#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 -4.26 2.46 4.77 -1.26 -4.94 117.00 113.77 1n3t n LEU 3 Ca 0.00 0.00 -0.23 0.00 -0.03 0.00 0.00 56.01 55.75 1n3t n LEU 3 Cb 0.00 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 40.96 1n3t n LEU 3 CO 0.00 0.00 -0.51 -0.94 -1.33 0.00 0.00 177.39 174.61 1n3t s SER 4 N 1.00 2.39 0.22 -1.43 1.04 -1.26 -5.04 113.70 110.62 1n3t s SER 4 Ca 0.00 -0.63 -0.10 0.00 0.48 0.00 0.00 55.95 55.70 1n3t s SER 4 Cb 0.00 -0.14 0.33 0.00 0.10 0.00 0.00 66.02 66.31 1n3t s SER 4 CO 0.00 0.06 1.66 0.11 0.98 0.00 0.00 173.24 176.05 1n3t h LYS 5 N 4.30 0.12 0.72 4.02 1.57 -2.02 -1.86 116.57 123.43 1n3t h LYS 5 Ca -0.44 -0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 58.29 1n3t h LYS 5 Cb 1.18 -0.03 0.01 0.00 0.08 0.00 0.00 32.23 33.47 1n3t h LYS 5 CO 0.41 0.08 -0.35 0.93 -0.57 0.00 0.00 179.45 179.95 1n3t h GLU 6 N 0.12 -0.94 -0.99 3.15 3.07 -1.97 -2.24 114.58 114.78 1n3t h GLU 6 Ca 0.35 0.06 0.41 0.00 -0.50 0.00 0.00 59.36 59.68 1n3t h GLU 6 Cb 0.57 0.21 -0.18 0.00 -0.84 0.00 0.00 28.75 28.52 1n3t h GLU 6 CO -0.56 -0.62 0.51 0.00 -1.40 0.00 0.00 179.01 176.93 1n3t n ALA 7 N -2.65 0.99 0.16 3.43 0.00 -1.02 0.74 120.51 122.16 1n3t n ALA 7 Ca -0.12 1.01 -0.13 0.00 0.00 0.00 0.00 53.44 54.20 1n3t n ALA 7 Cb 0.38 -1.00 -0.08 0.00 0.00 0.00 0.00 19.45 18.75 1n3t n ALA 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n3t h ALA 8 N 1.98 -0.40 -0.70 0.00 0.00 -1.22 -1.78 119.26 117.15 1n3t h ALA 8 Ca 0.83 -0.17 0.13 0.00 0.00 0.00 0.00 54.91 55.70 1n3t h ALA 8 Cb 2.17 0.15 -0.09 0.00 0.00 0.00 0.00 17.79 20.03 1n3t h ALA 8 CO -0.77 -0.57 0.24 -0.07 0.00 0.00 0.00 179.25 178.07 1n3t h LEU 9 N -0.70 0.17 -0.35 0.00 3.38 0.94 -1.55 115.31 117.20 1n3t h LEU 9 Ca -0.04 0.11 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 1n3t h LEU 9 Cb 0.48 0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 1n3t h LEU 9 CO 0.07 0.07 0.10 0.58 0.09 0.00 0.00 178.44 179.35 1n3t h VAL 10 N 0.37 1.21 0.51 1.22 2.07 -0.85 -2.56 116.25 118.22 1n3t h VAL 10 Ca 0.38 -0.70 -0.02 0.00 0.82 0.00 0.00 66.70 67.18 1n3t h VAL 10 Cb 0.57 1.01 0.00 0.00 -1.52 0.00 0.00 31.29 31.35 1n3t h VAL 10 CO -0.40 0.24 -0.26 -0.74 0.02 0.00 0.00 177.57 176.42 1n3t h HIS 11 N 0.41 -0.68 -0.98 1.57 -0.00 -0.58 -2.21 115.15 112.68 1n3t h HIS 11 Ca 0.11 -0.01 0.11 0.00 -0.00 0.00 0.00 60.37 60.58 1n3t h HIS 11 Cb 0.26 0.23 -0.08 0.00 -0.00 0.00 0.00 27.41 27.82 1n3t h HIS 11 CO 0.01 -0.42 0.61 0.93 -0.00 0.00 0.00 177.93 179.07 1n3t h GLU 12 N -0.71 0.95 -0.09 5.26 5.08 -1.36 0.11 114.58 123.82 1n3t h GLU 12 Ca -0.07 -0.06 -0.04 0.00 -1.00 0.00 0.00 59.36 58.19 1n3t h GLU 12 Cb 0.55 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 1n3t h GLU 12 CO 0.10 0.63 -0.14 0.00 -1.00 0.00 0.00 179.01 178.60 1n3t h ALA 13 N 1.52 1.59 0.19 3.43 0.00 -1.22 -0.50 119.26 124.27 1n3t h ALA 13 Ca 0.48 -0.19 -0.32 0.00 0.00 0.00 0.00 54.91 54.89 1n3t h ALA 13 Cb 0.45 -0.06 0.02 0.00 0.00 0.00 0.00 17.79 18.20 1n3t h ALA 13 CO -0.26 0.30 -1.48 -0.07 0.00 0.00 0.00 179.25 177.74 1n3t h LEU 14 N 0.14 0.62 -0.71 0.00 3.38 -0.44 -3.02 115.31 115.28 1n3t h LEU 14 Ca 0.03 -0.73 -0.07 0.00 0.09 0.00 0.00 57.88 57.19 1n3t h LEU 14 Cb 0.34 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 1n3t h LEU 14 CO 0.02 1.59 0.14 0.58 0.09 0.00 0.00 178.44 180.86 1n3t h VAL 15 N 0.11 1.26 -0.73 1.22 2.07 -0.85 0.04 116.25 119.38 1n3t h VAL 15 Ca -0.24 -1.01 0.08 0.00 0.82 0.00 0.00 66.70 66.35 1n3t h VAL 15 Cb 2.08 0.58 -0.07 0.00 -1.52 0.00 0.00 31.29 32.36 1n3t h VAL 15 CO 0.22 0.38 0.39 0.00 0.02 0.00 0.00 177.57 178.59 1n3t h ALA 16 N 1.08 1.01 -0.10 1.67 0.00 -1.14 0.21 119.26 121.99 1n3t h ALA 16 Ca 0.21 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1n3t h ALA 16 Cb 0.41 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1n3t h ALA 16 CO 0.01 0.02 0.00 -2.13 0.00 0.00 0.00 179.25 177.15 1n3t n ARG 17 N -4.81 1.76 -3.24 0.00 0.63 -1.04 -4.93 116.66 105.04 1n3t n ARG 17 Ca 0.11 -1.12 -0.22 0.00 -0.92 0.00 0.00 57.85 55.70 1n3t n ARG 17 Cb 0.24 -1.44 0.05 0.00 0.45 0.00 0.00 32.46 31.76 1n3t n ARG 17 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1n3t n GLY 18 N 1.18 -0.44 0.77 5.14 0.00 0.06 -4.90 105.19 107.00 1n3t n GLY 18 Ca 0.18 0.13 0.07 0.00 0.00 0.00 0.00 46.02 46.39 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 -4.22 3.04 -4.80 0.99 4.77 -0.24 -4.99 117.00 111.54 1n3t n LEU 19 Ca -0.05 -1.89 -0.34 0.00 -0.03 0.00 0.00 56.01 53.69 1n3t n LEU 19 Cb 0.58 -0.26 -0.05 0.00 -2.33 0.00 0.00 43.42 41.37 1n3t n LEU 19 CO 0.52 0.75 0.69 -1.61 -1.33 0.00 0.00 177.39 176.40 1n3t s GLU 20 N -1.02 4.10 0.38 3.23 0.41 -1.23 -4.80 118.70 119.78 1n3t s GLU 20 Ca 0.27 1.29 -0.28 0.00 -0.41 0.00 0.00 54.97 55.84 1n3t s GLU 20 Cb 0.15 -2.27 -0.11 0.00 -1.78 0.00 0.00 34.13 30.12 1n3t s GLU 20 CO 0.19 -0.16 1.48 0.99 -0.49 0.00 0.00 175.26 177.27 1n3t s THR 21 N -1.97 2.07 -0.59 3.63 2.01 -1.26 -4.80 115.64 114.72 1n3t s THR 21 Ca 0.62 0.07 -0.27 0.00 0.31 0.00 0.00 61.69 62.42 1n3t s THR 21 Cb -0.15 -3.04 -0.10 0.00 0.01 0.00 0.00 72.50 69.22 1n3t s THR 21 CO 0.19 0.02 2.46 -2.65 -0.69 0.00 0.00 174.62 173.94 1n3t n PRO 22 N 0.44 0.84 -4.42 4.92 -0.02 -1.26 -4.93 135.00 130.57 1n3t n PRO 22 Ca 0.01 -0.07 -0.25 0.00 -2.02 0.00 0.00 63.50 61.18 1n3t n PRO 22 Cb 0.39 -3.16 -0.11 0.00 -0.02 0.00 0.00 33.50 30.61 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 11.83 2.49 0.04 2.45 1.02 -1.26 -5.15 118.68 130.11 1n3t s LEU 23 Ca 1.04 -0.93 0.03 0.00 0.02 0.00 0.00 54.13 54.29 1n3t s LEU 23 Cb -0.34 -1.07 -0.04 0.00 0.02 0.00 0.00 46.19 