 -0.27 -0.36 0.00 0.00 0.00 0.00 179.25 178.59 1n3t h ALA 8 N 1.53 -1.13 -0.82 0.00 0.00 -0.99 0.28 119.26 118.12 1n3t h ALA 8 Ca 0.37 -0.22 0.12 0.00 0.00 0.00 0.00 54.91 55.17 1n3t h ALA 8 Cb 0.57 0.39 -0.13 0.00 0.00 0.00 0.00 17.79 18.62 1n3t h ALA 8 CO -0.42 -1.06 -0.42 -0.07 0.00 0.00 0.00 179.25 177.28 1n3t h LEU 9 N -1.14 -1.52 0.11 0.00 3.38 -1.03 0.29 115.31 115.41 1n3t h LEU 9 Ca -0.10 0.28 -0.00 0.00 0.09 0.00 0.00 57.88 58.14 1n3t h LEU 9 Cb 0.78 0.74 -0.00 0.00 0.09 0.00 0.00 40.66 42.27 1n3t h LEU 9 CO 0.17 -0.30 -0.06 0.58 0.09 0.00 0.00 178.44 178.92 1n3t h VAL 10 N -0.09 0.87 -0.29 1.22 2.07 -1.06 -1.32 116.25 117.65 1n3t h VAL 10 Ca 0.25 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.83 1n3t h VAL 10 Cb 0.55 0.87 -0.06 0.00 -1.52 0.00 0.00 31.29 31.14 1n3t h VAL 10 CO -0.85 0.00 -0.08 -0.74 0.02 0.00 0.00 177.57 175.92 1n3t h HIS 11 N -0.16 -0.16 0.11 1.57 -0.00 0.74 -1.85 115.15 115.40 1n3t h HIS 11 Ca -0.01 0.03 -0.01 0.00 -0.00 0.00 0.00 60.37 60.38 1n3t h HIS 11 Cb 0.13 0.12 0.00 0.00 -0.00 0.00 0.00 27.41 27.66 1n3t h HIS 11 CO -0.08 -0.13 -0.05 0.93 -0.00 0.00 0.00 177.93 178.60 1n3t h GLU 12 N -0.00 -0.15 -0.72 5.26 5.08 -0.35 -2.22 114.58 121.48 1n3t h GLU 12 Ca 0.14 0.01 0.18 0.00 -1.00 0.00 0.00 59.36 58.69 1n3t h GLU 12 Cb 0.22 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.46 1n3t h GLU 12 CO -0.30 -0.07 0.50 0.00 -1.00 0.00 0.00 179.01 178.13 1n3t h ALA 13 N 0.70 2.42 0.05 3.43 0.00 -0.99 0.30 119.26 125.18 1n3t h ALA 13 Ca -0.02 -0.01 -0.23 0.00 0.00 0.00 0.00 54.91 54.65 1n3t h ALA 13 Cb 0.14 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1n3t h ALA 13 CO 0.03 -0.62 -1.05 -0.07 0.00 0.00 0.00 179.25 177.54 1n3t h LEU 14 N 0.18 0.27 -0.02 0.00 3.38 -0.95 -3.16 115.31 115.01 1n3t h LEU 14 Ca 0.35 -0.26 -0.26 0.00 0.09 0.00 0.00 57.88 57.79 1n3t h LEU 14 Cb 1.12 -0.09 0.02 0.00 0.09 0.00 0.00 40.66 41.81 1n3t h LEU 14 CO -0.06 1.15 -1.03 0.58 0.09 0.00 0.00 178.44 179.17 1n3t h VAL 15 N 0.08 1.28 -1.05 1.22 2.07 -0.40 0.11 116.25 119.55 1n3t h VAL 15 Ca -0.07 -2.23 0.28 0.00 0.82 0.00 0.00 66.70 65.49 1n3t h VAL 15 Cb 1.75 2.36 -0.10 0.00 -1.52 0.00 0.00 31.29 33.78 1n3t h VAL 15 CO 0.16 0.69 0.68 0.00 0.02 0.00 0.00 177.57 179.12 1n3t h ALA 16 N 0.42 2.25 -0.50 1.67 0.00 -0.53 0.49 119.26 123.07 1n3t h ALA 16 Ca -0.12 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1n3t h ALA 16 Cb 1.68 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.51 1n3t h ALA 16 CO 0.20 -0.68 0.00 -2.13 0.00 0.00 0.00 179.25 176.65 1n3t n ARG 17 N -4.64 2.56 -2.15 0.00 0.63 -1.17 -4.95 116.66 106.95 1n3t n ARG 17 Ca 0.26 -2.34 -0.20 0.00 -0.92 0.00 0.00 57.85 54.65 1n3t n ARG 17 Cb 0.91 -1.47 -0.03 0.00 0.45 0.00 0.00 32.46 32.31 1n3t n ARG 17 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1n3t n GLY 18 N 1.33 0.24 1.20 5.14 0.00 0.17 -4.86 105.19 108.41 1n3t n GLY 18 Ca 0.19 -0.05 0.08 0.00 0.00 0.00 0.00 46.02 46.24 1n3t n GLY 18 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1n3t n LEU 19 N -2.69 3.50 -4.81 0.99 4.77 0.33 -4.92 117.00 114.17 1n3t n LEU 19 Ca -0.23 -1.76 -0.34 0.00 -0.03 0.00 0.00 56.01 53.65 1n3t n LEU 19 Cb 0.67 -0.46 -0.06 0.00 -2.33 0.00 0.00 43.42 41.25 1n3t n LEU 19 CO 0.28 0.68 0.67 -1.61 -1.33 0.00 0.00 177.39 176.09 1n3t s GLU 20 N -1.59 4.16 0.14 3.23 0.41 -1.19 -4.79 118.70 119.07 1n3t s GLU 20 Ca 0.39 1.24 -0.31 0.00 -0.41 0.00 0.00 54.97 55.88 1n3t s GLU 20 Cb 0.23 -2.26 -0.08 0.00 -1.78 0.00 0.00 34.13 30.24 1n3t s GLU 20 CO 0.21 -0.11 1.40 0.99 -0.49 0.00 0.00 175.26 177.27 1n3t s THR 21 N -2.02 3.17 -0.96 3.63 2.01 -1.26 -4.84 115.64 115.38 1n3t s THR 21 Ca 0.62 0.87 -0.18 0.00 0.31 0.00 0.00 61.69 63.31 1n3t s THR 21 Cb -0.13 -3.56 -0.27 0.00 0.01 0.00 0.00 72.50 68.55 1n3t s THR 21 CO 0.17 0.08 2.35 -2.65 -0.69 0.00 0.00 174.62 173.88 1n3t n PRO 22 N 3.63 0.10 -4.39 4.92 -0.02 -1.26 -4.93 135.00 133.06 1n3t n PRO 22 Ca 0.11 -0.08 -0.20 0.00 -2.02 0.00 0.00 63.50 61.30 1n3t n PRO 22 Cb 0.42 -1.51 -0.10 0.00 -0.02 0.00 0.00 33.50 32.29 1n3t n PRO 22 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1n3t s LEU 23 N 4.52 2.56 0.05 2.45 1.02 -1.26 -5.15 118.68 122.86 1n3t s LEU 23 Ca 1.28 -1.05 0.04 0.00 0.02 0.00 0.00 54.13 54.42 1n3t s LEU 23 Cb -0.87 -0.76 -0.04 0.00 0.02 0.00 0.00 46.19 44.54 1n3t s LEU 23 CO 0.49 -0.15 -0.04 -0.60 0.02 0.00 0.00 176.35 176.07 1n3t s ARG 24 N -3.63 2.53 0.01 1.70 3.52 -1.26 -5.06 118.95 116.76 1n3t s ARG 24 Ca 0.25 -0.79 -0.36 0.00 -0.13 0.00 0.00 55.73 54.70 1n3t s ARG 24 Cb -0.01 -2.52 -0.15 0.00 -1.56 0.00 0.00 34.95 30.72 1n3t s ARG 24 CO 0.09 0.57 1.59 -2.30 -0.81 0.00 0.00 175.30 174.44 1n3t n PRO 25 N 1.04 1.65 -0.29 5.12 -0.02 -1.26 -4.84 135.00 136.40 1n3t n PRO 25 Ca -0.13 0.60 0.10 0.00 -2.02 0.00 0.00 63.50 62.05 1n3t n PRO 25 Cb 0.52 -2.32 0.26 0.00 -0.02 0.00 0.00 33.50 31.93 1n3t n PRO 25 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1n3t h PRO 26 N 6.32 0.35 0.00 0.52 0.11 -2.05 -3.46 132.00 133.79 1n3t h PRO 26 Ca -0.47 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1n3t h PRO 26 Cb 1.30 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1n3t h PRO 26 CO 0.88 0.23 0.00 0.28 -0.21 0.00 0.00 178.00 179.18 1n3t n VAL 27 N -5.08 0.00 -4.00 3.15 0.31 -1.26 -4.82 118.33 106.64 1n3t n VAL 27 Ca 0.19 0.00 -0.23 0.00 -0.01 0.00 0.00 64.34 64.29 1n3t n VAL 27 Cb 0.57 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 33.47 1n3t n VAL 27 CO 0.00 0.00 0.00 -1.38 -1.32 0.00 0.00 176.83 174.13 1n3t s HIS 28 N 0.00 3.38 -1.15 3.52 -3.43 -1.26 -5.04 115.29 111.31 1n3t s HIS 28 Ca 0.00 -0.01 -0.05 0.00 -0.80 0.00 0.00 55.06 54.20 1n3t s HIS 28 Cb 0.00 -1.56 0.26 0.00 -1.43 0.00 0.00 32.58 29.85 1n3t s HIS 28 CO 0.00 0.48 1.68 0.39 -2.00 0.00 0.00 174.74 175.29 1n3t n GLU 29 N -1.11 4.33 -1.67 -0.38 1.02 -1.26 -5.02 120.64 116.54 1n3t n GLU 29 Ca -0.08 -4.20 -0.44 0.00 -0.02 0.00 0.00 57.16 52.41 1n3t n GLU 29 Cb 0.56 -2.64 -0.02 0.00 -0.02 0.00 0.00 31.44 29.32 1n3t n GLU 29 CO 0.00 0.00 0.00 -0.12 1.18 0.00 0.00 177.13 178.19 1n3t n MET 30 N 1.96 2.04 -1.59 3.49 0.00 -1.26 -4.79 117.12 116.98 1n3t n MET 30 Ca 0.34 0.73 -0.62 0.00 -0.00 0.00 0.00 57.70 58.14 1n3t n MET 30 Cb 0.33 -2.37 -0.09 0.00 0.00 0.00 0.00 33.22 31.09 1n3t n MET 30 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 175.97 172.50 1n3t n ASP 31 N 1.96 0.45 -0.28 6.12 2.03 -1.26 -4.82 116.55 120.75 1n3t n ASP 31 Ca 0.11 1.17 -0.05 0.00 0.52 0.00 0.00 54.79 56.54 1n3t n ASP 31 Cb 0.32 -0.90 0.07 0.00 -0.72 0.00 0.00 41.12 39.89 1n3t n ASP 31 CO 0.00 0.00 0.00 -1.13 -1.92 0.00 0.00 177.20 174.15 1n3t h ASN 32 N 3.74 0.90 0.65 1.67 -1.24 -2.01 -1.26 115.58 118.02 1n3t h ASN 32 Ca -0.48 -0.04 0.00 0.00 0.71 0.00 0.00 56.30 56.49 1n3t h ASN 32 Cb 1.40 -0.22 0.00 0.00 0.73 0.00 0.00 38.32 40.23 1n3t h ASN 32 CO 0.77 0.66 0.00 -0.33 -1.29 0.00 0.00 177.43 177.25 1n3t h GLU 33 N 1.04 0.00 0.00 6.67 5.08 -2.01 -2.63 114.58 122.74 1n3t h GLU 33 Ca 0.28 0.00 -0.27 0.00 -1.00 0.00 0.00 59.36 58.36 1n3t h GLU 33 Cb -0.09 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.11 1n3t h GLU 33 CO -0.06 0.00 -1.56 1.15 -1.00 0.00 0.00 179.01 177.54 1n3t h THR 34 N 0.00 1.03 -0.31 1.13 2.02 -1.58 -3.27 112.91 111.92 1n3t h THR 34 Ca 0.00 -2.85 -0.13 0.00 0.77 0.00 0.00 66.41 