#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 0.00 0.00 -4.19 2.46 4.77 -1.26 -4.98 117.00 113.79 1n3t n LEU 3 Ca 0.00 0.00 -0.16 0.00 -0.03 0.00 0.00 56.01 55.82 1n3t n LEU 3 Cb 0.00 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 40.98 1n3t n LEU 3 CO 0.00 0.00 -0.43 -0.94 -1.33 0.00 0.00 177.39 174.69 1n3t s SER 4 N 1.00 1.65 0.14 -1.43 1.04 -1.26 -5.07 113.70 109.78 1n3t s SER 4 Ca 0.00 -0.77 -0.30 0.00 0.48 0.00 0.00 55.95 55.36 1n3t s SER 4 Cb 0.00 -0.03 -0.05 0.00 0.10 0.00 0.00 66.02 66.04 1n3t s SER 4 CO 0.00 -0.19 1.56 0.11 0.98 0.00 0.00 173.24 175.70 1n3t h LYS 5 N 3.69 -0.36 0.04 4.02 1.57 -2.02 -2.03 116.57 121.48 1n3t h LYS 5 Ca -0.39 0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.42 1n3t h LYS 5 Cb 1.19 0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.58 1n3t h LYS 5 CO 0.50 -0.24 -0.02 0.93 -0.57 0.00 0.00 179.45 180.04 1n3t h GLU 6 N -0.38 -0.06 -0.86 3.15 3.07 -1.98 -2.45 114.58 115.08 1n3t h GLU 6 Ca 0.11 0.00 0.14 0.00 -0.50 0.00 0.00 59.36 59.11 1n3t h GLU 6 Cb 0.60 0.01 -0.15 0.00 -0.84 0.00 0.00 28.75 28.37 1n3t h GLU 6 CO -0.57 -0.01 -0.35 0.00 -1.40 0.00 0.00 179.01 176.68 1n3t h ALA 7 N 0.87 0.17 0.58 3.43 0.00 -1.81 0.12 119.26 122.62 1n3t h ALA 7 Ca -0.01 0.26 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 1n3t h ALA 7 Cb 0.07 0.89 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 1n3t h ALA 7 CO 0.01 -0.60 -0.48 0.00 0.00 0.00 0.00 179.25 178.18 1n3t h ALA 8 N 1.35 -1.13 -0.49 0.00 0.00 -1.16 0.24 119.26 118.07 1n3t h ALA 8 Ca 0.33 -0.20 0.08 0.00 0.00 0.00 0.00 54.91 55.11 1n3t h ALA 8 Cb 0.59 0.66 -0.10 0.00 0.00 0.00 0.00 17.79 18.94 1n3t h ALA 8 CO -0.89 -1.17 -0.43 -0.07 0.00 0.00 0.00 179.25 176.70 1n3t h LEU 9 N -1.04 -1.45 0.15 0.00 3.38 -0.78 0.45 115.31 116.03 1n3t h LEU 9 Ca -0.07 0.23 0.02 0.00 0.09 0.00 0.00 57.88 58.14 1n3t h LEU 9 Cb 0.88 0.65 -0.03 0.00 0.09 0.00 0.00 40.66 42.24 1n3t h LEU 9 CO -0.01 -0.35 -0.30 0.58 0.09 0.00 0.00 178.44 178.46 1n3t h VAL 10 N -0.28 0.36 -0.32 1.22 2.07 -0.60 -0.53 116.25 118.17 1n3t h VAL 10 Ca 0.16 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.75 1n3t h VAL 10 Cb 0.57 0.36 -0.07 0.00 -1.52 0.00 0.00 31.29 30.63 1n3t h VAL 10 CO -0.63 0.00 -0.16 -0.74 0.02 0.00 0.00 177.57 176.06 1n3t h HIS 11 N -0.54 -0.39 -0.58 1.57 -0.00 0.42 -2.07 115.15 113.56 1n3t h HIS 11 Ca 0.02 0.04 0.08 0.00 -0.00 0.00 0.00 60.37 60.51 1n3t h HIS 11 Cb 0.55 0.22 -0.06 0.00 -0.00 0.00 0.00 27.41 28.12 1n3t h HIS 11 CO -0.25 -0.23 0.25 0.93 -0.00 0.00 0.00 177.93 178.62 1n3t h GLU 12 N -0.11 0.44 -0.86 5.26 5.08 0.24 -1.47 114.58 123.16 1n3t h GLU 12 Ca 0.17 -0.03 0.06 0.00 -1.00 0.00 0.00 59.36 58.56 1n3t h GLU 12 Cb 0.36 -0.10 -0.05 0.00 0.50 0.00 0.00 28.75 29.46 1n3t h GLU 12 CO -0.39 0.29 0.56 0.00 -1.00 0.00 0.00 179.01 178.47 1n3t h ALA 13 N 1.37 1.54 -0.04 3.43 0.00 -0.44 -0.39 119.26 124.72 1n3t h ALA 13 Ca 0.28 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 55.05 1n3t h ALA 13 Cb 0.30 -0.26 0.01 0.00 0.00 0.00 0.00 17.79 17.83 1n3t h ALA 13 CO -0.25 0.34 -0.43 -0.07 0.00 0.00 0.00 179.25 178.84 1n3t h LEU 14 N 0.99 0.44 -0.80 0.00 3.38 -0.83 -2.96 115.31 115.53 1n3t h LEU 14 Ca 0.37 -0.71 0.08 0.00 0.09 0.00 0.00 57.88 57.70 1n3t h LEU 14 Cb 0.17 -0.13 -0.07 0.00 0.09 0.00 0.00 40.66 40.72 1n3t h LEU 14 CO -0.13 1.09 0.46 0.58 0.09 0.00 0.00 178.44 180.53 1n3t h VAL 15 N -0.17 0.96 -0.34 1.22 2.07 -0.94 0.23 116.25 119.28 1n3t h VAL 15 Ca -0.04 -0.28 0.07 0.00 0.82 0.00 0.00 66.70 67.26 1n3t h VAL 15 Cb 1.12 0.07 -0.06 0.00 -1.52 0.00 0.00 31.29 30.90 1n3t h VAL 15 CO 0.09 0.15 -0.06 0.00 0.02 0.00 0.00 177.57 177.77 1n3t h ALA 16 N 1.42 0.26 0.00 1.67 0.00 -1.09 -2.20 119.26 119.31 1n3t h ALA 16 Ca 0.37 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.40 1n3t h ALA 16 Cb 0.27 0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1n3t h ALA 16 CO -0.21 -0.44 0.00 -2.13 0.00 0.00 0.00 179.25 176.47 1n3t n ARG 17 N -5.24 0.27 -0.87 0.00 3.00 -0.49 -4.92 116.66 108.41 1n3t n ARG 17 Ca 0.01 0.22 0.00 0.00 -0.00 0.00 0.00 57.85 58.08 1n3t n ARG 17 Cb 0.19 -1.81 0.00 0.00 0.00 0.00 0.00 32.46 30.83 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 1.28 0.47 0.76 5.14 0.00 0.71 -4.93 105.19 108.62 1n3t n GLY 18 Ca 0.05 -0.94 0.10 0.00 0.00 0.00 0.00 46.02 45.24 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 0.00 2.27 -4.76 0.99 4.77 -0.66 -4.92 117.00 114.68 1n3t n LEU 19 Ca 0.00 -0.99 -0.39 0.00 -0.03 0.00 0.00 56.01 54.60 1n3t n LEU 19 Cb 0.01 -0.18 -0.05 0.00 -2.33 0.00 0.00 43.42 40.87 1n3t n LEU 19 CO 0.00 0.50 0.73 -1.61 -1.33 0.00 0.00 177.39 175.67 1n3t s GLU 20 N -1.65 4.64 -0.02 3.23 0.41 -1.25 -4.81 118.70 119.25 1n3t s GLU 20 Ca 0.33 1.63 -0.32 0.00 -0.41 0.00 0.00 54.97 56.20 1n3t s GLU 20 Cb 0.18 -3.10 -0.11 0.00 -1.78 0.00 0.00 34.13 29.33 1n3t s GLU 20 CO 0.27 0.26 1.91 2.41 -0.49 0.00 0.00 175.26 179.61 1n3t n THR 21 N 1.05 0.62 -1.50 3.63 -1.04 -1.26 -4.74 114.28 111.04 1n3t n THR 21 Ca -0.00 -0.11 -0.34 0.00 -2.04 0.00 0.00 64.05 61.55 1n3t n THR 21 Cb 0.47 -2.05 -0.17 0.00 -1.82 0.00 0.00 70.33 66.75 1n3t n THR 21 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 1n3t n PRO 22 N 6.80 0.05 -4.26 -2.82 -0.02 -1.26 -4.91 135.00 128.59 1n3t n PRO 22 Ca 0.21 -0.02 -0.25 0.00 -2.02 0.00 0.00 63.50 61.43 1n3t n PRO 22 Cb 0.34 -1.45 -0.08 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 6.42 3.06 -0.01 2.45 1.02 -1.26 -5.15 118.68 125.21 1n3t s LEU 23 Ca 1.33 -1.01 0.08 0.00 0.02 0.00 0.00 54.13 54.55 1n3t s LEU 23 Cb -1.07 -1.41 -0.02 0.00 0.02 0.00 0.00 46.19 43.71 1n3t s LEU 23 CO 0.50 -0.36 -0.25 -0.60 0.02 0.00 0.00 176.35 175.67 1n3t s ARG 24 N -3.79 2.08 -0.31 1.70 3.52 -1.26 -5.07 118.95 115.81 1n3t s ARG 24 Ca 0.37 -0.95 -0.41 0.00 -0.13 0.00 0.00 55.73 54.61 1n3t s ARG 24 Cb 0.01 -2.07 -0.16 0.00 -1.56 0.00 0.00 34.95 31.17 1n3t s ARG 24 CO 0.21 0.55 1.71 -2.30 -0.81 0.00 0.00 175.30 174.66 1n3t n PRO 25 N 2.24 0.93 -0.03 5.12 -0.02 -1.26 -4.77 135.00 137.22 1n3t n PRO 25 Ca -0.16 0.34 0.24 0.00 -2.02 0.00 0.00 63.50 61.90 1n3t n PRO 25 Cb 0.51 -1.99 0.72 0.00 -0.02 0.00 0.00 33.50 32.72 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 6.72 0.00 0.00 0.52 0.11 -2.06 -3.45 132.00 133.85 1n3t h PRO 26 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1n3t h PRO 26 Cb 1.33 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.44 1n3t h PRO 26 CO 0.96 0.00 0.00 0.28 -0.21 0.00 0.00 178.00 179.03 1n3t n VAL 27 N -3.92 0.00 -3.24 3.15 0.31 -1.26 -4.65 118.33 108.72 1n3t n VAL 27 Ca 0.12 0.00 -0.29 0.00 -0.01 0.00 0.00 64.34 64.16 1n3t n VAL 27 Cb 0.79 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 33.69 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 3.47 -1.15 3.52 -3.43 -1.26 -5.02 115.29 111.42 1n3t s HIS 28 Ca 0.00 0.74 -0.06 0.00 -0.80 0.00 0.00 55.06 54.95 1n3t s HIS 28 Cb 0.00 -2.19 0.25 0.00 -1.43 0.00 0.00 32.58 29.22 1n3t s HIS 28 CO 0.00 0.12 1.70 0.39 -2.00 0.00 0.00 174.74 174.94 1n3t n GLU 29 N -0.96 4.31 -1.62 -0.38 1.02 -1.26 -5.02 120.64 116.73 1n3t n GLU 29 Ca -0.01 -4.18 -0.43 0.00 -0.02 0.00 0.00 57.16 52.52 1n3t n GLU 29 Cb 0.54 -2.64 -0.01 0.00 -0.02 0.00 0.00 31.44 29.31 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 2.02 1.57 -1.63 3.49 0.00 -1.26 -4.81 117.12 116.50 1n3t n MET 30 Ca 0.34 0.55 -0.50 0.00 -0.00 0.00 0.00 57.70 58.09 1n3t n MET 30 Cb 0.33 -2.02 -0.05 0.00 0.00 0.00 0.00 33.22 31.48 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 0.96 2.23 -0.24 6.12 2.03 -1.26 -4.89 116.55 121.50 1n3t n ASP 31 Ca 0.08 1.10 0.02 0.00 0.52 0.00 0.00 54.79 56.51 1n3t n ASP 31 Cb 0.35 -1.27 0.15 0.00 -0.72 0.00 0.00 41.12 39.62 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 5.35 0.37 0.90 1.67 -1.24 -2.02 0.95 115.58 121.57 1n3t h ASN 32 Ca -0.47 0.08 0.00 0.00 0.71 0.00 0.00 56.30 56.62 1n3t h ASN 32 Cb 1.31 0.02 0.00 0.00 0.73 0.00 0.00 38.32 40.38 1n3t h ASN 32 CO 0.83 0.20 0.00 -0.33 -1.29 0.00 0.00 177.43 176.84 1n3t h GLU 33 N 0.52 0.00 -0.06 6.67 5.08 -2.01 -2.59 114.58 122.20 1n3t h GLU 33 Ca 0.36 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.54 1n3t h GLU 33 Cb 0.44 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 1n3t h GLU 33 CO -0.31 0.00 -0.74 1.15 -1.00 0.00 0.00 179.01 178.11 1n3t h THR 34 N 0.00 1.40 -0.20 1.13 2.02 -1.17 -3.07 112.91 113.02 1n3t h THR 34 Ca 0.00 -2.21 -0.10 0.00 0.77 0.00 0.00 66.41 64.87 1n3t h THR 34 Cb 0.45 2.17 -0.00 0.00 -1.74 0.00 0.00 68.15 69.03 1n3t h THR 34 CO 0.00 0.66 -0.26 0.03 0.37 0.00 0.00 175.52 176.32 1n3t h ARG 35 N 0.22 0.53 -0.76 6.66 3.08 -1.17 -3.07 114.38 119.88 1n3t h ARG 35 Ca -0.03 -0.30 0.06 0.00 0.07 0.00 0.00 59.98 59.77 1n3t h ARG 35 Cb 1.31 0.02 -0.05 0.00 0.08 0.00 0.00 29.97 31.34 1n3t h ARG 35 CO 0.12 0.90 0.50 0.87 -1.07 0.00 0.00 179.97 181.29 1n3t h LYS 36 N 0.20 0.81 0.00 0.04 1.57 -1.57 -0.73 116.57 116.89 1n3t h LYS 36 Ca 0.02 -0.05 -0.10 0.00 -1.87 0.00 0.00 60.65 58.66 1n3t h LYS 36 Cb 0.83 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.94 1n3t h LYS 36 CO 0.06 0.53 -0.47 0.66 -0.57 0.00 0.00 179.45 179.67 1n3t h SER 37 N 0.83 0.00 0.09 0.86 4.64 -1.52 -1.43 113.55 117.03 1n3t h SER 37 Ca 0.32 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.64 1n3t h SER 37 Cb 0.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 1n3t h SER 37 CO -0.11 0.47 -0.04 -0.07 -0.87 0.00 0.00 176.83 176.21 1n3t h LEU 38 N 0.00 -0.10 -0.67 5.97 3.38 -1.14 -2.88 115.31 119.87 1n3t h LEU 38 Ca -0.00 -0.36 0.08 0.00 0.09 0.00 0.00 57.88 57.69 1n3t h LEU 38 Cb 0.89 0.03 -0.07 0.00 0.09 0.00 0.00 40.66 41.60 1n3t h LEU 38 CO 0.06 0.53 0.33 0.40 0.09 0.00 0.00 178.44 179.85 1n3t h ILE 39 N -0.96 0.86 -0.75 1.22 2.04 -1.25 0.31 117.51 118.98 1n3t h ILE 39 Ca -0.01 -0.20 0.14 0.00 1.00 0.00 0.00 64.86 65.79 1n3t h ILE 39 Cb 0.46 0.24 -0.09 0.00 -0.74 0.00 0.00 36.82 36.69 1n3t h ILE 39 CO 0.02 0.10 0.31 0.00 0.00 0.00 0.00 178.15 178.58 1n3t h ALA 40 N 1.40 1.05 0.71 1.87 0.00 -1.36 0.45 119.26 123.38 1n3t h ALA 40 Ca 0.32 0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.31 1n3t h ALA 40 Cb 0.32 0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.19 1n3t h ALA 40 CO -0.25 -0.19 -0.34 0.78 0.00 0.00 0.00 179.25 179.25 1n3t h GLY 41 N 0.46 -1.00 0.02 0.00 0.00 -0.75 0.85 103.07 102.65 1n3t h GLY 41 Ca 0.41 0.37 0.23 0.00 0.00 0.00 0.00 47.33 48.34 1n3t h GLY 41 CO -0.39 -0.36 0.64 0.45 0.00 0.00 0.00 176.54 176.88 1n3t h HIS 42 N -0.99 0.73 -0.39 5.60 -0.00 -0.34 0.50 115.15 120.25 1n3t h HIS 42 Ca -0.10 0.02 -0.15 0.00 -0.00 0.00 0.00 60.37 60.15 1n3t h HIS 42 Cb 0.74 -0.22 -0.01 0.00 -0.00 0.00 0.00 27.41 27.93 1n3t h HIS 42 CO -0.02 0.12 -0.35 0.52 -0.00 0.00 0.00 177.93 178.20 1n3t h MET 43 N 0.48 0.93 -0.32 2.45 2.86 -0.53 -1.50 114.93 119.31 1n3t h MET 43 Ca 0.57 -0.47 0.07 0.00 -2.06 0.00 0.00 59.70 57.80 1n3t h MET 43 Cb 1.29 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.94 1n3t h MET 43 CO -0.29 1.13 0.22 1.15 1.06 0.00 0.00 176.91 180.18 1n3t h THR 44 N 0.75 0.90 0.14 2.22 2.02 0.24 -0.33 112.91 118.85 1n3t h THR 44 Ca 0.07 -0.04 -0.01 0.00 0.77 0.00 0.00 66.41 67.20 1n3t h THR 44 Cb 0.94 0.78 0.00 0.00 -1.74 0.00 0.00 68.15 68.13 1n3t h THR 44 CO 0.09 0.02 -0.07 -0.33 0.37 0.00 0.00 175.52 175.60 1n3t h GLU 45 N 0.11 -0.19 -0.85 6.66 4.39 -0.56 -2.96 114.58 121.19 1n3t h GLU 45 Ca 0.15 0.01 0.13 0.00 0.34 0.00 0.00 59.36 59.99 1n3t h GLU 45 Cb 0.44 0.04 -0.06 0.00 -0.10 0.00 0.00 28.75 29.07 1n3t h GLU 45 CO -0.02 0.26 0.55 0.82 -1.16 0.00 0.00 179.01 179.47 1n3t h ILE 46 N -0.85 0.85 0.00 3.13 2.04 -0.68 0.16 117.51 122.16 1n3t h ILE 46 Ca -0.02 -0.23 -0.07 0.00 1.00 0.00 0.00 64.86 65.55 1n3t h ILE 46 Cb 0.53 0.14 -0.01 0.00 -0.74 0.00 0.00 36.82 36.74 1n3t h ILE 46 CO 0.03 0.12 -0.31 0.24 0.00 0.00 0.00 178.15 178.23 1n3t h MET 47 N 0.66 0.00 0.06 2.37 2.86 -1.14 -2.51 114.93 117.23 1n3t h MET 47 Ca 0.42 0.00 -0.24 0.00 -2.06 0.00 0.00 59.70 57.82 1n3t h MET 47 Cb 0.68 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.33 1n3t h MET 47 CO -0.18 0.31 -1.12 1.96 1.06 0.00 0.00 176.91 178.94 1n3t h GLN 48 N 0.00 0.13 0.00 1.72 4.20 -0.62 -2.15 115.11 118.39 1n3t h GLN 48 Ca -0.00 -0.22 0.00 0.00 0.06 0.00 0.00 58.65 58.49 1n3t h GLN 48 Cb 0.85 0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.71 1n3t h GLN 48 CO 0.04 1.10 0.00 -0.07 -0.67 0.00 0.00 178.83 179.23 1n3t h LEU 49 N 0.03 0.00 -3.41 1.46 3.38 -0.49 -1.68 115.31 114.59 1n3t h LEU 49 Ca -0.07 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.76 1n3t h LEU 49 Cb 1.87 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 42.54 1n3t h LEU 49 CO 0.16 0.00 0.05 0.18 0.09 0.00 0.00 178.44 178.93 1n3t n LEU 50 N -2.40 4.49 -4.20 1.67 4.77 -1.00 -4.96 117.00 115.38 1n3t n LEU 50 Ca 0.00 -3.38 -0.30 0.00 -0.03 0.00 0.00 56.01 52.31 1n3t n LEU 50 Cb 0.17 -0.63 -0.07 0.00 -2.33 0.00 0.00 43.42 40.56 1n3t n LEU 50 CO 0.17 0.94 -0.34 0.59 -1.33 0.00 0.00 177.39 177.42 1n3t n ASN 51 N -0.74 0.03 -4.49 -1.43 3.02 -0.63 -4.92 115.26 106.10 1n3t n ASN 51 Ca 0.31 -1.16 -0.39 0.00 -0.03 0.00 0.00 54.58 53.31 1n3t n ASN 51 Cb 1.07 -2.18 -0.11 0.00 -0.61 0.00 0.00 39.78 37.95 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 -7.22 4.18 -0.94 3.41 1.43 -0.82 -5.00 118.68 113.72 1n3t s LEU 52 Ca 0.11 -0.38 -0.26 0.00 -1.03 0.00 0.00 54.13 52.57 1n3t s LEU 52 Cb -0.06 -2.06 -0.17 0.00 0.03 0.00 0.00 46.19 43.93 1n3t s LEU 52 CO 0.96 -0.17 2.23 -0.62 0.23 0.00 0.00 176.35 178.98 1n3t s ASP 53 N 1.67 3.83 0.00 2.29 2.15 -1.26 -4.65 116.67 120.70 1n3t s ASP 53 Ca 0.06 -0.50 0.06 0.00 0.43 0.00 0.00 52.55 52.59 1n3t s ASP 53 Cb -0.17 -2.57 0.31 0.00 -0.30 0.00 0.00 42.92 40.19 1n3t s ASP 53 CO 0.08 -4.14 0.89 0.18 -0.17 0.00 0.00 175.17 172.01 1n3t n LEU 54 N 18.59 0.00 0.14 -1.34 4.77 -1.26 -1.01 117.00 136.89 1n3t n LEU 54 Ca 0.44 0.11 -0.00 0.00 -0.03 0.00 0.00 56.01 56.53 1n3t n LEU 54 Cb 0.45 -0.11 0.25 0.00 -2.33 0.00 0.00 43.42 41.68 1n3t n LEU 54 CO 0.57 -0.09 0.62 0.00 -1.33 0.00 0.00 177.39 177.16 1n3t h ALA 55 N 2.32 1.15 -2.58 -1.18 0.00 -1.95 -3.37 119.26 113.65 1n3t h ALA 55 Ca 0.00 -0.43 -0.54 0.00 0.00 0.00 0.00 54.91 53.94 1n3t h ALA 55 Cb 0.02 -0.08 0.06 0.00 0.00 0.00 0.00 17.79 17.79 1n3t h ALA 55 CO 0.00 0.60 0.94 -3.47 0.00 0.00 0.00 179.25 177.32 1n3t n ASP 56 N -3.98 3.76 -0.26 0.00 2.03 -0.18 -4.91 116.55 113.02 1n3t n ASP 56 Ca -0.02 1.08 0.22 0.00 0.52 0.00 0.00 54.79 56.59 1n3t n ASP 56 Cb 0.50 -1.54 0.55 0.00 -0.72 0.00 0.00 41.12 39.90 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 6.26 0.35 0.00 