44.76 1n3t s LEU 23 CO 0.29 0.06 -0.01 -0.60 0.02 0.00 0.00 176.35 176.10 1n3t s ARG 24 N -3.03 2.63 -0.21 1.70 3.52 -1.26 -5.05 118.95 117.25 1n3t s ARG 24 Ca 0.23 -0.74 -0.33 0.00 -0.13 0.00 0.00 55.73 54.76 1n3t s ARG 24 Cb -0.06 -2.58 -0.10 0.00 -1.56 0.00 0.00 34.95 30.65 1n3t s ARG 24 CO 0.11 0.58 2.06 -2.30 -0.81 0.00 0.00 175.30 174.94 1n3t n PRO 25 N 1.03 1.74 -0.49 5.12 -0.02 -1.26 -4.81 135.00 136.31 1n3t n PRO 25 Ca -0.13 0.56 0.42 0.00 -2.02 0.00 0.00 63.50 62.33 1n3t n PRO 25 Cb 0.52 -2.70 0.66 0.00 -0.02 0.00 0.00 33.50 31.96 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 11.53 0.00 0.00 0.52 0.11 -2.04 -3.44 132.00 138.68 1n3t h PRO 26 Ca -0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1n3t h PRO 26 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1n3t h PRO 26 CO 0.98 0.00 0.00 0.28 -0.21 0.00 0.00 178.00 179.05 1n3t n VAL 27 N -3.64 0.00 -3.60 3.15 0.31 -1.26 -4.61 118.33 108.67 1n3t n VAL 27 Ca 0.35 0.00 -0.26 0.00 -0.01 0.00 0.00 64.34 64.42 1n3t n VAL 27 Cb 1.80 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 34.70 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 -1.12 3.52 -3.43 -1.26 -5.04 115.29 111.44 1n3t s HIS 28 Ca 0.00 0.36 -0.10 0.00 -0.80 0.00 0.00 55.06 54.52 1n3t s HIS 28 Cb 0.00 -1.88 0.25 0.00 -1.43 0.00 0.00 32.58 29.53 1n3t s HIS 28 CO 0.00 0.31 1.16 -1.21 -2.00 0.00 0.00 174.74 172.99 1n3t s GLU 29 N -3.58 4.15 0.28 -0.38 2.02 -1.26 -5.02 118.70 114.92 1n3t s GLU 29 Ca 0.39 -3.06 -0.30 0.00 0.02 0.00 0.00 54.97 52.03 1n3t s GLU 29 Cb -0.11 -4.65 -0.11 0.00 0.10 0.00 0.00 34.13 29.37 1n3t s GLU 29 CO 0.30 -1.35 1.54 1.41 0.02 0.00 0.00 175.26 177.19 1n3t s MET 30 N -0.63 4.17 0.11 1.61 -2.45 -1.26 -4.89 119.30 115.95 1n3t s MET 30 Ca 0.32 2.49 -0.35 0.00 -1.25 0.00 0.00 55.69 56.91 1n3t s MET 30 Cb -0.09 -3.05 -0.15 0.00 1.25 0.00 0.00 34.83 32.80 1n3t s MET 30 CO -0.07 -0.56 1.54 -3.47 1.05 0.00 0.00 175.02 173.51 1n3t n ASP 31 N 2.21 2.70 -0.15 1.11 2.03 -1.26 -4.89 116.55 118.29 1n3t n ASP 31 Ca 0.08 1.08 0.11 0.00 0.52 0.00 0.00 54.79 56.58 1n3t n ASP 31 Cb 0.38 -1.35 0.44 0.00 -0.72 0.00 0.00 41.12 39.88 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 5.82 0.49 0.67 1.67 -1.24 -2.01 0.03 115.58 121.01 1n3t h ASN 32 Ca -0.46 0.01 -0.14 0.00 0.71 0.00 0.00 56.30 56.43 1n3t h ASN 32 Cb 1.28 -0.09 -0.02 0.00 0.73 0.00 0.00 38.32 40.22 1n3t h ASN 32 CO 0.86 0.29 -0.65 -0.33 -1.29 0.00 0.00 177.43 176.32 1n3t h GLU 33 N 0.55 0.00 -0.62 6.67 4.39 -2.01 -3.06 114.58 120.50 1n3t h GLU 33 Ca 0.32 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.95 1n3t h GLU 33 Cb 0.52 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.15 1n3t h GLU 33 CO -0.11 0.65 0.09 1.15 -1.16 0.00 0.00 179.01 179.64 1n3t h THR 34 N 0.00 1.26 -0.43 1.13 2.02 -1.37 -2.36 112.91 113.15 1n3t h THR 34 Ca -0.01 -1.00 -0.04 0.00 0.77 0.00 0.00 66.41 66.13 1n3t h THR 34 Cb 1.16 0.68 -0.02 0.00 -1.74 0.00 0.00 68.15 68.23 1n3t h THR 34 CO 0.08 0.37 0.11 0.03 0.37 0.00 0.00 175.52 176.48 1n3t h ARG 35 N 0.95 0.69 -0.52 6.66 3.08 -1.34 -2.05 114.38 121.84 1n3t h ARG 35 Ca 0.19 -0.16 -0.07 0.00 0.07 0.00 0.00 59.98 60.01 1n3t h ARG 35 Cb 0.42 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.36 1n3t h ARG 35 CO 0.01 0.69 0.06 0.87 -1.07 0.00 0.00 179.97 180.54 1n3t h LYS 36 N 0.56 0.84 0.00 0.04 1.57 -1.45 0.29 116.57 118.42 1n3t h LYS 36 Ca 0.13 -0.20 -0.03 0.00 -1.87 0.00 0.00 60.65 58.68 1n3t h LYS 36 Cb 0.31 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.51 1n3t h LYS 36 CO 0.00 0.80 -0.12 0.66 -0.57 0.00 0.00 179.45 180.22 1n3t h SER 37 N 0.80 0.00 0.00 0.86 4.64 -1.25 -0.32 113.55 118.28 1n3t h SER 37 Ca 0.16 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.48 1n3t h SER 37 Cb 0.39 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.48 1n3t h SER 37 CO 0.01 0.12 -0.03 -0.07 -0.87 0.00 0.00 176.83 176.00 1n3t h LEU 38 N 0.00 0.00 -0.61 5.97 3.38 -0.53 -3.12 115.31 120.40 1n3t h LEU 38 Ca -0.00 -0.28 0.08 0.00 0.09 0.00 0.00 57.88 57.77 1n3t h LEU 38 Cb 0.65 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.34 1n3t h LEU 38 CO 0.02 0.65 0.28 0.40 0.09 0.00 0.00 178.44 179.88 1n3t h ILE 39 N -1.00 0.86 -0.91 1.22 2.04 -0.46 0.30 117.51 119.56 1n3t h ILE 39 Ca -0.00 -0.17 0.18 0.00 1.00 0.00 0.00 64.86 65.86 1n3t h ILE 39 Cb 0.30 0.31 -0.11 0.00 -0.74 0.00 0.00 36.82 36.59 1n3t h ILE 39 CO -0.00 0.09 0.48 0.00 0.00 0.00 0.00 178.15 178.72 1n3t h ALA 40 N 1.37 1.44 0.61 1.87 0.00 -1.19 -1.88 119.26 121.50 1n3t h ALA 40 Ca 0.29 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.28 1n3t h ALA 40 Cb 0.29 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1n3t h ALA 40 CO -0.24 -0.15 -0.45 0.78 0.00 0.00 0.00 179.25 179.19 1n3t h GLY 41 N 0.61 -1.24 -0.49 0.00 0.00 -0.87 0.63 103.07 101.70 1n3t h GLY 41 Ca 0.52 0.53 0.32 0.00 0.00 0.00 0.00 47.33 48.71 1n3t h GLY 41 CO -0.41 -0.40 0.63 0.45 0.00 0.00 0.00 176.54 176.80 1n3t h HIS 42 N -1.02 0.85 -0.31 5.60 -0.00 -1.01 0.28 115.15 119.54 1n3t h HIS 42 Ca -0.08 0.03 -0.18 0.00 -0.00 0.00 0.00 60.37 60.14 1n3t h HIS 42 Cb 0.84 -0.23 -0.00 0.00 -0.00 0.00 0.00 27.41 28.02 1n3t h HIS 42 CO -0.15 -0.11 -0.52 0.52 -0.00 0.00 0.00 177.93 177.67 1n3t h MET 43 N 0.34 0.90 0.00 2.45 2.86 -0.77 -1.60 114.93 119.11 1n3t h MET 43 Ca 0.71 -0.55 -0.01 0.00 -2.06 0.00 0.00 59.70 57.80 1n3t h MET 43 Cb 1.71 0.06 -0.00 0.00 0.06 0.00 0.00 31.60 33.42 1n3t h MET 43 CO -0.52 1.19 -0.03 1.15 1.06 0.00 0.00 176.91 179.76 1n3t h THR 44 N 0.70 0.22 0.01 2.22 2.02 0.18 -0.97 112.91 117.30 1n3t h THR 44 Ca 0.02 -0.23 -0.02 0.00 0.77 0.00 