64.20 1n3t h THR 34 Cb 0.32 2.51 -0.01 0.00 -1.74 0.00 0.00 68.15 69.23 1n3t h THR 34 CO 0.00 0.59 -0.34 0.03 0.37 0.00 0.00 175.52 176.17 1n3t h ARG 35 N 0.00 0.70 -0.07 6.66 3.08 -1.08 -2.67 114.38 121.00 1n3t h ARG 35 Ca -0.23 -0.33 -0.05 0.00 0.07 0.00 0.00 59.98 59.44 1n3t h ARG 35 Cb 1.96 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 32.00 1n3t h ARG 35 CO 0.09 0.94 -0.18 0.87 -1.07 0.00 0.00 179.97 180.61 1n3t h LYS 36 N 0.58 0.10 -0.34 0.04 1.57 -1.64 -1.21 116.57 115.68 1n3t h LYS 36 Ca 0.06 -0.02 -0.11 0.00 -1.87 0.00 0.00 60.65 58.71 1n3t h LYS 36 Cb 0.86 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.15 1n3t h LYS 36 CO 0.08 0.29 -0.20 0.66 -0.57 0.00 0.00 179.45 179.71 1n3t h SER 37 N 0.10 0.77 -0.12 0.86 4.64 -1.53 -1.27 113.55 116.99 1n3t h SER 37 Ca 0.02 -0.42 -0.13 0.00 -0.47 0.00 0.00 61.79 60.79 1n3t h SER 37 Cb 0.39 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 1n3t h SER 37 CO 0.03 1.02 -0.42 -0.07 -0.87 0.00 0.00 176.83 176.52 1n3t h LEU 38 N 0.52 0.58 -0.03 5.97 3.38 -1.32 -2.30 115.31 122.10 1n3t h LEU 38 Ca 0.07 -0.61 0.00 0.00 0.09 0.00 0.00 57.88 57.43 1n3t h LEU 38 Cb 0.75 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.33 1n3t h LEU 38 CO 0.06 1.09 0.02 0.40 0.09 0.00 0.00 178.44 180.10 1n3t h ILE 39 N 0.11 1.03 -0.57 1.22 2.04 -1.26 -0.14 117.51 119.94 1n3t h ILE 39 Ca -0.02 -0.07 0.09 0.00 1.00 0.00 0.00 64.86 65.86 1n3t h ILE 39 Cb 1.05 1.01 -0.07 0.00 -0.74 0.00 0.00 36.82 38.07 1n3t h ILE 39 CO 0.09 0.02 0.20 0.00 0.00 0.00 0.00 178.15 178.46 1n3t h ALA 40 N 0.99 0.71 -0.88 1.87 0.00 -1.29 -0.77 119.26 119.89 1n3t h ALA 40 Ca 0.01 0.08 0.05 0.00 0.00 0.00 0.00 54.91 55.05 1n3t h ALA 40 Cb 0.02 0.06 -0.06 0.00 0.00 0.00 0.00 17.79 17.81 1n3t h ALA 40 CO -0.00 -0.21 0.56 0.78 0.00 0.00 0.00 179.25 180.38 1n3t h GLY 41 N 0.38 1.30 0.93 0.00 0.00 -0.83 0.15 103.07 105.00 1n3t h GLY 41 Ca 0.28 -0.42 -0.06 0.00 0.00 0.00 0.00 47.33 47.14 1n3t h GLY 41 CO -0.29 0.33 0.01 0.45 0.00 0.00 0.00 176.54 177.04 1n3t h HIS 42 N 1.06 0.71 -0.81 5.60 -0.00 0.01 -2.28 115.15 119.44 1n3t h HIS 42 Ca 0.36 -0.12 0.04 0.00 -0.00 0.00 0.00 60.37 60.65 1n3t h HIS 42 Cb 0.08 -0.19 -0.05 0.00 -0.00 0.00 0.00 27.41 27.25 1n3t h HIS 42 CO -0.02 0.74 0.53 0.52 -0.00 0.00 0.00 177.93 179.70 1n3t h MET 43 N 0.47 0.95 -0.67 2.45 2.86 -0.39 0.01 114.93 120.61 1n3t h MET 43 Ca 0.11 -0.06 0.08 0.00 -2.06 0.00 0.00 59.70 57.77 1n3t h MET 43 Cb 0.45 -0.21 -0.04 0.00 0.06 0.00 0.00 31.60 31.85 1n3t h MET 43 CO 0.02 0.63 0.44 1.15 1.06 0.00 0.00 176.91 180.21 1n3t h THR 44 N 0.98 0.95 0.13 2.22 2.02 -0.18 -1.28 112.91 117.75 1n3t h THR 44 Ca 0.32 -0.20 -0.01 0.00 0.77 0.00 0.00 66.41 67.30 1n3t h THR 44 Cb 0.07 0.32 0.00 0.00 -1.74 0.00 0.00 68.15 66.80 1n3t h THR 44 CO -0.10 0.11 -0.06 -0.33 0.37 0.00 0.00 175.52 175.50 1n3t h GLU 45 N 0.58 -0.17 -0.94 6.66 4.39 -0.57 -2.89 114.58 121.62 1n3t h GLU 45 Ca 0.30 0.01 0.17 0.00 0.34 0.00 0.00 59.36 60.18 1n3t h GLU 45 Cb 0.42 0.04 -0.16 0.00 -0.10 0.00 0.00 28.75 28.94 1n3t h GLU 45 CO -0.10 -0.12 -0.31 -0.89 -1.16 0.00 0.00 179.01 176.44 1n3t n ILE 46 N -2.66 -0.45 -0.30 3.13 5.41 -0.81 0.19 119.36 123.87 1n3t n ILE 46 Ca -0.02 2.19 0.09 0.00 1.00 0.00 0.00 62.75 66.01 1n3t n ILE 46 Cb 0.07 -2.96 0.31 0.00 -0.71 0.00 0.00 39.64 36.35 1n3t n ILE 46 CO 0.00 0.00 0.00 0.24 0.00 0.00 0.00 176.55 176.79 1n3t h MET 47 N 0.00 0.83 0.00 0.38 2.86 -1.29 0.37 114.93 118.07 1n3t h MET 47 Ca 0.39 -0.05 -0.02 0.00 -2.06 0.00 0.00 59.70 57.95 1n3t h MET 47 Cb 0.62 -0.19 -0.00 0.00 0.06 0.00 0.00 31.60 32.09 1n3t h MET 47 CO -0.95 0.55 -0.11 1.96 1.06 0.00 0.00 176.91 179.41 1n3t h GLN 48 N 0.85 0.00 0.00 1.72 4.20 -0.04 -2.38 115.11 119.46 1n3t h GLN 48 Ca 0.45 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.16 1n3t h GLN 48 Cb 0.54 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.32 1n3t h GLN 48 CO -0.21 0.11 -0.04 1.28 -0.67 0.00 0.00 178.83 179.29 1n3t n LEU 49 N -3.17 0.04 -0.96 1.46 4.77 0.12 -2.90 117.00 116.37 1n3t n LEU 49 Ca 0.02 0.46 0.08 0.00 -0.03 0.00 0.00 56.01 56.54 1n3t n LEU 49 Cb 0.48 -0.48 0.23 0.00 -2.33 0.00 0.00 43.42 41.31 1n3t n LEU 49 CO 0.33 0.01 0.69 0.18 -1.33 0.00 0.00 177.39 177.27 1n3t n LEU 50 N -1.50 3.37 -2.33 2.23 4.77 -0.56 -4.96 117.00 118.02 1n3t n LEU 50 Ca 0.07 -1.96 -0.17 0.00 -0.03 0.00 0.00 56.01 53.92 1n3t n LEU 50 Cb 0.34 -0.34 0.03 0.00 -2.33 0.00 0.00 43.42 41.12 1n3t n LEU 50 CO 0.28 0.83 -0.01 0.59 -1.33 0.00 0.00 177.39 177.75 1n3t n ASN 51 N 1.04 -5.06 -4.77 -1.43 3.02 -1.14 -5.00 115.26 101.91 1n3t n ASN 51 Ca 0.17 -0.21 -0.37 0.00 -0.03 0.00 0.00 54.58 54.14 1n3t n ASN 51 Cb 0.51 -3.93 -0.06 0.00 -0.61 0.00 0.00 39.78 35.69 1n3t n ASN 51 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1n3t s LEU 52 N -5.20 4.34 -1.00 3.41 1.43 -0.93 -5.00 118.68 115.72 1n3t s LEU 52 Ca 0.22 0.75 -0.23 0.00 -1.03 0.00 0.00 54.13 53.84 1n3t s LEU 52 Cb -0.10 -2.53 -0.01 0.00 0.03 0.00 0.00 46.19 43.58 1n3t s LEU 52 CO 0.27 0.15 1.75 -0.62 0.23 0.00 0.00 176.35 178.13 1n3t s ASP 53 N -0.05 5.75 0.00 2.29 -1.08 -1.26 -4.60 116.67 117.73 1n3t s ASP 53 Ca 0.22 -1.17 0.03 0.00 -0.52 0.00 0.00 52.55 51.12 1n3t s ASP 53 Cb -0.15 -2.57 0.20 0.00 -1.46 0.00 0.00 42.92 38.95 1n3t s ASP 53 CO 0.09 -2.21 0.61 0.18 0.52 0.00 0.00 175.17 174.36 1n3t n LEU 54 N 11.74 0.00 0.04 -1.34 4.77 -1.26 -1.00 117.00 129.95 1n3t n LEU 54 Ca 0.38 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 56.22 1n3t n LEU 54 Cb 0.48 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.53 1n3t n LEU 54 CO 0.64 0.00 0.22 0.00 -1.33 0.00 0.00 177.39 176.92 1n3t h ALA 55 N 2.07 0.37 -1.50 -1.18 0.00 -1.96 -3.38 119.26 113.68 1n3t h ALA 55 Ca 0.00 -0.66 -0.74 0.00 0.00 0.00 0.00 54.91 53.51 1n3t h ALA 55 Cb 0.00 -0.02 0.03 0.00 0.00 0.00 0.00 17.79 17.80 1n3t h ALA 55 CO 0.00 0.76 0.67 -3.47 0.00 0.00 0.00 179.25 177.21 1n3t n ASP 56 N -3.82 1.85 0.25 0.00 2.03 -0.17 -4.80 116.55 111.89 1n3t n ASP 56 Ca -0.07 1.11 0.18 0.00 0.52 0.00 0.00 54.79 56.52 1n3t n ASP 56 Cb 0.80 -1.12 0.84 0.00 -0.72 0.00 0.00 41.12 40.92 1n3t n ASP 56 CO 0.00 0.00 0.00 -2.24 -1.92 0.00 0.00 177.20 173.04 1n3t h ASP 57 N 5.82 0.00 0.00 1.67 2.03 -1.90 0.76 116.42 124.80 1n3t h ASP 57 Ca -0.47 0.00 -0.04 0.00 -0.73 0.00 0.00 57.03 55.79 1n3t h ASP 57 Cb 1.34 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 39.83 1n3t h ASP 57 CO 0.88 0.00 -0.48 -1.28 -1.03 0.00 0.00 179.24 177.33 1n3t h SER 58 N 0.00 0.00 -0.31 4.15 0.87 -1.95 -3.36 113.55 112.95 1n3t h SER 58 Ca 0.07 -0.14 0.09 0.00 -1.23 0.00 0.00 61.79 60.58 1n3t h SER 58 Cb 0.69 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.63 1n3t h SER 58 CO -0.00 0.83 0.31 -0.07 -0.53 0.00 0.00 176.83 177.37 1n3t h LEU 59 N -1.00 0.00 -0.67 2.23 3.38 -1.79 -2.87 115.31 114.59 1n3t h LEU 59 Ca -0.06 0.00 0.14 0.00 0.09 0.00 0.00 57.88 58.06 1n3t h LEU 59 Cb 0.55 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 41.19 1n3t h LEU 59 CO -0.03 0.00 0.10 -0.03 0.09 0.00 0.00 178.44 178.56 1n3t h MET 60 N 0.00 0.20 0.00 1.13 4.05 -1.00 -2.46 114.93 116.85 1n3t h MET 60 Ca 0.15 -0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.55 1n3t h MET 60 Cb 0.77 -0.04 0.00 0.00 -0.80 0.00 0.00 31.60 31.53 1n3t h MET 60 CO -0.00 0.13 -0.16 0.93 0.23 0.00 0.00 176.91 178.04 1n3t