#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 -5.13 113.62 113.65 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 -0.15 0.00 0.00 -0.75 0.00 0.00 64.21 63.31 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 -1.82 0.00 -4.18 2.46 4.77 -1.26 -4.95 117.00 112.02 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 -0.10 0.00 -2.33 0.00 0.00 43.42 40.99 1n3t n LEU 3 CO 0.00 0.00 -0.40 -0.94 -1.33 0.00 0.00 177.39 174.72 1n3t s SER 4 N 1.09 1.36 0.13 -1.43 1.04 -1.26 -5.05 113.70 109.58 1n3t s SER 4 Ca 0.00 -0.90 -0.18 0.00 0.48 0.00 0.00 55.95 55.34 1n3t s SER 4 Cb 0.00 0.04 -0.03 0.00 0.10 0.00 0.00 66.02 66.13 1n3t s SER 4 CO 0.00 -0.35 1.79 0.11 0.98 0.00 0.00 173.24 175.77 1n3t h LYS 5 N 3.26 0.35 -0.16 4.02 1.57 -2.02 -2.55 116.57 121.03 1n3t h LYS 5 Ca -0.36 -0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 58.34 1n3t h LYS 5 Cb 1.18 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 33.41 1n3t h LYS 5 CO 0.58 0.23 -0.11 0.93 -0.57 0.00 0.00 179.45 180.51 1n3t h GLU 6 N 0.36 0.36 -1.06 3.15 3.07 -1.98 -2.29 114.58 116.19 1n3t h GLU 6 Ca 0.10 -0.17 0.29 0.00 -0.50 0.00 0.00 59.36 59.08 1n3t h GLU 6 Cb -0.03 -0.00 -0.11 0.00 -0.84 0.00 0.00 28.75 27.77 1n3t h GLU 6 CO -0.03 0.70 0.66 0.00 -1.40 0.00 0.00 179.01 178.94 1n3t h ALA 7 N 0.65 2.16 0.52 3.43 0.00 -1.90 -0.47 119.26 123.65 1n3t h ALA 7 Ca 0.03 0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 1n3t h ALA 7 Cb 0.61 0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.46 1n3t h ALA 7 CO 0.03 -0.62 -0.25 0.00 0.00 0.00 0.00 179.25 178.40 1n3t h ALA 8 N 1.67 -0.77 -0.84 0.00 0.00 -1.22 -1.95 119.26 116.15 1n3t h ALA 8 Ca 0.64 -0.15 0.18 0.00 0.00 0.00 0.00 54.91 55.58 1n3t h ALA 8 Cb 1.57 0.27 -0.16 0.00 0.00 0.00 0.00 17.79 19.48 1n3t h ALA 8 CO -0.38 -0.72 -0.14 -0.07 0.00 0.00 0.00 179.25 177.95 1n3t h LEU 9 N -1.08 -0.65 0.18 0.00 3.38 -0.70 0.18 115.31 116.63 1n3t h LEU 9 Ca -0.07 0.24 -0.01 0.00 0.09 0.00 0.00 57.88 58.13 1n3t h LEU 9 Cb 0.54 0.48 0.00 0.00 0.09 0.00 0.00 40.66 41.77 1n3t h LEU 9 CO 0.12 -0.26 -0.09 0.58 0.09 0.00 0.00 178.44 178.88 1n3t h VAL 10 N 0.02 0.86 0.28 1.22 2.07 -1.18 0.25 116.25 119.77 1n3t h VAL 10 Ca 0.43 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.76 1n3t h VAL 10 Cb 0.71 0.98 -0.03 0.00 -1.52 0.00 0.00 31.29 31.43 1n3t h VAL 10 CO -0.83 0.05 -0.33 -0.74 0.02 0.00 0.00 177.57 175.74 1n3t h HIS 11 N -0.34 -0.89 -0.04 1.57 -0.00 -0.44 0.12 115.15 115.14 1n3t h HIS 11 Ca -0.03 0.01 0.04 0.00 -0.00 0.00 0.00 60.37 60.39 1n3t h HIS 11 Cb 0.26 0.35 -0.06 0.00 -0.00 0.00 0.00 27.41 27.97 1n3t h HIS 11 CO -0.04 -0.46 -0.36 0.93 -0.00 0.00 0.00 177.93 178.00 1n3t h GLU 12 N -0.65 -0.48 -0.16 5.26 5.08 -0.63 0.77 114.58 123.77 1n3t h GLU 12 Ca -0.01 0.03 0.05 0.00 -1.00 0.00 0.00 59.36 58.43 1n3t h GLU 12 Cb 0.61 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.97 1n3t h GLU 12 CO -0.09 -0.32 0.24 0.00 -1.00 0.00 0.00 179.01 177.84 1n3t h ALA 13 N 0.18 1.67 0.20 3.43 0.00 -0.22 -0.17 119.26 124.36 1n3t h ALA 13 Ca 0.07 -0.01 -0.35 0.00 0.00 0.00 0.00 54.91 54.62 1n3t h ALA 13 Cb 0.60 0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.41 1n3t h ALA 13 CO -0.31 -0.32 -1.68 -0.07 0.00 0.00 0.00 179.25 176.87 1n3t h LEU 14 N 0.00 0.68 -0.64 0.00 3.38 0.98 -3.31 115.31 116.39 1n3t h LEU 14 Ca 0.08 -0.93 -0.13 0.00 0.09 0.00 0.00 57.88 56.98 1n3t h LEU 14 Cb 0.55 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 1n3t h LEU 14 CO -0.00 1.77 -0.38 0.58 0.09 0.00 0.00 178.44 180.50 1n3t h VAL 15 N 0.11 1.29 -0.46 1.22 2.07 0.12 -1.53 116.25 119.06 1n3t h VAL 15 Ca -0.32 -1.54 0.09 0.00 0.82 0.00 0.00 66.70 65.75 1n3t h VAL 15 Cb 2.11 1.49 -0.08 0.00 -1.52 0.00 0.00 31.29 33.29 1n3t h VAL 15 CO 0.20 0.49 -0.05 0.00 0.02 0.00 0.00 177.57 178.23 1n3t h ALA 16 N 1.05 0.38 0.00 1.67 0.00 -1.19 -0.31 119.26 120.86 1n3t h ALA 16 Ca 0.05 0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1n3t h ALA 16 Cb 0.89 0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1n3t h ALA 16 CO 0.08 -0.42 0.00 -2.13 0.00 0.00 0.00 179.25 176.78 1n3t n ARG 17 N -5.27 0.22 -2.54 0.00 3.00 -1.18 -4.92 116.66 105.96 1n3t n ARG 17 Ca 0.04 0.18 -0.06 0.00 -0.00 0.00 0.00 57.85 58.02 1n3t n ARG 17 Cb 0.25 -1.76 0.01 0.00 0.00 0.00 0.00 32.46 30.96 1n3t n ARG 17 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1n3t n GLY 18 N 1.32 0.43 0.75 5.14 0.00 -0.13 -4.93 105.19 107.78 1n3t n GLY 18 Ca 0.06 -0.52 0.08 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.33 2.72 -4.76 0.99 4.77 -0.63 -4.99 117.00 113.78 1n3t n LEU 19 Ca -0.02 -1.36 -0.32 0.00 -0.03 0.00 0.00 56.01 54.27 1n3t n LEU 19 Cb 0.53 -0.12 0.08 0.00 -2.33 0.00 0.00 43.42 41.57 1n3t n LEU 19 CO 0.13 0.57 0.73 -1.61 -1.33 0.00 0.00 177.39 175.88 1n3t s GLU 20 N -1.23 2.40 -0.04 3.23 0.41 -1.22 -4.81 118.70 117.45 1n3t s GLU 20 Ca 0.24 1.38 -0.30 0.00 -0.41 0.00 0.00 54.97 55.88 1n3t s GLU 20 Cb 0.15 -1.90 -0.04 0.00 -1.78 0.00 0.00 34.13 30.56 1n3t s GLU 20 CO 0.21 -1.56 1.25 0.99 -0.49 0.00 0.00 175.26 175.67 1n3t s THR 21 N -2.50 4.11 -0.87 3.63 2.01 -1.26 -4.85 115.64 115.91 1n3t s THR 21 Ca 0.66 1.45 -0.14 0.00 0.31 0.00 0.00 61.69 63.97 1n3t s THR 21 Cb -0.21 -3.93 -0.26 0.00 0.01 0.00 0.00 72.50 68.11 1n3t s THR 21 CO 0.48 -0.00 2.01 -2.65 -0.69 0.00 0.00 174.62 173.77 1n3t n PRO 22 N 5.24 0.00 -4.42 4.92 -0.02 -1.26 -4.89 135.00 134.57 1n3t n PRO 22 Ca 0.11 0.00 -0.24 0.00 -2.02 0.00 0.00 63.50 61.36 1n3t n PRO 22 Cb 0.45 -1.00 -0.11 0.00 -0.02 0.00 0.00 33.50 32.83 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 2.41 2.51 -0.04 2.45 1.02 -1.26 -5.15 118.68 120.63 1n3t s LEU 23 Ca 1.15 -0.95 0.01 0.00 0.02 0.00 0.00 54.13 54.36 1n3t s LEU 23 Cb -0.85 -1.02 -0.03 0.00 0.02 0.00 0.00 46.19 44.31 1n3t s LEU 23 CO 0.47 0.02 -0.03 -0.60 0.02 0.00 0.00 176.35 176.24 1n3t s ARG 24 N -3.16 2.79 -0.31 1.70 3.52 -1.26 -5.04 118.95 117.19 1n3t s ARG 24 Ca 0.24 -0.56 -0.37 0.00 -0.13 0.00 0.00 55.73 54.90 1n3t s ARG 24 Cb -0.05 -2.66 -0.13 0.00 -1.56 0.00 0.00 34.95 30.55 1n3t s ARG 24 CO 0.11 0.65 2.01 -2.30 -0.81 0.00 0.00 175.30 174.96 1n3t n PRO 25 N 1.81 1.15 -0.36 5.12 -0.02 -1.26 -4.77 135.00 136.67 1n3t n PRO 25 Ca -0.17 0.37 0.36 0.00 -2.02 0.00 0.00 63.50 62.05 1n3t n PRO 25 Cb 0.53 -2.30 0.64 0.00 -0.02 0.00 0.00 33.50 32.35 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 10.10 0.00 0.00 0.52 0.11 -2.04 -3.45 132.00 137.25 1n3t h PRO 26 Ca -0.35 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.76 1n3t h PRO 26 Cb 1.