1.67 2.03 -1.89 -1.64 116.42 123.19 1n3t h ASP 57 Ca -0.44 0.04 -0.00 0.00 -0.73 0.00 0.00 57.03 55.90 1n3t h ASP 57 Cb 1.22 -0.02 -0.00 0.00 -0.83 0.00 0.00 39.33 39.70 1n3t h ASP 57 CO 0.92 0.12 -0.05 -1.28 -1.03 0.00 0.00 179.24 177.91 1n3t h SER 58 N 0.33 0.00 0.00 4.15 0.87 -1.94 -3.32 113.55 113.65 1n3t h SER 58 Ca 0.50 -0.20 0.00 0.00 -1.23 0.00 0.00 61.79 60.86 1n3t h SER 58 Cb 1.36 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.32 1n3t h SER 58 CO -0.17 0.62 0.06 -0.07 -0.53 0.00 0.00 176.83 176.74 1n3t h LEU 59 N -1.00 0.00 -0.63 2.23 3.38 -1.88 -2.67 115.31 114.74 1n3t h LEU 59 Ca -0.01 0.00 0.08 0.00 0.09 0.00 0.00 57.88 58.05 1n3t h LEU 59 Cb 0.24 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.92 1n3t h LEU 59 CO -0.00 0.00 0.28 -0.03 0.09 0.00 0.00 178.44 178.77 1n3t h MET 60 N 0.00 0.48 0.04 1.13 4.05 -1.39 -3.09 114.93 116.14 1n3t h MET 60 Ca 0.00 -0.03 -0.26 0.00 -0.28 0.00 0.00 59.70 59.13 1n3t h MET 60 Cb 0.12 -0.11 -0.03 0.00 -0.80 0.00 0.00 31.60 30.78 1n3t h MET 60 CO 0.00 0.32 -1.37 0.93 0.23 0.00 0.00 176.91 177.01 1n3t h GLU 61 N 0.49 0.08 -0.39 0.39 4.39 -1.65 -3.40 114.58 114.48 1n3t h GLU 61 Ca 0.31 -0.13 0.04 0.00 0.34 0.00 0.00 59.36 59.91 1n3t h GLU 61 Cb 0.33 0.05 -0.05 0.00 -0.10 0.00 0.00 28.75 28.98 1n3t h GLU 61 CO -0.27 0.89 -0.22 2.41 -1.16 0.00 0.00 179.01 180.66 1n3t n THR 62 N -3.29 -0.26 -0.25 1.13 -1.04 -1.17 -0.41 114.28 109.00 1n3t n THR 62 Ca -0.10 0.94 -0.02 0.00 -2.04 0.00 0.00 64.05 62.83 1n3t n THR 62 Cb 1.00 -1.17 0.05 0.00 -1.82 0.00 0.00 70.33 68.39 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 -0.07 -0.43 -2.82 0.11 -1.78 0.73 132.00 127.73 1n3t h PRO 63 Ca 0.07 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.18 1n3t h PRO 63 Cb 0.17 0.02 -0.02 0.00 0.11 0.00 0.00 31.00 31.27 1n3t h PRO 63 CO -0.37 -0.05 0.23 1.25 -0.21 0.00 0.00 178.00 178.86 1n3t h HIS 64 N -0.07 0.57 0.39 0.65 -0.00 -1.02 -2.05 115.15 113.62 1n3t h HIS 64 Ca 0.31 -0.00 -0.02 0.00 -0.00 0.00 0.00 60.37 60.65 1n3t h HIS 64 Cb 0.56 -0.19 0.00 0.00 -0.00 0.00 0.00 27.41 27.78 1n3t h HIS 64 CO -0.64 0.40 -0.19 0.00 -0.00 0.00 0.00 177.93 177.50 1n3t h ARG 65 N 0.60 -0.51 -0.56 5.26 3.08 0.73 0.06 114.38 123.04 1n3t h ARG 65 Ca 0.15 0.03 0.08 0.00 0.07 0.00 0.00 59.98 60.32 1n3t h ARG 65 Cb 0.02 0.12 -0.07 0.00 0.08 0.00 0.00 29.97 30.12 1n3t h ARG 65 CO -0.03 -0.23 0.20 0.82 -1.07 0.00 0.00 179.97 179.66 1n3t h ILE 66 N -0.73 0.79 -0.10 2.04 2.04 -0.70 0.38 117.51 121.23 1n3t h ILE 66 Ca -0.05 -0.13 0.03 0.00 1.00 0.00 0.00 64.86 65.70 1n3t h ILE 66 Cb 0.51 0.38 -0.03 0.00 -0.74 0.00 0.00 36.82 36.94 1n3t h ILE 66 CO 0.09 0.07 -0.07 0.00 0.00 0.00 0.00 178.15 178.24 1n3t h ALA 67 N 1.38 0.01 -0.88 1.87 0.00 -1.27 0.30 119.26 120.67 1n3t h ALA 67 Ca 0.28 0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.24 1n3t h ALA 67 Cb 0.32 0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.22 1n3t h ALA 67 CO -0.28 -0.53 0.58 -0.22 0.00 0.00 0.00 179.25 178.80 1n3t h LYS 68 N -0.08 1.14 -0.90 0.00 3.11 -0.20 -2.07 116.57 117.57 1n3t h LYS 68 Ca 0.06 -0.07 -0.01 0.00 -2.81 0.00 0.00 60.65 57.82 1n3t h LYS 68 Cb 0.17 -0.26 -0.04 0.00 -1.00 0.00 0.00 32.23 31.10 1n3t h LYS 68 CO -0.15 0.75 0.50 1.98 -2.81 0.00 0.00 179.45 179.73 1n3t h MET 69 N 1.17 1.24 0.26 1.90 4.05 0.69 -1.15 114.93 123.10 1n3t h MET 69 Ca 0.33 -0.14 -0.01 0.00 -0.28 0.00 0.00 59.70 59.60 1n3t h MET 69 Cb -0.10 -0.25 0.00 0.00 -0.80 0.00 0.00 31.60 30.45 1n3t h MET 69 CO -0.08 0.90 -0.13 1.88 0.23 0.00 0.00 176.91 179.71 1n3t h TYR 70 N 1.25 -0.33 0.85 1.39 0.05 -0.52 -1.58 116.97 118.09 1n3t h TYR 70 Ca 0.32 -0.01 -0.04 0.00 0.05 0.00 0.00 58.73 59.05 1n3t h TYR 70 Cb 0.01 0.11 0.01 0.00 1.01 0.00 0.00 36.73 37.87 1n3t h TYR 70 CO 0.01 0.01 -0.41 0.28 -1.05 0.00 0.00 178.16 177.00 1n3t h VAL 71 N -0.95 0.00 -0.01 -2.88 2.07 -1.42 -3.27 116.25 109.79 1n3t h VAL 71 Ca -0.04 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 67.41 1n3t h VAL 71 Cb 0.48 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.25 1n3t h VAL 71 CO 0.06 0.00 -0.20 0.47 0.02 0.00 0.00 177.57 177.92 1n3t n ASP 72 N -5.28 0.99 0.00 0.57 8.00 -0.44 -4.37 116.55 116.02 1n3t n ASP 72 Ca -0.14 -0.91 0.00 0.00 0.71 0.00 0.00 54.79 54.45 1n3t n ASP 72 Cb 0.45 0.09 0.00 0.00 -0.02 0.00 0.00 41.12 41.64 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 -0.61 0.00 0.03 -1.24 1.02 -1.01 -4.69 120.64 114.15 1n3t n GLU 73 Ca 0.13 0.00 0.01 0.00 -0.02 0.00 0.00 57.16 57.28 1n3t n GLU 73 Cb 0.34 0.00 0.06 0.00 -0.02 0.00 0.00 31.44 31.82 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 0.99 -0.01 -3.67 -5.35 -0.63 -0.56 119.36 110.13 1n3t n ILE 74 Ca 0.00 0.54 0.00 0.00 -0.27 0.00 0.00 62.75 63.02 1n3t n ILE 74 Cb 0.00 -1.54 0.00 0.00 -1.74 0.00 0.00 39.64 36.36 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 -1.41 0.00 0.31 4.28 3.72 -1.23 -2.88 117.46 120.25 1n3t n PHE 75 Ca -0.00 -0.11 0.06 0.00 -0.05 0.00 0.00 57.45 57.35 1n3t n PHE 75 Cb 0.25 -0.01 0.31 0.00 -0.94 0.00 0.00 39.48 39.09 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 0.47 4.37 4.64 -0.95 0.35 113.55 122.43 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 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 1n3t h SER 76 CO 0.00 0.00 -0.05 0.61 -0.87 0.00 0.00 176.83 176.52 1n3t n GLY 77 N -1.37 -1.14 0.15 -0.77 0.00 -0.59 -3.19 105.19 98.28 1n3t n GLY 77 Ca -0.01 -0.19 0.13 0.00 0.00 0.00 0.00 46.02 45.95 1n3t n GLY 77 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1n3t h LEU 78 N 0.21 0.00 -7.92 0.99 3.38 -1.03 -3.41 115.31 107.54 1n3t h LEU 78 Ca 0.00 0.00 -0.72 0.00 0.09 0.00 0.00 57.88 57.25 1n3t h LEU 78 Cb 0.30 0.00 -0.31 0.00 0.09 0.00 0.00 40.66 40.75 1n3t h LEU 78 CO 0.00 0.00 -0.43 -0.62 0.09 0.00 0.00 178.44 177.48 1n3t s ASP 79 N -4.95 5.59 0.00 -0.43 2.15 -1.19 -4.94 116.67 112.90 1n3t s ASP 79 Ca 0.08 -1.95 0.00 0.00 0.43 0.00 0.00 52.55 51.10 1n3t s ASP 79 Cb 0.10 -1.97 0.00 0.00 -0.30 0.00 0.00 42.92 40.75 1n3t s ASP 79 CO 0.56 -0.66 0.29 -1.22 -0.17 0.00 0.00 175.17 173.98 1n3t n TYR 80 N 4.82 0.00 0.91 -5.34 4.02 -1.26 0.48 117.16 120.78 1n3t n TYR 80 Ca -0.06 0.00 0.13 0.00 -0.01 0.00 0.00 57.90 57.95 1n3t n TYR 80 Cb 0.41 0.00 0.56 0.00 -0.02 0.00 0.00 39.34 40.29 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 -0.78 2.19 0.83 -0.72 0.00 -1.26 -2.81 120.51 117.96 1n3t n ALA 81 Ca 0.00 -0.09 0.08 0.00 0.00 0.00 0.00 53.44 53.43 1n3t n ALA 81 Cb 0.00 -1.42 -0.10 0.00 0.00 0.00 0.00 19.45 17.93 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 -1.49 0.84 -4.58 0.00 3.02 0.18 -5.01 115.26 108.21 1n3t n ASN 82 Ca 0.06 -0.91 -0.49 0.00 -0.03 0.00 0.00 54.58 53.22 1n3t n ASN 82 Cb 0.30 1.01 -0.04 0.00 -0.61 0.00 0.00 39.78 40.44 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 -1.42 1.35 -0.64 3.10 7.35 -1.12 -4.92 117.46 121.16 1n3t n PHE 83 Ca 0.03 0.66 -0.31 0.00 -0.76 0.00 0.00 57.45 57.08 1n3t n PHE 83 Cb 0.28 -2.29 0.18 0.00 0.35 0.00 0.00 39.48 38.00 1n3t n PHE 83 CO 0.00 0.00 0.00 -0.35 -0.76 0.00 0.00 176.76 175.65 1n3t n PRO 84 N 1.78 -0.93 -3.14 -7.13 -0.04 -1.26 -4.96 135.00 119.32 1n3t n PRO 84 Ca 0.15 -0.22 -0.41 0.00 -0.04 0.00 0.00 63.50 62.98 1n3t n PRO 84 Cb 0.25 -2.24 -0.07 0.00 -0.04 0.00 0.00 33.50 31.40 1n3t n PRO 84 