h GLU 61 N 0.20 0.00 -0.52 0.39 4.39 -1.70 -3.38 114.58 113.96 1n3t h GLU 61 Ca 0.37 0.00 0.10 0.00 0.34 0.00 0.00 59.36 60.17 1n3t h GLU 61 Cb 0.61 0.00 -0.10 0.00 -0.10 0.00 0.00 28.75 29.15 1n3t h GLU 61 CO -0.51 0.00 -0.18 1.15 -1.16 0.00 0.00 179.01 178.31 1n3t h THR 62 N 0.00 0.39 -0.77 1.13 2.02 -1.57 -1.46 112.91 112.65 1n3t h THR 62 Ca 0.00 0.00 0.18 0.00 0.77 0.00 0.00 66.41 67.36 1n3t h THR 62 Cb 0.76 0.39 -0.12 0.00 -1.74 0.00 0.00 68.15 67.45 1n3t h THR 62 CO 0.00 0.00 0.19 -0.65 0.37 0.00 0.00 175.52 175.43 1n3t h PRO 63 N -0.06 0.25 -0.59 6.66 0.11 -1.77 0.18 132.00 136.79 1n3t h PRO 63 Ca 0.25 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 66.32 1n3t h PRO 63 Cb 0.44 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 31.47 1n3t h PRO 63 CO -0.57 0.17 0.30 1.25 -0.21 0.00 0.00 178.00 178.95 1n3t h HIS 64 N 0.26 0.83 0.45 0.65 -0.00 -1.57 -1.35 115.15 114.42 1n3t h HIS 64 Ca 0.45 -0.03 -0.02 0.00 -0.00 0.00 0.00 60.37 60.77 1n3t h HIS 64 Cb 0.80 -0.26 0.00 0.00 -0.00 0.00 0.00 27.41 27.95 1n3t h HIS 64 CO -0.26 0.62 -0.22 0.00 -0.00 0.00 0.00 177.93 178.07 1n3t h ARG 65 N 0.80 -0.58 -0.55 5.26 3.08 -0.08 0.02 114.38 122.33 1n3t h ARG 65 Ca 0.20 0.04 0.11 0.00 0.07 0.00 0.00 59.98 60.40 1n3t h ARG 65 Cb 0.08 0.13 -0.09 0.00 0.08 0.00 0.00 29.97 30.17 1n3t h ARG 65 CO -0.03 -0.29 -0.02 0.82 -1.07 0.00 0.00 179.97 179.38 1n3t h ILE 66 N -0.82 0.54 0.12 2.04 2.04 -0.85 0.45 117.51 121.05 1n3t h ILE 66 Ca -0.06 -0.03 0.02 0.00 1.00 0.00 0.00 64.86 65.78 1n3t h ILE 66 Cb 0.56 0.44 -0.04 0.00 -0.74 0.00 0.00 36.82 37.03 1n3t h ILE 66 CO 0.10 0.02 -0.31 0.00 0.00 0.00 0.00 178.15 177.96 1n3t h ALA 67 N 1.50 -0.53 -0.84 1.87 0.00 -1.08 -1.62 119.26 118.55 1n3t h ALA 67 Ca 0.28 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 1n3t h ALA 67 Cb 0.43 0.51 -0.04 0.00 0.00 0.00 0.00 17.79 18.69 1n3t h ALA 67 CO -0.48 -0.85 0.48 -0.22 0.00 0.00 0.00 179.25 178.18 1n3t h LYS 68 N -0.53 1.16 -0.59 0.00 3.11 -0.14 -1.61 116.57 117.96 1n3t h LYS 68 Ca 0.03 -0.12 0.03 0.00 -2.81 0.00 0.00 60.65 57.79 1n3t h LYS 68 Cb 0.56 -0.24 -0.04 0.00 -1.00 0.00 0.00 32.23 31.52 1n3t h LYS 68 CO -0.18 0.83 0.35 1.98 -2.81 0.00 0.00 179.45 179.61 1n3t h MET 69 N 1.17 0.66 0.32 1.90 4.05 0.44 0.15 114.93 123.61 1n3t h MET 69 Ca 0.30 -0.04 -0.02 0.00 -0.28 0.00 0.00 59.70 59.67 1n3t h MET 69 Cb -0.01 -0.15 0.00 0.00 -0.80 0.00 0.00 31.60 30.64 1n3t h MET 69 CO -0.05 0.43 -0.15 1.88 0.23 0.00 0.00 176.91 179.25 1n3t h TYR 70 N 0.68 -0.40 0.56 1.39 0.05 -0.98 -1.14 116.97 117.13 1n3t h TYR 70 Ca 0.24 -0.01 -0.03 0.00 0.05 0.00 0.00 58.73 58.99 1n3t h TYR 70 Cb 0.06 0.13 0.01 0.00 1.01 0.00 0.00 36.73 37.94 1n3t h TYR 70 CO -0.07 -0.05 -0.27 0.28 -1.05 0.00 0.00 178.16 177.00 1n3t h VAL 71 N -0.84 0.00 -0.00 -2.88 2.07 -1.19 -3.35 116.25 110.06 1n3t h VAL 71 Ca -0.04 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.41 1n3t h VAL 71 Cb 0.52 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.29 1n3t h VAL 71 CO 0.07 0.00 -0.44 0.47 0.02 0.00 0.00 177.57 177.69 1n3t n ASP 72 N -4.20 0.82 0.00 0.57 8.00 0.52 -4.62 116.55 117.64 1n3t n ASP 72 Ca -0.09 -0.62 0.00 0.00 0.71 0.00 0.00 54.79 54.78 1n3t n ASP 72 Cb 0.30 0.27 0.00 0.00 -0.02 0.00 0.00 41.12 41.67 1n3t n ASP 72 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1n3t n GLU 73 N -1.08 0.00 -0.38 -1.24 1.02 -0.71 -4.76 120.64 113.48 1n3t n GLU 73 Ca 0.08 0.00 0.34 0.00 -0.02 0.00 0.00 57.16 57.56 1n3t n GLU 73 Cb 0.35 0.00 0.67 0.00 -0.02 0.00 0.00 31.44 32.44 1n3t n GLU 73 CO 0.00 0.00 0.00 -0.84 1.18 0.00 0.00 177.13 177.47 1n3t h ILE 74 N 0.00 0.35 -0.39 -3.67 3.07 -1.49 -0.72 117.51 114.66 1n3t h ILE 74 Ca 0.00 -0.04 -0.11 0.00 1.55 0.00 0.00 64.86 66.25 1n3t h ILE 74 Cb 0.00 0.21 -0.07 0.00 -0.27 0.00 0.00 36.82 36.69 1n3t h ILE 74 CO 0.00 0.02 0.04 0.49 -1.05 0.00 0.00 178.15 177.65 1n3t n PHE 75 N -4.38 1.29 0.33 0.16 3.72 -1.25 -3.05 117.46 114.28 1n3t n PHE 75 Ca 0.29 -1.20 0.21 0.00 -0.05 0.00 0.00 57.45 56.70 1n3t n PHE 75 Cb 1.25 -0.45 1.14 0.00 -0.94 0.00 0.00 39.48 40.47 1n3t n PHE 75 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1n3t h SER 76 N 1.63 0.00 0.00 4.37 4.64 -1.09 -1.49 113.55 121.61 1n3t h SER 76 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 1n3t h SER 76 Cb 1.70 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.79 1n3t h SER 76 CO 0.39 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.96 1n3t n GLY 77 N -1.15 -0.65 0.02 -0.77 0.00 0.13 -2.63 105.19 100.14 1n3t n GLY 77 Ca -0.03 -0.11 0.13 0.00 0.00 0.00 0.00 46.02 46.01 1n3t n GLY 77 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1n3t n LEU 78 N -0.93 0.28 -4.03 0.99 4.77 -0.56 -4.65 117.00 112.88 1n3t n LEU 78 Ca 0.13 0.22 -0.31 0.00 -0.03 0.00 0.00 56.01 56.01 1n3t n LEU 78 Cb 0.06 -0.34 -0.15 0.00 -2.33 0.00 0.00 43.42 40.66 1n3t n LEU 78 CO 0.10 0.06 -0.42 -0.62 -1.33 0.00 0.00 177.39 175.18 1n3t s ASP 79 N -2.89 4.41 0.00 -1.43 2.15 -1.08 -4.97 116.67 112.85 1n3t s ASP 79 Ca 0.16 -1.53 0.00 0.00 0.43 0.00 0.00 52.55 51.61 1n3t s ASP 79 Cb 0.19 -1.49 0.00 0.00 -0.30 0.00 0.00 42.92 41.32 1n3t s ASP 79 CO 0.58 -0.24 0.86 -1.22 -0.17 0.00 0.00 175.17 174.98 1n3t n TYR 80 N 4.44 0.00 0.27 -5.34 4.02 -1.26 -0.16 117.16 119.13 1n3t n TYR 80 Ca -0.10 0.00 0.13 0.00 -0.01 0.00 0.00 57.90 57.93 1n3t n TYR 80 Cb 0.42 -0.37 0.82 0.00 -0.02 0.00 0.00 39.34 40.19 1n3t n TYR 80 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1n3t h ALA 81 N 1.79 1.72 -0.49 -0.72 0.00 -1.92 -0.61 119.26 119.02 1n3t h ALA 81 Ca 0.00 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1n3t h ALA 81 Cb 0.09 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1n3t h ALA 81 CO 0.00 -0.04 0.03 0.09 0.00 0.00 0.00 179.25 179.33 1n3t n ASN 82 N -4.07 4.79 -4.76 0.00 3.02 0.77 -4.95 115.26 110.06 1n3t n ASN 82 Ca -0.02 -2.79 -0.40 0.00 -0.03 0.00 0.00 54.58 51.33 1n3t n ASN 82 Cb 0.11 -0.66 -0.04 0.00 -0.61 0.00 0.00 39.78 38.59 1n3t n ASN 82 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1n3t s PHE 83 N -2.45 3.44 0.51 3.10 5.36 -0.24 -4.98 117.98 122.72 1n3t s PHE 83 Ca 0.44 1.63 -0.22 0.00 -0.96 0.00 0.00 56.93 57.82 1n3t s PHE 83 Cb 0.34 -3.39 -0.06 0.00 -0.34 0.00 0.00 43.02 39.57 1n3t s PHE 83 CO 0.13 -0.88 1.23 -1.25 -1.46 0.00 0.00 175.22 172.98 1n3t s PRO 84 N -1.54 3.46 -0.47 10.12 0.04 -1.26 -4.92 135.00 140.43 1n3t s PRO 84 Ca 0.46 1.91 -0.28 0.00 0.04 0.00 0.00 61.00 63.12 1n3t s PRO 84 Cb -0.34 -2.28 0.00 0.00 0.04 0.00 0.00 34.50 31.92 1n3t s PRO 84 CO 0.44 -0.84 1.57 0.15 0.04 0.00 0.00 177.00 178.36 1n3t s LYS 85 N -2.87 3.28 0.57 4.56 1.02 -1.26 -4.97 119.74 120.08 1n3t s LYS 85 Ca 0.68 0.83 -0.15 0.00 0.02 0.00 0.00 55.97 57.36 1n3t s LYS 85 Cb -0.32 -4.15 -0.06 0.00 -0.52 0.00 0.00 37.83 32.78 1n3t s LYS 85 CO 0.38 -1.94 1.01 0.42 -0.92 0.00 0.00 175.35 174.31 1n3t s ILE 86 N 6.53 4.40 -0.22 2.17 1.01 -1.26 -5.03 121.20 128.79 1n3t s ILE 86 Ca 0.63 1.03 -0.10 0.00 0.00 0.00 0.00 60.65 62.22 1n3t s ILE 86 Cb -0.14 -3.67 0.08 0.00 0.01 0.00 0.00 42.46 38.74 1n3t s ILE 86 CO 0.28 -0.77 0.50 0.42 0.00 0.00 0.00 174.94 175.37 1n3t s THR 87 N -2.75 -0.40 0.39 2.92 -4.23 -1.26 -5.12 115.64 105.19 1n3t s THR 87 Ca 0.59 0.09 0.08 0.00 -1.18 0.00 0.00 61.69 61.27 1n3t s THR 87 Cb -0.12 -0.76 -0.06 0.00 1.34 0.00 0.00 72.50 