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.43 1n3t h PRO 26 CO 1.00 0.00 0.00 0.28 -0.21 0.00 0.00 178.00 179.07 1n3t n VAL 27 N -3.64 0.00 -3.21 3.15 0.31 -1.26 -4.67 118.33 109.01 1n3t n VAL 27 Ca 0.29 0.00 -0.29 0.00 -0.01 0.00 0.00 64.34 64.33 1n3t n VAL 27 Cb 1.55 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 34.45 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 3.48 -1.01 3.52 -3.43 -1.26 -5.02 115.29 111.57 1n3t s HIS 28 Ca 0.00 0.72 -0.15 0.00 -0.80 0.00 0.00 55.06 54.83 1n3t s HIS 28 Cb 0.00 -2.18 0.18 0.00 -1.43 0.00 0.00 32.58 29.16 1n3t s HIS 28 CO 0.00 0.09 1.13 -1.21 -2.00 0.00 0.00 174.74 172.76 1n3t s GLU 29 N -3.69 3.83 0.05 -0.38 2.02 -1.26 -4.99 118.70 114.27 1n3t s GLU 29 Ca 0.45 -2.35 -0.30 0.00 0.02 0.00 0.00 54.97 52.79 1n3t s GLU 29 Cb -0.11 -4.80 -0.09 0.00 0.10 0.00 0.00 34.13 29.24 1n3t s GLU 29 CO 0.31 -1.59 1.78 1.41 0.02 0.00 0.00 175.26 177.19 1n3t s MET 30 N 1.26 4.16 0.10 1.61 -2.45 -1.26 -4.87 119.30 117.86 1n3t s MET 30 Ca 0.32 2.45 -0.35 0.00 -1.25 0.00 0.00 55.69 56.86 1n3t s MET 30 Cb -0.06 -3.81 -0.18 0.00 1.25 0.00 0.00 34.83 32.03 1n3t s MET 30 CO -0.07 -0.84 0.96 -3.47 1.05 0.00 0.00 175.02 172.65 1n3t n ASP 31 N 6.37 0.03 -0.32 1.11 2.03 -1.26 -4.82 116.55 119.69 1n3t n ASP 31 Ca 0.18 1.15 -0.02 0.00 0.52 0.00 0.00 54.79 56.61 1n3t n ASP 31 Cb 0.40 -1.01 0.13 0.00 -0.72 0.00 0.00 41.12 39.92 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 2.62 1.08 0.33 1.67 -1.24 -2.01 -1.80 115.58 116.22 1n3t h ASN 32 Ca -0.43 -0.07 -0.06 0.00 0.71 0.00 0.00 56.30 56.45 1n3t h ASN 32 Cb 1.41 -0.27 -0.01 0.00 0.73 0.00 0.00 38.32 40.18 1n3t h ASN 32 CO 0.65 0.83 -0.30 -0.33 -1.29 0.00 0.00 177.43 176.99 1n3t h GLU 33 N 1.24 0.00 -0.57 6.67 5.08 -2.01 -2.49 114.58 122.50 1n3t h GLU 33 Ca 0.32 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.57 1n3t h GLU 33 Cb -0.05 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.18 1n3t h GLU 33 CO -0.06 0.30 -0.08 1.15 -1.00 0.00 0.00 179.01 179.33 1n3t h THR 34 N 0.00 1.27 -0.31 1.13 2.02 -1.68 -2.91 112.91 112.43 1n3t h THR 34 Ca -0.00 -1.24 -0.05 0.00 0.77 0.00 0.00 66.41 65.89 1n3t h THR 34 Cb 0.55 0.91 -0.01 0.00 -1.74 0.00 0.00 68.15 67.85 1n3t h THR 34 CO 0.04 0.44 0.01 0.03 0.37 0.00 0.00 175.52 176.41 1n3t h ARG 35 N 0.94 0.54 0.00 6.66 3.08 -1.17 -2.19 114.38 122.24 1n3t h ARG 35 Ca 0.15 -0.17 -0.00 0.00 0.07 0.00 0.00 59.98 60.03 1n3t h ARG 35 Cb 0.64 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.64 1n3t h ARG 35 CO 0.04 0.67 -0.01 0.87 -1.07 0.00 0.00 179.97 180.47 1n3t h LYS 36 N 0.34 0.00 0.00 0.04 1.57 -1.50 0.44 116.57 117.46 1n3t h LYS 36 Ca 0.09 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.73 1n3t h LYS 36 Cb 0.43 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.71 1n3t h LYS 36 CO 0.01 0.01 -0.86 0.66 -0.57 0.00 0.00 179.45 178.71 1n3t h SER 37 N 0.00 0.00 0.42 0.86 4.64 -1.31 -2.43 113.55 115.72 1n3t h SER 37 Ca -0.00 0.00 -0.31 0.00 -0.47 0.00 0.00 61.79 61.01 1n3t h SER 37 Cb 0.03 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.13 1n3t h SER 37 CO 0.00 0.56 -1.46 -0.07 -0.87 0.00 0.00 176.83 174.99 1n3t h LEU 38 N 0.00 0.57 -0.47 5.97 3.38 -0.44 -3.04 115.31 121.28 1n3t h LEU 38 Ca -0.06 -0.68 -0.17 0.00 0.09 0.00 0.00 57.88 57.06 1n3t h LEU 38 Cb 1.48 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 42.04 1n3t h LEU 38 CO 0.06 1.55 -0.63 0.40 0.09 0.00 0.00 178.44 179.91 1n3t h ILE 39 N 0.10 1.34 -0.49 1.22 2.04 -0.29 -3.09 117.51 118.34 1n3t h ILE 39 Ca -0.23 -1.93 -0.02 0.00 1.00 0.00 0.00 64.86 63.68 1n3t h ILE 39 Cb 2.06 1.91 -0.02 0.00 -0.74 0.00 0.00 36.82 40.03 1n3t h ILE 39 CO 0.21 0.59 0.24 0.00 0.00 0.00 0.00 178.15 179.19 1n3t h ALA 40 N 0.95 0.64 -0.92 1.87 0.00 -1.52 -1.65 119.26 118.61 1n3t h ALA 40 Ca -0.01 -0.12 0.10 0.00 0.00 0.00 0.00 54.91 54.88 1n3t h ALA 40 Cb 1.18 -0.20 -0.08 0.00 0.00 0.00 0.00 17.79 18.70 1n3t h ALA 40 CO 0.11 0.20 0.57 0.78 0.00 0.00 0.00 179.25 180.91 1n3t h GLY 41 N 0.65 1.46 1.35 0.00 0.00 -1.50 0.14 103.07 105.17 1n3t h GLY 41 Ca 0.17 -0.39 -0.03 0.00 0.00 0.00 0.00 47.33 47.08 1n3t h GLY 41 CO -0.02 0.19 0.24 0.45 0.00 0.00 0.00 176.54 177.40 1n3t h HIS 42 N 0.95 0.84 -0.15 5.60 -0.00 -1.24 -1.12 115.15 120.04 1n3t h HIS 42 Ca 0.44 -0.04 -0.19 0.00 -0.00 0.00 0.00 60.37 60.58 1n3t h HIS 42 Cb 0.36 -0.26 0.01 0.00 -0.00 0.00 0.00 27.41 27.52 1n3t h HIS 42 CO -0.03 0.65 -0.64 0.52 -0.00 0.00 0.00 177.93 178.43 1n3t h MET 43 N 0.83 0.69 -0.89 2.45 2.86 -0.68 -1.46 114.93 118.73 1n3t h MET 43 Ca 0.20 -0.55 0.20 0.00 -2.06 0.00 0.00 59.70 57.49 1n3t h MET 43 Cb 0.15 0.11 -0.06 0.00 0.06 0.00 0.00 31.60 31.86 1n3t h MET 43 CO -0.02 1.17 0.59 1.15 1.06 0.00 0.00 176.91 180.86 1n3t h THR 44 N 0.38 0.68 0.15 2.22 2.02 -0.15 0.22 112.91 118.43 1n3t h THR 44 Ca -0.04 -0.14 -0.01 0.00 0.77 0.00 0.00 66.41 67.00 1n3t h THR 44 Cb 1.28 0.25 0.00 0.00 -1.74 0.00 0.00 68.15 67.94 1n3t h THR 44 CO 0.13 0.07 -0.07 -0.33 0.37 0.00 0.00 175.52 175.69 1n3t h GLU 45 N 0.39 -0.20 -0.96 6.66 4.39 -0.91 -2.80 114.58 121.15 1n3t h GLU 45 Ca 0.46 0.01 0.15 0.00 0.34 0.00 0.00 59.36 60.33 1n3t h GLU 45 Cb 1.17 0.05 -0.08 0.00 -0.10 0.00 0.00 28.75 29.78 1n3t h GLU 45 CO -0.17 0.23 0.61 0.82 -1.16 0.00 0.00 179.01 179.33 1n3t h ILE 46 N -0.89 0.81 -0.43 3.13 2.04 -0.16 0.71 117.51 122.73 1n3t h ILE 46 Ca -0.02 -0.27 -0.11 0.00 1.00 0.00 0.00 64.86 65.46 1n3t h ILE 46 Cb 0.52 -0.04 -0.02 0.00 -0.74 0.00 0.00 36.82 36.54 1n3t h ILE 46 CO 0.03 0.14 -0.17 0.24 0.00 0.00 0.00 178.15 178.40 1n3t h MET 47 N 0.79 0.82 0.00 2.37 2.86 -0.67 -1.55 114.93 119.55 1n3t h MET 47 Ca 0.50 -0.31 -0.06 0.00 -2.06 0.00 0.00 59.70 57.77 1n3t h MET 47 Cb 0.73 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.34 1n3t h MET 47 CO -0.27 0.93 -0.29 1.96 1.06 0.00 0.00 176.91 180.30 1n3t h GLN 48 N 0.73 0.00 0.00 1.72 4.20 -0.84 -1.03 115.11 119.89 1n3t h GLN 48 Ca 0.11 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.82 1n3t h GLN 48 Cb 0.68 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.46 1n3t h GLN 48 CO 0.05 0.29 0.00 1.28 -0.67 0.00 0.00 178.83 179.78 1n3t n LEU 49 N -3.57 0.00 -0.64 1.46 4.77 0.09 -2.24 117.00 116.86 1n3t n LEU 49 Ca -0.01 0.38 0.06 0.00 -0.03 0.00 0.00 56.01 56.41 1n3t n LEU 49 Cb 0.43 -0.38 0.14 0.00 -2.33 0.00 0.00 43.42 41.28 1n3t n LEU 49 CO 0.35 -0.04 0.59 0.18 -1.33 0.00 0.00 177.39 177.14 1n3t n LEU 50 N -1.38 2.76 -2.94 2.23 4.77 -0.49 -4.96 117.00 116.99 1n3t n LEU 50 Ca 0.10 -1.76 -0.19 0.00 -0.03 0.00 0.00 56.01 54.13 1n3t n LEU 50 Cb 0.25 -0.19 0.06 0.00 -2.33 0.00 0.00 43.42 41.22 1n3t n LEU 50 CO 0.22 0.66 0.19 0.59 -1.33 0.00 0.00 177.39 177.72 1n3t n ASN 51 N 0.62 -5.50 -4.53 -1.43 3.02 -0.95 -4.97 115.26 101.51 1n3t n ASN 51 Ca 0.11 -0.42 -0.42 0.00 -0.03 0.00 0.00 54.58 53.82 1n3t n ASN 51 Cb 0.41 -4.12 -0.08 0.00 -0.61 0.00 0.00 39.78 35.38 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 -6.01 4.50 -0.92 3.41 1.43 -0.59 -4.96 118.68 115.54 1n3t s LEU 52 Ca 0.46 -0.25 -0.24 0.00 -1.03 0.00 0.00 54.13 53.06 1n3t s LEU 52 Cb -0.20 -2.61 -0.20 0.00 0.03 0.00 0.00 46.19 43.22 1n3t s LEU 52 CO 0.57 -0.61 2.14 -0.67 0.23 0.00 0.00 176.35 178.01 1n3t n ASP 53 N 5.91 1.15 0.00 2.29 2.03 -1.26 -4.60 116.55 122.07 1n3t n ASP 53 Ca -0.04 -2.02 0.00 0.00 0.52 0.00 0.00 54.79 53.25 1n3t n ASP 53 Cb 0.48 -1.59 0.01 0.00 -0.72 0.00 0.00 41.12 39.30 1n3t n ASP 53 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1n3t n LEU 54 N 18.10 0.00 0.05 -2.67 4.77 -1.26 -1.28 117.00 134.70 1n3t n LEU 54 Ca 0.41 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 56.31 1n3t n LEU 54 Cb 0.45 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.41 1n3t n LEU 54 CO 0.59 0.00 -0.01 0.00 -1.33 0.00 0.00 177.39 176.64 1n3t h ALA 55 N 1.35 0.39 -2.06 -1.18 0.00 -1.95 -3.38 119.26 112.44 1n3t h ALA 55 Ca 0.00 -1.01 -0.61 0.00 0.00 0.00 0.00 54.91 53.29 1n3t h ALA 55 Cb 0.00 -0.01 0.08 0.00 0.00 0.00 0.00 17.79 17.85 1n3t h ALA 55 CO 0.00 1.27 0.49 -3.47 0.00 0.00 0.00 179.25 177.54 1n3t n ASP 56 N -3.32 2.17 0.21 0.00 2.03 -0.41 -4.84 116.55 112.38 1n3t n ASP 56 Ca -0.04 1.14 0.13 0.00 0.52 0.00 0.00 54.79 56.54 1n3t n ASP 56 Cb 0.97 -1.33 0.72 0.00 -0.72 0.00 0.00 41.12 40.76 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 4.05 0.00 0.00 1.67 2.03 -1.91 -1.58 116.42 120.69 1n3t h ASP 57 Ca -0.44 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.86 1n3t h ASP 57 Cb 1.30 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.80 1n3t h ASP 57 CO 0.75 0.00 -0.75 -0.24 -1.03 0.00 0.00 179.24 177.96 1n3t n SER 58 N -2.46 1.57 0.30 4.15 2.88 -1.26 -4.43 113.62 114.37 1n3t n SER 58 Ca -0.02 0.32 0.17 0.00 -1.33 0.00 0.00 58.87 58.02 1n3t n SER 58 Cb 0.10 -0.72 0.92 0.00 -0.75 0.00 0.00 64.21 63.76 1n3t n SER 58 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1n3t h LEU 59 N -0.82 0.00 -0.90 2.46 3.38 -1.88 -2.73 115.31 114.81 1n3t h LEU 59 Ca 0.00 0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.01 1n3t h LEU 59 Cb 0.75 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.45 1n3t h LEU 59 CO 0.00 0.00 0.58 -0.03 0.09 0.00 0.00 178.44 179.08 1n3t h MET 60 N 0.00 1.09 0.00 1.13 4.05 -1.47 -3.02 114.93 116.72 1n3t h MET 60 Ca 0.00 -0.07 -0.03 0.00 -0.28 0.00 0.00 59.70 59.32 1n3t h MET 60 Cb 0.29 -0.25 -0.01 0.00 -0.80 0.00 0.00 31.60 30.84 1n3t h MET 60 CO 0.00 0.72 -0.57 0.93 0.23 0.00 0.00 176.91 178.23 1n3t h GLU 61 N 1.13 0.00 -0.73 0.39 4.39 -1.74 -3.40 114.58 114.62 1n3t h GLU 61 Ca 0.36 0.00 0.13 0.00 0.34 0.00 0.00 59.36 60.20 1n3t h GLU 61 Cb 0.02 0.00 -0.13 0.00 -0.10 0.00 0.00 28.75 28.54 1n3t h GLU 61 CO -0.12 0.11 -0.22 2.41 -1.16 0.00 0.00 179.01 180.02 1n3t n THR 62 N -2.95 -0.34 0.13 1.13 -1.04 -1.14 -1.75 114.28 108.32 1n3t n THR 62 Ca 0.01 1.68 -0.15 0.00 -2.04 0.00 0.00 64.05 63.55 1n3t n THR 62 Cb 0.60 -2.29 -0.08 0.00 -1.82 0.00 0.00 70.33 66.75 1n3t n THR 62 CO 0.00 0.00 0.00 -0.65 -0.64 0.00 0.00 175.07 173.78 1n3t h PRO 63 N 0.00 -0.66 -0.59 -2.82 0.11 -1.79 0.81 132.00 127.05 1n3t h PRO 63 Ca 0.31 0.05 0.07 0.00 0.11 0.00 0.00 66.00 66.54 1n3t h PRO 63 Cb 0.49 0.15 -0.04 0.00 0.11 0.00 0.00 31.00 31.72 1n3t h PRO 63 CO -0.74 -0.44 0.39 1.25 -0.21 0.00 0.00 178.00 178.25 1n3t h HIS 64 N -0.69 0.54 0.57 0.65 -0.00 -1.65 -1.08 115.15 113.50 1n3t h HIS 64 Ca 0.01 0.01 -0.03 0.00 -0.00 0.00 0.00 60.37 60.37 1n3t h HIS 64 Cb 0.70 -0.18 0.01 0.00 -0.00 0.00 0.00 27.41 27.94 1n3t h HIS 64 CO -0.37 0.28 -0.28 0.00 -0.00 0.00 0.00 177.93 177.57 1n3t h ARG 65 N 0.53 -0.74 -0.09 5.26 3.08 -0.79 -0.56 114.38 121.07 1n3t h ARG 65 Ca 0.26 0.05 0.04 0.00 0.07 0.00 0.00 59.98 60.40 1n3t h ARG 65 Cb 0.34 0.17 -0.05 0.00 0.08 0.00 0.00 29.97 30.51 1n3t h ARG 65 CO -0.08 -0.44 -0.25 0.82 -1.07 0.00 0.00 179.97 178.95 1n3t h ILE 66 N -0.94 0.41 -0.61 2.04 2.04 -0.58 0.17 117.51 120.03 1n3t h ILE 66 Ca -0.08 0.00 0.12 0.00 1.00 0.00 0.00 64.86 65.90 1n3t h ILE 66 Cb 0.65 0.41 -0.12 0.00 -0.74 0.00 0.00 36.82 37.02 1n3t h ILE 66 CO 0.13 0.00 -0.16 0.00 0.00 0.00 0.00 178.15 178.12 1n3t h ALA 67 N 0.56 0.39 -0.55 1.87 0.00 -1.14 0.22 119.26 120.62 1n3t h ALA 67 Ca 0.09 0.24 -0.06 0.00 0.00 0.00 0.00 54.91 55.18 1n3t h ALA 67 Cb 0.47 0.48 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 1n3t h ALA 67 CO -0.29 -0.43 0.10 -0.22 0.00 0.00 0.00 179.25 178.41 1n3t h LYS 68 N -0.01 0.86 -0.01 0.00 3.11 -0.59 -1.37 116.57 118.57 1n3t h LYS 68 Ca 0.29 -0.20 -0.09 0.00 -2.81 0.00 0.00 60.65 57.85 1n3t h LYS 68 Cb 0.45 -0.12 -0.01 0.00 -1.00 0.00 0.00 32.23 31.55 1n3t h LYS 68 CO -0.63 0.80 -0.40 1.98 -2.81 0.00 0.00 179.45 178.38 1n3t h MET 69 N 0.82 0.01 0.12 1.90 4.05 0.12 0.31 114.93 122.26 1n3t h MET 69 Ca 0.17 -0.01 -0.01 0.00 -0.28 0.00 0.00 59.70 59.58 1n3t h MET 69 Cb 0.35 -0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.15 1n3t h MET 69 CO 0.01 0.42 -0.06 1.88 0.23 0.00 0.00 176.91 179.39 1n3t h TYR 70 N 0.01 -0.15 -0.17 1.39 -1.99 -0.24 -0.66 116.97 115.16 1n3t h TYR 70 Ca -0.00 -0.00 -0.09 0.00 2.00 0.00 0.00 58.73 60.63 1n3t h TYR 70 Cb 0.72 0.05 -0.00 0.00 2.00 0.00 0.00 36.73 39.50 1n3t h TYR 70 CO 0.00 0.05 -0.26 0.28 -0.00 0.00 0.00 178.16 178.23 1n3t h VAL 71 N -1.02 1.35 0.00 -2.88 2.07 -1.29 -3.26 116.25 111.21 1n3t h VAL 71 Ca -0.02 -1.48 -0.00 0.00 0.82 0.00 0.00 66.70 66.02 1n3t h VAL 71 Cb 0.27 1.90 -0.00 0.00 -1.52 0.00 0.00 31.29 31.94 1n3t h VAL 71 CO 0.03 0.45 -1.17 0.47 0.02 0.00 0.00 177.57 177.36 1n3t n ASP 72 N -4.41 0.72 0.00 0.57 8.00 0.11 -4.45 116.55 117.09 1n3t n ASP 72 Ca -0.06 0.28 0.00 0.00 0.71 0.00 0.00 54.79 55.72 1n3t n ASP 72 Cb 0.45 0.69 0.00 0.00 -0.02 0.00 0.00 41.12 42.23 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 -2.62 0.00 0.00 -1.24 1.02 -1.14 -4.64 120.64 112.02 1n3t n GLU 73 Ca -0.01 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.13 1n3t n GLU 73 Cb 0.56 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.98 1n3t n GLU 73 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 1n3t n ILE 74 N 0.00 0.67 -0.59 -3.67 -5.35 -0.27 -0.40 119.36 109.74 1n3t n ILE 74 Ca 0.00 0.50 0.00 0.00 -0.27 0.00 0.00 62.75 62.98 1n3t n ILE 74 Cb 0.00 -1.50 0.00 0.00 -1.74 0.00 0.00 39.64 36.40 1n3t n ILE 74 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 1n3t n PHE 75 N -1.17 0.00 0.22 4.28 3.72 -1.20 -3.22 117.46 120.09 1n3t n PHE 75 Ca -0.00 -0.15 0.09 0.00 -0.05 0.00 0.00 57.45 57.35 1n3t n PHE 75 Cb 0.33 -0.01 0.49 0.00 -0.94 0.00 0.00 39.48 39.35 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 0.00 0.00 0.00 4.37 4.64 -0.71 0.80 113.55 122.65 1n3t h SER 76 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1n3t h SER 76 Cb 0.65 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.74 1n3t h SER 76 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 1n3t n GLY 77 N -1.26 -0.86 0.51 -0.77 0.00 -0.87 -2.72 105.19 99.20 1n3t n GLY 77 Ca -0.01 -0.09 0.12 0.00 0.00 0.00 0.00 46.02 46.03 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 -0.77 1.55 -4.02 0.99 4.77 0.27 -4.68 117.00 115.12 1n3t n LEU 78 Ca 0.11 -0.60 -0.31 0.00 -0.03 0.00 0.00 56.01 55.18 1n3t n LEU 78 Cb 0.05 -0.06 -0.16 0.00 -2.33 0.00 0.00 43.42 40.92 1n3t n LEU 78 CO 0.08 0.30 -0.48 -0.62 -1.33 0.00 0.00 177.39 175.34 1n3t s ASP 79 N -1.73 3.06 0.00 -1.43 -1.08 -1.10 -4.97 116.67 109.41 1n3t s ASP 79 Ca 0.35 -0.69 0.15 0.00 -0.52 0.00 0.00 52.55 51.84 1n3t s ASP 79 Cb 0.19 -1.24 0.91 0.00 -1.46 0.00 0.00 42.92 41.31 1n3t s ASP 79 CO 0.29 -0.09 1.32 -1.22 0.52 0.00 0.00 175.17 176.00 1n3t n TYR 80 N 4.71 0.00 1.38 -5.34 4.02 -1.26 -1.68 117.16 118.99 1n3t n TYR 80 Ca -0.16 0.00 0.13 0.00 -0.01 0.00 0.00 57.90 57.85 1n3t n TYR 80 Cb 0.48 0.00 0.70 0.00 -0.02 0.00 0.00 39.34 40.50 1n3t n TYR 80 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1n3t n ALA 81 N -0.94 2.36 0.47 -0.72 0.00 -1.26 -2.54 120.51 117.88 1n3t n ALA 81 Ca 0.11 -0.14 0.05 0.00 0.00 0.00 0.00 53.44 53.46 1n3t n ALA 81 Cb 0.05 -1.42 -0.04 0.00 0.00 0.00 0.00 19.45 18.04 1n3t n ALA 81 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1n3t n ASN 82 N -1.17 0.68 -4.55 0.00 3.02 -0.68 -5.04 115.26 107.52 1n3t n ASN 82 Ca 0.15 -0.84 -0.56 0.00 -0.03 0.00 0.00 54.58 53.30 1n3t n ASN 82 Cb 0.16 0.86 -0.07 0.00 -0.61 0.00 0.00 39.78 40.12 1n3t n ASN 82 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1n3t n PHE 83 N -0.98 1.13 -1.64 3.10 7.35 -1.05 -4.88 117.46 120.48 1n3t n PHE 83 Ca 0.03 0.84 -0.36 0.00 -0.76 0.00 