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1n3t s LYS 85 N -4.42 3.72 -0.05 0.54 1.02 -1.26 -4.94 119.74 114.36 1n3t s LYS 85 Ca 0.66 0.06 -0.17 0.00 0.02 0.00 0.00 55.97 56.54 1n3t s LYS 85 Cb -0.23 -3.79 -0.05 0.00 -0.52 0.00 0.00 37.83 33.24 1n3t s LYS 85 CO 0.61 -0.68 0.46 0.42 -0.92 0.00 0.00 175.35 175.24 1n3t s ILE 86 N 2.62 5.07 -0.07 2.17 1.01 -1.26 -4.99 121.20 125.75 1n3t s ILE 86 Ca 0.23 0.94 0.01 0.00 0.00 0.00 0.00 60.65 61.83 1n3t s ILE 86 Cb -0.15 -3.79 0.02 0.00 0.01 0.00 0.00 42.46 38.56 1n3t s ILE 86 CO 0.14 0.45 -0.06 0.42 0.00 0.00 0.00 174.94 175.89 1n3t s THR 87 N -0.26 0.78 0.38 2.92 -4.23 -1.26 -5.09 115.64 108.88 1n3t s THR 87 Ca 0.25 -0.21 0.08 0.00 -1.18 0.00 0.00 61.69 60.64 1n3t s THR 87 Cb -0.16 -0.79 -0.06 0.00 1.34 0.00 0.00 72.50 72.83 1n3t s THR 87 CO 0.13 0.30 0.08 -0.76 -0.54 0.00 0.00 174.62 173.83 1n3t s LEU 88 N 1.25 3.03 -0.02 4.79 1.43 -1.26 -1.73 118.68 126.17 1n3t s LEU 88 Ca -0.05 -1.09 -0.00 0.00 -1.03 0.00 0.00 54.13 51.96 1n3t s LEU 88 Cb -0.14 -1.32 0.02 0.00 0.03 0.00 0.00 46.19 44.79 1n3t s LEU 88 CO -0.02 -0.40 0.03 -0.63 0.23 0.00 0.00 176.35 175.55 1n3t s ILE 89 N -2.58 -0.04 0.31 -0.59 1.01 -0.99 -4.96 121.20 113.36 1n3t s ILE 89 Ca 0.37 0.14 -0.26 0.00 0.00 0.00 0.00 60.65 60.90 1n3t s ILE 89 Cb 0.03 -0.06 -0.15 0.00 0.01 0.00 0.00 42.46 42.29 1n3t s ILE 89 CO 0.20 0.06 0.70 1.21 0.00 0.00 0.00 174.94 177.11 1n3t n GLU 90 N 3.79 0.67 -2.33 2.79 2.13 -1.26 -1.31 120.64 125.12 1n3t n GLU 90 Ca -0.22 0.24 -0.43 0.00 0.66 0.00 0.00 57.16 57.41 1n3t n GLU 90 Cb 0.54 -1.47 0.00 0.00 0.27 0.00 0.00 31.44 30.78 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 1.50 4.89 0.06 4.31 5.15 -0.95 -4.69 115.26 125.54 1n3t n ASN 91 Ca 0.13 -3.04 -0.21 0.00 -0.60 0.00 0.00 54.58 50.86 1n3t n ASN 91 Cb 0.32 -1.53 -0.11 0.00 -0.53 0.00 0.00 39.78 37.93 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 6.06 0.67 -0.01 1.20 1.57 -1.90 -3.16 116.57 121.00 1n3t h LYS 92 Ca 0.42 -0.78 0.00 0.00 -1.87 0.00 0.00 60.65 58.42 1n3t h LYS 92 Cb 0.67 0.24 -0.00 0.00 0.08 0.00 0.00 32.23 33.22 1n3t h LYS 92 CO 1.61 1.35 0.03 0.52 -0.57 0.00 0.00 179.45 182.38 1n3t h MET 93 N 0.33 0.00 -4.11 3.15 2.86 -2.00 -3.46 114.93 111.71 1n3t h MET 93 Ca -0.15 0.00 -0.18 0.00 -2.06 0.00 0.00 59.70 57.31 1n3t h MET 93 Cb 1.77 0.00 0.10 0.00 0.06 0.00 0.00 31.60 33.53 1n3t h MET 93 CO 0.22 0.00 -0.44 1.63 1.06 0.00 0.00 176.91 179.38 1n3t n LYS 94 N -3.29 -3.20 -2.15 1.72 4.01 -1.19 -4.94 118.16 109.12 1n3t n LYS 94 Ca -0.03 0.48 -0.43 0.00 -0.51 0.00 0.00 58.31 57.82 1n3t n LYS 94 Cb 0.10 -4.29 -0.03 0.00 -0.51 0.00 0.00 35.03 30.31 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 -3.20 3.64 -0.90 -0.18 1.01 -1.26 -4.82 120.40 114.69 1n3t s VAL 95 Ca 0.05 0.63 0.16 0.00 0.00 0.00 0.00 61.98 62.82 1n3t s VAL 95 Cb -0.01 -3.91 0.53 0.00 0.00 0.00 0.00 36.38 32.99 1n3t s VAL 95 CO 0.41 -0.62 1.45 -0.90 0.00 0.00 0.00 175.10 175.44 1n3t n ASP 96 N 9.89 3.90 -4.48 3.32 5.75 -1.26 -4.27 116.55 129.40 1n3t n ASP 96 Ca 0.20 -2.40 -0.29 0.00 -0.01 0.00 0.00 54.79 52.28 1n3t n ASP 96 Cb 0.48 -0.45 -0.12 0.00 -1.03 0.00 0.00 41.12 40.00 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 -1.73 1.79 0.63 0.11 0.41 -1.26 -4.98 118.70 113.67 1n3t s GLU 97 Ca 0.40 -1.17 -0.19 0.00 -0.41 0.00 0.00 54.97 53.60 1n3t s GLU 97 Cb 0.26 -2.11 -0.02 0.00 -1.78 0.00 0.00 34.13 30.48 1n3t s GLU 97 CO 0.19 0.48 1.30 0.00 -0.49 0.00 0.00 175.26 176.74 1n3t s MET 98 N -2.06 2.66 -0.16 1.61 0.23 -1.26 -4.56 119.30 115.76 1n3t s MET 98 Ca 0.17 2.08 -0.02 0.00 -1.03 0.00 0.00 55.69 56.89 1n3t s MET 98 Cb -0.11 -1.91 -0.01 0.00 -1.53 0.00 0.00 34.83 31.27 1n3t s MET 98 CO 0.09 -1.51 -0.10 0.08 -2.03 0.00 0.00 175.02 171.55 1n3t s VAL 99 N -1.39 3.18 -0.14 5.16 1.01 0.43 -4.93 120.40 123.71 1n3t s VAL 99 Ca 0.81 -0.60 0.02 0.00 0.00 0.00 0.00 61.98 62.21 1n3t s VAL 99 Cb -0.38 -2.37 0.00 0.00 0.00 0.00 0.00 36.38 33.63 1n3t s VAL 99 CO 0.40 0.49 -0.19 -0.89 0.00 0.00 0.00 175.10 174.92 1n3t s THR 100 N 0.73 2.36 -0.27 3.92 2.01 -1.26 -1.94 115.64 121.18 1n3t s THR 100 Ca -0.05 -0.88 -0.02 0.00 0.31 0.00 0.00 61.69 61.05 1n3t s THR 100 Cb -0.15 -1.97 0.04 0.00 0.01 0.00 0.00 72.50 70.43 1n3t s THR 100 CO 0.02 0.53 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.77 1n3t s VAL 101 N 0.74 2.98 0.25 3.82 1.01 0.11 -5.00 120.40 124.30 1n3t s VAL 101 Ca -0.08 -1.18 0.08 0.00 0.00 0.00 0.00 61.98 60.80 1n3t s VAL 101 Cb -0.16 -2.61 -0.04 0.00 0.00 0.00 0.00 36.38 33.58 1n3t s VAL 101 CO 0.01 0.05 0.13 0.00 0.00 0.00 0.00 175.10 175.28 1n3t s ARG 102 N 1.30 2.72 -1.24 2.72 1.70 -1.26 -0.89 118.95 123.99 1n3t s ARG 102 Ca -0.02 -1.16 -0.02 0.00 -0.47 0.00 0.00 55.73 54.05 1n3t s ARG 102 Cb -0.18 -2.44 -0.01 0.00 -0.57 0.00 0.00 34.95 31.75 1n3t s ARG 102 CO -0.03 0.39 0.79 -0.25 -1.08 0.00 0.00 175.30 175.13 1n3t n ASP 103 N -1.04 -2.26 -4.71 -2.89 8.00 -1.21 -4.96 116.55 107.48 1n3t n ASP 103 Ca -0.07 -0.78 -0.41 0.00 0.71 0.00 0.00 54.79 54.24 1n3t n ASP 103 Cb 0.58 -4.35 -0.04 0.00 -0.02 0.00 0.00 41.12 37.29 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 -3.56 4.97 -0.07 0.53 1.01 -0.55 -4.83 121.20 118.71 1n3t s ILE 104 Ca 0.09 1.68 -0.29 0.00 0.00 0.00 0.00 60.65 62.12 1n3t s ILE 104 Cb -0.02 -4.15 -0.06 0.00 0.01 0.00 0.00 42.46 38.24 1n3t s ILE 104 CO 0.79 0.20 1.86 -0.89 0.00 0.00 0.00 174.94 176.91 1n3t s THR 105 N 0.97 3.28 -0.23 2.92 2.01 -1.26 -1.30 115.64 122.04 1n3t s THR 105 Ca 0.43 0.33 0.02 0.00 0.31 0.00 0.00 61.69 62.78 1n3t s THR 105 Cb -0.19 -3.25 0.05 0.00 0.01 0.00 0.00 72.50 69.12 1n3t s THR 105 CO 0.21 -0.07 -0.14 -0.22 -0.69 0.00 0.00 174.62 173.72 1n3t s LEU 106 N 5.03 2.95 -0.15 4.42 0.20 -1.00 -4.75 118.68 125.38 1n3t s LEU 106 Ca 0.83 -1.13 -0.02 0.00 0.69 0.00 0.00 54.13 54.50 1n3t s LEU 106 Cb -0.36 -1.50 -0.02 0.00 -0.43 0.00 0.00 46.19 43.88 1n3t s LEU 106 CO 0.35 -0.13 -0.08 0.42 -0.29 0.00 0.00 176.35 176.62 1n3t s THR 107 N 1.18 3.43 0.36 3.68 -4.23 -1.26 -1.68 115.64 117.12 1n3t s THR 107 Ca -0.04 -0.52 0.01 0.00 -1.18 0.00 0.00 61.69 59.96 1n3t s THR 107 Cb -0.18 -2.49 -0.00 0.00 1.34 0.00 0.00 72.50 71.18 1n3t s THR 107 CO -0.08 0.50 0.44 -0.55 -0.54 0.00 0.00 174.62 174.39 1n3t s SER 108 N 0.51 1.25 -0.03 3.99 0.15 -0.68 -4.24 113.70 114.64 1n3t s SER 108 Ca -0.06 -1.61 0.01 0.00 0.70 0.00 0.00 55.95 54.99 1n3t s SER 108 Cb -0.15 0.66 0.02 0.00 -1.71 0.00 0.00 66.02 64.84 1n3t s SER 108 CO 0.03 -1.27 -0.02 -0.89 1.20 0.00 0.00 173.24 172.29 1n3t s THR 109 N -3.02 0.30 0.05 6.45 2.01 -1.25 -0.48 115.64 119.70 1n3t s THR 109 Ca 0.33 0.01 -0.31 0.00 0.31 0.00 0.00 61.69 62.03 1n3t s THR 109 Cb -0.00 -0.37 -0.06 0.00 0.01 0.00 0.00 72.50 72.08 1n3t s THR 109 CO 0.24 0.17 1.28 0.00 -0.69 0.00 0.00 174.62 175.61 1n3t h GLU 111 N 7.04 0.00 -0.33 0.00 4.11 -1.39 0.44 114.58 124.45 1n3t h GLU 111 Ca -0.40 0.00 -0.15 0.00 0.07 0.00 0.00 59.36 58.88 1n3t h GLU 111 Cb 1.20 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.44 1n3t h GLU 111 CO 0.85 0.06 -0.40 0.45 0.07 0.00 0.00 179.01 180.04 1n3t h HIS 112 N 0.00 0.96 0.00 2.06 3.86 -1.90 -3.37 115.15 116.76 1n3t h HIS 112 Ca -0.00 -0.29 0.00 0.00 -1.16 0.00 0.00 60.37 58.92 1n3t h HIS 112 Cb 0.38 -0.20 0.00 0.00 1.06 0.00 0.00 27.41 28.64 1n3t h HIS 112 CO 0.00 1.07 -0.16 0.72 0.86 0.00 0.00 177.93 180.42 1n3t n HIS 113 N -4.04 0.00 -3.05 2.45 8.25 -1.15 -5.00 115.22 112.68 1n3t n HIS 113 Ca -0.02 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.31 1n3t n HIS 113 Cb 0.54 0.00 0.05 0.00 1.12 0.00 0.00 29.99 31.70 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 -0.85 -1.59 -4.35 4.41 3.01 0.15 -5.02 117.46 113.22 1n3t n PHE 114 Ca 0.00 0.60 -0.29 0.00 1.01 0.00 0.00 57.45 58.78 1n3t n PHE 114 Cb 0.00 -3.63 -0.12 0.00 -0.01 0.00 0.00 39.48 35.72 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 -3.20 2.60 0.47 -4.37 1.01 -1.21 -4.89 120.40 110.81 1n3t s VAL 115 Ca 0.22 -1.69 -0.21 0.00 0.00 0.00 0.00 61.98 60.29 1n3t s VAL 115 Cb -0.09 -2.20 -0.10 0.00 0.00 0.00 0.00 36.38 33.98 1n3t s VAL 115 CO 0.44 0.04 0.70 0.41 0.00 0.00 0.00 175.10 176.70 1n3t n THR 116 N 0.66 2.25 -3.76 3.92 -1.04 -1.26 -0.67 114.28 114.38 1n3t n THR 116 Ca -0.15 -0.50 -0.27 0.00 -2.04 0.00 0.00 64.05 61.09 1n3t n THR 116 Cb 0.54 -0.80 -0.17 0.00 -1.82 0.00 0.00 70.33 68.08 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 -1.48 0.56 -0.18 12.58 1.01 0.37 -2.47 121.20 131.59 1n3t s ILE 117 Ca 0.66 -0.43 -0.09 0.00 0.00 0.00 0.00 60.65 60.79 1n3t s ILE 117 Cb -0.54 -0.96 -0.05 0.00 0.01 0.00 0.00 42.46 40.93 1n3t s ILE 117 CO 0.56 -0.07 0.13 -0.62 0.00 0.00 0.00 174.94 174.93 1n3t s ASP 118 N 1.85 6.20 0.30 3.58 2.15 0.06 -1.69 116.67 129.13 1n3t s ASP 118 Ca 0.00 0.27 -0.08 0.00 0.43 0.00 0.00 52.55 53.18 1n3t s ASP 118 Cb -0.16 -2.07 0.03 0.00 -0.30 0.00 0.00 42.92 40.42 1n3t s ASP 118 CO -0.07 0.23 0.53 0.61 -0.17 0.00 0.00 175.17 176.29 1n3t n GLY 119 N 3.17 1.64 3.04 2.66 0.00 -0.68 -0.20 105.19 114.83 1n3t n GLY 119 Ca -0.17 -1.35 -0.13 0.00 0.00 0.00 0.00 46.02 44.38 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 -2.29 0.20 -0.03 1.61 3.01 -0.82 -2.36 119.74 119.05 1n3t s LYS 120 Ca 0.17 0.45 0.07 0.00 -1.01 0.00 0.00 55.97 55.64 1n3t s LYS 120 Cb -0.03 -0.07 -0.02 0.00 -1.01 0.00 0.00 37.83 36.70 1n3t s LYS 120 CO 0.12 -0.13 -0.25 0.00 0.51 0.00 0.00 175.35 175.60 1n3t s ALA 121 N 0.97 2.09 -0.17 5.17 0.00 -0.42 -1.85 121.76 127.55 1n3t s ALA 121 Ca -0.07 -1.06 -0.03 0.00 0.00 0.00 0.00 51.96 50.80 1n3t s ALA 121 Cb -0.08 -0.56 -0.02 0.00 0.00 0.00 0.00 23.12 22.46 1n3t s ALA 121 CO -0.06 0.48 -0.06 0.99 0.00 0.00 0.00 175.76 177.11 1n3t s THR 122 N -0.48 3.49 0.02 0.00 2.01 0.68 -1.48 115.64 119.89 1n3t s THR 122 Ca 0.06 -0.49 0.07 0.00 0.31 0.00 0.00 61.69 61.64 1n3t s THR 122 Cb -0.11 -2.53 -0.02 0.00 0.01 0.00 0.00 72.50 69.85 1n3t s THR 122 CO 0.00 0.48 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.51 1n3t s VAL 123 N 0.75 1.62 0.05 3.82 1.01 -0.07 -1.47 120.40 126.11 1n3t s VAL 123 Ca -0.03 -1.07 -0.09 0.00 0.00 0.00 0.00 61.98 60.79 1n3t s VAL 123 Cb -0.15 -1.39 0.00 0.00 0.00 0.00 0.00 36.38 34.84 1n3t s VAL 123 CO 0.02 0.29 0.18 0.00 0.00 0.00 0.00 175.10 175.58 1n3t s ALA 124 N -0.68 -0.29 -0.03 5.51 0.00 -0.75 0.06 121.76 125.58 1n3t s ALA 124 Ca 0.07 -0.40 -0.29 0.00 0.00 0.00 0.00 51.96 51.35 1n3t s ALA 124 Cb -0.08 0.32 0.10 0.00 0.00 0.00 0.00 23.12 23.46 1n3t s ALA 124 CO 0.01 -0.39 0.84 1.52 0.00 0.00 0.00 175.76 177.74 1n3t s TYR 125 N -2.88 -0.43 -0.32 0.00 1.13 -0.82 0.08 117.35 114.11 1n3t s TYR 125 Ca -0.03 0.49 -0.07 0.00 -1.41 0.00 0.00 57.07 56.05 1n3t s TYR 125 Cb 0.00 0.50 0.02 0.00 -1.10 0.00 0.00 41.96 41.38 1n3t s TYR 125 CO -0.06 -0.54 0.10 0.42 -2.51 0.00 0.00 175.55 172.96 1n3t s ILE 126 N -2.36 3.93 0.19 -3.49 1.01 0.68 -0.43 121.20 120.73 1n3t s ILE 126 Ca 0.00 -0.89 -0.33 0.00 0.00 0.00 0.00 60.65 59.44 1n3t s ILE 126 Cb -0.01 -3.12 -0.13 0.00 0.01 0.00 0.00 42.46 39.21 1n3t s ILE 126 CO -0.04 -0.05 1.57 -2.65 0.00 0.00 0.00 174.94 173.77 1n3t n PRO 127 N 4.85 2.27 0.00 2.79 -0.02 -1.26 -4.78 135.00 138.84 1n3t n PRO 127 Ca -0.13 0.82 0.00 0.00 -2.02 0.00 0.00 63.50 62.16 1n3t n PRO 127 Cb 0.46 -2.58 0.00 0.00 -0.02 0.00 0.00 33.50 31.37 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 3.14 0.00 0.00 -0.52 4.81 -1.26 -4.71 118.16 119.63 1n3t n LYS 128 Ca 0.15 0.00 0.12 0.00 -0.87 0.00 0.00 58.31 57.71 1n3t n LYS 128 Cb 0.31 0.00 0.19 0.00 0.02 0.00 0.00 35.03 35.55 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 1.34 -4.02 3.14 8.00 -1.26 -4.72 116.55 119.03 1n3t n ASP 129 Ca 0.00 -1.07 -0.09 0.00 0.71 0.00 0.00 54.79 54.34 1n3t n ASP 129 Cb 0.00 0.33 -0.09 0.00 -0.02 0.00 0.00 41.12 41.35 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 -2.57 0.25 -0.28 -2.24 1.04 -1.26 -2.23 113.70 106.40 1n3t s SER 130 Ca 0.20 -0.95 0.01 0.00 0.48 0.00 0.00 55.95 55.68 1n3t s SER 130 Cb 0.18 0.32 0.08 0.00 0.10 0.00 0.00 66.02 66.70 1n3t s SER 130 CO 0.58 -0.74 0.03 -0.69 0.98 0.00 0.00 173.24 173.40 1n3t s VAL 131 N -3.96 1.41 0.54 5.02 1.01 -0.43 -4.67 120.40 119.32 1n3t s VAL 131 Ca 0.14 -1.50 -0.20 0.00 0.00 0.00 0.00 61.98 60.42 1n3t s VAL 131 Cb 0.06 -1.91 -0.06 0.00 0.00 0.00 0.00 36.38 34.47 1n3t s VAL 131 CO -0.04 -0.42 1.15 -0.63 0.00 0.00 0.00 175.10 175.15 1n3t s ILE 132 N 1.39 3.05 0.17 2.22 1.01 -1.26 -2.36 121.20 125.42 1n3t s ILE 132 Ca 0.04 0.68 -0.31 0.00 0.00 0.00 0.00 60.65 61.06 1n3t s ILE 132 Cb -0.18 -3.29 -0.09 0.00 0.01 0.00 0.00 42.46 38.90 1n3t s ILE 132 CO -0.13 -0.12 1.49 -0.83 0.00 0.00 0.00 174.94 175.35 1n3t s GLY 133 N -1.66 1.85 0.20 6.18 0.00 -0.70 -4.92 107.32 108.28 1n3t s GLY 133 Ca 0.72 1.29 -0.20 0.00 0.00 0.00 0.00 44.72 46.53 1n3t s GLY 133 CO 0.29 2.47 1.57 1.41 0.00 0.00 0.00 173.10 178.85 1n3t h LEU 134 N 6.38 -1.27 -2.33 0.66 3.38 -1.92 0.17 115.31 120.38 1n3t h LEU 134 Ca -0.43 0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.80 1n3t h LEU 134 Cb 1.21 0.65 0.00 0.00 0.09 0.00 0.00 40.66 42.61 1n3t h LEU 134 CO 0.87 -0.30 0.14 0.77 0.09 0.00 0.00 178.44 180.01 1n3t h SER 135 N -0.10 0.00 -0.58 -0.43 4.64 -2.00 -1.69 113.55 113.38 1n3t h SER 135 Ca 0.27 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.49 1n3t h SER 135 Cb 0.57 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.64 1n3t h SER 135 CO -0.80 0.00 -0.02 0.11 -0.87 0.00 0.00 176.83 175.25 1n3t h LYS 136 N 0.00 1.05 -0.58 4.77 1.79 -1.32 -2.19 116.57 120.09 1n3t h LYS 136 Ca 0.00 -0.34 -0.02 0.00 -2.18 0.00 0.00 60.65 58.11 1n3t h LYS 136 Cb 0.29 -0.09 -0.03 0.00 -1.58 0.00 0.00 32.23 30.82 1n3t h LYS 136 CO 0.00 1.04 0.29 0.82 -1.08 0.00 0.00 179.45 180.52 1n3t h ILE 137 N 0.96 1.18 0.34 1.86 2.04 -1.42 -0.34 117.51 122.14 1n3t h ILE 137 Ca 0.17 -0.49 -0.02 0.00 1.00 0.00 0.00 64.86 65.52 1n3t h ILE 137 Cb 0.58 0.43 0.00 0.00 -0.74 0.00 0.00 36.82 37.09 1n3t h ILE 137 CO 0.03 0.21 -0.16 0.78 0.00 0.00 0.00 178.15 179.01 1n3t h ASN 138 N 0.80 -0.39 -0.59 1.72 -0.26 -1.62 -2.47 115.58 112.78 1n3t h ASN 138 Ca 0.20 -0.15 0.12 0.00 -0.56 0.00 0.00 56.30 55.90 1n3t h ASN 138 Cb 0.05 0.10 -0.11 0.00 -1.06 0.00 0.00 38.32 37.30 1n3t h ASN 138 CO -0.03 -0.02 -0.19 0.03 -1.06 0.00 0.00 177.43 176.15 1n3t h ARG 139 N -0.80 -0.05 -0.46 0.81 3.08 -1.12 -0.68 114.38 115.17 1n3t h ARG 139 Ca -0.05 0.00 0.03 0.00 0.07 0.00 0.00 59.98 60.04 1n3t h ARG 139 Cb 0.52 0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.54 1n3t h ARG 139 CO 0.08 -0.03 0.25 0.82 -1.07 0.00 0.00 179.97 180.02 1n3t h ILE 140 N -0.05 1.01 0.10 2.04 2.04 -1.06 -1.23 117.51 120.36 