72.91 1n3t s THR 87 CO 0.39 0.04 0.08 -0.76 -0.54 0.00 0.00 174.62 173.83 1n3t s LEU 88 N 2.11 2.99 -0.05 4.79 1.43 -1.26 -2.66 118.68 126.03 1n3t s LEU 88 Ca -0.06 -1.16 -0.02 0.00 -1.03 0.00 0.00 54.13 51.85 1n3t s LEU 88 Cb -0.10 -1.22 0.03 0.00 0.03 0.00 0.00 46.19 44.94 1n3t s LEU 88 CO -0.15 -0.43 0.09 -0.63 0.23 0.00 0.00 176.35 175.45 1n3t s ILE 89 N -2.62 -0.14 0.22 -0.59 1.01 -0.87 -4.97 121.20 113.24 1n3t s ILE 89 Ca 0.37 0.36 -0.18 0.00 0.00 0.00 0.00 60.65 61.20 1n3t s ILE 89 Cb 0.05 -0.18 -0.12 0.00 0.01 0.00 0.00 42.46 42.22 1n3t s ILE 89 CO 0.20 0.15 0.23 1.21 0.00 0.00 0.00 174.94 176.73 1n3t n GLU 90 N 5.06 0.00 -2.42 2.79 2.13 -1.26 -1.82 120.64 125.12 1n3t n GLU 90 Ca -0.09 0.00 -0.43 0.00 0.66 0.00 0.00 57.16 57.30 1n3t n GLU 90 Cb 0.50 -0.73 0.00 0.00 0.27 0.00 0.00 31.44 31.48 1n3t n GLU 90 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 1n3t n ASN 91 N 1.57 5.10 0.14 4.31 5.15 -1.04 -4.61 115.26 125.88 1n3t n ASN 91 Ca 0.11 -3.09 0.02 0.00 -0.60 0.00 0.00 54.58 51.01 1n3t n ASN 91 Cb 0.23 -1.49 0.05 0.00 -0.53 0.00 0.00 39.78 38.05 1n3t n ASN 91 CO 0.00 0.00 0.00 0.11 1.40 0.00 0.00 177.26 178.77 1n3t h LYS 92 N 5.94 0.00 0.00 1.20 1.57 -1.90 -3.07 116.57 120.31 1n3t h LYS 92 Ca 0.38 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.16 1n3t h LYS 92 Cb 0.66 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.97 1n3t h LYS 92 CO 1.57 0.54 0.00 -1.33 -0.57 0.00 0.00 179.45 179.66 1n3t n MET 93 N -3.28 0.44 -3.65 3.15 2.81 -1.26 -4.93 117.12 110.40 1n3t n MET 93 Ca 0.01 0.01 -0.31 0.00 -1.81 0.00 0.00 57.70 55.61 1n3t n MET 93 Cb 0.73 -1.50 0.05 0.00 -0.71 0.00 0.00 33.22 31.78 1n3t n MET 93 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1n3t n LYS 94 N -1.27 -1.26 -2.40 0.03 4.01 -1.16 -4.89 118.16 111.21 1n3t n LYS 94 Ca 0.14 0.48 -0.43 0.00 -0.51 0.00 0.00 58.31 58.00 1n3t n LYS 94 Cb 0.22 -4.21 -0.02 0.00 -0.51 0.00 0.00 35.03 30.51 1n3t n LYS 94 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 1n3t s VAL 95 N -3.45 4.12 -0.77 -0.18 1.01 -1.26 -4.85 120.40 115.01 1n3t s VAL 95 Ca 0.48 1.27 0.14 0.00 0.00 0.00 0.00 61.98 63.86 1n3t s VAL 95 Cb -0.16 -4.11 0.46 0.00 0.00 0.00 0.00 36.38 32.57 1n3t s VAL 95 CO 0.85 -0.44 1.39 -0.90 0.00 0.00 0.00 175.10 176.00 1n3t n ASP 96 N 7.63 3.61 -4.52 3.32 5.75 -1.26 -4.32 116.55 126.75 1n3t n ASP 96 Ca 0.15 -2.39 -0.30 0.00 -0.01 0.00 0.00 54.79 52.24 1n3t n ASP 96 Cb 0.46 -0.40 -0.11 0.00 -1.03 0.00 0.00 41.12 40.04 1n3t n ASP 96 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 1n3t s GLU 97 N -1.71 2.01 0.38 0.11 0.41 -1.26 -4.97 118.70 113.66 1n3t s GLU 97 Ca 0.35 -1.06 -0.26 0.00 -0.41 0.00 0.00 54.97 53.59 1n3t s GLU 97 Cb 0.23 -2.22 -0.09 0.00 -1.78 0.00 0.00 34.13 30.27 1n3t s GLU 97 CO 0.16 0.51 1.22 0.00 -0.49 0.00 0.00 175.26 176.66 1n3t s MET 98 N -1.98 4.11 -0.16 1.61 0.23 -1.26 -4.48 119.30 117.37 1n3t s MET 98 Ca 0.18 1.97 -0.05 0.00 -1.03 0.00 0.00 55.69 56.77 1n3t s MET 98 Cb -0.11 -2.79 -0.03 0.00 -1.53 0.00 0.00 34.83 30.37 1n3t s MET 98 CO 0.10 -0.31 -0.01 0.08 -2.03 0.00 0.00 175.02 172.86 1n3t s VAL 99 N -1.32 4.17 -0.05 5.16 1.01 -0.10 -4.94 120.40 124.32 1n3t s VAL 99 Ca 0.55 -0.26 0.06 0.00 0.00 0.00 0.00 61.98 62.32 1n3t s VAL 99 Cb -0.34 -2.84 -0.01 0.00 0.00 0.00 0.00 36.38 33.20 1n3t s VAL 99 CO 0.43 0.49 -0.22 -0.89 0.00 0.00 0.00 175.10 174.91 1n3t s THR 100 N 0.29 1.82 -0.23 3.92 2.01 -1.26 -2.74 115.64 119.44 1n3t s THR 100 Ca -0.01 -0.94 0.00 0.00 0.31 0.00 0.00 61.69 61.05 1n3t s THR 100 Cb -0.13 -1.54 0.03 0.00 0.01 0.00 0.00 72.50 70.87 1n3t s THR 100 CO 0.02 0.51 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.66 1n3t s VAL 101 N -0.13 2.50 0.31 3.82 1.01 0.06 -5.01 120.40 122.97 1n3t s VAL 101 Ca -0.03 -1.13 0.08 0.00 0.00 0.00 0.00 61.98 60.91 1n3t s VAL 101 Cb -0.13 -2.25 -0.04 0.00 0.00 0.00 0.00 36.38 33.96 1n3t s VAL 101 CO 0.03 0.25 0.12 0.00 0.00 0.00 0.00 175.10 175.50 1n3t s ARG 102 N 1.27 2.44 -1.48 2.72 1.70 -1.26 -1.47 118.95 122.86 1n3t s ARG 102 Ca -0.00 -1.44 -0.12 0.00 -0.47 0.00 0.00 55.73 53.69 1n3t s ARG 102 Cb -0.16 -2.24 0.06 0.00 -0.57 0.00 0.00 34.95 32.04 1n3t s ARG 102 CO -0.07 0.20 0.96 -0.25 -1.08 0.00 0.00 175.30 175.06 1n3t n ASP 103 N -1.11 -5.18 -4.70 -2.89 8.00 -1.18 -4.94 116.55 104.55 1n3t n ASP 103 Ca -0.04 -0.66 -0.42 0.00 0.71 0.00 0.00 54.79 54.38 1n3t n ASP 103 Cb 0.60 -4.13 -0.03 0.00 -0.02 0.00 0.00 41.12 37.54 1n3t n ASP 103 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1n3t s ILE 104 N -3.26 3.83 0.22 0.53 1.01 -0.70 -4.82 121.20 118.01 1n3t s ILE 104 Ca 0.60 1.28 -0.31 0.00 0.00 0.00 0.00 60.65 62.22 1n3t s ILE 104 Cb -0.29 -3.82 -0.10 0.00 0.01 0.00 0.00 42.46 38.25 1n3t s ILE 104 CO 0.74 0.06 1.51 -0.89 0.00 0.00 0.00 174.94 176.37 1n3t s THR 105 N 1.57 2.58 -0.10 2.92 2.01 -1.26 -1.44 115.64 121.91 1n3t s THR 105 Ca 0.61 0.45 -0.03 0.00 0.31 0.00 0.00 61.69 63.03 1n3t s THR 105 Cb -0.31 -3.29 0.04 0.00 0.01 0.00 0.00 72.50 68.96 1n3t s THR 105 CO 0.28 0.06 0.07 -0.22 -0.69 0.00 0.00 174.62 174.11 1n3t s LEU 106 N 0.27 0.31 -0.17 4.42 0.20 -1.07 -4.71 118.68 117.93 1n3t s LEU 106 Ca 0.64 -0.25 -0.01 0.00 0.69 0.00 0.00 54.13 55.21 1n3t s LEU 106 Cb -0.43 -0.23 -0.01 0.00 -0.43 0.00 0.00 46.19 45.09 1n3t s LEU 106 CO 0.38 -0.29 -0.12 0.42 -0.29 0.00 0.00 176.35 176.46 1n3t s THR 107 N 2.13 2.93 0.33 3.68 -4.23 -1.26 -2.11 115.64 117.10 1n3t s THR 107 Ca 0.04 -0.67 0.05 0.00 -1.18 0.00 0.00 61.69 59.92 1n3t s THR 107 Cb -0.14 -2.27 -0.02 0.00 1.34 0.00 0.00 72.50 71.42 1n3t s THR 107 CO -0.06 0.49 0.33 -0.24 -0.54 0.00 0.00 174.62 174.61 1n3t n SER 108 N 4.15 -0.87 -3.75 3.99 2.88 -0.81 -4.05 113.62 115.16 1n3t n SER 108 Ca -0.19 -3.06 -0.19 0.00 -1.33 0.00 0.00 58.87 54.10 1n3t n SER 108 Cb 0.52 1.87 -0.17 0.00 -0.75 0.00 0.00 64.21 65.67 1n3t n SER 108 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 1n3t s THR 109 N -3.18 0.11 -0.09 2.46 2.01 -1.25 -0.22 115.64 115.48 1n3t s THR 109 Ca 0.36 0.23 -0.30 0.00 0.31 0.00 0.00 61.69 62.29 1n3t s THR 109 Cb 0.01 -0.28 -0.04 0.00 0.01 0.00 0.00 72.50 72.20 1n3t s THR 109 CO 0.26 0.18 1.53 0.00 -0.69 0.00 0.00 174.62 175.90 1n3t n GLU 111 N 6.97 0.00 0.08 0.00 0.28 -0.44 -0.04 120.64 127.49 1n3t n GLU 111 Ca 0.16 0.48 -0.05 0.00 -0.16 0.00 0.00 57.16 57.60 1n3t n GLU 111 Cb 0.43 -1.51 -0.08 0.00 1.43 0.00 0.00 31.44 31.71 1n3t n GLU 111 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 1n3t h HIS 112 N 0.00 0.00 0.00 -1.84 3.86 -1.89 -3.38 115.15 111.91 1n3t h HIS 112 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1n3t h HIS 112 Cb 0.02 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.49 1n3t h HIS 112 CO 0.00 0.88 0.00 0.72 0.86 0.00 0.00 177.93 180.39 1n3t n HIS 113 N -3.33 0.00 -3.65 2.45 8.25 -0.99 -4.99 115.22 112.96 1n3t n HIS 113 Ca 0.00 -0.02 -0.24 0.00 -0.26 0.00 0.00 57.72 57.20 1n3t n HIS 113 Cb 0.89 -0.00 0.07 0.00 1.12 0.00 0.00 29.99 32.07 1n3t n HIS 113 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1n3t n PHE 114 N -0.02 -2.63 -4.30 4.41 3.01 0.94 -4.98 117.46 113.89 1n3t n PHE 114 Ca 0.00 0.98 -0.28 0.00 1.01 0.00 0.00 57.45 59.16 1n3t n PHE 114 Cb 0.30 -4.80 -0.10 0.00 -0.01 0.00 0.00 39.48 34.87 1n3t n PHE 114 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1n3t s VAL 115 N -3.34 3.08 