0.00 66.41 66.96 1n3t h THR 44 Cb 1.13 1.18 0.00 0.00 -1.74 0.00 0.00 68.15 68.71 1n3t h THR 44 CO 0.12 0.03 -0.07 -0.33 0.37 0.00 0.00 175.52 175.63 1n3t h GLU 45 N 0.00 0.02 -0.68 6.66 4.39 -0.73 -3.25 114.58 120.99 1n3t h GLU 45 Ca -0.00 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.66 1n3t h GLU 45 Cb 0.18 0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 28.81 1n3t h GLU 45 CO 0.00 1.02 0.43 0.82 -1.16 0.00 0.00 179.01 180.12 1n3t h ILE 46 N -0.95 1.19 0.00 3.13 2.04 -0.85 -0.35 117.51 121.71 1n3t h ILE 46 Ca -0.01 -0.38 -0.04 0.00 1.00 0.00 0.00 64.86 65.43 1n3t h ILE 46 Cb 1.05 0.21 -0.01 0.00 -0.74 0.00 0.00 36.82 37.33 1n3t h ILE 46 CO 0.01 0.19 -0.18 0.24 0.00 0.00 0.00 178.15 178.41 1n3t h MET 47 N 0.93 0.00 0.00 2.37 2.86 -1.32 -1.98 114.93 117.80 1n3t h MET 47 Ca 0.25 0.00 -0.19 0.00 -2.06 0.00 0.00 59.70 57.70 1n3t h MET 47 Cb -0.06 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.57 1n3t h MET 47 CO -0.05 0.18 -1.01 1.96 1.06 0.00 0.00 176.91 179.05 1n3t h GLN 48 N 0.00 0.00 0.00 1.72 4.20 -1.15 -0.78 115.11 119.10 1n3t h GLN 48 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1n3t h GLN 48 Cb 0.54 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.32 1n3t h GLN 48 CO 0.02 0.75 0.00 1.28 -0.67 0.00 0.00 178.83 180.21 1n3t n LEU 49 N -3.24 0.31 -0.78 1.46 4.77 -0.43 -2.31 117.00 116.78 1n3t n LEU 49 Ca -0.03 0.54 0.08 0.00 -0.03 0.00 0.00 56.01 56.58 1n3t n LEU 49 Cb 0.90 -0.46 0.14 0.00 -2.33 0.00 0.00 43.42 41.66 1n3t n LEU 49 CO 0.45 -0.18 0.59 0.18 -1.33 0.00 0.00 177.39 177.10 1n3t n LEU 50 N -1.81 2.83 -3.15 2.23 4.77 -0.93 -4.99 117.00 115.95 1n3t n LEU 50 Ca 0.05 -1.49 -0.14 0.00 -0.03 0.00 0.00 56.01 54.40 1n3t n LEU 50 Cb 0.31 -0.16 0.07 0.00 -2.33 0.00 0.00 43.42 41.31 1n3t n LEU 50 CO 0.24 0.62 0.06 0.59 -1.33 0.00 0.00 177.39 177.57 1n3t n ASN 51 N 0.93 -4.33 -4.31 -1.43 3.02 -0.98 -5.01 115.26 103.16 1n3t n ASN 51 Ca 0.13 -0.61 -0.35 0.00 -0.03 0.00 0.00 54.58 53.72 1n3t n ASN 51 Cb 0.45 -4.76 -0.14 0.00 -0.61 0.00 0.00 39.78 34.72 1n3t n ASN 51 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1n3t s LEU 52 N -5.54 3.12 -0.72 3.41 1.43 -0.31 -5.03 118.68 115.04 1n3t s LEU 52 Ca 0.23 -0.48 -0.25 0.00 -1.03 0.00 0.00 54.13 52.59 1n3t s LEU 52 Cb -0.03 -1.77 -0.14 0.00 0.03 0.00 0.00 46.19 44.29 1n3t s LEU 52 CO 0.67 -0.06 2.41 -0.67 0.23 0.00 0.00 176.35 178.93 1n3t n ASP 53 N 4.80 1.69 0.00 2.29 -0.08 -1.26 -4.63 116.55 119.36 1n3t n ASP 53 Ca -0.17 -1.10 0.05 0.00 -1.51 0.00 0.00 54.79 52.06 1n3t n ASP 53 Cb 0.50 -1.54 0.28 0.00 2.34 0.00 0.00 41.12 42.69 1n3t n ASP 53 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1n3t n LEU 54 N 16.82 0.00 0.00 -2.67 4.77 -1.26 -1.76 117.00 132.91 1n3t n LEU 54 Ca 0.46 0.00 -0.18 0.00 -0.03 0.00 0.00 56.01 56.26 1n3t n LEU 54 Cb 0.43 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.42 1n3t n LEU 54 CO 0.64 0.00 0.24 0.00 -1.33 0.00 0.00 177.39 176.94 1n3t h ALA 55 N 2.64 0.11 -1.37 -1.18 0.00 -1.95 -3.38 119.26 114.13 1n3t h ALA 55 Ca 0.00 -0.58 -0.73 0.00 0.00 0.00 0.00 54.91 53.60 1n3t h ALA 55 Cb 0.00 0.03 0.05 0.00 0.00 0.00 0.00 17.79 17.87 1n3t h ALA 55 CO 0.00 0.42 0.27 -3.47 0.00 0.00 0.00 179.25 176.47 1n3t n ASP 56 N -4.15 0.89 0.31 0.00 2.03 -0.72 -4.80 116.55 110.11 1n3t n ASP 56 Ca -0.10 1.14 0.18 0.00 0.52 0.00 0.00 54.79 56.53 1n3t n ASP 56 Cb 0.70 -1.07 0.93 0.00 -0.72 0.00 0.00 41.12 40.96 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 3.83 0.00 0.00 1.67 2.03 -1.90 -0.74 116.42 121.31 1n3t h ASP 57 Ca -0.49 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.81 1n3t h ASP 57 Cb 1.38 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.88 1n3t h ASP 57 CO 0.72 0.00 -0.27 -0.24 -1.03 0.00 0.00 179.24 178.42 1n3t n SER 58 N -3.09 0.86 0.29 4.15 2.88 -1.26 -4.37 113.62 113.08 1n3t n SER 58 Ca -0.01 0.40 0.18 0.00 -1.33 0.00 0.00 58.87 58.11 1n3t n SER 58 Cb 0.30 -0.67 0.92 0.00 -0.75 0.00 0.00 64.21 64.01 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 -0.47 0.00 -0.89 2.46 3.38 -1.86 -2.83 115.31 115.10 1n3t h LEU 59 Ca 0.00 0.00 0.10 0.00 0.09 0.00 0.00 57.88 58.07 1n3t h LEU 59 Cb 0.27 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.94 1n3t h LEU 59 CO 0.00 0.00 0.53 -0.03 0.09 0.00 0.00 178.44 179.03 1n3t h MET 60 N 0.00 0.86 0.00 1.13 4.05 -1.32 -2.76 114.93 116.89 1n3t h MET 60 Ca 0.03 -0.05 0.00 0.00 -0.28 0.00 0.00 59.70 59.40 1n3t h MET 60 Cb 0.50 -0.19 0.00 0.00 -0.80 0.00 0.00 31.60 31.10 1n3t h MET 60 CO -0.00 0.57 -0.60 0.39 0.23 0.00 0.00 176.91 177.50 1n3t n GLU 61 N -4.68 0.24 -0.26 0.39 -0.58 -1.07 -4.43 120.64 110.25 1n3t n GLU 61 Ca 0.15 0.07 -0.08 0.00 -0.42 0.00 0.00 57.16 56.88 1n3t n GLU 61 Cb 0.28 -1.65 -0.03 0.00 -0.57 0.00 0.00 31.44 29.47 1n3t n GLU 61 CO 0.00 0.00 0.00 1.15 -0.48 0.00 0.00 177.13 177.80 1n3t h THR 62 N 0.00 0.06 -0.82 2.62 2.02 -1.62 -1.65 112.91 113.52 1n3t h THR 62 Ca 0.00 0.00 0.20 0.00 0.77 0.00 0.00 66.41 67.38 1n3t h THR 62 Cb 0.70 0.06 -0.14 0.00 -1.74 0.00 0.00 68.15 67.03 1n3t h THR 62 CO 0.00 0.00 0.02 -0.65 0.37 0.00 0.00 175.52 175.26 1n3t h PRO 63 N -0.16 0.09 -0.52 6.66 0.11 -1.77 0.46 132.00 136.86 1n3t h PRO 63 Ca 0.20 -0.01 -0.08 0.00 0.11 0.00 0.00 66.00 66.23 1n3t h PRO 63 Cb 0.55 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 31.62 1n3t h PRO 63 CO -0.77 0.06 0.02 0.45 -0.21 0.00 0.00 178.00 177.55 1n3t h HIS 64 N 0.09 0.93 0.31 0.65 3.86 -1.63 -2.06 115.15 117.30 1n3t h HIS 64 Ca 0.46 -0.13 -0.02 0.00 -1.16 0.00 0.00 60.37 59.53 1n3t h HIS 64 Cb 0.85 -0.25 0.00 0.00 1.06 0.00 0.00 27.41 29.07 1n3t h HIS 64 CO -0.44 0.84 -0.15 0.00 0.86 0.00 0.00 177.93 179.04 1n3t h ARG 65 N 0.81 -0.40 -0.63 2.45 3.08 0.59 0.47 114.38 120.75 1n3t h ARG 65 Ca 0.16 0.03 0.08 0.00 0.07 0.00 0.00 59.98 60.31 1n3t h ARG 65 Cb 0.46 0.09 -0.06 0.00 0.08 0.00 0.00 29.97 30.54 1n3t h ARG 65 CO 0.02 -0.11 0.30 0.82 -1.07 0.00 0.00 179.97 179.92 1n3t h ILE 66 N -0.67 0.87 0.05 2.04 2.04 -0.84 0.51 117.51 121.50 1n3t h ILE 66 Ca -0.04 -0.18 0.03 0.00 1.00 0.00 0.00 64.86 65.66 1n3t h ILE 66 Cb 0.47 0.28 -0.05 0.00 -0.74 0.00 0.00 36.82 36.79 1n3t h ILE 66 CO 0.07 0.10 -0.37 0.00 0.00 0.00 0.00 178.15 177.94 1n3t h ALA 67 N 1.38 -0.61 -0.65 1.87 0.00 -1.19 0.21 119.26 120.27 1n3t h ALA 67 Ca 0.30 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.14 1n3t h ALA 67 Cb 0.29 0.64 -0.03 0.00 0.00 0.00 0.00 17.79 18.69 1n3t h ALA 67 CO -0.24 -0.91 0.28 -0.22 0.00 0.00 0.00 179.25 178.16 1n3t h LYS 68 N -0.56 0.94 -0.22 0.00 3.11 -0.24 -2.25 116.57 117.35 1n3t h LYS 68 Ca 0.04 -0.14 -0.00 0.00 -2.81 0.00 0.00 60.65 57.74 1n3t h LYS 68 Cb 0.62 -0.17 -0.01 0.00 -1.00 0.00 0.00 32.23 31.67 1n3t h LYS 68 CO -0.26 0.75 0.14 1.98 -2.81 0.00 0.00 179.45 179.25 1n3t h MET 69 N 0.93 0.30 0.77 1.90 4.05 0.14 -1.22 114.93 121.80 1n3t h MET 69 Ca 0.22 -0.03 -0.04 0.00 -0.28 0.00 0.00 59.70 59.58 1n3t h MET 69 Cb 0.15 -0.06 0.01 0.00 -0.80 0.00 0.00 31.60 30.89 1n3t h MET 69 CO -0.02 0.24 -0.37 1.88 0.23 0.00 0.00 176.91 178.87 1n3t h TYR 70 N 0.28 -0.95 0.01 1.39 -1.99 -0.35 -1.98 116.97 113.38 1n3t h TYR 70 Ca 0.08 -0.02 -0.00 0.00 2.00 0.00 0.00 58.73 60.79 1n3t h TYR 70 Cb 0.02 0.32 0.00 0.00 2.00 0.00 0.00 36.73 39.06 1n3t h TYR 70 CO -0.05 -0.59 -0.01 0.28 -0.00 0.00 0.00 178.16 177.79 1n3t h VAL 71 N -1.04 1.05 0.00 -2.88 2.07 -1.45 -3.17 116.25 110.84 1n3t h VAL 71 Ca -0.11 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.21 1n3t h VAL 71 Cb 0.79 1.19 0.00 0.00 -1.52 0.00 0.00 31.29 31.75 1n3t h VAL 71 CO 0.17 0.05 -1.05 0.47 0.02 0.00 0.00 177.57 177.23 1n3t n ASP 72 N -5.06 0.61 0.00 0.57 8.00 -0.46 -4.28 116.55 115.92 1n3t n ASP 72 Ca -0.07 -0.11 0.00 0.00 0.71 0.00 0.00 54.79 55.31 1n3t n ASP 72 Cb 0.08 0.78 0.00 0.00 -0.02 0.00 0.00 41.12 41.96 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 -2.07 0.00 0.17 -1.24 1.02 -0.79 -4.50 120.64 113.22 1n3t n GLU 73 Ca 0.01 0.00 0.12 0.00 -0.02 0.00 0.00 57.16 57.27 1n3t n GLU 73 Cb 0.46 0.00 0.31 0.00 -0.02 0.00 0.00 31.44 32.19 1n3t n GLU 73 CO 0.00 0.00 0.00 -0.84 1.18 0.00 0.00 177.13 177.47 1n3t h ILE 74 N 0.00 0.03 -0.03 -3.67 3.07 -1.65 0.87 117.51 116.13 1n3t h ILE 74 Ca 0.00 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.41 1n3t h ILE 74 Cb 0.00 0.17 0.00 0.00 -0.27 0.00 0.00 36.82 36.72 1n3t h ILE 74 CO 0.00 0.00 0.00 0.49 -1.05 0.00 0.00 178.15 177.59 1n3t n PHE 75 N -2.86 0.03 0.00 0.16 3.72 -1.20 -2.75 117.46 114.56 1n3t n PHE 75 Ca 0.06 -0.14 0.00 0.00 -0.05 0.00 0.00 57.45 57.32 1n3t n PHE 75 Cb 1.01 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 39.53 1n3t n PHE 75 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1n3t n SER 76 N 0.05 0.00 -0.56 4.37 3.41 0.30 -0.26 113.62 120.93 1n3t n SER 76 Ca 0.02 0.11 0.14 0.00 -0.26 0.00 0.00 58.87 58.88 1n3t n SER 76 Cb 0.14 -0.11 0.46 0.00 -0.26 0.00 0.00 64.21 64.43 1n3t n SER 76 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1n3t n GLY 77 N -1.01 0.17 0.36 5.00 0.00 -0.64 -3.96 105.19 105.11 1n3t n GLY 77 Ca 0.00 -0.48 0.11 0.00 0.00 0.00 0.00 46.02 45.65 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 0.36 1.10 -4.00 0.99 4.77 0.64 -4.67 117.00 116.18 1n3t n LEU 78 Ca 0.18 -0.44 -0.31 0.00 -0.03 0.00 0.00 56.01 55.42 1n3t n LEU 78 Cb 0.39 -0.05 -0.15 0.00 -2.33 0.00 0.00 43.42 41.28 1n3t n LEU 78 CO 0.16 0.22 -0.45 -0.62 -1.33 0.00 0.00 177.39 175.37 1n3t s ASP 79 N -1.69 3.89 0.00 -1.43 -1.08 -1.25 -4.99 116.67 110.12 1n3t s ASP 79 Ca 0.34 -1.15 0.07 0.00 -0.52 0.00 0.00 52.55 51.29 1n3t s ASP 79 Cb 0.17 -1.32 0.41 0.00 -1.46 0.00 0.00 42.92 40.73 1n3t s ASP 79 CO 0.27 -0.19 0.85 -1.22 0.52 0.00 0.00 175.17 175.41 1n3t n TYR 80 N 4.60 0.00 0.99 -5.34 4.02 -1.26 -1.40 117.16 118.77 1n3t n TYR 80 Ca -0.14 0.00 0.11 0.00 -0.01 0.00 0.00 57.90 57.86 1n3t n TYR 80 Cb 0.44 0.00 0.54 0.00 -0.02 0.00 0.00 39.34 40.31 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 -0.96 2.12 0.31 -0.72 0.00 -1.26 -2.62 120.51 117.38 1n3t n ALA 81 Ca 0.05 -0.10 0.08 0.00 0.00 0.00 0.00 53.44 53.48 1n3t n ALA 81 Cb 0.02 -1.36 -0.12 0.00 0.00 0.00 0.00 19.45 17.99 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 -1.33 0.97 -4.56 0.00 3.02 -0.49 -5.00 115.26 107.86 1n3t n ASN 82 Ca 0.09 -0.36 -0.58 0.00 -0.03 0.00 0.00 54.58 53.71 1n3t n ASN 82 Cb 0.20 1.47 -0.08 0.00 -0.61 0.00 0.00 39.78 40.76 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 -1.81 1.07 -0.77 3.10 7.35 -1.08 -4.85 117.46 120.47 1n3t n PHE 83 Ca -0.01 0.93 -0.33 0.00 -0.76 0.00 0.00 57.45 57.29 1n3t n PHE 83 Cb 0.37 -2.19 0.13 0.00 0.35 0.00 0.00 39.48 38.14 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 2.25 -0.36 -2.86 -7.13 -0.04 -1.26 -4.93 135.00 120.68 1n3t n PRO 84 Ca 0.21 -0.06 -0.42 0.00 -0.04 0.00 0.00 63.50 63.19 1n3t n PRO 84 Cb 0.10 -1.95 -0.04 0.00 -0.04 0.00 0.00 33.50 31.57 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 -3.82 4.05 -0.02 0.54 1.02 -1.26 -4.92 119.74 115.33 1n3t s LYS 85 Ca 0.59 0.81 -0.15 0.00 0.02 0.00 0.00 55.97 57.24 1n3t s LYS 85 Cb -0.21 -3.71 -0.05 0.00 -0.52 0.00 0.00 37.83 33.34 1n3t s LYS 85 CO 0.66 -0.68 0.40 0.42 -0.92 0.00 0.00 175.35 175.22 1n3t s ILE 86 N 3.08 5.07 -0.03 2.17 1.01 -1.26 -4.94 121.20 126.30 