1n3t h ILE 140 Ca 0.28 -0.17 0.01 0.00 1.00 0.00 0.00 64.86 65.97 1n3t h ILE 140 Cb 0.47 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 36.99 1n3t h ILE 140 CO -0.63 0.09 -0.14 0.58 0.00 0.00 0.00 178.15 178.06 1n3t h VAL 141 N 0.50 0.68 0.00 1.67 2.07 -0.78 -2.45 116.25 117.95 1n3t h VAL 141 Ca 0.19 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.71 1n3t h VAL 141 Cb 0.06 0.68 -0.00 0.00 -1.52 0.00 0.00 31.29 30.51 1n3t h VAL 141 CO -0.11 0.00 -0.02 1.56 0.02 0.00 0.00 177.57 179.02 1n3t h GLN 142 N -0.28 0.00 0.23 1.57 1.08 -0.89 -1.24 115.11 115.58 1n3t h GLN 142 Ca 0.02 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.20 1n3t h GLN 142 Cb 0.29 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.72 1n3t h GLN 142 CO -0.06 0.02 -0.11 0.35 -0.95 0.00 0.00 178.83 178.07 1n3t h PHE 143 N 0.00 -0.29 0.00 2.96 3.57 -0.74 -2.61 116.94 119.84 1n3t h PHE 143 Ca -0.00 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.49 1n3t h PHE 143 Cb 0.21 0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.05 1n3t h PHE 143 CO 0.00 -0.18 0.00 0.74 -2.23 0.00 0.00 178.31 176.64 1n3t h PHE 144 N -0.51 0.00 -0.04 0.41 0.04 -1.53 -1.13 116.94 114.18 1n3t h PHE 144 Ca -0.03 0.00 -0.19 0.00 2.80 0.00 0.00 57.97 60.55 1n3t h PHE 144 Cb 0.24 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.38 1n3t h PHE 144 CO 0.07 0.00 -0.79 0.00 -0.60 0.00 0.00 178.31 176.99 1n3t h ALA 145 N 2.05 0.57 -1.09 2.45 0.00 -1.16 -3.37 119.26 118.71 1n3t h ALA 145 Ca 0.00 -0.65 -0.72 0.00 0.00 0.00 0.00 54.91 53.54 1n3t h ALA 145 Cb 0.09 -0.06 -0.12 0.00 0.00 0.00 0.00 17.79 17.70 1n3t h ALA 145 CO 0.00 0.81 1.97 1.04 0.00 0.00 0.00 179.25 183.07 1n3t n GLN 146 N -3.77 3.28 -3.55 0.00 1.13 -0.43 -4.31 117.38 109.73 1n3t n GLN 146 Ca -0.04 -3.45 -0.07 0.00 -1.94 0.00 0.00 57.00 51.50 1n3t n GLN 146 Cb 0.75 -3.23 -0.02 0.00 0.11 0.00 0.00 30.24 27.85 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 2.60 0.79 -0.31 -1.09 0.52 -1.14 -1.54 118.95 118.77 1n3t s ARG 147 Ca 0.47 -0.32 -0.29 0.00 -0.52 0.00 0.00 55.73 55.08 1n3t s ARG 147 Cb 0.03 0.34 -0.01 0.00 0.52 0.00 0.00 34.95 35.83 1n3t s ARG 147 CO 0.02 -0.35 1.67 -2.14 0.02 0.00 0.00 175.30 174.52 1n3t s PRO 148 N -3.03 3.52 0.45 3.54 0.02 -1.26 -3.93 135.00 134.31 1n3t s PRO 148 Ca 0.07 1.40 0.06 0.00 0.02 0.00 0.00 61.00 62.54 1n3t s PRO 148 Cb -0.01 -4.12 -0.04 0.00 0.02 0.00 0.00 34.50 30.36 1n3t s PRO 148 CO -0.07 -1.64 0.14 -0.65 -0.33 0.00 0.00 177.00 174.45 1n3t s GLN 149 N 5.23 2.17 -0.05 5.54 -1.52 0.20 -4.60 119.66 126.64 1n3t s GLN 149 Ca 0.74 -2.05 -0.01 0.00 -1.95 0.00 0.00 55.36 52.10 1n3t s GLN 149 Cb -0.21 -1.83 0.03 0.00 -0.22 0.00 0.00 33.01 30.77 1n3t s GLN 149 CO 0.32 -0.23 0.01 0.08 -0.25 0.00 0.00 175.29 175.22 1n3t s VAL 150 N -2.71 0.22 0.16 1.09 1.01 -1.26 -1.15 120.40 117.77 1n3t s VAL 150 Ca 0.31 0.14 -0.16 0.00 0.00 0.00 0.00 61.98 62.27 1n3t s VAL 150 Cb 0.04 -0.36 0.06 0.00 0.00 0.00 0.00 36.38 36.11 1n3t s VAL 150 CO 0.17 0.20 1.71 -0.61 0.00 0.00 0.00 175.10 176.57 1n3t h GLN 151 N 7.82 0.13 -1.00 2.72 4.15 -1.98 0.87 115.11 127.82 1n3t h GLN 151 Ca -0.29 -0.01 0.17 0.00 0.77 0.00 0.00 58.65 59.29 1n3t h GLN 151 Cb 1.13 -0.03 -0.10 0.00 0.21 0.00 0.00 27.48 28.69 1n3t h GLN 151 CO 0.34 0.09 0.62 0.93 -1.93 0.00 0.00 178.83 178.88 1n3t h GLU 152 N 0.13 0.80 0.04 1.69 3.07 -1.99 -1.87 114.58 116.45 1n3t h GLU 152 Ca 0.19 -0.05 -0.12 0.00 -0.50 0.00 0.00 59.36 58.88 1n3t h GLU 152 Cb 0.25 -0.18 0.01 0.00 -0.84 0.00 0.00 28.75 27.99 1n3t h GLU 152 CO -0.29 0.53 -0.49 -0.09 -1.40 0.00 0.00 179.01 177.28 1n3t h ARG 153 N 0.83 0.26 -0.54 2.33 2.43 -1.86 -3.24 114.38 114.59 1n3t h ARG 153 Ca 0.55 -0.33 0.16 0.00 -0.81 0.00 0.00 59.98 59.55 1n3t h ARG 153 Cb 0.78 0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 30.42 1n3t h ARG 153 CO -0.34 1.08 0.42 1.25 -1.51 0.00 0.00 179.97 180.87 1n3t h LEU 154 N -0.41 0.00 -0.06 3.80 5.85 -0.30 -0.81 115.31 123.39 1n3t h LEU 154 Ca -0.07 0.00 -0.17 0.00 0.84 0.00 0.00 57.88 58.48 1n3t h LEU 154 Cb 1.28 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.32 1n3t h LEU 154 CO 0.09 0.00 -0.63 0.74 -0.34 0.00 0.00 178.44 178.30 1n3t h THR 155 N 0.00 1.37 0.16 1.05 2.02 -1.41 -3.24 112.91 112.86 1n3t h THR 155 Ca 0.26 -1.98 0.01 0.00 0.77 0.00 0.00 66.41 65.46 1n3t h THR 155 Cb 1.10 2.34 -0.02 0.00 -1.74 0.00 0.00 68.15 69.83 1n3t h THR 155 CO -0.00 0.59 -0.17 1.56 0.37 0.00 0.00 175.52 177.87 1n3t h GLN 156 N 0.12 -0.35 -0.71 6.66 1.08 -1.19 -2.87 115.11 117.85 1n3t h GLN 156 Ca -0.06 0.02 0.15 0.00 -1.45 0.00 0.00 58.65 57.31 1n3t h GLN 156 Cb 1.30 0.08 -0.10 0.00 -0.05 0.00 0.00 27.48 28.71 1n3t h GLN 156 CO 0.13 -0.23 0.19 1.96 -0.95 0.00 0.00 178.83 179.92 1n3t h GLN 157 N -0.36 0.29 -0.89 1.46 4.20 -1.51 -0.29 115.11 118.01 1n3t h GLN 157 Ca 0.00 -0.02 0.01 0.00 0.06 0.00 0.00 58.65 58.71 1n3t h GLN 157 Cb 0.35 -0.06 -0.04 0.00 0.30 0.00 0.00 27.48 28.02 1n3t h GLN 157 CO -0.05 0.19 0.59 0.82 -0.67 0.00 0.00 178.83 179.71 1n3t h ILE 158 N 0.29 1.23 0.53 2.54 2.04 -1.54 -0.71 117.51 121.90 1n3t h ILE 158 Ca 0.39 -0.42 -0.03 0.00 1.00 0.00 0.00 64.86 65.81 1n3t h ILE 158 Cb 0.65 -0.08 0.01 0.00 -0.74 0.00 0.00 36.82 36.65 1n3t h ILE 158 CO -0.47 0.22 -0.26 0.25 0.00 0.00 0.00 178.15 177.89 1n3t h LEU 159 N 1.21 -0.61 -0.31 1.44 5.85 -0.91 -1.50 115.31 120.49 1n3t h LEU 159 Ca 0.33 0.02 0.07 0.00 0.84 0.00 0.00 57.88 59.14 1n3t h LEU 159 Cb -0.14 0.16 -0.08 0.00 0.37 0.00 0.00 40.66 40.97 1n3t h LEU 159 CO -0.07 -0.37 -0.28 0.40 -0.34 0.00 0.00 178.44 177.77 1n3t h ILE 160 N -0.84 0.31 -0.60 4.05 2.04 -1.43 0.24 117.51 121.29 1n3t h ILE 160 Ca -0.07 0.00 0.12 0.00 1.00 0.00 0.00 64.86 65.91 1n3t h ILE 160 Cb 0.55 0.31 -0.10 0.00 -0.74 0.00 0.00 36.82 36.84 1n3t h ILE 160 CO 0.12 0.00 0.02 0.00 0.00 0.00 0.00 178.15 178.29 1n3t h ALA 161 N 0.77 0.60 -0.39 1.87 0.00 -1.17 0.15 119.26 121.10 1n3t h ALA 161 Ca 0.15 0.17 -0.05 0.00 0.00 0.00 0.00 54.91 55.19 1n3t h ALA 161 Cb 0.50 0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 1n3t h ALA 161 CO -0.46 -0.38 0.05 -0.07 0.00 0.00 0.00 179.25 178.39 1n3t h LEU 162 N 0.14 0.63 -0.91 0.00 3.38 -0.12 -2.71 115.31 115.72 1n3t h LEU 162 Ca 0.31 -0.27 0.05 0.00 0.09 0.00 0.00 57.88 58.06 1n3t h LEU 162 Cb 0.50 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 41.02 1n3t h LEU 162 CO -0.49 0.75 0.58 1.56 0.09 0.00 0.00 178.44 180.93 1n3t h GLN 163 N 0.50 1.05 -0.02 1.13 4.20 0.64 -0.15 115.11 122.45 1n3t h GLN 163 Ca 0.12 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.76 1n3t h GLN 163 Cb 0.40 -0.24 -0.00 0.00 0.30 0.00 0.00 27.48 27.94 1n3t h GLN 163 CO 0.01 0.69 0.01 1.15 -0.67 0.00 0.00 178.83 180.03 1n3t h THR 164 N 1.08 1.02 -0.23 -0.54 2.02 -0.64 0.16 112.91 115.79 1n3t h THR 164 Ca 0.39 -0.06 -0.10 0.00 0.77 0.00 0.00 66.41 67.40 1n3t h THR 164 Cb 0.12 1.