0.00 57.45 57.20 1n3t n PHE 83 Cb 0.17 -2.22 0.08 0.00 0.35 0.00 0.00 39.48 37.86 1n3t n PHE 83 CO 0.00 0.00 0.00 -1.25 -0.76 0.00 0.00 176.76 174.75 1n3t s PRO 84 N 0.39 2.41 -0.43 -7.13 0.04 -1.26 -4.91 135.00 124.11 1n3t s PRO 84 Ca 0.88 2.00 -0.29 0.00 0.04 0.00 0.00 61.00 63.63 1n3t s PRO 84 Cb -1.12 -1.84 0.02 0.00 0.04 0.00 0.00 34.50 31.61 1n3t s PRO 84 CO 0.53 -1.69 1.24 0.15 0.04 0.00 0.00 177.00 177.26 1n3t s LYS 85 N -3.51 3.71 0.31 4.56 1.02 -1.26 -4.94 119.74 119.62 1n3t s LYS 85 Ca 0.81 0.78 -0.22 0.00 0.02 0.00 0.00 55.97 57.36 1n3t s LYS 85 Cb -0.36 -3.93 -0.09 0.00 -0.52 0.00 0.00 37.83 32.93 1n3t s LYS 85 CO 0.41 -1.39 0.84 0.42 -0.92 0.00 0.00 175.35 174.71 1n3t s ILE 86 N 4.72 4.42 -0.10 2.17 1.01 -1.26 -5.02 121.20 127.15 1n3t s ILE 86 Ca 0.53 1.47 -0.05 0.00 0.00 0.00 0.00 60.65 62.59 1n3t s ILE 86 Cb -0.10 -3.84 0.04 0.00 0.01 0.00 0.00 42.46 38.57 1n3t s ILE 86 CO 0.30 0.04 0.24 0.42 0.00 0.00 0.00 174.94 175.94 1n3t s THR 87 N -1.73 -0.04 0.17 2.92 -4.23 -1.26 -5.13 115.64 106.34 1n3t s THR 87 Ca 0.50 0.13 0.06 0.00 -1.18 0.00 0.00 61.69 61.21 1n3t s THR 87 Cb -0.15 -0.37 -0.04 0.00 1.34 0.00 0.00 72.50 73.27 1n3t s THR 87 CO 0.20 0.05 -0.12 -0.76 -0.54 0.00 0.00 174.62 173.45 1n3t s LEU 88 N 1.14 2.53 -0.01 4.79 1.43 -1.26 -2.88 118.68 124.43 1n3t s LEU 88 Ca -0.08 -1.00 0.04 0.00 -1.03 0.00 0.00 54.13 52.06 1n3t s LEU 88 Cb -0.10 -0.50 -0.01 0.00 0.03 0.00 0.00 46.19 45.62 1n3t s LEU 88 CO -0.08 -0.25 -0.14 -0.63 0.23 0.00 0.00 176.35 175.48 1n3t s ILE 89 N -3.10 1.12 0.16 -0.59 1.01 -1.05 -4.96 121.20 113.79 1n3t s ILE 89 Ca 0.19 -0.63 -0.34 0.00 0.00 0.00 0.00 60.65 59.87 1n3t s ILE 89 Cb 0.01 -0.94 -0.15 0.00 0.01 0.00 0.00 42.46 41.39 1n3t s ILE 89 CO 0.03 0.30 1.39 1.21 0.00 0.00 0.00 174.94 177.87 1n3t n GLU 90 N 2.69 1.63 -1.31 2.79 2.13 -1.26 -1.72 120.64 125.58 1n3t n GLU 90 Ca -0.14 0.59 -0.37 0.00 0.66 0.00 0.00 57.16 57.89 1n3t n GLU 90 Cb 0.55 -2.24 -0.02 0.00 0.27 0.00 0.00 31.44 30.00 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 2.59 5.65 0.25 4.31 5.15 -1.05 -4.56 115.26 127.60 1n3t n ASN 91 Ca 0.16 -2.63 0.15 0.00 -0.60 0.00 0.00 54.58 51.66 1n3t n ASN 91 Cb 0.26 -1.44 0.49 0.00 -0.53 0.00 0.00 39.78 38.55 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 5.97 0.00 0.00 1.20 1.57 -1.90 -2.43 116.57 120.98 1n3t h LYS 92 Ca 0.65 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.43 1n3t h LYS 92 Cb 0.43 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.74 1n3t h LYS 92 CO 1.78 0.02 -0.09 -1.33 -0.57 0.00 0.00 179.45 179.26 1n3t n MET 93 N -3.11 0.06 -3.68 3.15 2.81 -1.26 -4.94 117.12 110.14 1n3t n MET 93 Ca 0.02 0.04 -0.28 0.00 -1.81 0.00 0.00 57.70 55.67 1n3t n MET 93 Cb 0.40 -1.56 0.04 0.00 -0.71 0.00 0.00 33.22 31.38 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 -1.67 -2.15 -2.41 0.03 4.01 -0.92 -4.84 118.16 110.22 1n3t n LYS 94 Ca 0.06 0.51 -0.39 0.00 -0.51 0.00 0.00 58.31 57.98 1n3t n LYS 94 Cb 0.36 -4.50 -0.03 0.00 -0.51 0.00 0.00 35.03 30.35 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 -3.56 3.66 -0.91 -0.18 1.01 -1.26 -4.81 120.40 114.36 1n3t s VAL 95 Ca 0.34 0.10 0.08 0.00 0.00 0.00 0.00 61.98 62.50 1n3t s VAL 95 Cb -0.11 -4.67 0.39 0.00 0.00 0.00 0.00 36.38 31.99 1n3t s VAL 95 CO 0.85 -1.60 1.15 -0.90 0.00 0.00 0.00 175.10 174.59 1n3t n ASP 96 N 10.35 3.06 -4.34 3.32 5.75 -1.26 -4.23 116.55 129.20 1n3t n ASP 96 Ca 0.15 -2.37 -0.27 0.00 -0.01 0.00 0.00 54.79 52.29 1n3t n ASP 96 Cb 0.50 -0.52 -0.13 0.00 -1.03 0.00 0.00 41.12 39.94 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 -1.80 1.33 0.63 0.11 0.41 -1.26 -5.00 118.70 113.12 1n3t s GLU 97 Ca 0.26 -1.23 -0.18 0.00 -0.41 0.00 0.00 54.97 53.41 1n3t s GLU 97 Cb 0.19 -1.69 -0.02 0.00 -1.78 0.00 0.00 34.13 30.83 1n3t s GLU 97 CO 0.10 0.40 1.21 0.00 -0.49 0.00 0.00 175.26 176.48 1n3t s MET 98 N -1.87 2.77 -0.18 1.61 0.23 -1.26 -4.57 119.30 116.04 1n3t s MET 98 Ca 0.11 1.81 -0.01 0.00 -1.03 0.00 0.00 55.69 56.57 1n3t s MET 98 Cb -0.10 -1.91 0.00 0.00 -1.53 0.00 0.00 34.83 31.30 1n3t s MET 98 CO 0.05 -1.36 -0.14 0.08 -2.03 0.00 0.00 175.02 171.62 1n3t s VAL 99 N -1.70 2.66 -0.08 5.16 1.01 -0.29 -4.94 120.40 122.24 1n3t s VAL 99 Ca 0.77 -0.75 0.01 0.00 0.00 0.00 0.00 61.98 62.00 1n3t s VAL 99 Cb -0.30 -2.15 -0.03 0.00 0.00 0.00 0.00 36.38 33.90 1n3t s VAL 99 CO 0.36 0.50 -0.09 -0.89 0.00 0.00 0.00 175.10 174.99 1n3t s THR 100 N 1.10 3.51 -0.31 3.92 2.01 -1.26 -2.16 115.64 122.45 1n3t s THR 100 Ca 0.00 -0.54 0.03 0.00 0.31 0.00 0.00 61.69 61.49 1n3t s THR 100 Cb -0.14 -2.44 0.09 0.00 0.01 0.00 0.00 72.50 70.02 1n3t s THR 100 CO -0.04 0.58 0.02 -0.69 -0.69 0.00 0.00 174.62 173.79 1n3t s VAL 101 N -0.56 1.98 0.42 3.82 1.01 0.00 -5.01 120.40 122.06 1n3t s VAL 101 Ca 0.08 -1.98 0.05 0.00 0.00 0.00 0.00 61.98 60.14 1n3t s VAL 101 Cb -0.12 -2.38 0.01 0.00 0.00 0.00 0.00 36.38 33.89 1n3t s VAL 101 CO 0.02 -0.46 0.58 0.00 0.00 0.00 0.00 175.10 175.24 1n3t s ARG 102 N 1.09 2.91 -1.50 2.72 1.70 -1.26 -1.76 118.95 122.85 1n3t s ARG 102 Ca 0.06 -0.98 -0.01 0.00 -0.47 0.00 0.00 55.73 54.32 1n3t s ARG 102 Cb -0.19 -2.71 0.00 0.00 -0.57 0.00 0.00 34.95 31.48 1n3t s ARG 102 CO -0.10 -0.23 0.13 -0.25 -1.08 0.00 0.00 175.30 173.77 1n3t n ASP 103 N -1.89 0.45 -4.73 -2.89 8.00 -1.24 -4.90 116.55 109.36 1n3t n ASP 103 Ca 0.04 -1.22 -0.41 0.00 0.71 0.00 0.00 54.79 53.92 1n3t n ASP 103 Cb 0.59 -1.94 -0.04 0.00 -0.02 0.00 0.00 41.12 39.70 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 -4.25 4.24 0.10 0.53 1.01 -0.27 -4.82 121.20 117.74 1n3t s ILE 104 Ca 0.02 1.87 -0.31 0.00 0.00 0.00 0.00 60.65 62.23 1n3t s ILE 104 Cb -0.01 -4.19 -0.08 0.00 0.01 0.00 0.00 42.46 38.19 1n3t s ILE 104 CO 0.97 0.29 1.38 -0.89 0.00 0.00 0.00 174.94 176.69 1n3t s THR 105 N -0.02 3.39 -0.12 2.92 2.01 -1.26 -1.02 115.64 121.53 1n3t s THR 105 Ca 0.49 0.98 -0.02 0.00 0.31 0.00 0.00 61.69 63.45 1n3t s THR 105 Cb -0.26 -3.63 0.04 0.00 0.01 0.00 0.00 72.50 68.66 1n3t s THR 105 CO 0.32 0.07 -0.01 -0.22 -0.69 0.00 0.00 174.62 174.09 1n3t s LEU 106 N 1.21 0.95 -0.14 4.42 0.20 -0.88 -4.75 118.68 119.68 1n3t s LEU 106 Ca 0.64 -0.39 -0.03 0.00 0.69 0.00 0.00 54.13 55.05 1n3t s LEU 106 Cb -0.36 -0.59 -0.03 0.00 -0.43 0.00 0.00 46.19 44.78 1n3t s LEU 106 CO 0.30 -0.21 -0.05 0.42 -0.29 0.00 0.00 176.35 176.51 1n3t s THR 107 N 1.87 3.79 0.24 3.68 -4.23 -1.26 -2.28 115.64 117.44 1n3t s THR 107 Ca 0.03 -0.40 -0.10 0.00 -1.18 0.00 0.00 61.69 60.03 1n3t s THR 107 Cb -0.14 -2.64 -0.01 0.00 1.34 0.00 0.00 72.50 71.05 1n3t s THR 107 CO -0.07 0.51 0.40 -0.55 -0.54 0.00 0.00 174.62 174.38 1n3t s SER 108 N 0.21 -0.04 -0.10 3.99 0.15 -0.43 -4.26 113.70 113.21 1n3t s SER 108 Ca -0.03 -1.02 0.00 0.00 0.70 0.00 0.00 55.95 55.60 1n3t s SER 108 Cb -0.14 0.54 0.02 0.00 -1.71 0.00 0.00 66.02 64.73 1n3t s SER 108 CO 0.03 -1.07 -0.09 -0.89 1.20 0.00 0.00 173.24 172.42 1n3t s THR 109 N -4.05 1.09 0.05 6.45 2.01 -1.26 0.89 115.64 120.82 1n3t s THR 109 Ca 0.26 -0.36 -0.31 0.00 0.31 0.00 0.00 61.69 61.59 1n3t s THR 109 Cb 0.01 -1.07 -0.06 0.00 0.01 0.00 0.00 72.50 71.39 1n3t s THR 109 CO 0.09 0.37 1.34 0.00 -0.69 0.00 0.00 174.62 175.73 1n3t n GLU 111 N 4.53 0.05 0.10 0.00 0.28 -0.59 0.51 120.64 125.51 1n3t n GLU 111 Ca 0.11 0.39 -0.17 0.00 -0.16 0.00 0.00 57.16 57.34 1n3t n GLU 111 Cb 0.44 -1.62 -0.14 0.00 1.43 0.00 0.00 