1n3t s ILE 86 Ca 0.36 0.81 0.01 0.00 0.00 0.00 0.00 60.65 61.82 1n3t s ILE 86 Cb -0.14 -3.70 0.02 0.00 0.01 0.00 0.00 42.46 38.65 1n3t s ILE 86 CO 0.11 0.56 -0.00 0.42 0.00 0.00 0.00 174.94 176.03 1n3t s THR 87 N -0.90 0.19 0.23 2.92 -4.23 -1.26 -5.11 115.64 107.48 1n3t s THR 87 Ca 0.23 0.05 0.07 0.00 -1.18 0.00 0.00 61.69 60.87 1n3t s THR 87 Cb -0.16 -0.27 -0.05 0.00 1.34 0.00 0.00 72.50 73.36 1n3t s THR 87 CO 0.12 0.13 -0.12 -0.76 -0.54 0.00 0.00 174.62 173.46 1n3t s LEU 88 N 0.86 2.53 0.01 4.79 1.43 -1.26 -2.28 118.68 124.75 1n3t s LEU 88 Ca -0.09 -1.07 0.04 0.00 -1.03 0.00 0.00 54.13 51.98 1n3t s LEU 88 Cb -0.12 -0.67 -0.01 0.00 0.03 0.00 0.00 46.19 45.42 1n3t s LEU 88 CO -0.01 -0.22 -0.12 -0.63 0.23 0.00 0.00 176.35 175.59 1n3t s ILE 89 N -2.98 0.96 0.29 -0.59 1.01 -1.09 -4.94 121.20 113.87 1n3t s ILE 89 Ca 0.25 -0.72 -0.30 0.00 0.00 0.00 0.00 60.65 59.88 1n3t s ILE 89 Cb 0.01 -0.85 -0.13 0.00 0.01 0.00 0.00 42.46 41.50 1n3t s ILE 89 CO 0.09 0.12 1.38 1.21 0.00 0.00 0.00 174.94 177.73 1n3t n GLU 90 N 2.37 2.16 -2.41 2.79 2.13 -1.26 -1.10 120.64 125.32 1n3t n GLU 90 Ca -0.16 0.76 -0.43 0.00 0.66 0.00 0.00 57.16 58.00 1n3t n GLU 90 Cb 0.55 -2.40 0.00 0.00 0.27 0.00 0.00 31.44 29.87 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 1.52 4.94 0.15 4.31 5.15 -1.14 -4.62 115.26 125.57 1n3t n ASN 91 Ca 0.08 -3.03 0.07 0.00 -0.60 0.00 0.00 54.58 51.10 1n3t n ASN 91 Cb 0.34 -1.54 0.06 0.00 -0.53 0.00 0.00 39.78 38.11 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 6.20 0.00 0.00 1.20 1.57 -1.91 -3.12 116.57 120.51 1n3t h LYS 92 Ca 0.41 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.19 1n3t h LYS 92 Cb 0.70 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.01 1n3t h LYS 92 CO 1.57 0.20 0.00 -1.33 -0.57 0.00 0.00 179.45 179.32 1n3t n MET 93 N -3.04 0.11 -3.46 3.15 2.81 -1.26 -4.90 117.12 110.53 1n3t n MET 93 Ca 0.01 0.11 -0.25 0.00 -1.81 0.00 0.00 57.70 55.76 1n3t n MET 93 Cb 0.64 -1.50 0.04 0.00 -0.71 0.00 0.00 33.22 31.69 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 -1.43 -5.94 -1.64 0.03 4.01 -1.18 -4.83 118.16 107.18 1n3t n LYS 94 Ca 0.07 0.76 -0.33 0.00 -0.51 0.00 0.00 58.31 58.31 1n3t n LYS 94 Cb 0.23 -5.69 -0.04 0.00 -0.51 0.00 0.00 35.03 29.02 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 -3.23 3.07 -0.31 -0.18 1.01 -1.26 -4.73 120.40 114.77 1n3t s VAL 95 Ca 0.50 0.02 0.12 0.00 0.00 0.00 0.00 61.98 62.61 1n3t s VAL 95 Cb -0.23 -3.17 0.75 0.00 0.00 0.00 0.00 36.38 33.73 1n3t s VAL 95 CO 0.61 -0.16 1.68 -0.90 0.00 0.00 0.00 175.10 176.32 1n3t n ASP 96 N 15.88 5.23 -4.32 3.32 5.75 -1.26 -4.27 116.55 136.88 1n3t n ASP 96 Ca 0.36 -2.92 -0.25 0.00 -0.01 0.00 0.00 54.79 51.97 1n3t n ASP 96 Cb 0.53 -0.69 -0.13 0.00 -1.03 0.00 0.00 41.12 39.80 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 -2.67 1.21 0.16 0.11 0.41 -1.26 -5.01 118.70 111.65 1n3t s GLU 97 Ca 0.51 -1.23 -0.31 0.00 -0.41 0.00 0.00 54.97 53.52 1n3t s GLU 97 Cb 0.39 -1.53 -0.10 0.00 -1.78 0.00 0.00 34.13 31.12 1n3t s GLU 97 CO 0.14 0.35 1.51 0.00 -0.49 0.00 0.00 175.26 176.78 1n3t s MET 98 N -2.01 4.25 -0.28 1.61 0.23 -1.26 -4.55 119.30 117.28 1n3t s MET 98 Ca 0.09 2.29 -0.11 0.00 -1.03 0.00 0.00 55.69 56.93 1n3t s MET 98 Cb -0.10 -3.17 -0.05 0.00 -1.53 0.00 0.00 34.83 29.98 1n3t s MET 98 CO 0.05 -0.55 0.18 0.08 -2.03 0.00 0.00 175.02 172.75 1n3t s VAL 99 N 1.01 5.22 0.00 5.16 1.01 -0.80 -4.93 120.40 127.08 1n3t s VAL 99 Ca 0.68 0.14 0.02 0.00 0.00 0.00 0.00 61.98 62.82 1n3t s VAL 99 Cb -0.42 -3.49 -0.03 0.00 0.00 0.00 0.00 36.38 32.44 1n3t s VAL 99 CO 0.32 0.26 -0.04 -0.89 0.00 0.00 0.00 175.10 174.75 1n3t s THR 100 N 1.74 3.88 -0.22 3.92 2.01 -1.26 -2.61 115.64 123.10 1n3t s THR 100 Ca 0.07 -0.70 -0.00 0.00 0.31 0.00 0.00 61.69 61.37 1n3t s THR 100 Cb -0.16 -2.71 0.06 0.00 0.01 0.00 0.00 72.50 69.70 1n3t s THR 100 CO 0.10 0.38 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.69 1n3t s VAL 101 N -1.04 1.28 0.14 3.82 1.01 -0.00 -5.00 120.40 120.60 1n3t s VAL 101 Ca 0.18 -1.04 0.04 0.00 0.00 0.00 0.00 61.98 61.16 1n3t s VAL 101 Cb -0.11 -1.60 -0.04 0.00 0.00 0.00 0.00 36.38 34.63 1n3t s VAL 101 CO 0.09 -0.12 0.13 0.00 0.00 0.00 0.00 175.10 175.20 1n3t s ARG 102 N 1.51 2.92 -1.14 2.72 1.70 -1.26 -1.10 118.95 124.30 1n3t s ARG 102 Ca -0.04 -0.81 -0.08 0.00 -0.47 0.00 0.00 55.73 54.33 1n3t s ARG 102 Cb -0.18 -2.68 -0.03 0.00 -0.57 0.00 0.00 34.95 31.48 1n3t s ARG 102 CO -0.07 0.51 0.85 -0.25 -1.08 0.00 0.00 175.30 175.26 1n3t n ASP 103 N -0.14 -4.69 -4.63 -2.89 8.00 -1.05 -4.94 116.55 106.22 1n3t n ASP 103 Ca -0.08 -0.80 -0.42 0.00 0.71 0.00 0.00 54.79 54.19 1n3t n ASP 103 Cb 0.54 -4.49 -0.04 0.00 -0.02 0.00 0.00 41.12 37.11 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 -3.46 4.74 -0.10 0.53 1.01 -0.06 -4.77 121.20 119.09 1n3t s ILE 104 Ca 0.32 1.52 -0.33 0.00 0.00 0.00 0.00 60.65 62.15 1n3t s ILE 104 Cb -0.07 -4.21 -0.11 0.00 0.01 0.00 0.00 42.46 38.08 1n3t s ILE 104 CO 0.79 -0.23 1.93 0.41 0.00 0.00 0.00 174.94 177.84 1n3t n THR 105 N 5.48 0.58 -4.04 2.92 -1.04 -1.26 -1.40 114.28 115.52 1n3t n THR 105 Ca 0.07 -0.14 -0.31 0.00 -2.04 0.00 0.00 64.05 61.63 1n3t n THR 105 Cb 0.47 -1.96 -0.16 0.00 -1.82 0.00 0.00 70.33 66.86 1n3t n THR 105 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 1n3t s LEU 106 N 4.55 2.46 -0.14 -4.42 0.20 -0.93 -4.73 118.68 115.66 1n3t s LEU 106 Ca 0.94 -0.92 -0.01 0.00 0.69 0.00 0.00 54.13 54.82 1n3t s LEU 106 Cb -0.65 -1.35 -0.02 0.00 -0.43 0.00 0.00 46.19 43.75 1n3t s LEU 106 CO 0.50 -0.12 -0.11 0.42 -0.29 0.00 0.00 176.35 176.75 1n3t s THR 107 N 1.32 3.23 0.30 3.68 -4.23 -1.26 -1.69 115.64 116.99 1n3t s THR 107 Ca -0.01 -0.59 -0.01 0.00 -1.18 0.00 0.00 61.69 59.89 1n3t s THR 107 Cb -0.16 -2.38 0.01 0.00 1.34 0.00 0.00 72.50 71.31 1n3t s THR 107 CO -0.09 0.51 0.42 -0.24 -0.54 0.00 0.00 174.62 174.68 1n3t n SER 108 N 3.59 -1.16 -3.84 3.99 2.88 -0.68 -4.11 113.62 114.29 1n3t n SER 108 Ca -0.18 -2.64 -0.23 0.00 -1.33 0.00 0.00 58.87 54.49 1n3t n SER 108 Cb 0.53 2.18 -0.17 0.00 -0.75 0.00 0.00 64.21 65.99 1n3t n SER 108 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 1n3t s THR 109 N -2.77 0.56 0.30 2.46 2.01 -1.25 -1.11 115.64 115.85 1n3t s THR 109 Ca 0.25 -0.05 -0.29 0.00 0.31 0.00 0.00 61.69 61.91 1n3t s THR 109 Cb -0.01 -0.65 -0.10 0.00 0.01 0.00 0.00 72.50 71.75 1n3t s THR 109 CO 0.18 0.27 1.40 0.00 -0.69 0.00 0.00 174.62 175.78 1n3t n GLU 111 N 1.42 0.37 0.02 0.00 0.28 0.79 -0.85 120.64 122.67 1n3t n GLU 111 Ca 0.03 0.04 -0.05 0.00 -0.16 0.00 0.00 57.16 57.02 1n3t n GLU 111 Cb 0.41 -1.50 -0.11 0.00 1.43 0.00 0.00 31.44 31.67 1n3t n GLU 111 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 1n3t h HIS 112 N 0.00 0.00 0.00 -1.84 3.86 -1.89 -3.41 115.15 111.87 1n3t h HIS 112 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1n3t h HIS 112 Cb 0.25 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.72 1n3t h HIS 112 CO 0.00 0.85 -0.17 0.72 0.86 0.00 0.00 177.93 180.19 1n3t n HIS 113 N -3.07 0.00 -2.41 2.45 8.25 -1.23 -5.01 115.22 114.20 1n3t n HIS 113 Ca -0.11 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.27 1n3t n HIS 113 Cb 0.95 0.00 0.01 0.00 1.12 0.00 0.00 29.99 32.07 1n3t n HIS 113 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1n3t n PHE 114 N -0.51 -0.63 -4.17 4.41 3.01 -0.03 -5.03 117.46 114.51 1n3t n PHE 114 Ca 0.00 0.13 -0.25 0.00 1.01 0.00 0.00 57.45 58.34 1n3t n PHE 114 Cb 0.00 -2.30 -0.06 0.00 -0.01 0.00 0.00 39.48 37.11 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 -2.65 4.00 0.23 -4.37 1.01 -1.23 -4.82 120.40 112.57 1n3t s VAL 115 Ca 0.08 -1.41 -0.30 0.00 0.00 0.00 0.00 61.98 60.35 1n3t s VAL 115 Cb -0.03 -3.06 -0.15 0.00 0.00 0.00 0.00 36.38 33.13 1n3t s VAL 115 CO 0.09 -0.19 1.03 0.41 0.00 0.00 0.00 175.10 176.44 1n3t n THR 116 N -0.48 1.53 -3.90 3.92 -1.04 -1.26 -0.81 114.28 112.24 1n3t n THR 116 Ca -0.08 -0.38 -0.27 0.00 -2.04 0.00 0.00 64.05 61.27 1n3t n THR 116 Cb 0.56 -0.84 -0.17 0.00 -1.82 0.00 0.00 70.33 68.07 1n3t n THR 116 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1n3t s ILE 117 N -0.69 1.05 -0.24 12.58 1.01 -0.26 -1.37 121.20 133.28 1n3t s ILE 117 Ca 0.65 -0.38 -0.01 0.00 0.00 0.00 0.00 60.65 60.91 1n3t s ILE 117 Cb -0.79 -1.11 0.03 0.00 0.01 0.00 0.00 42.46 40.59 1n3t s ILE 117 CO 0.56 0.30 -0.08 -0.62 0.00 0.00 0.00 174.94 175.10 1n3t s ASP 118 N 1.69 4.17 0.33 3.58 2.15 -0.61 -1.69 116.67 126.29 1n3t s ASP 118 Ca 0.04 -0.86 0.04 0.00 0.43 0.00 0.00 52.55 52.20 1n3t s ASP 118 Cb -0.13 -1.63 -0.02 0.00 -0.30 0.00 0.00 42.92 40.83 1n3t s ASP 118 CO -0.08 -0.11 0.32 -0.83 -0.17 0.00 0.00 175.17 174.30 1n3t s GLY 119 N 1.31 2.08 -0.00 2.66 0.00 -0.68 -0.68 107.32 112.01 1n3t s GLY 119 Ca 0.00 -1.92 0.03 0.00 0.00 0.00 0.00 44.72 42.84 1n3t s GLY 119 CO -0.06 -1.35 -0.11 0.54 0.00 0.00 0.00 173.10 172.13 1n3t s LYS 120 N -3.37 0.86 0.01 2.90 3.01 -0.84 -2.19 119.74 120.10 1n3t s LYS 120 Ca 0.38 -0.44 0.07 0.00 -1.01 0.00 0.00 55.97 54.97 1n3t s LYS 120 Cb 0.02 -0.83 -0.02 0.00 -1.01 0.00 0.00 37.83 35.99 1n3t s LYS 120 CO 0.25 0.22 -0.21 0.00 0.51 0.00 0.00 175.35 176.13 1n3t s ALA 121 N -0.37 1.74 -0.13 5.17 0.00 -0.49 -1.63 121.76 126.06 1n3t s ALA 121 Ca 0.03 -0.96 0.01 0.00 0.00 0.00 0.00 51.96 51.05 1n3t s ALA 121 Cb -0.05 -0.41 -0.01 0.00 0.00 0.00 0.00 23.12 22.66 1n3t s ALA 121 CO -0.00 0.41 -0.18 0.99 0.00 0.00 0.00 175.76 176.99 1n3t s THR 122 N -0.60 2.56 -0.02 0.00 2.01 0.22 -0.89 115.64 118.93 1n3t s THR 122 Ca 0.08 -0.83 0.06 0.00 0.31 0.00 0.00 61.69 61.31 1n3t s THR 122 Cb -0.08 -2.05 -0.01 0.00 0.01 0.00 0.00 72.50 70.37 1n3t s THR 122 CO 0.00 0.54 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.58 1n3t s VAL 123 N 0.50 1.56 0.01 3.82 1.01 -0.26 -0.82 120.40 126.22 1n3t s VAL 123 Ca -0.12 -0.84 -0.04 0.00 0.00 0.00 0.00 61.98 60.98 1n3t s VAL 123 Cb -0.16 -1.30 -0.01 0.00 0.00 0.00 0.00 36.38 34.91 1n3t s VAL 123 CO 0.05 0.44 0.06 0.00 0.00 0.00 0.00 175.10 175.65 1n3t s ALA 124 N -0.41 -0.12 0.05 5.51 0.00 -0.68 -0.82 121.76 125.29 1n3t s ALA 124 Ca 0.06 -0.34 -0.22 0.00 0.00 0.00 0.00 51.96 51.47 1n3t s ALA 124 Cb -0.08 0.13 0.05 0.00 0.00 0.00 0.00 23.12 23.22 1n3t s ALA 124 CO -0.00 -0.19 0.50 1.52 0.00 0.00 0.00 175.76 177.59 1n3t s TYR 125 N -1.41 -0.40 -0.50 0.00 1.13 -1.07 -0.22 117.35 114.88 1n3t s TYR 125 Ca -0.15 0.42 -0.12 0.00 -1.41 0.00 0.00 57.07 55.81 1n3t s TYR 125 Cb -0.09 0.32 0.12 0.00 -1.10 0.00 0.00 41.96 41.22 1n3t s TYR 125 CO 0.00 -0.64 0.41 0.42 -2.51 0.00 0.00 175.55 173.24 1n3t s ILE 126 N -2.48 4.66 0.12 -3.49 1.01 -0.44 -1.90 121.20 118.69 1n3t s ILE 126 Ca -0.05 -1.62 -0.33 0.00 0.00 0.00 0.00 60.65 58.65 1n3t s ILE 126 Cb -0.01 -4.01 -0.18 0.00 0.01 0.00 0.00 42.46 38.27 1n3t s ILE 126 CO -0.02 -0.79 0.73 -2.65 0.00 0.00 0.00 174.94 172.21 1n3t n PRO 127 N 5.06 0.00 0.00 2.79 -0.02 -1.26 -4.88 135.00 136.69 1n3t n PRO 127 Ca -0.11 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.37 1n3t n PRO 127 Cb 0.41 -1.19 0.00 0.00 -0.02 0.00 0.00 33.50 32.69 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 1.19 0.00 -0.02 -0.52 4.81 -1.26 -4.77 118.16 117.59 1n3t n LYS 128 Ca 0.19 0.00 0.02 0.00 -0.87 0.00 0.00 58.31 57.65 1n3t n LYS 128 Cb 0.18 -0.08 0.03 0.00 0.02 0.00 