0.21 -4.37 1.01 -1.17 -4.87 120.40 110.96 1n3t s VAL 115 Ca 0.50 -1.62 -0.32 0.00 0.00 0.00 0.00 61.98 60.54 1n3t s VAL 115 Cb -0.23 -2.49 -0.15 0.00 0.00 0.00 0.00 36.38 33.51 1n3t s VAL 115 CO 0.76 -0.05 1.23 0.41 0.00 0.00 0.00 175.10 177.45 1n3t n THR 116 N 0.27 1.04 -4.06 3.92 -1.04 -1.26 0.03 114.28 113.18 1n3t n THR 116 Ca -0.12 -0.26 -0.32 0.00 -2.04 0.00 0.00 64.05 61.31 1n3t n THR 116 Cb 0.55 -1.09 -0.16 0.00 -1.82 0.00 0.00 70.33 67.81 1n3t n THR 116 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1n3t s ILE 117 N -0.24 1.88 -0.34 12.58 1.01 0.70 -2.08 121.20 134.70 1n3t s ILE 117 Ca 0.70 -1.04 -0.08 0.00 0.00 0.00 0.00 60.65 60.23 1n3t s ILE 117 Cb -0.76 -1.83 0.03 0.00 0.01 0.00 0.00 42.46 39.91 1n3t s ILE 117 CO 0.52 0.32 0.13 -0.62 0.00 0.00 0.00 174.94 175.29 1n3t s ASP 118 N 1.32 5.41 0.35 3.58 2.15 -0.68 -1.93 116.67 126.87 1n3t s ASP 118 Ca 0.01 -1.07 0.04 0.00 0.43 0.00 0.00 52.55 51.96 1n3t s ASP 118 Cb -0.15 -1.91 -0.01 0.00 -0.30 0.00 0.00 42.92 40.54 1n3t s ASP 118 CO -0.10 -0.33 0.37 -0.83 -0.17 0.00 0.00 175.17 174.12 1n3t s GLY 119 N 1.45 2.04 -0.00 2.66 0.00 -0.90 -0.61 107.32 111.96 1n3t s GLY 119 Ca -0.00 -1.87 0.02 0.00 0.00 0.00 0.00 44.72 42.87 1n3t s GLY 119 CO 0.04 -1.28 -0.08 0.54 0.00 0.00 0.00 173.10 172.32 1n3t s LYS 120 N -3.19 0.63 0.13 2.90 3.01 -0.09 -2.61 119.74 120.52 1n3t s LYS 120 Ca 0.37 -0.33 0.10 0.00 -1.01 0.00 0.00 55.97 55.10 1n3t s LYS 120 Cb 0.01 -0.59 -0.04 0.00 -1.01 0.00 0.00 37.83 36.19 1n3t s LYS 120 CO 0.26 0.16 -0.25 0.00 0.51 0.00 0.00 175.35 176.02 1n3t s ALA 121 N -0.28 2.27 -0.08 5.17 0.00 -0.52 -1.51 121.76 126.81 1n3t s ALA 121 Ca 0.02 -1.44 0.01 0.00 0.00 0.00 0.00 51.96 50.55 1n3t s ALA 121 Cb -0.04 -0.34 0.02 0.00 0.00 0.00 0.00 23.12 22.76 1n3t s ALA 121 CO -0.00 0.49 -0.11 0.99 0.00 0.00 0.00 175.76 177.12 1n3t s THR 122 N -1.17 1.13 0.08 0.00 2.01 0.15 -1.73 115.64 116.11 1n3t s THR 122 Ca 0.13 -0.43 0.09 0.00 0.31 0.00 0.00 61.69 61.79 1n3t s THR 122 Cb -0.10 -1.07 -0.03 0.00 0.01 0.00 0.00 72.50 71.31 1n3t s THR 122 CO 0.06 0.36 -0.24 -0.69 -0.69 0.00 0.00 174.62 173.42 1n3t s VAL 123 N 1.01 2.00 -0.20 3.82 1.01 -0.54 -0.63 120.40 126.87 1n3t s VAL 123 Ca -0.08 -1.49 -0.18 0.00 0.00 0.00 0.00 61.98 60.23 1n3t s VAL 123 Cb -0.15 -1.75 0.05 0.00 0.00 0.00 0.00 36.38 34.53 1n3t s VAL 123 CO -0.01 0.17 0.52 0.00 0.00 0.00 0.00 175.10 175.79 1n3t s ALA 124 N -0.95 -1.30 0.18 5.51 0.00 -0.47 -0.76 121.76 123.98 1n3t s ALA 124 Ca 0.11 1.49 -0.10 0.00 0.00 0.00 0.00 51.96 53.45 1n3t s ALA 124 Cb -0.10 -0.86 -0.01 0.00 0.00 0.00 0.00 23.12 22.15 1n3t s ALA 124 CO 0.04 -0.25 0.33 1.52 0.00 0.00 0.00 175.76 177.40 1n3t s TYR 125 N 0.29 0.37 -0.26 0.00 1.13 -1.11 0.57 117.35 118.35 1n3t s TYR 125 Ca -0.00 -0.73 -0.01 0.00 -1.41 0.00 0.00 57.07 54.92 1n3t s TYR 125 Cb -0.04 0.00 0.04 0.00 -1.10 0.00 0.00 41.96 40.86 1n3t s TYR 125 CO 0.01 -0.77 -0.06 0.42 -2.51 0.00 0.00 175.55 172.63 1n3t s ILE 126 N -3.97 2.72 0.21 -3.49 1.01 -0.88 -0.93 121.20 115.86 1n3t s ILE 126 Ca 0.18 -1.23 -0.32 0.00 0.00 0.00 0.00 60.65 59.27 1n3t s ILE 126 Cb 0.02 -2.46 -0.13 0.00 0.01 0.00 0.00 42.46 39.91 1n3t s ILE 126 CO 0.02 0.09 1.54 -2.65 0.00 0.00 0.00 174.94 173.94 1n3t n PRO 127 N 4.61 2.25 0.00 2.79 -0.02 -1.26 -4.85 135.00 138.51 1n3t n PRO 127 Ca -0.15 0.81 0.00 0.00 -2.02 0.00 0.00 63.50 62.13 1n3t n PRO 127 Cb 0.45 -2.55 0.00 0.00 -0.02 0.00 0.00 33.50 31.38 1n3t n PRO 127 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1n3t n LYS 128 N 2.91 0.00 -0.18 -0.52 4.81 -1.26 -4.69 118.16 119.22 1n3t n LYS 128 Ca 0.14 0.00 0.10 0.00 -0.87 0.00 0.00 58.31 57.68 1n3t n LYS 128 Cb 0.31 0.00 0.19 0.00 0.02 0.00 0.00 35.03 35.56 1n3t n LYS 128 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1n3t n ASP 129 N 0.00 3.24 -3.62 3.14 8.00 -1.26 -4.79 116.55 121.26 1n3t n ASP 129 Ca 0.00 -1.93 -0.15 0.00 0.71 0.00 0.00 54.79 53.42 1n3t n ASP 129 Cb 0.00 -0.24 -0.07 0.00 -0.02 0.00 0.00 41.12 40.79 1n3t n ASP 129 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1n3t s SER 130 N -1.27 -0.44 -0.20 -2.24 1.04 -1.26 -2.51 113.70 106.82 1n3t s SER 130 Ca 0.34 0.34 0.00 0.00 0.48 0.00 0.00 55.95 57.11 1n3t s SER 130 Cb 0.19 0.45 0.02 0.00 0.10 0.00 0.00 66.02 66.79 1n3t s SER 130 CO 0.27 -0.59 -0.15 -0.69 0.98 0.00 0.00 173.24 173.05 1n3t s VAL 131 N -1.64 2.38 0.46 5.02 1.01 -0.75 -4.72 120.40 122.15 1n3t s VAL 131 Ca -0.10 -0.94 -0.22 0.00 0.00 0.00 0.00 61.98 60.73 1n3t s VAL 131 Cb -0.02 -2.07 -0.08 0.00 0.00 0.00 0.00 36.38 34.21 1n3t s VAL 131 CO 0.04 0.43 1.08 -0.63 0.00 0.00 0.00 175.10 176.02 1n3t s ILE 132 N 1.31 3.57 0.47 2.22 1.01 -1.26 -2.05 121.20 126.46 1n3t s ILE 132 Ca 0.03 1.09 -0.24 0.00 0.00 0.00 0.00 60.65 61.53 1n3t s ILE 132 Cb -0.14 -3.51 -0.07 0.00 0.01 0.00 0.00 42.46 38.75 1n3t s ILE 132 CO -0.10 -0.10 1.31 -0.83 0.00 0.00 0.00 174.94 175.22 1n3t s GLY 133 N -1.70 2.88 0.09 6.18 0.00 -1.09 -4.93 107.32 108.75 1n3t s GLY 133 Ca 0.64 1.23 -0.29 0.00 0.00 0.00 0.00 44.72 46.31 1n3t s GLY 133 CO 0.26 1.77 1.66 1.41 0.00 0.00 0.00 173.10 178.20 1n3t h LEU 134 N 2.09 -0.53 0.00 0.66 3.38 -1.93 -2.34 115.31 116.64 1n3t h LEU 134 Ca -0.50 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.50 1n3t h LEU 134 Cb 1.27 0.16 0.00 0.00 0.09 0.00 0.00 40.66 42.17 1n3t h LEU 134 CO 0.60 -0.34 0.04 -1.54 0.09 0.00 0.00 178.44 177.30 1n3t n SER 135 N -5.34 0.00 0.10 -0.43 3.41 -1.26 -1.23 113.62 108.86 1n3t n SER 135 Ca -0.10 0.29 -0.19 0.00 -0.26 0.00 0.00 58.87 58.61 1n3t n SER 135 Cb 0.25 -0.29 -0.11 0.00 -0.26 0.00 0.00 64.21 63.79 1n3t n SER 135 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1n3t h LYS 136 N 0.00 0.47 0.00 4.33 1.79 -1.79 -2.64 116.57 118.73 1n3t h LYS 136 Ca 0.00 -0.65 -0.02 0.00 -2.18 0.00 0.00 60.65 57.80 1n3t h LYS 136 Cb 0.09 0.22 -0.00 0.00 -1.58 0.00 0.00 32.23 30.95 1n3t h LYS 136 CO 0.00 1.28 -0.10 0.82 -1.08 0.00 0.00 179.45 180.36 1n3t h ILE 137 N 0.20 0.63 0.10 1.86 2.04 -1.29 -1.68 117.51 119.37 1n3t h ILE 137 Ca -0.15 -0.43 -0.21 0.00 1.00 0.00 0.00 64.86 65.06 1n3t h ILE 137 Cb 1.87 1.27 0.02 0.00 -0.74 0.00 0.00 36.82 39.25 1n3t h ILE 137 CO 0.21 0.10 -0.89 0.78 0.00 0.00 0.00 178.15 178.35 1n3t h ASN 138 N 0.00 0.62 -0.22 1.72 2.35 -1.63 -3.00 115.58 115.42 1n3t h ASN 138 Ca -0.00 -0.86 -0.01 0.00 -0.55 0.00 0.00 56.30 54.89 1n3t h ASN 138 Cb 0.26 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.43 1n3t h ASN 138 CO 0.01 1.41 0.12 0.03 -1.65 0.00 0.00 177.43 177.35 1n3t h ARG 139 N -0.10 0.30 0.41 0.81 2.47 -1.02 -2.12 114.38 115.15 1n3t h ARG 139 Ca -0.14 -0.04 -0.02 0.00 -1.26 0.00 0.00 59.98 58.53 1n3t h ARG 139 Cb 1.64 -0.06 -0.00 0.00 -1.65 0.00 0.00 29.97 29.90 1n3t h ARG 139 CO 0.17 0.29 -0.23 0.82 0.56 0.00 0.00 179.97 181.58 1n3t h ILE 140 N 0.24 0.52 -0.30 2.04 2.04 -1.46 0.28 117.51 120.86 1n3t h ILE 140 Ca 0.08 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.00 1n3t h ILE 140 Cb 0.08 0.52 -0.08 0.00 -0.74 0.00 0.00 36.82 36.60 1n3t h ILE 140 CO -0.01 0.00 -0.40 0.58 0.00 0.00 0.00 178.15 178.32 1n3t h VAL 141 N -0.61 0.16 -0.09 1.67 2.07 -1.46 -0.60 116.25 117.39 1n3t h VAL 141 Ca -0.05 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.44 1n3t h VAL 141 Cb 0.49 0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 1n3t h VAL 141 CO 0.06 