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.54 1n3t h THR 164 CO -0.16 0.02 -0.28 -0.07 0.37 0.00 0.00 175.52 175.40 1n3t h LEU 165 N 0.01 0.45 0.00 2.58 3.38 -1.13 -3.15 115.31 117.45 1n3t h LEU 165 Ca 0.01 -0.16 -0.06 0.00 0.09 0.00 0.00 57.88 57.75 1n3t h LEU 165 Cb 0.02 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1n3t h LEU 165 CO -0.00 0.73 -1.12 -0.07 0.09 0.00 0.00 178.44 178.07 1n3t h LEU 166 N 0.39 0.00 0.16 1.67 3.38 -0.94 -3.48 115.31 116.49 1n3t h LEU 166 Ca 0.05 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 1n3t h LEU 166 Cb 0.70 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.45 1n3t h LEU 166 CO 0.05 0.23 -0.04 0.61 0.09 0.00 0.00 178.44 179.38 1n3t n GLY 167 N 1.26 0.33 3.26 0.83 0.00 0.54 -4.67 105.19 106.74 1n3t n GLY 167 Ca -0.03 -0.82 -0.11 0.00 0.00 0.00 0.00 46.02 45.06 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 -2.11 0.03 -0.59 2.61 2.01 -1.11 -4.94 115.64 111.53 1n3t s THR 168 Ca 0.00 -1.83 0.11 0.00 0.31 0.00 0.00 61.69 60.28 1n3t s THR 168 Cb -0.00 -2.29 -0.10 0.00 0.01 0.00 0.00 72.50 70.11 1n3t s THR 168 CO 0.00 -0.13 0.50 0.59 -0.69 0.00 0.00 174.62 174.89 1n3t n ASN 169 N -0.24 0.63 -3.97 3.53 3.02 -1.26 -4.50 115.26 112.47 1n3t n ASN 169 Ca -0.01 -0.81 -0.42 0.00 -0.03 0.00 0.00 54.58 53.30 1n3t n ASN 169 Cb 0.65 0.93 0.00 0.00 -0.61 0.00 0.00 39.78 40.75 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 -1.12 4.20 -3.93 6.41 3.02 -1.26 0.15 115.26 122.73 1n3t n ASN 170 Ca 0.02 -2.87 -0.11 0.00 -0.03 0.00 0.00 54.58 51.59 1n3t n ASN 170 Cb 0.18 -1.68 -0.13 0.00 -0.61 0.00 0.00 39.78 37.55 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 3.38 0.10 -0.01 2.41 1.01 -1.26 -0.23 120.40 125.80 1n3t s VAL 171 Ca 0.49 -0.41 0.02 0.00 0.00 0.00 0.00 61.98 62.08 1n3t s VAL 171 Cb 0.11 -0.16 -0.00 0.00 0.00 0.00 0.00 36.38 36.33 1n3t s VAL 171 CO -0.04 -0.19 -0.07 0.00 0.00 0.00 0.00 175.10 174.80 1n3t s ALA 172 N -0.61 0.62 -0.04 5.51 0.00 0.11 -1.19 121.76 126.17 1n3t s ALA 172 Ca -0.06 -0.27 0.01 0.00 0.00 0.00 0.00 51.96 51.65 1n3t s ALA 172 Cb -0.04 -0.21 0.02 0.00 0.00 0.00 0.00 23.12 22.89 1n3t s ALA 172 CO -0.00 0.12 -0.06 0.08 0.00 0.00 0.00 175.76 175.90 1n3t s VAL 173 N 0.03 0.61 -0.02 0.00 1.01 -0.09 -1.80 120.40 120.14 1n3t s VAL 173 Ca -0.00 -0.20 0.01 0.00 0.00 0.00 0.00 61.98 61.78 1n3t s VAL 173 Cb -0.05 -0.60 0.02 0.00 0.00 0.00 0.00 36.38 35.74 1n3t s VAL 173 CO -0.00 0.23 -0.02 -0.55 0.00 0.00 0.00 175.10 174.75 1n3t s SER 174 N 0.65 0.53 -0.10 3.32 0.15 -0.54 0.61 113.70 118.32 1n3t s SER 174 Ca -0.09 -0.06 0.01 0.00 0.70 0.00 0.00 55.95 56.50 1n3t s SER 174 Cb -0.12 -0.22 0.02 0.00 -1.71 0.00 0.00 66.02 63.99 1n3t s SER 174 CO 0.01 -0.04 -0.11 -0.63 1.20 0.00 0.00 173.24 173.67 1n3t s ILE 175 N 0.65 1.18 -0.23 6.45 1.01 0.27 -0.23 121.20 130.30 1n3t s ILE 175 Ca -0.07 -0.42 -0.06 0.00 0.00 0.00 0.00 60.65 60.10 1n3t s ILE 175 Cb -0.10 -1.14 -0.03 0.00 0.01 0.00 0.00 42.46 41.21 1n3t s ILE 175 CO -0.01 0.38 0.04 -0.62 0.00 0.00 0.00 174.94 174.73 1n3t s ASP 176 N 1.32 4.98 0.05 3.58 2.15 -0.77 -1.38 116.67 126.59 1n3t s ASP 176 Ca -0.01 -0.21 -0.11 0.00 0.43 0.00 0.00 52.55 52.65 1n3t s ASP 176 Cb -0.14 -1.88 0.01 0.00 -0.30 0.00 0.00 42.92 40.62 1n3t s ASP 176 CO -0.05 0.01 0.23 0.00 -0.17 0.00 0.00 175.17 175.19 1n3t s ALA 177 N 1.33 -0.43 -0.24 3.66 0.00 0.26 -1.94 121.76 124.41 1n3t s ALA 177 Ca 0.05 -0.26 -0.03 0.00 0.00 0.00 0.00 51.96 51.71 1n3t s ALA 177 Cb -0.15 0.34 0.01 0.00 0.00 0.00 0.00 23.12 23.32 1n3t s ALA 177 CO 0.02 -0.41 -0.05 0.08 0.00 0.00 0.00 175.76 175.40 1n3t s VAL 178 N -2.83 3.10 -0.31 0.00 1.01 0.73 0.03 120.40 122.14 1n3t s VAL 178 Ca -0.03 -0.77 -0.16 0.00 0.00 0.00 0.00 61.98 61.02 1n3t s VAL 178 Cb 0.00 -2.49 -0.02 0.00 0.00 0.00 0.00 36.38 33.87 1n3t s VAL 178 CO -0.05 0.31 0.40 -1.00 0.00 0.00 0.00 175.10 174.76 1n3t s HIS 179 N 1.40 3.22 0.41 5.22 3.76 -1.26 -0.76 115.29 127.27 1n3t s HIS 179 Ca 0.03 0.21 0.30 0.00 -0.15 0.00 0.00 55.06 55.45 1n3t s HIS 179 Cb -0.15 -2.69 1.55 0.00 1.11 0.00 0.00 32.58 32.40 1n3t s HIS 179 CO -0.04 -0.37 2.10 1.88 -0.85 0.00 0.00 174.74 177.45 1n3t h TYR 180 N 8.34 0.00 0.00 1.40 -1.99 -1.82 -1.04 116.97 121.86 1n3t h TYR 180 Ca -0.30 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.43 1n3t h TYR 180 Cb 1.15 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.88 1n3t h TYR 180 CO 0.73 0.09 0.00 -1.13 -0.00 0.00 0.00 178.16 177.85 1n3t n SER 181 N -3.52 0.00 0.00 3.88 3.41 -1.26 -0.99 113.62 115.13 1n3t n SER 181 Ca -0.02 -1.26 0.00 0.00 -0.26 0.00 0.00 58.87 57.33 1n3t n SER 181 Cb 0.23 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.18 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 -0.69 0.00 -0.08 -3.33 0.31 -0.43 -4.60 118.33 109.50 1n3t n VAL 182 Ca 0.07 0.00 -0.09 0.00 -0.01 0.00 0.00 64.34 64.31 1n3t n VAL 182 Cb 0.03 -0.18 -0.04 0.00 -0.91 0.00 0.00 33.84 32.75 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 -1.62 0.49 -0.38 5.55 4.81 -0.90 -1.09 118.16 125.03 1n3t n LYS 183 Ca 0.00 0.44 0.03 0.00 -0.87 0.00 0.00 58.31 57.92 1n3t n LYS 183 Cb 0.21 -1.63 0.18 0.00 0.02 0.00 0.00 35.03 33.82 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 -3.84 3.05 -3.72 3.14 0.00 -0.16 -3.43 120.51 115.55 1n3t n ALA 184 Ca -0.14 -0.84 -0.04 0.00 0.00 0.00 0.00 53.44 52.42 1n3t n ALA 184 Cb 0.41 -1.05 -0.01 0.00 0.00 0.00 0.00 19.45 18.80 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 -1.77 1.11 6.87 0.00 3.52 -1.25 -4.98 118.95 122.45 1n3t s ARG 185 Ca 0.24 -0.60 0.00 0.00 -0.13 0.00 0.00 55.73 55.24 1n3t s ARG 185 Cb 0.18 0.39 0.00 0.00 -1.56 0.00 0.00 34.95 33.96 1n3t s ARG 185 CO 0.08 -0.51 0.00 0.41 -0.81 0.00 0.00 175.30 174.47 1n3t n GLY 186 N -0.45 3.60 0.22 8.12 0.00 -1.26 -1.17 105.19 114.25 1n3t n GLY 186 Ca -0.06 0.23 0.03 0.00 0.00 0.00 0.00 46.02 46.21 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 1.20 -5.52 -0.61 2.04 -1.88 -3.48 117.51 109.27 1n3t h ILE 187 Ca 0.00 -0.93 -0.10 0.00 1.00 0.00 0.00 64.86 64.83 1n3t h ILE 187 Cb 0.00 1.42 0.05 0.00 -0.74 0.00 0.00 36.82 37.55 1n3t h ILE 187 CO 0.00 0.27 -0.29 0.54 0.00 0.00 0.00 178.15 178.67 1n3t n ARG 188 N -4.22 -1.52 -3.62 2.37 1.74 -0.31 -4.97 116.66 106.12 1n3t n ARG 188 Ca -0.02 1.28 -0.38 0.00 -0.77 0.00 0.00 57.85 57.96 1n3t n ARG 188 Cb 0.32 -5.48 -0.11 0.00 -1.02 0.00 0.00 32.46 26.16 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 -3.10 5.80 0.00 0.55 -1.08 -0.25 -4.93 116.67 113.66 1n3t s ASP 189 Ca 0.12 -0.20 0.26 0.00 -0.52 0.00 0.00 52.55 52.20 1n3t s ASP 189 Cb -0.02 -2.07 0.63 0.00 -1.46 0.00 0.00 42.92 40.00 1n3t s ASP 189 CO 0.76 -0.11 1.50 0.00 0.52 0.00 0.00 175.17 177.84 1n3t n ALA 190 N 5.03 3.33 0.01 3.66 0.00 -1.26 -3.97 120.51 127.31 1n3t n ALA 190 Ca -0.14 -0.35 0.04 0.00 0.00 0.00 0.00 53.44 52.99 1n3t n ALA 190 Cb 0.51 -1.14 -0.07 0.00 0.00 0.00 0.00 19.45 18.75 1n3t n ALA 190 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1n3t n THR 191 N -1.22 0.00 -1.14 0.00 -2.24 -1.26 -5.07 114.28 103.35 1n3t n THR 191 Ca 0.08 -0.21 -0.30 0.00 -2.27 0.00 0.00 64.05 61.35 1n3t n THR 191 Cb 0.34 0.33 0.14 0.00 -2.10 0.00 0.00 70.33 69.03 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 -2.97 3.49 -0.06 3.42 1.04 -1.26 -5.09 113.70 112.27 1n3t s SER 192 Ca -0.03 1.61 -0.28 0.00 0.48 0.00 0.00 55.95 57.73 1n3t s SER 192 Cb 0.06 -2.27 0.06 0.00 0.10 0.00 0.00 66.02 63.97 1n3t s SER 192 CO 0.37 -2.64 0.62 0.00 0.98 0.00 0.00 173.24 172.56 1n3t s ALA 193 N -2.88 -1.60 -0.14 5.32 0.00 -1.26 -4.83 121.76 116.36 1n3t s ALA 193 Ca 0.63 1.20 -0.02 0.00 0.00 0.00 0.00 51.96 53.77 1n3t s ALA 193 Cb -0.19 -0.06 -0.02 0.00 0.00 0.00 0.00 23.12 22.85 1n3t s ALA 193 CO 0.57 -0.35 -0.07 0.99 0.00 