31.44 31.55 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 0.51 0.00 -1.84 3.86 -1.90 -3.39 115.15 112.39 1n3t h HIS 112 Ca 0.00 -0.37 0.00 0.00 -1.16 0.00 0.00 60.37 58.84 1n3t h HIS 112 Cb 0.18 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 28.63 1n3t h HIS 112 CO 0.00 1.32 0.00 0.72 0.86 0.00 0.00 177.93 180.83 1n3t n HIS 113 N -3.52 0.00 -3.53 2.45 8.25 -1.13 -4.99 115.22 112.75 1n3t n HIS 113 Ca -0.11 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.15 1n3t n HIS 113 Cb 1.03 0.00 0.08 0.00 1.12 0.00 0.00 29.99 32.22 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 -0.17 -2.39 -4.33 4.41 3.01 0.18 -4.99 117.46 113.18 1n3t n PHE 114 Ca 0.00 0.96 -0.24 0.00 1.01 0.00 0.00 57.45 59.18 1n3t n PHE 114 Cb 0.07 -4.97 -0.08 0.00 -0.01 0.00 0.00 39.48 34.49 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 -3.37 2.87 0.40 -4.37 1.01 -1.16 -4.86 120.40 110.92 1n3t s VAL 115 Ca 0.21 -2.00 -0.27 0.00 0.00 0.00 0.00 61.98 59.93 1n3t s VAL 115 Cb -0.10 -2.75 -0.10 0.00 0.00 0.00 0.00 36.38 33.44 1n3t s VAL 115 CO 0.74 -0.28 1.41 -0.89 0.00 0.00 0.00 175.10 176.08 1n3t s THR 116 N -2.45 2.25 -0.20 3.92 2.01 -1.26 -0.20 115.64 119.70 1n3t s THR 116 Ca 0.33 0.23 -0.01 0.00 0.31 0.00 0.00 61.69 62.56 1n3t s THR 116 Cb -0.03 -3.14 0.05 0.00 0.01 0.00 0.00 72.50 69.39 1n3t s THR 116 CO 0.19 0.04 -0.03 -0.63 -0.69 0.00 0.00 174.62 173.51 1n3t s ILE 117 N -1.18 1.10 -0.33 1.82 1.01 0.26 -1.88 121.20 122.00 1n3t s ILE 117 Ca 0.56 -0.82 -0.10 0.00 0.00 0.00 0.00 60.65 60.29 1n3t s ILE 117 Cb -0.43 -1.40 0.00 0.00 0.01 0.00 0.00 42.46 40.65 1n3t s ILE 117 CO 0.57 -0.05 0.16 -0.62 0.00 0.00 0.00 174.94 175.00 1n3t s ASP 118 N 1.61 5.55 0.31 3.58 2.15 -0.56 -1.32 116.67 127.99 1n3t s ASP 118 Ca -0.02 -0.68 -0.02 0.00 0.43 0.00 0.00 52.55 52.26 1n3t s ASP 118 Cb -0.17 -1.99 0.01 0.00 -0.30 0.00 0.00 42.92 40.47 1n3t s ASP 118 CO -0.07 -0.25 0.44 0.61 -0.17 0.00 0.00 175.17 175.73 1n3t n GLY 119 N 4.97 2.20 2.87 2.66 0.00 -0.97 -0.38 105.19 116.54 1n3t n GLY 119 Ca -0.13 -1.58 -0.16 0.00 0.00 0.00 0.00 46.02 44.16 1n3t n GLY 119 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n3t s LYS 120 N -2.68 0.27 0.03 1.61 3.01 0.62 -2.08 119.74 120.53 1n3t s LYS 120 Ca 0.25 -0.01 0.07 0.00 -1.01 0.00 0.00 55.97 55.27 1n3t s LYS 120 Cb -0.01 -0.36 -0.03 0.00 -1.01 0.00 0.00 37.83 36.41 1n3t s LYS 120 CO 0.18 -0.04 -0.18 0.00 0.51 0.00 0.00 175.35 175.82 1n3t s ALA 121 N 0.51 2.58 -0.21 5.17 0.00 -0.19 -1.05 121.76 128.57 1n3t s ALA 121 Ca -0.05 -1.17 0.02 0.00 0.00 0.00 0.00 51.96 50.75 1n3t s ALA 121 Cb -0.08 -0.75 0.04 0.00 0.00 0.00 0.00 23.12 22.33 1n3t s ALA 121 CO -0.01 0.57 -0.13 0.99 0.00 0.00 0.00 175.76 177.18 1n3t s THR 122 N -0.90 1.95 -0.07 0.00 2.01 0.06 -1.12 115.64 117.58 1n3t s THR 122 Ca 0.14 -1.21 0.01 0.00 0.31 0.00 0.00 61.69 60.94 1n3t s THR 122 Cb -0.10 -1.96 -0.03 0.00 0.01 0.00 0.00 72.50 70.42 1n3t s THR 122 CO 0.05 0.21 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.40 1n3t s VAL 123 N 1.26 3.44 -0.02 3.82 1.01 -0.72 -2.26 120.40 126.93 1n3t s VAL 123 Ca -0.02 -0.57 -0.05 0.00 0.00 0.00 0.00 61.98 61.34 1n3t s VAL 123 Cb -0.17 -2.40 0.01 0.00 0.00 0.00 0.00 36.38 33.82 1n3t s VAL 123 CO -0.08 0.58 0.12 0.00 0.00 0.00 0.00 175.10 175.71 1n3t s ALA 124 N -0.61 -0.28 0.08 5.51 0.00 -0.70 -0.82 121.76 124.94 1n3t s ALA 124 Ca 0.09 0.09 -0.15 0.00 0.00 0.00 0.00 51.96 51.99 1n3t s ALA 124 Cb -0.11 -0.06 0.03 0.00 0.00 0.00 0.00 23.12 22.97 1n3t s ALA 124 CO 0.02 -0.12 0.35 1.52 0.00 0.00 0.00 175.76 177.52 1n3t s TYR 125 N -0.60 -0.14 -0.48 0.00 1.13 -0.92 -0.44 117.35 115.90 1n3t s TYR 125 Ca -0.07 -0.08 -0.10 0.00 -1.41 0.00 0.00 57.07 55.41 1n3t s TYR 125 Cb -0.04 0.17 0.12 0.00 -1.10 0.00 0.00 41.96 41.11 1n3t s TYR 125 CO 0.01 -0.60 0.36 0.42 -2.51 0.00 0.00 175.55 173.22 1n3t s ILE 126 N -3.22 4.29 0.16 -3.49 1.01 -0.89 -1.13 121.20 117.92 1n3t s ILE 126 Ca -0.00 -1.78 -0.31 0.00 0.00 0.00 0.00 60.65 58.56 1n3t s ILE 126 Cb 0.01 -3.82 -0.18 0.00 0.01 0.00 0.00 42.46 38.49 1n3t s ILE 126 CO -0.08 -0.79 0.67 -2.65 0.00 0.00 0.00 174.94 172.10 1n3t n PRO 127 N 4.92 0.07 0.00 2.79 -0.02 -1.26 -4.86 135.00 136.65 1n3t n PRO 127 Ca -0.08 0.03 0.00 0.00 -2.02 0.00 0.00 63.50 61.42 1n3t n PRO 127 Cb 0.41 -1.16 0.00 0.00 -0.02 0.00 0.00 33.50 32.73 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 1.12 0.00 0.00 -0.52 4.81 -1.26 -4.80 118.16 117.51 1n3t n LYS 128 Ca 0.18 0.00 0.11 0.00 -0.87 0.00 0.00 58.31 57.73 1n3t n LYS 128 Cb 0.22 0.00 -0.02 0.00 0.02 0.00 0.00 35.03 35.25 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 1.53 -3.85 3.14 8.00 -1.26 -4.80 116.55 119.31 1n3t n ASP 129 Ca 0.00 -1.24 -0.12 0.00 0.71 0.00 0.00 54.79 54.15 1n3t n ASP 129 Cb 0.00 0.65 -0.10 0.00 -0.02 0.00 0.00 41.12 41.65 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 -2.70 -0.02 -0.21 -2.24 1.04 -1.26 -2.53 113.70 105.78 1n3t s SER 130 Ca 0.15 -0.15 -0.02 0.00 0.48 0.00 0.00 55.95 56.41 1n3t s SER 130 Cb 0.17 0.23 0.00 0.00 0.10 0.00 0.00 66.02 66.52 1n3t s SER 130 CO 0.69 -0.39 -0.09 -0.69 0.98 0.00 0.00 173.24 173.74 1n3t s VAL 131 N -1.39 2.96 0.36 5.02 1.01 -0.70 -4.71 120.40 122.95 1n3t s VAL 131 Ca -0.14 -0.67 -0.25 0.00 0.00 0.00 0.00 61.98 60.92 1n3t s VAL 131 Cb -0.07 -2.34 -0.10 0.00 0.00 0.00 0.00 36.38 33.87 1n3t s VAL 131 CO 0.02 0.43 0.98 -0.63 0.00 0.00 0.00 175.10 175.90 1n3t s ILE 132 N 1.41 4.09 0.09 2.22 1.01 -1.26 -2.53 121.20 126.23 1n3t s ILE 132 Ca 0.05 1.64 -0.31 0.00 0.00 0.00 0.00 60.65 62.03 1n3t s ILE 132 Cb -0.14 -3.87 -0.10 0.00 0.01 0.00 0.00 42.46 38.36 1n3t s ILE 132 CO -0.06 0.05 1.90 -0.83 0.00 0.00 0.00 174.94 176.00 1n3t s GLY 133 N -1.66 1.38 0.30 6.18 0.00 -1.14 -4.87 107.32 107.51 1n3t s GLY 133 Ca 0.54 1.40 0.01 0.00 0.00 0.00 0.00 44.72 46.67 1n3t s GLY 133 CO 0.24 3.31 1.59 1.41 0.00 0.00 0.00 173.10 179.65 1n3t h LEU 134 N 9.53 -0.38 0.00 0.66 3.38 -1.93 0.48 115.31 127.05 1n3t h LEU 134 Ca -0.48 0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.75 1n3t h LEU 134 Cb 1.23 0.43 0.00 0.00 0.09 0.00 0.00 40.66 42.41 1n3t h LEU 134 CO 0.95 -0.30 0.00 -1.54 0.09 0.00 0.00 178.44 177.64 1n3t n SER 135 N -5.42 0.00 0.01 -0.43 3.41 -1.26 -2.53 113.62 107.39 1n3t n SER 135 Ca 0.22 -0.51 -0.17 0.00 -0.26 0.00 0.00 58.87 58.14 1n3t n SER 135 Cb 0.71 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.52 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 0.19 0.00 4.33 1.79 -0.39 -2.67 116.57 119.83 1n3t h LYS 136 Ca 0.00 -0.33 -0.04 0.00 -2.18 0.00 0.00 60.65 58.10 1n3t h LYS 136 Cb 0.00 0.12 -0.01 0.00 -1.58 0.00 0.00 32.23 30.77 1n3t h LYS 136 CO 0.00 1.00 -0.19 0.82 -1.08 0.00 0.00 179.45 180.00 1n3t h ILE 137 N 0.05 1.06 -0.02 1.86 2.04 -1.61 0.22 117.51 121.11 1n3t h ILE 137 Ca -0.35 -0.67 -0.03 0.00 1.00 0.00 0.00 64.86 64.81 1n3t h ILE 137 Cb 2.03 1.37 0.00 0.00 -0.74 0.00 0.00 36.82 39.48 1n3t h ILE 137 CO 0.11 0.19 -0.11 0.78 0.00 0.00 0.00 178.15 179.11 1n3t h ASN 138 N 0.00 0.13 -0.69 1.72 -0.26 -1.64 -2.82 115.58 112.02 1n3t h ASN 138 Ca -0.00 -0.68 -0.04 0.00 -0.56 0.00 0.00 56.30 55.02 1n3t h ASN 138 Cb 0.35 -0.04 -0.03 0.00 -1.06 0.00 0.00 38.32 37.54 1n3t h ASN 138 CO 0.02 0.79 0.30 0.03 -1.06 0.00 0.00 177.43 177.51 1n3t h ARG 139 N -0.52 1.04 -0.26 0.81 3.08 -1.00 -1.96 114.38 115.56 1n3t h ARG 139 