0.00 35.03 35.18 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 -1.72 1.60 -3.64 3.14 8.00 -1.26 -4.86 116.55 117.81 1n3t n ASP 129 Ca 0.00 -1.39 -0.13 0.00 0.71 0.00 0.00 54.79 53.98 1n3t n ASP 129 Cb 0.00 -0.02 -0.06 0.00 -0.02 0.00 0.00 41.12 41.02 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 -0.51 -0.33 -0.28 -2.24 1.04 -1.26 -2.91 113.70 107.21 1n3t s SER 130 Ca 0.06 0.06 0.01 0.00 0.48 0.00 0.00 55.95 56.56 1n3t s SER 130 Cb 0.04 0.44 0.06 0.00 0.10 0.00 0.00 66.02 66.65 1n3t s SER 130 CO 0.05 -0.67 -0.06 -0.69 0.98 0.00 0.00 173.24 172.85 1n3t s VAL 131 N -2.41 2.53 0.50 5.02 1.01 -0.26 -4.70 120.40 122.09 1n3t s VAL 131 Ca -0.06 -1.53 -0.22 0.00 0.00 0.00 0.00 61.98 60.17 1n3t s VAL 131 Cb -0.01 -2.48 -0.06 0.00 0.00 0.00 0.00 36.38 33.83 1n3t s VAL 131 CO -0.02 -0.07 1.23 -0.63 0.00 0.00 0.00 175.10 175.61 1n3t s ILE 132 N 1.17 2.75 0.33 2.22 1.01 -1.26 -2.66 121.20 124.75 1n3t s ILE 132 Ca -0.07 0.55 -0.29 0.00 0.00 0.00 0.00 60.65 60.84 1n3t s ILE 132 Cb -0.20 -3.27 -0.11 0.00 0.01 0.00 0.00 42.46 38.89 1n3t s ILE 132 CO -0.03 -0.02 1.42 -0.83 0.00 0.00 0.00 174.94 175.48 1n3t s GLY 133 N -1.26 2.80 0.30 6.18 0.00 -0.97 -4.92 107.32 109.45 1n3t s GLY 133 Ca 0.67 1.41 0.03 0.00 0.00 0.00 0.00 44.72 46.83 1n3t s GLY 133 CO 0.38 2.15 1.85 1.41 0.00 0.00 0.00 173.10 178.90 1n3t h LEU 134 N 3.64 0.87 -1.08 0.66 3.38 -1.93 -2.45 115.31 118.40 1n3t h LEU 134 Ca -0.49 0.04 -0.09 0.00 0.09 0.00 0.00 57.88 57.43 1n3t h LEU 134 Cb 1.23 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.83 1n3t h LEU 134 CO 0.68 0.47 -0.45 0.77 0.09 0.00 0.00 178.44 180.00 1n3t h SER 135 N 0.93 0.00 -0.66 -0.43 4.64 -2.00 -3.03 113.55 113.00 1n3t h SER 135 Ca 0.47 0.00 0.10 0.00 -0.47 0.00 0.00 61.79 61.89 1n3t h SER 135 Cb 0.50 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.52 1n3t h SER 135 CO -0.24 0.45 0.27 0.11 -0.87 0.00 0.00 176.83 176.55 1n3t h LYS 136 N 0.00 0.45 -0.93 4.77 1.79 -1.80 0.13 116.57 120.97 1n3t h LYS 136 Ca -0.00 -0.03 0.10 0.00 -2.18 0.00 0.00 60.65 58.54 1n3t h LYS 136 Cb 0.82 -0.10 -0.08 0.00 -1.58 0.00 0.00 32.23 31.29 1n3t h LYS 136 CO 0.06 0.30 0.57 0.82 -1.08 0.00 0.00 179.45 180.11 1n3t h ILE 137 N 0.46 0.94 -0.55 1.86 2.04 -1.62 0.25 117.51 120.89 1n3t h ILE 137 Ca 0.34 -0.32 -0.03 0.00 1.00 0.00 0.00 64.86 65.84 1n3t h ILE 137 Cb 0.42 -0.08 -0.02 0.00 -0.74 0.00 0.00 36.82 36.39 1n3t h ILE 137 CO -0.31 0.17 0.22 0.78 0.00 0.00 0.00 178.15 179.01 1n3t h ASN 138 N 0.94 0.76 0.31 1.72 2.35 -0.92 -2.32 115.58 118.42 1n3t h ASN 138 Ca 0.45 -0.17 -0.17 0.00 -0.55 0.00 0.00 56.30 55.86 1n3t h ASN 138 Cb 0.40 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.56 1n3t h ASN 138 CO -0.25 0.73 -0.67 0.03 -1.65 0.00 0.00 177.43 175.62 1n3t h ARG 139 N 0.75 0.33 -0.37 0.81 3.08 0.44 -2.47 114.38 116.95 1n3t h ARG 139 Ca 0.18 -0.25 -0.04 0.00 0.07 0.00 0.00 59.98 59.94 1n3t h ARG 139 Cb 0.20 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.28 1n3t h ARG 139 CO -0.01 0.89 0.08 0.82 -1.07 0.00 0.00 179.97 180.67 1n3t h ILE 140 N 0.24 1.23 -0.22 2.04 2.04 -0.42 0.15 117.51 122.56 1n3t h ILE 140 Ca -0.02 -0.81 -0.06 0.00 1.00 0.00 0.00 64.86 64.97 1n3t h ILE 140 Cb 1.22 1.05 -0.01 0.00 -0.74 0.00 0.00 36.82 38.33 1n3t h ILE 140 CO 0.11 0.28 -0.14 0.58 0.00 0.00 0.00 178.15 178.98 1n3t h VAL 141 N 0.46 1.21 0.00 1.67 2.07 -1.39 -2.08 116.25 118.19 1n3t h VAL 141 Ca 0.11 -0.94 -0.04 0.00 0.82 0.00 0.00 66.70 66.66 1n3t h VAL 141 Cb 0.33 1.20 -0.01 0.00 -1.52 0.00 0.00 31.29 31.29 1n3t h VAL 141 CO 0.00 0.30 -0.30 1.56 0.02 0.00 0.00 177.57 179.15 1n3t h GLN 142 N 0.35 0.00 0.01 1.57 1.08 -1.25 -2.86 115.11 114.00 1n3t h GLN 142 Ca 0.07 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.27 1n3t h GLN 142 Cb 0.45 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.88 1n3t h GLN 142 CO 0.03 0.15 -0.00 0.35 -0.95 0.00 0.00 178.83 178.41 1n3t h PHE 143 N 0.00 -0.01 0.00 2.96 3.57 -0.26 -2.50 116.94 120.70 1n3t h PHE 143 Ca -0.01 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.49 1n3t h PHE 143 Cb 1.13 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.88 1n3t h PHE 143 CO 0.00 -0.01 0.00 0.74 -2.23 0.00 0.00 178.31 176.81 1n3t h PHE 144 N -0.02 0.00 -0.37 0.41 0.04 -1.66 -2.02 116.94 113.32 1n3t h PHE 144 Ca -0.00 0.00 -0.13 0.00 2.80 0.00 0.00 57.97 60.64 1n3t h PHE 144 Cb 0.01 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.15 1n3t h PHE 144 CO 0.19 0.00 -0.29 0.00 -0.60 0.00 0.00 178.31 177.62 1n3t h ALA 145 N 2.00 0.80 -0.72 2.45 0.00 -1.30 -3.34 119.26 119.15 1n3t h ALA 145 Ca 0.00 -0.40 -0.70 0.00 0.00 0.00 0.00 54.91 53.80 1n3t h ALA 145 Cb 0.00 -0.14 -0.09 0.00 0.00 0.00 0.00 17.79 17.56 1n3t h ALA 145 CO 0.00 0.65 2.35 1.04 0.00 0.00 0.00 179.25 183.29 1n3t n GLN 146 N -4.08 3.16 -3.49 0.00 1.13 -0.76 -4.25 117.38 109.08 1n3t n GLN 146 Ca -0.01 -3.18 -0.13 0.00 -1.94 0.00 0.00 57.00 51.74 1n3t n GLN 146 Cb 0.47 -3.32 -0.04 0.00 0.11 0.00 0.00 30.24 27.47 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 3.19 1.03 -0.26 -1.09 0.52 -1.11 -1.63 118.95 119.59 1n3t s ARG 147 Ca 0.49 -0.12 -0.29 0.00 -0.52 0.00 0.00 55.73 55.29 1n3t s ARG 147 Cb 0.07 0.48 -0.02 0.00 0.52 0.00 0.00 34.95 35.99 1n3t s ARG 147 CO 0.01 -0.40 1.69 -2.14 0.02 0.00 0.00 175.30 174.48 1n3t s PRO 148 N -2.45 3.62 0.53 3.54 0.02 -1.26 -3.83 135.00 135.18 1n3t s PRO 148 Ca -0.02 1.57 0.04 0.00 0.02 0.00 0.00 61.00 62.60 1n3t s PRO 148 Cb -0.01 -4.10 0.02 0.00 0.02 0.00 0.00 34.50 30.43 1n3t s PRO 148 CO -0.03 -1.51 0.26 -0.65 -0.33 0.00 0.00 177.00 174.75 1n3t s GLN 149 N 5.05 2.24 -0.06 5.54 -1.52 