0.00 0.00 175.76 176.91 1n3t s THR 194 N -1.11 3.63 -0.23 0.00 2.01 0.11 -4.91 115.64 115.15 1n3t s THR 194 Ca -0.11 -0.46 0.00 0.00 0.31 0.00 0.00 61.69 61.44 1n3t s THR 194 Cb -0.01 -2.56 0.03 0.00 0.01 0.00 0.00 72.50 69.96 1n3t s THR 194 CO 0.08 0.51 -0.12 -0.89 -0.69 0.00 0.00 174.62 173.52 1n3t s THR 195 N 0.23 2.48 0.12 -0.82 2.01 -1.26 -0.57 115.64 117.83 1n3t s THR 195 Ca -0.04 -1.09 0.09 0.00 0.31 0.00 0.00 61.69 60.96 1n3t s THR 195 Cb -0.14 -2.22 -0.04 0.00 0.01 0.00 0.00 72.50 70.10 1n3t s THR 195 CO 0.04 0.28 -0.20 0.42 -0.69 0.00 0.00 174.62 174.47 1n3t s THR 196 N 1.28 2.74 0.02 -0.82 -4.23 -0.48 -4.98 115.64 109.17 1n3t s THR 196 Ca 0.00 -1.58 -0.00 0.00 -1.18 0.00 0.00 61.69 58.94 1n3t s THR 196 Cb -0.16 -2.25 -0.02 0.00 1.34 0.00 0.00 72.50 71.41 1n3t s THR 196 CO -0.07 0.08 -0.03 0.42 -0.54 0.00 0.00 174.62 174.48 1n3t s THR 197 N -1.17 0.11 -0.17 3.99 -4.23 -1.26 -0.57 115.64 112.35 1n3t s THR 197 Ca 0.18 -0.94 -0.02 0.00 -1.18 0.00 0.00 61.69 59.73 1n3t s THR 197 Cb -0.10 -0.31 0.05 0.00 1.34 0.00 0.00 72.50 73.48 1n3t s THR 197 CO 0.10 -0.52 0.01 -0.44 -0.54 0.00 0.00 174.62 173.23 1n3t s SER 198 N -1.51 2.65 -0.13 3.99 0.01 0.20 -4.98 113.70 113.93 1n3t s SER 198 Ca -0.15 -0.65 -0.05 0.00 1.31 0.00 0.00 55.95 56.41 1n3t s SER 198 Cb -0.09 -0.63 -0.04 0.00 0.21 0.00 0.00 66.02 65.47 1n3t s SER 198 CO -0.01 -0.26 0.04 -0.76 0.41 0.00 0.00 173.24 172.66 1n3t s LEU 199 N 1.83 3.78 0.47 2.44 1.43 -1.26 -0.91 118.68 126.45 1n3t s LEU 199 Ca 0.00 0.16 0.05 0.00 -1.03 0.00 0.00 54.13 53.31 1n3t s LEU 199 Cb -0.16 -1.91 -0.03 0.00 0.03 0.00 0.00 46.19 44.12 1n3t s LEU 199 CO -0.07 0.30 0.10 -0.83 0.23 0.00 0.00 176.35 176.08 1n3t s GLY 200 N -0.41 2.65 0.00 -3.19 0.00 -0.33 -4.66 107.32 101.38 1n3t s GLY 200 Ca 0.09 -1.40 0.00 0.00 0.00 0.00 0.00 44.72 43.41 1n3t s GLY 200 CO 0.02 -2.07 0.00 0.61 0.00 0.00 0.00 173.10 171.66 1n3t n GLY 201 N -1.25 1.14 0.35 0.20 0.00 0.41 -0.93 105.19 105.11 1n3t n GLY 201 Ca -0.09 -0.04 0.11 0.00 0.00 0.00 0.00 46.02 46.00 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 0.79 -0.40 0.99 3.38 -1.95 -1.04 115.31 117.08 1n3t h LEU 202 Ca 0.00 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1n3t h LEU 202 Cb 0.00 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.69 1n3t h LEU 202 CO 0.00 0.31 0.21 0.49 0.09 0.00 0.00 178.44 179.54 1n3t n PHE 203 N -4.75 0.20 -0.02 1.13 3.72 -0.10 0.10 117.46 117.74 1n3t n PHE 203 Ca 0.22 0.11 -0.03 0.00 -0.05 0.00 0.00 57.45 57.70 1n3t n PHE 203 Cb 0.52 -0.50 -0.03 0.00 -0.94 0.00 0.00 39.48 38.53 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 -1.64 1.20 -0.01 -1.08 4.81 -0.43 -4.26 118.16 116.74 1n3t n LYS 204 Ca -0.00 0.02 -0.07 0.00 -0.87 0.00 0.00 58.31 57.39 1n3t n LYS 204 Cb 0.22 -1.10 -0.13 0.00 0.02 0.00 0.00 35.03 34.04 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 -2.48 0.86 -4.48 3.14 3.41 -0.66 -4.79 113.62 108.63 1n3t n SER 205 Ca -0.08 0.41 -0.43 0.00 -0.26 0.00 0.00 58.87 58.50 1n3t n SER 205 Cb 0.60 -0.01 -0.06 0.00 -0.26 0.00 0.00 64.21 64.49 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 -6.02 6.28 0.31 4.04 0.15 0.29 -4.91 113.70 113.83 1n3t s SER 206 Ca -0.04 -0.65 0.06 0.00 0.70 0.00 0.00 55.95 56.02 1n3t s SER 206 Cb 0.08 -2.34 0.74 0.00 -1.71 0.00 0.00 66.02 62.79 1n3t s SER 206 CO 0.82 -0.98 1.79 -0.61 1.20 0.00 0.00 173.24 175.46 1n3t h GLN 207 N 9.08 0.75 0.71 5.44 5.75 -1.86 0.28 115.11 135.25 1n3t h GLN 207 Ca -0.27 -0.05 -0.03 0.00 -0.15 0.00 0.00 58.65 58.15 1n3t h GLN 207 Cb 1.09 -0.17 0.01 0.00 1.07 0.00 0.00 27.48 29.48 1n3t h GLN 207 CO 0.99 0.50 -0.34 -0.97 -2.65 0.00 0.00 178.83 176.36 1n3t h ASN 208 N 0.77 -0.80 -0.84 -0.69 -1.24 -1.93 -2.47 115.58 108.39 1n3t h ASN 208 Ca 0.57 0.01 0.06 0.00 0.71 0.00 0.00 56.30 57.64 1n3t h ASN 208 Cb 0.87 0.21 -0.06 0.00 0.73 0.00 0.00 38.32 40.07 1n3t h ASN 208 CO -0.36 -0.45 0.51 0.74 -1.29 0.00 0.00 177.43 176.59 1n3t h THR 209 N -1.18 1.03 -0.47 -3.57 2.02 -1.74 -1.51 112.91 107.49 1n3t h THR 209 Ca -0.10 -0.32 0.08 0.00 0.77 0.00 0.00 66.41 66.84 1n3t h THR 209 Cb 0.75 0.01 -0.07 0.00 -1.74 0.00 0.00 68.15 67.10 1n3t h THR 209 CO 0.16 0.17 0.07 -0.09 0.37 0.00 0.00 175.52 176.20 1n3t h ARG 210 N 0.94 0.19 0.00 6.66 2.43 -0.45 -1.32 114.38 122.82 1n3t h ARG 210 Ca 0.37 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.52 1n3t h ARG 210 Cb 0.17 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.68 1n3t h ARG 210 CO -0.17 0.12 -0.03 0.72 -1.51 0.00 0.00 179.97 179.10 1n3t n HIS 211 N -5.14 0.26 0.48 2.20 8.25 -0.90 -2.66 115.22 117.70 1n3t n HIS 211 Ca 0.05 0.08 0.13 0.00 -0.26 0.00 0.00 57.72 57.71 1n3t n HIS 211 Cb 0.24 -0.61 0.34 0.00 1.12 0.00 0.00 29.99 31.07 1n3t n HIS 211 CO 0.00 0.00 0.00 0.93 0.64 0.00 0.00 176.34 177.91 1n3t h GLU 212 N 0.00 0.00 0.00 -0.41 5.08 -0.23 -3.26 114.58 115.76 1n3t h GLU 212 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1n3t h GLU 212 Cb 0.57 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.82 1n3t h GLU 212 CO 0.00 0.00 -0.31 0.34 -1.00 0.00 0.00 179.01 178.04 1n3t n PHE 213 N -2.56 0.29 -0.38 4.33 7.35 -1.04 -4.04 117.46 121.41 1n3t n PHE 213 Ca 0.05 0.13 0.30 0.00 -0.76 0.00 0.00 57.45 57.17 1n3t n PHE 213 Cb 0.45 -0.40 0.58 0.00 0.35 0.00 0.00 39.48 40.46 1n3t n PHE 213 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 1n3t h LEU 214 N -0.46 0.35 -0.17 -2.13 3.38 -1.69 0.42 115.31 115.01 1n3t h LEU 214 Ca 0.00 0.12 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 1n3t h LEU 214 Cb 0.31 0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 1n3t h LEU 214 CO 0.00 -0.08 0.04 -0.09 0.09 0.00 0.00 178.44 178.40 1n3t h ARG 215 N 0.22 0.28 -0.68 1.13 2.43 -1.78 -2.61 114.38 113.37 1n3t h ARG 215 Ca 0.73 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.83 1n3t h ARG 215 Cb 2.08 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 31.59 1n3t h ARG 215 CO -0.40 0.42 0.00 0.00 -1.51 0.00 0.00 179.97 178.48 1n3t n ALA 216 N -2.27 2.29 -2.64 2.80 0.00 0.12 -4.79 120.51 116.02 1n3t n ALA 216 Ca -0.05 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.10 1n3t n ALA 216 Cb 0.16 -1.00 -0.09 0.00 0.00 0.00 0.00 19.45 18.53 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 -1.21 3.73 -0.06 0.00 1.01 -0.98 -4.84 120.40 118.05 1n3t s VAL 217 Ca 0.00 -1.19 -0.00 0.00 0.00 0.00 0.00 61.98 60.79 1n3t s VAL 217 Cb 0.00 -2.79 0.00 0.00 0.00 0.00 0.00 36.38 33.59 1n3t s VAL 217 CO 0.00 0.06 0.07 -1.14 0.00 0.00 0.00 175.10 174.09 1n3t n ARG 218 N 0.45 -0.15 -4.43 2.72 0.00 -1.26 -5.03 116.66 108.96 1n3t n ARG 218 Ca -0.11 0.61 -0.24 0.00 -0.00 0.00 0.00 57.85 58.11 1n3t n ARG 218 Cb 0.53 -1.91 -0.11 0.00 0.00 0.00 0.00 32.46 30.97 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 -2.54 2.20 -0.14 -0.14 3.76 -1.26 -5.14 115.29 112.03 1n3t s HIS 219 Ca 0.01 -0.37 0.02 0.00 -0.15 0.00 0.00 55.06 54.57 1n3t s HIS 219 Cb -0.00 -1.01 0.01 0.00 1.11 0.00 0.00 32.58 32.69 1n3t s HIS 219 CO 0.07 0.58 -0.20 -1.58 -0.85 0.00 0.00 174.74 172.77 1n3t s HIS 220 N -2.24 2.48 0.00 1.40 2.46 -1.26 -4.93 115.29 113.20 1n3t s HIS 220 Ca 0.25 -1.26 0.00 0.00 0.47 0.00 0.00 55.06 54.52 1n3t s HIS 220 Cb -0.06 -1.71 0.00 0.00 -0.13 0.00 0.00 32.58 30.68 1n3t s HIS 220 CO 0.12 -0.60 0.00 0.09 -2.47 0.00 0.00 174.74 171.88