Ca -0.01 -0.17 -0.12 0.00 0.07 0.00 0.00 59.98 59.75 1n3t h ARG 139 Cb 0.79 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 30.66 1n3t h ARG 139 CO 0.02 0.83 -0.32 0.82 -1.07 0.00 0.00 179.97 180.26 1n3t h ILE 140 N 1.02 1.31 -0.02 2.04 2.04 -0.69 -1.28 117.51 121.93 1n3t h ILE 140 Ca 0.24 -1.50 0.03 0.00 1.00 0.00 0.00 64.86 64.63 1n3t h ILE 140 Cb 0.17 1.66 -0.03 0.00 -0.74 0.00 0.00 36.82 37.88 1n3t h ILE 140 CO -0.02 0.48 -0.14 0.58 0.00 0.00 0.00 178.15 179.04 1n3t h VAL 141 N 0.40 0.65 -0.13 1.67 2.07 -1.27 -1.92 116.25 117.72 1n3t h VAL 141 Ca 0.03 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.51 1n3t h VAL 141 Cb 0.90 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 31.31 1n3t h VAL 141 CO 0.08 0.00 -0.10 1.56 0.02 0.00 0.00 177.57 179.12 1n3t h GLN 142 N -0.22 0.20 0.37 1.57 1.08 -1.36 -1.76 115.11 114.99 1n3t h GLN 142 Ca 0.06 -0.04 -0.01 0.00 -1.45 0.00 0.00 58.65 57.21 1n3t h GLN 142 Cb 0.29 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.68 1n3t h GLN 142 CO -0.15 0.31 -0.27 0.35 -0.95 0.00 0.00 178.83 178.12 1n3t h PHE 143 N 0.19 -0.71 0.00 2.96 3.57 -0.43 -1.75 116.94 120.77 1n3t h PHE 143 Ca 0.04 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.52 1n3t h PHE 143 Cb 0.31 0.26 -0.00 0.00 2.79 0.00 0.00 35.95 39.31 1n3t h PHE 143 CO 0.00 -0.41 -0.09 0.74 -2.23 0.00 0.00 178.31 176.33 1n3t h PHE 144 N -0.63 0.00 -0.07 0.41 0.04 -1.43 -3.01 116.94 112.24 1n3t h PHE 144 Ca -0.03 0.00 -0.12 0.00 2.80 0.00 0.00 57.97 60.62 1n3t h PHE 144 Cb 0.54 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.68 1n3t h PHE 144 CO -0.13 0.09 -0.48 0.00 -0.60 0.00 0.00 178.31 177.19 1n3t h ALA 145 N 1.91 1.06 0.00 2.45 0.00 -0.82 -3.29 119.26 120.57 1n3t h ALA 145 Ca -0.00 -0.45 -0.22 0.00 0.00 0.00 0.00 54.91 54.23 1n3t h ALA 145 Cb 0.70 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.36 1n3t h ALA 145 CO 0.01 0.63 0.36 1.04 0.00 0.00 0.00 179.25 181.29 1n3t n GLN 146 N -3.97 1.90 -3.79 0.00 1.13 -0.71 -4.30 117.38 107.64 1n3t n GLN 146 Ca -0.02 -1.01 -0.10 0.00 -1.94 0.00 0.00 57.00 53.93 1n3t n GLN 146 Cb 0.52 -2.04 -0.07 0.00 0.11 0.00 0.00 30.24 28.76 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 1.55 0.86 0.09 -1.09 0.52 -1.20 -2.06 118.95 117.63 1n3t s ARG 147 Ca 0.56 -0.77 -0.31 0.00 -0.52 0.00 0.00 55.73 54.70 1n3t s ARG 147 Cb 0.25 0.36 -0.09 0.00 0.52 0.00 0.00 34.95 35.99 1n3t s ARG 147 CO -0.01 -0.28 1.69 -2.14 0.02 0.00 0.00 175.30 174.58 1n3t s PRO 148 N -3.39 4.18 0.34 3.54 0.02 -1.26 -4.07 135.00 134.36 1n3t s PRO 148 Ca 0.01 2.41 0.03 0.00 0.02 0.00 0.00 61.00 63.47 1n3t s PRO 148 Cb 0.02 -3.55 -0.05 0.00 0.02 0.00 0.00 34.50 30.94 1n3t s PRO 148 CO -0.09 -0.75 0.08 -0.65 -0.33 0.00 0.00 177.00 175.27 1n3t s GLN 149 N 2.51 1.70 -0.13 5.54 -1.52 0.15 -4.65 119.66 123.25 1n3t s GLN 149 Ca 0.75 -1.97 -0.01 0.00 -1.95 0.00 0.00 55.36 52.18 1n3t s GLN 149 Cb -0.42 -0.72 0.04 0.00 -0.22 0.00 0.00 33.01 31.69 1n3t s GLN 149 CO 0.33 -0.28 -0.01 0.08 -0.25 0.00 0.00 175.29 175.16 1n3t s VAL 150 N -3.34 0.62 0.23 1.09 1.01 -1.26 -1.55 120.40 117.21 1n3t s VAL 150 Ca 0.33 -0.24 -0.12 0.00 0.00 0.00 0.00 61.98 61.95 1n3t s VAL 150 Cb 0.07 -0.86 0.31 0.00 0.00 0.00 0.00 36.38 35.90 1n3t s VAL 150 CO 0.15 0.13 1.59 -0.61 0.00 0.00 0.00 175.10 176.36 1n3t h GLN 151 N 8.25 -0.02 -0.99 2.72 4.15 -1.99 -0.02 115.11 127.22 1n3t h GLN 151 Ca -0.21 0.00 0.21 0.00 0.77 0.00 0.00 58.65 59.42 1n3t h GLN 151 Cb 1.12 0.00 -0.09 0.00 0.21 0.00 0.00 27.48 28.72 1n3t h GLN 151 CO 0.32 -0.01 0.62 0.93 -1.93 0.00 0.00 178.83 178.76 1n3t h GLU 152 N -0.02 0.58 0.22 1.69 3.07 -1.98 -1.20 114.58 116.94 1n3t h GLU 152 Ca 0.36 -0.03 -0.34 0.00 -0.50 0.00 0.00 59.36 58.85 1n3t h GLU 152 Cb 0.58 -0.13 0.03 0.00 -0.84 0.00 0.00 28.75 28.39 1n3t h GLU 152 CO -0.82 0.38 -1.61 -0.09 -1.40 0.00 0.00 179.01 175.48 1n3t h ARG 153 N 0.59 0.47 -0.96 2.33 2.43 -1.50 -3.27 114.38 114.47 1n3t h ARG 153 Ca 0.56 -0.81 0.20 0.00 -0.81 0.00 0.00 59.98 59.12 1n3t h ARG 153 Cb 1.10 0.30 -0.11 0.00 -0.42 0.00 0.00 29.97 30.84 1n3t h ARG 153 CO -0.31 1.39 0.55 1.25 -1.51 0.00 0.00 179.97 181.33 1n3t h LEU 154 N 0.12 0.65 0.04 3.80 5.85 0.09 0.16 115.31 126.02 1n3t h LEU 154 Ca -0.30 0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.53 1n3t h LEU 154 Cb 2.13 0.01 0.00 0.00 0.37 0.00 0.00 40.66 43.18 1n3t h LEU 154 CO 0.23 0.18 -0.02 0.74 -0.34 0.00 0.00 178.44 179.23 1n3t h THR 155 N 0.64 1.14 -0.46 1.05 2.02 -1.52 -3.02 112.91 112.77 1n3t h THR 155 Ca 0.58 -0.58 0.09 0.00 0.77 0.00 0.00 66.41 67.27 1n3t h THR 155 Cb 0.98 1.53 -0.09 0.00 -1.74 0.00 0.00 68.15 68.83 1n3t h THR 155 CO -0.43 0.15 -0.10 1.56 0.37 0.00 0.00 175.52 177.07 1n3t h GLN 156 N -0.30 0.01 0.27 6.66 1.08 -1.07 -1.48 115.11 120.27 1n3t h GLN 156 Ca -0.01 -0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.19 1n3t h GLN 156 Cb 0.28 -0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.70 1n3t h GLN 156 CO 0.01 0.01 -0.18 1.96 -0.95 0.00 0.00 178.83 179.68 1n3t h GLN 157 N 0.01 -0.42 -0.39 1.46 4.20 -1.23 -0.70 115.11 118.04 1n3t h GLN 157 Ca 0.22 0.03 0.08 0.00 0.06 0.00 0.00 58.65 59.04 1n3t h GLN 157 Cb 0.34 0.10 -0.09 0.00 0.30 0.00 0.00 27.48 28.13 1n3t h GLN 157 CO -0.46 -0.28 -0.31 0.82 -0.67 0.00 0.00 178.83 177.93 1n3t h ILE 158 N -0.44 0.25 0.05 2.54 2.04 -1.35 0.35 117.51 120.95 1n3t h ILE 158 Ca -0.02 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.85 1n3t h ILE 158 Cb 0.37 0.25 -0.04 0.00 -0.74 0.00 0.00 36.82 36.67 1n3t h ILE 158 CO 0.02 0.00 -0.41 0.25 0.00 0.00 0.00 178.15 178.01 1n3t h LEU 159 N -0.24 -1.24 0.36 1.44 5.85 -1.04 -0.07 115.31 120.37 1n3t h LEU 159 Ca 0.18 0.13 -0.01 0.00 0.84 0.00 0.00 57.88 59.02 1n3t h LEU 159 Cb 0.53 0.46 -0.03 0.00 0.37 0.00 0.00 40.66 41.99 1n3t h LEU 159 CO -0.53 -0.42 -0.50 0.40 -0.34 0.00 0.00 178.44 177.06 1n3t h ILE 160 N -0.55 0.00 -0.86 4.05 2.04 -0.43 0.16 117.51 121.92 1n3t h ILE 160 Ca 0.00 0.00 0.20 0.00 1.00 0.00 0.00 64.86 66.06 1n3t h ILE 160 Cb 0.57 0.00 -0.16 0.00 -0.74 0.00 0.00 36.82 36.49 1n3t h ILE 160 CO -0.24 0.00 -0.06 0.00 0.00 0.00 0.00 178.15 177.84 1n3t h ALA 161 N -0.82 0.82 -0.36 1.87 0.00 -0.19 0.32 119.26 120.90 1n3t h ALA 161 Ca -0.04 0.30 -0.03 0.00 0.00 0.00 0.00 54.91 55.14 1n3t h ALA 161 Cb 0.81 0.55 -0.02 0.00 0.00 0.00 0.00 17.79 19.13 1n3t h ALA 161 CO -0.14 -0.45 0.11 -0.07 0.00 0.00 0.00 179.25 178.70 1n3t h LEU 162 N 0.04 0.52 -0.43 0.00 3.38 -0.36 -2.05 115.31 116.41 1n3t h LEU 162 Ca 0.47 -0.21 0.07 0.00 0.09 0.00 0.00 57.88 58.29 1n3t h LEU 162 Cb 0.83 -0.14 -0.06 0.00 0.09 0.00 0.00 40.66 41.39 1n3t h LEU 162 CO -0.81 0.59 0.08 1.56 0.09 0.00 0.00 178.44 179.95 1n3t h GLN 163 N 0.42 0.21 0.12 1.13 4.20 0.15 -0.79 115.11 120.55 1n3t h GLN 163 Ca 0.11 -0.01 0.02 0.00 0.06 0.00 0.00 58.65 58.83 1n3t h GLN 163 Cb 0.26 -0.05 -0.05 0.00 0.30 0.00 0.00 27.48 27.94 1n3t h GLN 163 CO -0.00 0.14 -0.43 1.15 -0.67 0.00 0.00 178.83 179.02 1n3t h THR 164 N 0.22 0.15 -0.44 -0.54 2.02 -0.40 0.15 112.91 114.06 1n3t h THR 164 Ca 0.21 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.34 1n3t h THR 164 Cb 0.26 0.15 -0.02 0.00 -1.74 0.00 0.00 68.15 66.79 1n3t h THR 164 CO -0.27 0.00 0.08 -0.07 0.37 0.00 0.00 175.52 175.62 1n3t h LEU 165 N -0.66 0.62 -0.13 2.58 3.38 -1.16 -2.85 115.31 117.10 1n3t h LEU 165 Ca 0.02 -0.11 -0.09 0.00 0.09 0.00 0.00 57.88 57.80 1n3t h LEU 165 Cb 0.68 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 1n3t h LEU 165 CO -0.25 0.64 -0.41 -0.07 0.09 0.00 0.00 178.44 178.45 1n3t h LEU 166 N 0.65 0.00 -0.50 1.67 3.38 -0.89 -3.48 115.31 116.13 1n3t h LEU 166 Ca 0.14 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.99 1n3t h LEU 166 Cb 0.29 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.07 1n3t h LEU 166 CO 0.00 0.41 -0.20 0.61 0.09 0.00 0.00 178.44 179.35 1n3t n GLY 167 N 1.08 0.39 3.39 0.83 0.00 0.49 -4.70 105.19 106.67 1n3t n GLY 167 Ca 0.02 -0.44 -0.14 0.00 0.00 0.00 0.00 46.02 45.46 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 -2.92 0.03 -1.00 2.61 2.01 -1.01 -4.91 115.64 110.45 1n3t s THR 168 Ca 0.14 -0.26 0.23 0.00 0.31 0.00 0.00 61.69 62.11 1n3t s THR 168 Cb -0.06 -0.96 -0.12 0.00 0.01 0.00 0.00 72.50 71.37 1n3t s THR 168 CO 0.18 -0.14 1.14 0.59 -0.69 0.00 0.00 174.62 175.69 1n3t n ASN 169 N 0.49 0.77 -4.54 3.53 3.02 -1.26 -4.35 115.26 112.91 1n3t n ASN 169 Ca -0.18 -0.65 -0.37 0.00 -0.03 0.00 0.00 54.58 53.35 1n3t n ASN 169 Cb 0.60 0.65 -0.03 0.00 -0.61 0.00 0.00 39.78 40.39 1n3t n ASN 169 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1n3t n ASN 170 N -1.50 4.06 -3.73 6.41 3.02 -1.26 0.37 115.26 122.62 1n3t n ASN 170 Ca 0.05 -2.82 -0.13 0.00 -0.03 0.00 0.00 54.58 51.65 1n3t n ASN 170 Cb 0.33 -1.73 -0.11 0.00 -0.61 0.00 0.00 39.78 37.67 1n3t n ASN 170 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1n3t s VAL 171 N 7.17 -0.01 -0.03 2.41 1.01 -1.26 -2.09 120.40 127.61 1n3t s VAL 171 Ca 0.60 0.02 0.02 0.00 0.00 0.00 0.00 61.98 62.63 1n3t s VAL 171 Cb 0.03 -0.54 0.00 0.00 0.00 0.00 0.00 36.38 35.87 1n3t s VAL 171 CO 0.10 0.01 -0.09 0.00 0.00 0.00 0.00 175.10 175.12 1n3t s ALA 172 N 0.47 0.85 0.06 5.51 0.00 0.42 -1.68 121.76 127.38 1n3t s ALA 172 Ca -0.02 -0.31 0.06 0.00 0.00 0.00 0.00 51.96 51.69 1n3t s ALA 172 Cb -0.04 -0.33 -0.03 0.00 0.00 0.00 0.00 23.12 22.72 1n3t s ALA 172 CO -0.02 0.13 -0.17 0.08 0.00 0.00 0.00 175.76 175.78 1n3t s VAL 173 N 0.24 1.36 -0.18 0.00 1.01 -0.82 -1.73 120.40 120.28 1n3t s VAL 173 Ca -0.04 -1.23 -0.08 0.00 0.00 0.00 0.00 61.98 60.64 1n3t s VAL 173 Cb -0.09 -1.23 0.07 0.00 0.00 0.00 0.00 36.38 35.13 1n3t s VAL 173 CO 0.01 -0.02 0.40 -0.55 0.00 0.00 0.00 175.10 174.94 1n3t s SER 174 N -1.45 -0.32 -0.01 3.32 0.15 -0.96 0.03 113.70 114.47 1n3t s SER 174 Ca 0.03 0.91 0.05 0.00 0.70 0.00 0.00 55.95 57.64 1n3t s SER 174 Cb -0.09 1.03 -0.03 0.00 -1.71 0.00 0.00 66.02 65.23 1n3t s SER 174 CO 0.02 -0.22 -0.15 -0.63 1.20 0.00 0.00 173.24 173.47 1n3t s ILE 175 N 2.06 3.02 -0.14 6.45 1.01 -0.27 -0.76 121.20 132.57 1n3t s ILE 175 Ca -0.05 -0.89 0.01 0.00 0.00 0.00 0.00 60.65 59.71 1n3t s ILE 175 Cb -0.10 -2.23 0.02 0.00 0.01 0.00 0.00 42.46 40.16 1n3t s ILE 175 CO -0.12 0.48 -0.15 -0.62 0.00 0.00 0.00 174.94 174.53 1n3t s ASP 176 N -1.05 2.68 0.16 3.58 2.15 -0.22 -1.74 116.67 122.23 1n3t s ASP 176 Ca 0.13 -0.49 -0.21 0.00 0.43 0.00 0.00 52.55 52.41 1n3t s ASP 176 Cb -0.11 -1.19 0.06 0.00 -0.30 0.00 0.00 42.92 41.39 1n3t s ASP 176 CO 0.03 -0.04 0.56 0.00 -0.17 0.00 0.00 175.17 175.55 1n3t s ALA 177 N 1.38 -1.43 -0.21 3.66 0.00 0.08 -0.27 121.76 124.96 1n3t s ALA 177 Ca 0.03 0.34 -0.04 0.00 0.00 0.00 0.00 51.96 52.29 1n3t s ALA 177 Cb -0.13 0.85 -0.01 0.00 0.00 0.00 0.00 23.12 23.82 1n3t s ALA 177 CO -0.09 -0.75 -0.04 0.08 0.00 0.00 0.00 175.76 174.95 1n3t s VAL 178 N -3.77 3.43 -0.44 0.00 1.01 0.49 -0.80 120.40 120.32 1n3t s VAL 178 Ca 0.02 -0.48 -0.19 0.00 0.00 0.00 0.00 61.98 61.33 1n3t s VAL 178 Cb -0.01 -2.55 0.03 0.00 0.00 0.00 0.00 36.38 33.85 1n3t s VAL 178 CO -0.12 0.43 0.58 -1.00 0.00 0.00 0.00 175.10 174.99 1n3t s HIS 179 N 1.33 3.09 -0.50 5.22 3.76 -1.26 -1.50 115.29 125.43 1n3t s HIS 179 Ca 0.04 -0.23 0.16 0.00 -0.15 0.00 0.00 55.06 54.87 1n3t s HIS 179 Cb -0.14 -3.24 0.80 0.00 1.11 0.00 0.00 32.58 31.10 1n3t s HIS 179 CO -0.02 -0.85 1.48 0.66 -0.85 0.00 0.00 174.74 175.16 1n3t n TYR 180 N 6.05 0.50 0.75 1.40 4.02 -0.79 0.13 117.16 129.23 1n3t n TYR 180 Ca -0.04 0.25 0.10 0.00 -0.01 0.00 0.00 57.90 58.19 1n3t n TYR 180 Cb 0.47 -0.90 0.45 0.00 -0.02 0.00 0.00 39.34 39.34 1n3t n TYR 180 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 1n3t n SER 181 N -2.00 0.00 -0.00 7.72 3.41 -1.26 -0.72 113.62 120.77 1n3t n SER 181 Ca -0.00 0.37 0.03 0.00 -0.26 0.00 0.00 58.87 59.01 1n3t n SER 181 Cb 0.06 -0.45 -0.05 0.00 -0.26 0.00 0.00 64.21 63.52 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 -1.45 0.00 -0.09 -3.33 0.31 0.12 -4.51 118.33 109.39 1n3t n VAL 182 Ca 0.06 -0.24 -0.13 0.00 -0.01 0.00 0.00 64.34 64.02 1n3t n VAL 182 Cb 0.21 0.64 -0.08 0.00 -0.91 0.00 0.00 33.84 33.71 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 -1.47 0.43 -0.57 5.55 4.81 -1.01 -0.95 118.16 124.95 1n3t n LYS 183 Ca -0.00 0.11 0.09 0.00 -0.87 0.00 0.00 58.31 57.64 1n3t n LYS 183 Cb 0.14 -1.33 0.34 0.00 0.02 0.00 0.00 35.03 34.20 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 -3.09 3.02 -3.60 3.14 0.00 0.10 -3.73 120.51 116.36 1n3t n ALA 184 Ca -0.31 -1.64 -0.07 0.00 0.00 0.00 0.00 53.44 51.41 1n3t n ALA 184 Cb 0.82 -0.94 -0.05 0.00 0.00 0.00 0.00 19.45 19.29 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 -1.89 0.38 6.06 0.00 3.52 -1.25 -4.98 118.95 120.80 1n3t s ARG 185 Ca 0.48 0.09 0.00 0.00 -0.13 0.00 0.00 55.73 56.17 1n3t s ARG 185 Cb 0.32 0.18 0.00 0.00 -1.56 0.00 0.00 34.95 33.89 1n3t s ARG 185 CO 0.22 -0.12 0.00 0.41 -0.81 0.00 0.00 175.30 175.00 1n3t n GLY 186 N 0.64 1.73 0.16 8.12 0.00 -1.26 -3.06 105.19 111.51 1n3t n GLY 186 Ca -0.06 -0.33 0.13 0.00 0.00 0.00 0.00 46.02 45.76 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 0.00 -6.43 -0.61 2.04 -1.87 -3.48 117.51 107.17 1n3t h ILE 187 Ca 0.00 -0.53 -0.37 0.00 1.00 0.00 0.00 64.86 64.96 1n3t h ILE 187 Cb 0.00 1.46 0.00 0.00 -0.74 0.00 0.00 36.82 37.54 1n3t h ILE 187 CO 0.00 0.00 -0.86 0.54 0.00 0.00 0.00 178.15 177.83 1n3t n ARG 188 N -2.54 -1.52 -3.51 2.37 1.74 -1.17 -4.91 116.66 107.11 1n3t n ARG 188 Ca 0.04 0.96 -0.42 0.00 -0.77 0.00 0.00 57.85 57.65 1n3t n ARG 188 Cb 0.39 -3.07 -0.09 0.00 -1.02 0.00 0.00 32.46 28.67 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 -2.93 5.83 0.53 0.55 -1.08 -0.13 -4.93 116.67 114.51 1n3t s ASP 189 Ca 0.02 -1.53 0.31 0.00 -0.52 0.00 0.00 52.55 50.83 1n3t s ASP 189 Cb -0.00 -2.06 1.22 0.00 -1.46 0.00 0.00 42.92 40.61 1n3t s ASP 189 CO 0.86 -0.61 1.93 0.00 0.52 0.00 0.00 175.17 177.87 1n3t h ALA 190 N 8.55 1.01 0.00 3.66 0.00 -1.85 -3.36 119.26 127.26 1n3t h ALA 190 Ca -0.25 -0.03 -0.31 0.00 0.00 0.00 0.00 54.91 54.32 1n3t h ALA 190 Cb 1.09 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.82 1n3t h ALA 190 CO 0.83 0.05 -2.27 0.25 0.00 0.00 0.00 179.25 178.11 1n3t n THR 191 N -3.14 1.18 -0.81 0.00 -2.24 -1.26 -5.02 114.28 102.99 1n3t n THR 191 Ca 0.01 -0.77 -0.31 0.00 -2.27 0.00 0.00 64.05 60.70 1n3t n THR 191 Cb 0.34 -0.45 0.15 0.00 -2.10 0.00 0.00 70.33 68.28 1n3t n THR 191 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1n3t s SER 192 N -5.24 3.21 -0.13 3.42 1.04 -1.26 -5.05 113.70 109.69 1n3t s SER 192 Ca -0.09 2.14 -0.25 0.00 0.48 0.00 0.00 55.95 58.23 1n3t s SER 192 Cb 0.06 -2.56 0.06 0.00 0.10 0.00 0.00 66.02 63.68 1n3t s SER 192 CO 0.78 -2.91 0.61 0.00 0.98 0.00 0.00 173.24 172.70 