0.00 -0.09 1.56 0.02 0.00 0.00 177.57 179.13 1n3t h GLN 142 N -0.37 0.13 0.66 1.57 1.08 -1.25 -1.51 115.11 115.42 1n3t h GLN 142 Ca 0.12 -0.02 -0.03 0.00 -1.45 0.00 0.00 58.65 57.27 1n3t h GLN 142 Cb 0.59 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 28.00 1n3t h GLN 142 CO -0.50 0.23 -0.36 0.35 -0.95 0.00 0.00 178.83 177.61 1n3t h PHE 143 N 0.13 -0.93 0.00 2.96 3.57 0.12 -0.95 116.94 121.83 1n3t h PHE 143 Ca 0.03 -0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.49 1n3t h PHE 143 Cb 0.24 0.32 -0.00 0.00 2.79 0.00 0.00 35.95 39.30 1n3t h PHE 143 CO 0.00 -0.55 -0.11 0.74 -2.23 0.00 0.00 178.31 176.16 1n3t h PHE 144 N -0.94 0.00 -0.29 0.41 0.04 -1.42 -1.96 116.94 112.79 1n3t h PHE 144 Ca -0.09 0.00 -0.07 0.00 2.80 0.00 0.00 57.97 60.61 1n3t h PHE 144 Cb 0.73 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.87 1n3t h PHE 144 CO 0.01 0.11 -0.12 0.00 -0.60 0.00 0.00 178.31 177.71 1n3t h ALA 145 N 1.89 1.26 -0.11 2.45 0.00 -0.82 -3.28 119.26 120.66 1n3t h ALA 145 Ca -0.00 -0.26 -0.71 0.00 0.00 0.00 0.00 54.91 53.94 1n3t h ALA 145 Cb 0.28 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 1n3t h ALA 145 CO 0.01 0.49 3.18 1.04 0.00 0.00 0.00 179.25 183.97 1n3t n GLN 146 N -4.21 3.19 -3.48 0.00 1.13 -0.40 -4.18 117.38 109.42 1n3t n GLN 146 Ca 0.01 -2.62 -0.11 0.00 -1.94 0.00 0.00 57.00 52.33 1n3t n GLN 146 Cb 0.32 -3.12 -0.02 0.00 0.11 0.00 0.00 30.24 27.53 1n3t n GLN 146 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 1n3t s ARG 147 N 2.54 1.31 -0.20 -1.09 0.52 -1.17 -0.69 118.95 120.16 1n3t s ARG 147 Ca 0.52 -0.55 -0.29 0.00 -0.52 0.00 0.00 55.73 54.89 1n3t s ARG 147 Cb 0.15 0.58 -0.03 0.00 0.52 0.00 0.00 34.95 36.17 1n3t s ARG 147 CO -0.07 -0.57 1.54 -2.14 0.02 0.00 0.00 175.30 174.07 1n3t s PRO 148 N -3.77 3.91 0.44 3.54 0.02 -1.26 -3.87 135.00 134.01 1n3t s PRO 148 Ca 0.02 1.68 0.06 0.00 0.02 0.00 0.00 61.00 62.78 1n3t s PRO 148 Cb -0.01 -3.98 -0.04 0.00 0.02 0.00 0.00 34.50 30.49 1n3t s PRO 148 CO -0.11 -1.14 0.14 -0.65 -0.33 0.00 0.00 177.00 174.91 1n3t s GLN 149 N 4.39 2.16 -0.21 5.54 -1.52 0.19 -4.64 119.66 125.58 1n3t s GLN 149 Ca 0.68 -2.01 -0.04 0.00 -1.95 0.00 0.00 55.36 52.04 1n3t s GLN 149 Cb -0.25 -1.85 0.07 0.00 -0.22 0.00 0.00 33.01 30.77 1n3t s GLN 149 CO 0.27 -0.19 0.08 0.08 -0.25 0.00 0.00 175.29 175.27 1n3t s VAL 150 N -2.69 0.22 0.22 1.09 1.01 -1.26 -1.33 120.40 117.66 1n3t s VAL 150 Ca 0.33 -0.51 -0.17 0.00 0.00 0.00 0.00 61.98 61.63 1n3t s VAL 150 Cb 0.04 -0.90 0.22 0.00 0.00 0.00 0.00 36.38 35.74 1n3t s VAL 150 CO 0.18 -0.36 1.48 1.67 0.00 0.00 0.00 175.10 178.07 1n3t n GLN 151 N 5.16 -0.23 -0.28 2.72 7.27 -1.26 0.22 117.38 130.97 1n3t n GLN 151 Ca -0.07 1.47 0.10 0.00 0.07 0.00 0.00 57.00 58.56 1n3t n GLN 151 Cb 0.47 -2.18 0.25 0.00 2.41 0.00 0.00 30.24 31.19 1n3t n GLN 151 CO 0.00 0.00 0.00 0.93 0.07 0.00 0.00 177.06 178.06 1n3t h GLU 152 N 0.00 0.37 -0.01 3.69 3.07 -1.98 -2.37 114.58 117.35 1n3t h GLU 152 Ca 0.33 -0.02 -0.01 0.00 -0.50 0.00 0.00 59.36 59.15 1n3t h GLU 152 Cb 0.56 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 28.39 1n3t h GLU 152 CO -0.95 0.25 -0.03 -0.09 -1.40 0.00 0.00 179.01 176.79 1n3t h ARG 153 N 0.38 0.05 -0.17 2.33 2.43 -0.67 -3.21 114.38 115.53 1n3t h ARG 153 Ca 0.49 -0.03 0.05 0.00 -0.81 0.00 0.00 59.98 59.68 1n3t h ARG 153 Cb 0.88 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.42 1n3t h ARG 153 CO -0.50 0.63 0.39 1.25 -1.51 0.00 0.00 179.97 180.23 1n3t h LEU 154 N -0.53 0.00 0.06 3.80 5.85 -0.52 0.23 115.31 124.19 1n3t h LEU 154 Ca -0.00 0.00 -0.13 0.00 0.84 0.00 0.00 57.88 58.59 1n3t h LEU 154 Cb 0.63 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.68 1n3t h LEU 154 CO 0.01 0.00 -0.54 0.74 -0.34 0.00 0.00 178.44 178.31 1n3t h THR 155 N 0.00 1.54 -0.24 1.05 2.02 -1.48 -3.06 112.91 112.74 1n3t h THR 155 Ca 0.08 -2.28 0.03 0.00 0.77 0.00 0.00 66.41 65.01 1n3t h THR 155 Cb 0.85 2.99 -0.03 0.00 -1.74 0.00 0.00 68.15 70.23 1n3t h THR 155 CO -0.00 0.64 0.07 1.56 0.37 0.00 0.00 175.52 178.16 1n3t h GLN 156 N -0.41 0.17 -0.89 6.66 1.08 -0.61 -2.22 115.11 118.90 1n3t h GLN 156 Ca -0.08 -0.01 -0.01 0.00 -1.45 0.00 0.00 58.65 57.09 1n3t h GLN 156 Cb 1.35 -0.04 -0.04 0.00 -0.05 0.00 0.00 27.48 28.70 1n3t h GLN 156 CO 0.10 0.11 0.51 1.96 -0.95 0.00 0.00 178.83 180.57 1n3t h GLN 157 N 0.18 1.22 -0.01 1.46 4.20 -1.28 -2.16 115.11 118.72 1n3t h GLN 157 Ca 0.11 -0.13 -0.09 0.00 0.06 0.00 0.00 58.65 58.61 1n3t h GLN 157 Cb 0.09 -0.25 -0.01 0.00 0.30 0.00 0.00 27.48 27.61 1n3t h GLN 157 CO -0.12 0.87 -0.40 0.82 -0.67 0.00 0.00 178.83 179.33 1n3t h ILE 158 N 1.23 1.29 0.42 2.54 2.04 -1.37 -2.45 117.51 121.21 1n3t h ILE 158 Ca 0.32 -1.38 -0.02 0.00 1.00 0.00 0.00 64.86 64.78 1n3t h ILE 158 Cb -0.01 1.73 0.00 0.00 -0.74 0.00 0.00 36.82 37.80 1n3t h ILE 158 CO -0.06 0.40 -0.20 0.25 0.00 0.00 0.00 178.15 178.54 1n3t h LEU 159 N 0.02 -0.48 -0.70 1.44 5.85 -0.79 -2.68 115.31 117.97 1n3t h LEU 159 Ca -0.00 0.02 0.11 0.00 0.84 0.00 0.00 57.88 58.84 1n3t h LEU 159 Cb 0.71 0.12 -0.08 0.00 0.37 0.00 0.00 40.66 41.79 1n3t h LEU 159 CO 0.05 -0.25 0.31 0.40 -0.34 0.00 0.00 178.44 178.61 1n3t h ILE 160 N -0.75 0.77 -0.12 4.05 2.04 -1.55 0.92 117.51 122.87 1n3t h ILE 160 Ca -0.06 -0.17 0.05 0.00 1.00 0.00 0.00 64.86 65.67 1n3t h ILE 160 Cb 0.43 0.22 -0.06 0.00 -0.74 0.00 0.00 36.82 36.67 1n3t h ILE 160 CO 0.09 0.09 -0.24 0.00 0.00 0.00 0.00 178.15 178.09 1n3t h ALA 161 N 1.46 -0.23 -0.29 1.87 0.00 -1.52 0.16 119.26 120.72 1n3t h ALA 161 Ca 0.36 0.04 -0.11 0.00 0.00 0.00 0.00 54.91 55.20 1n3t h ALA 161 Cb 0.45 0.47 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 1n3t h ALA 161 CO -0.32 -0.71 -0.27 -0.07 0.00 0.00 0.00 179.25 177.88 1n3t h LEU 162 N -0.31 0.60 0.17 0.00 3.38 -0.99 -2.44 115.31 115.71 1n3t h LEU 162 Ca 0.10 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1n3t h LEU 162 Cb 0.46 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 1n3t h LEU 162 CO -0.30 0.85 -0.17 1.56 0.09 0.00 0.00 178.44 180.46 1n3t h GLN 163 N 0.51 -0.36 -0.25 1.13 4.20 -0.07 -1.49 115.11 118.78 1n3t h GLN 163 Ca 0.07 0.02 0.04 0.00 0.06 0.00 0.00 58.65 58.85 1n3t h GLN 163 Cb 0.73 0.08 -0.07 0.00 0.30 0.00 0.00 27.48 28.52 1n3t h GLN 163 CO 0.06 -0.24 -0.52 1.15 -0.67 0.00 0.00 178.83 178.60 1n3t h THR 164 N -0.37 0.03 -0.89 -0.54 2.02 -0.49 0.72 112.91 113.38 1n3t h THR 164 Ca 0.00 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.19 1n3t h THR 164 Cb 0.35 0.03 -0.04 0.00 -1.74 0.00 0.00 68.15 66.75 1n3t h THR 164 CO -0.04 0.00 0.58 -0.07 0.37 0.00 0.00 175.52 176.36 1n3t h LEU 165 N -0.49 1.03 -0.20 2.58 3.38 -1.40 -2.72 115.31 117.49 1n3t h LEU 165 Ca 0.06 -0.03 -0.07 0.00 0.09 0.00 0.00 57.88 57.93 1n3t h LEU 165 Cb 0.64 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 1n3t h LEU 165 CO -0.50 0.76 -0.34 -0.07 0.09 0.00 0.00 178.44 178.38 1n3t h LEU 166 N 1.21 0.00 -2.25 1.67 3.38 -0.81 -3.48 115.31 115.04 1n3t h LEU 166 Ca 0.33 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 58.13 1n3t h LEU 166 Cb -0.13 0.00 0.10 0.00 0.09 0.00 0.00 40.66 40.73 1n3t h LEU 166 CO -0.07 0.34 -0.46 0.61 0.09 0.00 0.00 178.44 178.96 1n3t n GLY 167 N 1.01 -0.13 3.52 0.83 0.00 0.25 -4.73 105.19 105.93 1n3t n GLY 167 Ca 0.02 0.03 -0.10 0.00 0.00 0.00 0.00 46.02 45.97 1n3t n GLY 167 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1n3t