1n3t s ALA 193 N -2.68 -1.55 -0.08 5.32 0.00 -1.26 -4.86 121.76 116.65 1n3t s ALA 193 Ca 0.66 1.40 -0.01 0.00 0.00 0.00 0.00 51.96 54.01 1n3t s ALA 193 Cb -0.22 -0.45 -0.03 0.00 0.00 0.00 0.00 23.12 22.42 1n3t s ALA 193 CO 0.57 -0.32 -0.03 0.99 0.00 0.00 0.00 175.76 176.97 1n3t s THR 194 N -0.53 4.06 -0.07 0.00 2.01 0.02 -4.94 115.64 116.20 1n3t s THR 194 Ca -0.06 -0.34 0.04 0.00 0.31 0.00 0.00 61.69 61.63 1n3t s THR 194 Cb -0.03 -2.69 0.00 0.00 0.01 0.00 0.00 72.50 69.79 1n3t s THR 194 CO 0.05 0.60 -0.19 -0.89 -0.69 0.00 0.00 174.62 173.51 1n3t s THR 195 N -0.84 1.62 0.00 -0.82 2.01 -1.26 -0.74 115.64 115.61 1n3t s THR 195 Ca 0.13 -0.79 0.02 0.00 0.31 0.00 0.00 61.69 61.35 1n3t s THR 195 Cb -0.11 -1.40 -0.01 0.00 0.01 0.00 0.00 72.50 70.99 1n3t s THR 195 CO 0.02 0.46 -0.05 0.42 -0.69 0.00 0.00 174.62 174.78 1n3t s THR 196 N 0.26 0.39 0.22 -0.82 -4.23 -0.71 -5.02 115.64 105.72 1n3t s THR 196 Ca -0.11 -0.28 0.03 0.00 -1.18 0.00 0.00 61.69 60.15 1n3t s THR 196 Cb -0.15 -0.34 -0.05 0.00 1.34 0.00 0.00 72.50 73.30 1n3t s THR 196 CO 0.05 0.06 0.00 0.42 -0.54 0.00 0.00 174.62 174.61 1n3t s THR 197 N -0.23 0.91 -0.32 3.99 -4.23 -1.26 -1.12 115.64 113.38 1n3t s THR 197 Ca 0.01 -2.02 0.00 0.00 -1.18 0.00 0.00 61.69 58.50 1n3t s THR 197 Cb -0.03 -2.30 0.14 0.00 1.34 0.00 0.00 72.50 71.65 1n3t s THR 197 CO -0.00 -0.35 0.29 -0.44 -0.54 0.00 0.00 174.62 173.58 1n3t s SER 198 N -3.27 1.90 -0.17 3.99 0.01 0.10 -4.97 113.70 111.29 1n3t s SER 198 Ca 0.28 -1.24 -0.21 0.00 1.31 0.00 0.00 55.95 56.08 1n3t s SER 198 Cb 0.06 0.31 -0.03 0.00 0.21 0.00 0.00 66.02 66.58 1n3t s SER 198 CO 0.08 -0.35 0.65 -0.76 0.41 0.00 0.00 173.24 173.27 1n3t s LEU 199 N 1.90 4.17 0.43 2.44 1.43 -1.26 -1.95 118.68 125.84 1n3t s LEU 199 Ca 0.13 0.91 0.06 0.00 -1.03 0.00 0.00 54.13 54.20 1n3t s LEU 199 Cb -0.16 -2.94 -0.06 0.00 0.03 0.00 0.00 46.19 43.06 1n3t s LEU 199 CO -0.21 -0.26 0.05 -0.83 0.23 0.00 0.00 176.35 175.34 1n3t s GLY 200 N 1.12 2.56 0.00 -3.19 0.00 -0.68 -4.51 107.32 102.62 1n3t s GLY 200 Ca 0.31 -1.92 0.00 0.00 0.00 0.00 0.00 44.72 43.11 1n3t s GLY 200 CO 0.11 -2.08 0.00 0.61 0.00 0.00 0.00 173.10 171.74 1n3t n GLY 201 N -1.09 1.27 0.34 0.20 0.00 0.16 -0.82 105.19 105.25 1n3t n GLY 201 Ca -0.07 -0.44 0.16 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.12 0.99 3.38 -1.95 0.88 115.31 118.49 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 -2.94 0.13 0.01 1.13 3.72 0.00 -1.12 117.46 118.40 1n3t n PHE 203 Ca -0.02 0.05 0.01 0.00 -0.05 0.00 0.00 57.45 57.44 1n3t n PHE 203 Cb 0.35 -0.58 -0.01 0.00 -0.94 0.00 0.00 39.48 38.29 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 -1.62 1.21 -0.10 -1.08 4.81 0.29 -4.33 118.16 117.33 1n3t n LYS 204 Ca 0.03 -0.01 -0.15 0.00 -0.87 0.00 0.00 58.31 57.30 1n3t n LYS 204 Cb 0.16 -0.96 -0.09 0.00 0.02 0.00 0.00 35.03 34.16 1n3t n LYS 204 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 1n3t n SER 205 N -1.47 2.30 -4.55 3.14 3.41 -1.15 -4.90 113.62 110.40 1n3t n SER 205 Ca -0.00 -0.08 -0.42 0.00 -0.26 0.00 0.00 58.87 58.11 1n3t n SER 205 Cb 0.04 -0.36 -0.03 0.00 -0.26 0.00 0.00 64.21 63.60 1n3t n SER 205 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1n3t s SER 206 N -6.11 6.29 0.33 4.04 0.15 -0.28 -4.90 113.70 113.22 1n3t s SER 206 Ca -0.28 -0.29 0.12 0.00 0.70 0.00 0.00 55.95 56.20 1n3t s SER 206 Cb 0.08 -2.53 0.96 0.00 -1.71 0.00 0.00 66.02 62.82 1n3t s SER 206 CO 0.47 -1.60 1.71 -0.61 1.20 0.00 0.00 173.24 174.41 1n3t h GLN 207 N 9.73 0.48 0.31 5.44 5.75 -1.90 0.61 115.11 135.52 1n3t h GLN 207 Ca -0.27 -0.03 -0.02 0.00 -0.15 0.00 0.00 58.65 58.19 1n3t h GLN 207 Cb 1.06 -0.11 0.00 0.00 1.07 0.00 0.00 27.48 29.50 1n3t h GLN 207 CO 1.22 0.32 -0.15 -0.97 -2.65 0.00 0.00 178.83 176.59 1n3t h ASN 208 N 0.50 -0.36 -0.83 -0.69 -1.24 -1.93 -3.02 115.58 108.02 1n3t h ASN 208 Ca 0.67 0.01 0.20 0.00 0.71 0.00 0.00 56.30 57.89 1n3t h ASN 208 Cb 1.38 0.09 -0.12 0.00 0.73 0.00 0.00 38.32 40.40 1n3t h ASN 208 CO -0.50 -0.20 0.27 0.74 -1.29 0.00 0.00 177.43 176.46 1n3t h THR 209 N -0.54 0.46 0.08 -3.57 2.02 -1.67 -1.63 112.91 108.07 1n3t h THR 209 Ca -0.04 -0.11 0.00 0.00 0.77 0.00 0.00 66.41 67.03 1n3t h THR 209 Cb 0.32 0.12 -0.02 0.00 -1.74 0.00 0.00 68.15 66.84 1n3t h THR 209 CO 0.07 0.06 -0.22 -0.09 0.37 0.00 0.00 175.52 175.71 1n3t h ARG 210 N 0.31 -0.32 -0.77 6.66 2.43 -0.97 -2.60 114.38 119.11 1n3t h ARG 210 Ca 0.49 0.02 0.07 0.00 -0.81 0.00 0.00 59.98 59.76 1n3t h ARG 210 Cb 0.91 0.07 -0.06 0.00 -0.42 0.00 0.00 29.97 30.47 1n3t h ARG 210 CO -0.54 -0.22 0.45 0.45 -1.51 0.00 0.00 179.97 178.60 1n3t h HIS 211 N -0.34 0.82 -1.11 2.20 3.86 -1.32 0.14 115.15 119.40 1n3t h HIS 211 Ca -0.01 0.03 0.31 0.00 -1.16 0.00 0.00 60.37 59.54 1n3t h HIS 211 Cb 0.33 -0.25 -0.10 0.00 1.06 0.00 0.00 27.41 28.44 1n3t h HIS 211 CO -0.32 0.37 0.71 0.93 0.86 0.00 0.00 177.93 180.48 1n3t h GLU 212 N 0.79 0.30 0.04 2.45 5.08 -1.11 0.15 114.58 122.29 1n3t h GLU 212 Ca 0.35 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.69 1n3t h GLU 212 Cb 0.25 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.43 1n3t h GLU 212 CO -0.21 0.20 -0.02 0.35 -1.00 0.00 0.00 179.01 178.33 1n3t h PHE 213 N 0.31 -0.05 -1.00 4.33 3.57 -0.62 -3.14 116.94 120.34 1n3t h PHE 213 Ca 0.65 -0.00 0.33 0.00 3.53 0.00 0.00 57.97 62.48 1n3t h PHE 213 Cb 1.77 0.02 -0.18 0.00 2.79 0.00 0.00 35.95 40.35 1n3t h PHE 213 CO -0.00 -0.03 0.24 -0.07 -2.23 0.00 0.00 178.31 176.21 1n3t h LEU 214 N -0.25 -0.15 -0.88 0.59 3.38 -0.83 1.09 115.31 118.26 1n3t h LEU 214 Ca -0.01 0.27 -0.05 0.00 0.09 0.00 0.00 57.88 58.19 1n3t h LEU 214 Cb 0.04 0.40 -0.03 0.00 0.09 0.00 0.00 40.66 41.16 1n3t h LEU 214 CO 0.01 -0.39 0.28 -0.09 0.09 0.00 0.00 178.44 178.34 1n3t h ARG 215 N 0.01 1.10 -0.65 1.13 2.43 -0.86 -1.93 114.38 115.61 1n3t h ARG 215 Ca 0.70 -0.20 0.00 0.00 -0.81 0.00 0.00 59.98 59.67 1n3t h ARG 215 Cb 1.65 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 31.02 1n3t h ARG 215 CO -0.86 0.90 0.00 0.00 -1.51 0.00 0.00 179.97 178.50 1n3t n ALA 216 N -2.44 2.36 -2.65 2.80 0.00 0.37 -4.82 120.51 116.13 1n3t n ALA 216 Ca 0.06 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.27 1n3t n ALA 216 Cb 0.19 -1.00 -0.07 0.00 0.00 0.00 0.00 19.45 18.57 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 -1.28 3.49 -0.32 0.00 1.01 -0.73 -4.86 120.40 117.72 1n3t s VAL 217 Ca 0.00 -1.86 -0.04 0.00 0.00 0.00 0.00 61.98 60.07 1n3t s VAL 217 Cb 0.00 -2.86 0.01 0.00 0.00 0.00 0.00 36.38 33.53 1n3t s VAL 217 CO 0.00 -0.35 0.35 -1.14 0.00 0.00 0.00 175.10 173.96 1n3t n ARG 218 N -0.84 -1.00 -4.42 2.72 0.00 -1.26 -5.05 116.66 106.81 1n3t n ARG 218 Ca -0.07 1.21 -0.26 0.00 -0.00 0.00 0.00 57.85 58.73 1n3t n ARG 218 Cb 0.59 -3.79 -0.11 0.00 0.00 0.00 0.00 32.46 29.15 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 -2.44 2.35 -0.21 -0.14 3.76 -1.26 -5.14 115.29 112.21 1n3t s HIS 219 Ca 0.07 -0.33 0.02 0.00 -0.15 0.00 0.00 55.06 54.66 1n3t s HIS 219 Cb -0.02 -1.13 0.04 0.00 1.11 0.00 0.00 32.58 32.59 1n3t s HIS 219 CO 0.41 0.55 -0.14 -1.58 -0.85 0.00 0.00 174.74 173.13 1n3t s HIS 220 N -1.88 2.83 0.00 1.40 2.46 -1.26 -4.89 115.29 113.95 1n3t s HIS 220 Ca 0.24 -1.85 0.00 0.00 0.47 0.00 0.00 55.06 53.91 1n3t s HIS 220 Cb -0.07 -1.83 0.00 0.00 -0.13 0.00 0.00 32.58 30.54 1n3t s HIS 220 CO 0.12 -0.81 0.00 0.09 -2.47 0.00 0.00 174.74 171.67