s THR 168 N -3.21 0.00 -0.60 2.61 2.01 -1.06 -4.84 115.64 110.55 1n3t s THR 168 Ca 0.13 0.00 0.22 0.00 0.31 0.00 0.00 61.69 62.35 1n3t s THR 168 Cb -0.02 -1.00 -0.25 0.00 0.01 0.00 0.00 72.50 71.24 1n3t s THR 168 CO 0.41 0.00 0.77 0.59 -0.69 0.00 0.00 174.62 175.70 1n3t n ASN 169 N 0.11 0.59 -4.58 3.53 3.02 -1.26 -4.42 115.26 112.25 1n3t n ASN 169 Ca -0.10 -0.53 -0.35 0.00 -0.03 0.00 0.00 54.58 53.57 1n3t n ASN 169 Cb 0.60 1.33 -0.03 0.00 -0.61 0.00 0.00 39.78 41.07 1n3t n ASN 169 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1n3t s ASN 170 N -3.67 5.89 -0.06 6.41 0.01 -1.26 0.05 114.94 122.32 1n3t s ASN 170 Ca 0.02 -2.02 -0.11 0.00 -0.71 0.00 0.00 52.86 50.05 1n3t s ASN 170 Cb 0.15 -2.58 0.02 0.00 0.41 0.00 0.00 41.25 39.25 1n3t s ASN 170 CO 0.87 -2.17 0.26 -0.69 -1.51 0.00 0.00 177.10 173.87 1n3t s VAL 171 N 7.76 0.03 -0.01 1.60 1.01 -1.23 -2.08 120.40 127.48 1n3t s VAL 171 Ca 0.61 -0.25 0.02 0.00 0.00 0.00 0.00 61.98 62.36 1n3t s VAL 171 Cb 0.01 -0.46 0.00 0.00 0.00 0.00 0.00 36.38 35.94 1n3t s VAL 171 CO 0.10 -0.14 -0.05 0.00 0.00 0.00 0.00 175.10 175.02 1n3t s ALA 172 N -0.52 0.49 -0.02 5.51 0.00 0.19 -0.96 121.76 126.46 1n3t s ALA 172 Ca -0.06 -0.18 0.04 0.00 0.00 0.00 0.00 51.96 51.76 1n3t s ALA 172 Cb -0.04 -0.18 -0.01 0.00 0.00 0.00 0.00 23.12 22.89 1n3t s ALA 172 CO 0.02 0.08 -0.15 0.08 0.00 0.00 0.00 175.76 175.79 1n3t s VAL 173 N 0.11 1.19 -0.09 0.00 1.01 -0.56 -1.37 120.40 120.70 1n3t s VAL 173 Ca -0.01 -0.63 -0.03 0.00 0.00 0.00 0.00 61.98 61.31 1n3t s VAL 173 Cb -0.05 -1.00 0.05 0.00 0.00 0.00 0.00 36.38 35.37 1n3t s VAL 173 CO -0.00 0.34 0.17 -0.55 0.00 0.00 0.00 175.10 175.06 1n3t s SER 174 N -0.22 0.43 -0.07 3.32 0.15 0.19 -0.66 113.70 116.84 1n3t s SER 174 Ca 0.03 0.36 0.05 0.00 0.70 0.00 0.00 55.95 57.09 1n3t s SER 174 Cb -0.07 0.30 -0.01 0.00 -1.71 0.00 0.00 66.02 64.53 1n3t s SER 174 CO 0.00 -0.21 -0.22 -0.63 1.20 0.00 0.00 173.24 173.37 1n3t s ILE 175 N 1.96 2.30 -0.14 6.45 1.01 0.48 0.29 121.20 133.55 1n3t s ILE 175 Ca -0.01 -0.97 0.02 0.00 0.00 0.00 0.00 60.65 59.69 1n3t s ILE 175 Cb -0.12 -1.87 0.01 0.00 0.01 0.00 0.00 42.46 40.49 1n3t s ILE 175 CO -0.06 0.56 -0.21 -0.62 0.00 0.00 0.00 174.94 174.62 1n3t s ASP 176 N -0.07 3.25 0.13 3.58 2.15 -0.57 -0.90 116.67 124.24 1n3t s ASP 176 Ca -0.06 -0.56 -0.11 0.00 0.43 0.00 0.00 52.55 52.25 1n3t s ASP 176 Cb -0.14 -1.47 0.01 0.00 -0.30 0.00 0.00 42.92 41.01 1n3t s ASP 176 CO 0.04 0.09 0.29 0.00 -0.17 0.00 0.00 175.17 175.43 1n3t s ALA 177 N 0.74 -0.34 -0.14 3.66 0.00 0.86 -0.91 121.76 125.63 1n3t s ALA 177 Ca -0.08 -0.57 0.01 0.00 0.00 0.00 0.00 51.96 51.32 1n3t s ALA 177 Cb -0.16 0.69 0.00 0.00 0.00 0.00 0.00 23.12 23.66 1n3t s ALA 177 CO 0.00 -0.61 -0.18 0.08 0.00 0.00 0.00 175.76 175.05 1n3t s VAL 178 N -3.89 2.42 -0.25 0.00 1.01 0.22 0.02 120.40 119.93 1n3t s VAL 178 Ca 0.09 -0.86 -0.13 0.00 0.00 0.00 0.00 61.98 61.08 1n3t s VAL 178 Cb 0.03 -2.00 -0.04 0.00 0.00 0.00 0.00 36.38 34.37 1n3t s VAL 178 CO -0.06 0.53 0.29 -1.00 0.00 0.00 0.00 175.10 174.86 1n3t s HIS 179 N 0.77 3.29 -0.51 5.22 3.76 -1.26 -1.68 115.29 124.87 1n3t s HIS 179 Ca -0.07 0.35 0.25 0.00 -0.15 0.00 0.00 55.06 55.45 1n3t s HIS 179 Cb -0.16 -2.45 0.92 0.00 1.11 0.00 0.00 32.58 32.01 1n3t s HIS 179 CO 0.00 -0.10 1.76 1.88 -0.85 0.00 0.00 174.74 177.43 1n3t h TYR 180 N 7.88 0.00 0.00 1.40 -1.99 -1.75 -1.05 116.97 121.46 1n3t h TYR 180 Ca -0.35 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.38 1n3t h TYR 180 Cb 1.17 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.90 1n3t h TYR 180 CO 0.72 0.00 0.00 -1.13 -0.00 0.00 0.00 178.16 177.75 1n3t n SER 181 N -2.38 0.00 -0.03 3.88 3.41 -1.26 -0.56 113.62 116.68 1n3t n SER 181 Ca 0.03 -0.15 -0.03 0.00 -0.26 0.00 0.00 58.87 58.47 1n3t n SER 181 Cb 0.32 -0.24 -0.05 0.00 -0.26 0.00 0.00 64.21 63.99 1n3t n SER 181 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1n3t n VAL 182 N -1.24 0.39 -0.03 -3.33 0.31 -0.67 -4.46 118.33 109.31 1n3t n VAL 182 Ca 0.12 -0.25 -0.21 0.00 -0.01 0.00 0.00 64.34 63.98 1n3t n VAL 182 Cb 0.16 -0.78 -0.13 0.00 -0.91 0.00 0.00 33.84 32.18 1n3t n VAL 182 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 1n3t n LYS 183 N -2.20 0.71 -0.48 5.55 4.81 -0.49 -1.74 118.16 124.32 1n3t n LYS 183 Ca -0.09 0.31 0.08 0.00 -0.87 0.00 0.00 58.31 57.74 1n3t n LYS 183 Cb 0.67 -1.69 0.27 0.00 0.02 0.00 0.00 35.03 34.30 1n3t n LYS 183 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1n3t n ALA 184 N -3.15 3.03 -3.64 3.14 0.00 0.27 -3.71 120.51 116.45 1n3t n ALA 184 Ca -0.34 -2.11 -0.09 0.00 0.00 0.00 0.00 53.44 50.90 1n3t n ALA 184 Cb 0.97 -0.75 -0.07 0.00 0.00 0.00 0.00 19.45 19.60 1n3t n ALA 184 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1n3t s ARG 185 N -2.59 0.58 2.38 0.00 3.52 -1.23 -4.97 118.95 116.64 1n3t s ARG 185 Ca 0.42 0.79 0.00 0.00 -0.13 0.00 0.00 55.73 56.81 1n3t s ARG 185 Cb 0.33 0.23 0.00 0.00 -1.56 0.00 0.00 34.95 33.95 1n3t s ARG 185 CO 0.11 -0.09 0.00 0.41 -0.81 0.00 0.00 175.30 174.93 1n3t n GLY 186 N 2.90 1.25 0.23 8.12 0.00 -1.26 -3.77 105.19 112.66 1n3t n GLY 186 Ca -0.15 -0.77 0.12 0.00 0.00 0.00 0.00 46.02 45.22 1n3t n GLY 186 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1n3t h ILE 187 N 0.00 0.37 -5.92 -0.61 2.04 -1.88 -3.48 117.51 108.05 1n3t h ILE 187 Ca 0.00 -1.01 -0.20 0.00 1.00 0.00 0.00 64.86 64.65 1n3t h ILE 187 Cb 0.00 1.76 0.01 0.00 -0.74 0.00 0.00 36.82 37.85 1n3t h ILE 187 CO 0.00 0.16 -0.75 0.54 0.00 0.00 0.00 178.15 178.10 1n3t n ARG 188 N -3.27 -1.97 -3.63 2.37 1.74 -1.16 -4.92 116.66 105.80 1n3t n ARG 188 Ca 0.01 1.63 -0.39 0.00 -0.77 0.00 0.00 57.85 58.32 1n3t n ARG 188 Cb 0.42 -4.03 -0.10 0.00 -1.02 0.00 0.00 32.46 27.73 1n3t n ARG 188 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1n3t s ASP 189 N -2.33 5.56 0.15 0.55 -1.08 -0.71 -4.98 116.67 113.83 1n3t s ASP 189 Ca 0.23 -1.69 -0.14 0.00 -0.52 0.00 0.00 52.55 50.43 1n3t s ASP 189 Cb -0.04 -1.96 0.02 0.00 -1.46 0.00 0.00 42.92 39.48 1n3t s ASP 189 CO 0.82 -0.57 1.68 0.00 0.52 0.00 0.00 175.17 177.63 1n3t h ALA 190 N 8.34 0.61 0.04 3.66 0.00 -1.87 -3.37 119.26 126.67 1n3t h ALA 190 Ca -0.21 -0.16 -0.30 0.00 0.00 0.00 0.00 54.91 54.24 1n3t h ALA 190 Cb 1.07 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.64 1n3t h ALA 190 CO 0.77 0.24 -1.67 1.79 0.00 0.00 0.00 179.25 180.37 1n3t h THR 191 N 0.62 0.92 -2.77 0.00 1.35 -1.96 -3.49 112.91 107.58 1n3t h THR 191 Ca 0.15 -2.71 -0.41 0.00 -0.55 0.00 0.00 66.41 62.89 1n3t h THR 191 Cb 0.23 2.51 0.22 0.00 -1.73 0.00 0.00 68.15 69.38 1n3t h THR 191 CO -0.01 0.64 -0.38 -1.54 -0.25 0.00 0.00 175.52 173.98 1n3t n SER 192 N -3.20 -2.47 -3.65 5.36 3.41 -1.26 -5.08 113.62 106.73 1n3t n SER 192 Ca -0.18 -0.31 -0.06 0.00 -0.26 0.00 0.00 58.87 58.07 1n3t n SER 192 Cb 1.04 -1.09 -0.02 0.00 -0.26 0.00 0.00 64.21 63.88 1n3t n SER 192 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1n3t s ALA 193 N -2.28 -1.71 -0.05 7.33 0.00 -1.26 -4.88 121.76 118.91 1n3t s ALA 193 Ca 0.63 0.46 0.05 0.00 0.00 0.00 0.00 51.96 53.10 1n3t s ALA 193 Cb -0.18 0.57 -0.01 0.00 0.00 0.00 0.00 23.12 23.50 1n3t s ALA 193 CO 0.62 -0.90 -0.20 0.99 0.00 0.00 0.00 175.76 176.27 1n3t s THR 194 N -3.25 1.63 -0.14 0.00 2.01 0.10 -4.95 115.64 111.05 1n3t s THR 194 Ca 0.09 -0.83 0.02 0.00 0.31 0.00 0.00 61.69 61.28 1n3t s THR 194 Cb -0.01 -1.39 0.01 0.00 0.01 0.00 0.00 72.50 71.11 1n3t s THR 194 CO -0.02 0.46 -0.21 -0.89 -0.69 0.00 0.00 174.62 173.27 1n3t s THR 195 N -0.04 2.15 -0.01 -0.82 2.01 -1.26 -0.10 115.64 117.57 1n3t s THR 195 Ca -0.03 -0.95 0.04 0.00 0.31 0.00 0.00 61.69 61.06 1n3t s THR 195 Cb -0.12 -1.86 -0.01 0.00 0.01 0.00 0.00 72.50 70.52 1n3t s THR 195 CO 0.03 0.55 -0.13 0.42 -0.69 0.00 0.00 174.62 174.79 1n3t s THR 196 N 0.80 1.06 0.03 -0.82 -4.23 -0.08 -5.00 115.64 107.39 1n3t s THR 196 Ca -0.07 -0.61 0.01 0.00 -1.18 0.00 0.00 61.69 59.85 1n3t s THR 196 Cb -0.16 -0.89 -0.02 0.00 1.34 0.00 0.00 72.50 72.78 1n3t s THR 196 CO -0.01 0.27 -0.05 0.42 -0.54 0.00 0.00 174.62 174.71 1n3t s THR 197 N -0.36 0.34 -0.12 3.99 -4.23 -1.26 -0.39 115.64 113.60 1n3t s THR 197 Ca 0.05 -0.84 -0.01 0.00 -1.18 0.00 0.00 61.69 59.71 1n3t s THR 197 Cb -0.05 -0.41 0.03 0.00 1.34 0.00 0.00 72.50 73.40 1n3t s THR 197 CO -0.00 -0.34 -0.06 -0.44 -0.54 0.00 0.00 174.62 173.24 1n3t s SER 198 N -1.25 2.29 -0.13 3.99 0.01 0.16 -5.00 113.70 113.78 1n3t s SER 198 Ca -0.10 -0.37 -0.03 0.00 1.31 0.00 0.00 55.95 56.76 1n3t s SER 198 Cb -0.08 -0.83 -0.03 0.00 0.21 0.00 0.00 66.02 65.29 1n3t s SER 198 CO -0.00 -0.14 -0.04 -0.76 0.41 0.00 0.00 173.24 172.70 1n3t s LEU 199 N 1.71 3.24 0.28 2.44 1.43 -1.26 -1.50 118.68 125.02 1n3t s LEU 199 Ca 0.04 -0.10 0.05 0.00 -1.03 0.00 0.00 54.13 53.09 1n3t s LEU 199 Cb -0.13 -1.76 -0.06 0.00 0.03 0.00 0.00 46.19 44.27 1n3t s LEU 199 CO -0.08 0.22 -0.01 -0.83 0.23 0.00 0.00 176.35 175.88 1n3t s GLY 200 N 0.06 1.85 0.00 -3.19 0.00 -0.13 -4.58 107.32 101.32 1n3t s GLY 200 Ca -0.00 -1.92 0.00 0.00 0.00 0.00 0.00 44.72 42.79 1n3t s GLY 200 CO 0.03 -1.80 0.00 0.61 0.00 0.00 0.00 173.10 171.94 1n3t n GLY 201 N -0.58 2.20 0.32 0.20 0.00 0.11 -1.27 105.19 106.17 1n3t n GLY 201 Ca -0.04 -0.40 0.16 0.00 0.00 0.00 0.00 46.02 45.74 1n3t n GLY 201 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1n3t h LEU 202 N 0.00 0.00 0.00 0.99 3.38 -1.93 -1.71 115.31 116.04 1n3t h LEU 202 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1n3t h LEU 202 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1n3t h LEU 202 CO 0.00 0.00 0.00 0.49 0.09 0.00 0.00 178.44 179.02 1n3t n PHE 203 N -3.88 0.00 0.00 1.13 3.72 -0.40 0.07 117.46 118.10 1n3t n PHE 203 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1n3t n PHE 203 Cb 0.26 -0.28 0.00 0.00 -0.94 0.00 0.00 39.48 38.52 1n3t n PHE 203 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 1n3t n LYS 204 N -1.28 1.46 0.03 -1.08 4.81 -0.67 -4.41 118.16 117.03 1n3t n LYS 204 Ca 0.03 0.00 -0.21 0.00 -0.87 0.00 0.00 58.31 57.26 1n3t n LYS 204 Cb 0.05 -0.93 -0.14 0.00 0.02 0.00 0.00 35.03 34.03 1n3t n LYS 204 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1n3t h SER 205 N 0.00 0.44 -3.36 3.14 4.64 -1.27 -3.44 113.55 113.71 1n3t h SER 205 Ca 0.00 -0.89 -0.58 0.00 -0.47 0.00 0.00 61.79 59.86 1n3t h SER 205 Cb 0.85 -0.14 -0.09 0.00 -0.31 0.00 0.00 62.40 62.71 1n3t h SER 205 CO 0.00 1.58 0.79 -0.55 -0.87 0.00 0.00 176.83 177.78 1n3t s SER 206 N -7.07 6.45 0.37 4.97 0.15 0.11 -4.91 113.70 113.78 1n3t s SER 206 Ca -0.17 0.03 0.14 0.00 0.70 0.00 0.00 55.95 56.65 1n3t s SER 206 Cb 0.04 -2.50 0.99 0.00 -1.71 0.00 0.00 66.02 62.84 1n3t s SER 206 CO 0.80 -1.30 1.78 -0.61 1.20 0.00 0.00 173.24 175.10 1n3t h GLN 207 N 9.35 0.49 0.22 5.44 5.75 -1.86 0.10 115.11 134.60 1n3t h GLN 207 Ca -0.25 -0.03 -0.01 0.00 -0.15 0.00 0.00 58.65 58.21 1n3t h GLN 207 Cb 1.06 -0.11 0.00 0.00 1.07 0.00 0.00 27.48 29.51 1n3t h GLN 207 CO 1.12 0.32 -0.11 -0.97 -2.65 0.00 0.00 178.83 176.55 1n3t h ASN 208 N 0.50 -0.25 -0.35 -0.69 -1.24 -1.92 -2.81 115.58 108.83 1n3t h ASN 208 Ca 0.58 -0.28 -0.03 0.00 0.71 0.00 0.00 56.30 57.29 1n3t h ASN 208 Cb 1.29 0.06 -0.02 0.00 0.73 0.00 0.00 38.32 40.39 1n3t h ASN 208 CO -0.32 0.21 0.13 0.74 -1.29 0.00 0.00 177.43 176.90 1n3t h THR 209 N -0.79 1.17 0.18 -3.57 2.02 -1.67 -1.72 112.91 108.53 1n3t h THR 209 Ca -0.03 -0.57 -0.01 0.00 0.77 0.00 0.00 66.41 66.58 1n3t h THR 209 Cb 0.51 0.72 -0.00 0.00 -1.74 0.00 0.00 68.15 67.64 1n3t h THR 209 CO 0.05 0.21 -0.12 -0.09 0.37 0.00 0.00 175.52 175.94 1n3t h ARG 210 N 0.58 -0.27 -0.99 6.66 2.43 -0.86 -2.75 114.38 119.18 1n3t h ARG 210 Ca 0.14 0.02 0.11 0.00 -0.81 0.00 0.00 59.98 59.44 1n3t h ARG 210 Cb 0.17 0.06 -0.08 0.00 -0.42 0.00 0.00 29.97 29.70 1n3t h ARG 210 CO -0.01 -0.18 0.63 0.45 -1.51 0.00 0.00 179.97 179.35 1n3t h HIS 211 N -0.28 1.12 -0.64 2.20 3.86 -1.48 0.11 115.15 120.04 1n3t h HIS 211 Ca -0.02 0.03 0.19 0.00 -1.16 0.00 0.00 60.37 59.40 1n3t h HIS 211 Cb 0.23 -0.36 -0.03 0.00 1.06 0.00 0.00 27.41 28.32 1n3t h HIS 211 CO 0.04 0.47 0.49 0.93 0.86 0.00 0.00 177.93 180.73 1n3t h GLU 212 N 1.00 0.00 0.00 2.45 5.08 -1.22 -0.95 114.58 120.94 1n3t h GLU 212 Ca 0.48 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.81 1n3t h GLU 212 Cb 0.44 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.69 1n3t h GLU 212 CO -0.24 0.00 -0.32 0.35 -1.00 0.00 0.00 179.01 177.81 1n3t h PHE 213 N 0.00 0.00 -0.88 4.33 3.57 -0.51 -3.31 116.94 120.14 1n3t h PHE 213 Ca 0.30 0.00 0.23 0.00 3.53 0.00 0.00 57.97 62.04 1n3t h PHE 213 Cb 1.28 0.00 -0.05 0.00 2.79 0.00 0.00 35.95 39.97 1n3t h PHE 213 CO 0.00 0.36 0.61 -0.07 -2.23 0.00 0.00 178.31 176.98 1n3t h LEU 214 N -1.00 0.18 -0.12 0.59 3.38 -0.99 -0.60 115.31 116.75 1n3t h LEU 214 Ca -0.05 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 1n3t h LEU 214 Cb 0.49 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.22 1n3t h LEU 214 CO -0.03 0.07 -0.04 -0.09 0.09 0.00 0.00 178.44 178.44 1n3t h ARG 215 N 0.18 0.24 -0.15 1.13 2.43 -1.34 -2.96 114.38 113.90 1n3t h ARG 215 Ca 0.44 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 59.52 1n3t h ARG 215 Cb 1.45 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.99 1n3t h ARG 215 CO -0.09 0.55 0.00 0.00 -1.51 0.00 0.00 179.97 178.92 1n3t n ALA 216 N -2.34 2.09 -2.93 2.80 0.00 -0.25 -4.77 120.51 115.11 1n3t n ALA 216 Ca -0.06 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.13 1n3t n ALA 216 Cb 0.26 -1.00 -0.03 0.00 0.00 0.00 0.00 19.45 18.68 1n3t n ALA 216 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1n3t s VAL 217 N -1.76 5.17 -0.22 0.00 1.01 -1.12 -4.83 120.40 118.65 1n3t s VAL 217 Ca 0.00 -0.82 -0.07 0.00 0.00 0.00 0.00 61.98 61.10 1n3t s VAL 217 Cb 0.00 -3.69 0.01 0.00 0.00 0.00 0.00 36.38 32.70 1n3t s VAL 217 CO 0.00 -0.15 0.25 -1.14 0.00 0.00 0.00 175.10 174.07 1n3t n ARG 218 N -0.70 -1.49 -4.31 2.72 0.00 -1.26 -5.05 116.66 106.56 1n3t n ARG 218 Ca -0.08 1.51 -0.17 0.00 -0.00 0.00 0.00 57.85 59.11 1n3t n ARG 218 Cb 0.55 -3.75 -0.10 0.00 0.00 0.00 0.00 32.46 29.16 1n3t n ARG 218 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.63 176.62 1n3t s HIS 219 N -1.66 1.58 -0.17 -0.14 3.76 -1.26 -5.15 115.29 112.26 1n3t s HIS 219 Ca 0.11 -0.61 0.01 0.00 -0.15 0.00 0.00 55.06 54.41 1n3t s HIS 219 Cb -0.03 -0.76 0.02 0.00 1.11 0.00 0.00 32.58 32.93 1n3t s HIS 219 CO 0.43 0.27 -0.17 -1.58 -0.85 0.00 0.00 174.74 172.84 1n3t s HIS 220 N -2.96 2.49 0.00 1.40 2.46 -1.26 -4.95 115.29 112.47 1n3t s HIS 220 Ca 0.20 -1.45 0.00 0.00 0.47 0.00 0.00 55.06 54.27 1n3t s HIS 220 Cb -0.00 -1.77 0.00 0.00 -0.13 0.00 0.00 32.58 30.68 1n3t s HIS 220 CO 0.05 -0.74 0.00 0.09 -2.47 0.00 0.00 174.74 171.66