0.25 -4.56 119.66 126.60 1n3t s GLN 149 Ca 0.75 -2.15 -0.02 0.00 -1.95 0.00 0.00 55.36 51.99 1n3t s GLN 149 Cb -0.24 -1.90 0.03 0.00 -0.22 0.00 0.00 33.01 30.68 1n3t s GLN 149 CO 0.31 -0.52 0.06 0.08 -0.25 0.00 0.00 175.29 174.97 1n3t s VAL 150 N -2.80 -0.05 0.28 1.09 1.01 -1.26 -0.15 120.40 118.52 1n3t s VAL 150 Ca 0.24 0.32 0.00 0.00 0.00 0.00 0.00 61.98 62.55 1n3t s VAL 150 Cb -0.01 -0.25 0.28 0.00 0.00 0.00 0.00 36.38 36.41 1n3t s VAL 150 CO 0.15 0.13 1.67 -0.61 0.00 0.00 0.00 175.10 176.44 1n3t h GLN 151 N 8.42 0.27 -0.42 2.72 4.15 -2.00 0.15 115.11 128.40 1n3t h GLN 151 Ca -0.13 -0.02 0.04 0.00 0.77 0.00 0.00 58.65 59.31 1n3t h GLN 151 Cb 1.12 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 28.73 1n3t h GLN 151 CO 0.18 0.18 0.28 0.93 -1.93 0.00 0.00 178.83 178.47 1n3t h GLU 152 N 0.28 0.42 0.17 1.69 3.07 -1.99 -3.03 114.58 115.18 1n3t h GLU 152 Ca 0.51 -0.03 -0.27 0.00 -0.50 0.00 0.00 59.36 59.08 1n3t h GLU 152 Cb 0.98 -0.09 0.02 0.00 -0.84 0.00 0.00 28.75 28.81 1n3t h GLU 152 CO -0.58 0.28 -1.27 -0.09 -1.40 0.00 0.00 179.01 175.94 1n3t h ARG 153 N 0.43 0.36 -0.71 2.33 2.43 -1.42 -3.28 114.38 114.52 1n3t h ARG 153 Ca 0.17 -0.61 0.15 0.00 -0.81 0.00 0.00 59.98 58.88 1n3t h ARG 153 Cb 0.15 0.23 -0.10 0.00 -0.42 0.00 0.00 29.97 29.82 1n3t h ARG 153 CO -0.04 1.29 0.18 1.25 -1.51 0.00 0.00 179.97 181.14 1n3t h LEU 154 N -0.16 0.03 0.22 3.80 5.85 -1.29 -0.75 115.31 123.01 1n3t h LEU 154 Ca -0.24 0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.61 1n3t h LEU 154 Cb 1.87 0.18 -0.02 0.00 0.37 0.00 0.00 40.66 43.06 1n3t h LEU 154 CO 0.16 -0.02 -0.20 0.74 -0.34 0.00 0.00 178.44 178.78 1n3t h THR 155 N 0.28 0.56 -0.54 1.05 2.02 -1.67 -2.56 112.91 112.06 1n3t h THR 155 Ca 0.40 0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.68 1n3t h THR 155 Cb 0.65 0.56 -0.09 0.00 -1.74 0.00 0.00 68.15 67.53 1n3t h THR 155 CO -0.48 0.00 -0.01 1.56 0.37 0.00 0.00 175.52 176.96 1n3t h GLN 156 N -0.45 0.11 0.21 6.66 1.08 -1.24 -2.01 115.11 119.46 1n3t h GLN 156 Ca -0.00 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.19 1n3t h GLN 156 Cb 0.41 -0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.80 1n3t h GLN 156 CO -0.04 0.07 -0.20 1.96 -0.95 0.00 0.00 178.83 179.67 1n3t h GLN 157 N 0.11 -0.42 -0.78 1.46 4.20 -1.12 -1.09 115.11 117.47 1n3t h GLN 157 Ca 0.27 0.03 0.17 0.00 0.06 0.00 0.00 58.65 59.18 1n3t h GLN 157 Cb 0.42 0.10 -0.11 0.00 0.30 0.00 0.00 27.48 28.19 1n3t h GLN 157 CO -0.46 -0.28 0.27 0.82 -0.67 0.00 0.00 178.83 178.51 1n3t h ILE 158 N -0.44 0.56 0.28 2.54 2.04 -1.12 0.45 117.51 121.83 1n3t h ILE 158 Ca -0.00 -0.13 -0.01 0.00 1.00 0.00 0.00 64.86 65.72 1n3t h ILE 158 Cb 0.41 0.16 -0.00 0.00 -0.74 0.00 0.00 36.82 36.65 1n3t h ILE 158 CO -0.05 0.07 -0.19 0.25 0.00 0.00 0.00 178.15 178.23 1n3t h LEU 159 N 0.37 -0.49 -1.24 1.44 5.85 -0.63 -1.18 115.31 119.42 1n3t h LEU 159 Ca 0.45 0.03 0.06 0.00 0.84 0.00 0.00 57.88 59.26 1n3t h LEU 159 Cb 0.75 0.15 -0.05 0.00 0.37 0.00 0.00 40.66 41.87 1n3t h LEU 159 CO -0.47 -0.28 0.54 0.40 -0.34 0.00 0.00 178.44 178.28 1n3t h ILE 160 N -0.45 1.06 0.40 4.05 2.04 -0.79 0.52 117.51 124.34 1n3t h ILE 160 Ca -0.04 -0.32 -0.01 0.00 1.00 0.00 0.00 64.86 65.50 1n3t h ILE 160 Cb 0.36 0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 36.48 1n3t h ILE 160 CO 0.03 0.17 -0.32 0.00 0.00 0.00 0.00 178.15 178.03 1n3t h ALA 161 N 1.55 -0.73 -0.16 1.87 0.00 -0.03 -0.54 119.26 121.23 1n3t h ALA 161 Ca 0.35 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 55.17 1n3t h ALA 161 Cb 0.20 0.43 -0.03 0.00 0.00 0.00 0.00 17.79 18.39 1n3t h ALA 161 CO -0.12 -0.94 -0.05 -0.07 0.00 0.00 0.00 179.25 178.07 1n3t h LEU 162 N -0.72 -0.18 -0.56 0.00 3.38 -0.53 -1.96 115.31 114.73 1n3t h LEU 162 Ca -0.04 0.05 0.11 0.00 0.09 0.00 0.00 57.88 58.10 1n3t h LEU 162 Cb 0.62 0.11 -0.11 0.00 0.09 0.00 0.00 40.66 41.37 1n3t h LEU 162 CO -0.01 -0.07 -0.26 1.56 0.09 0.00 0.00 178.44 179.75 1n3t h GLN 163 N -0.02 -0.11 -0.92 1.13 4.20 -0.72 0.36 115.11 119.03 1n3t h GLN 163 Ca 0.08 0.01 0.13 0.00 0.06 0.00 0.00 58.65 58.93 1n3t h GLN 163 Cb 0.14 0.03 -0.09 0.00 0.30 0.00 0.00 27.48 27.86 1n3t h GLN 163 CO -0.17 -0.08 0.54 1.15 -0.67 0.00 0.00 178.83 179.60 1n3t h THR 164 N -0.12 0.84 0.12 -0.54 2.02 -0.41 0.04 112.91 114.86 1n3t h THR 164 Ca 0.25 -0.28 -0.28 0.00 0.77 0.00 0.00 66.41 66.87 1n3t h THR 164 Cb 0.52 -0.06 0.02 0.00 -1.74 0.00 0.00 68.15 66.89 1n3t h THR 164 CO -0.64 0.15 -1.22 -0.07 0.37 0.00 0.00 175.52 174.11 1n3t h LEU 165 N 0.82 0.65 -0.30 2.58 3.38 -0.22 -3.29 115.31 118.94 1n3t h LEU 165 Ca 0.48 -0.63 0.00 0.00 0.09 0.00 0.00 57.88 57.82 1n3t h LEU 165 Cb 0.56 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1n3t h LEU 165 CO -0.30 1.46 0.00 -0.07 0.09 0.00 0.00 178.44 179.62 1n3t h LEU 166 N 0.18 0.00 0.47 1.67 3.38 0.02 -3.47 115.31 117.56 1n3t h LEU 166 Ca -0.16 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.69 1n3t h LEU 166 Cb 1.91 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.66 1n3t h LEU 166 CO 0.22 0.00 -0.17 0.61 0.09 0.00 0.00 178.44 179.19 1n3t n GLY 167 N 0.89 0.20 3.40 0.83 0.00 -0.04 -4.67 105.19 105.80 1n3t n GLY 167 Ca 0.03 -0.58 -0.10 0.00 0.00 0.00 0.00 46.02 45.38 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 -2.49 0.05 -0.89 2.61 2.01 -1.14 -4.95 115.64 110.85 1n3t s THR 168 Ca 0.04 -0.71 0.18 0.00 0.31 0.00 0.00 61.69 61.50 1n3t s THR 168 Cb -0.02 -1.38 -0.19 0.00 0.01 0.00 0.00 72.50 70.93 1n3t s THR 168 CO 0.05 -0.23 0.77 0.59 -0.69 0.00 0.00 174.62 175.11 1n3t n ASN 169 N -0.27 0.89 -2.63 3.53 3.02 -1.26 -4.33 115.26 114.21 1n3t n ASN 169 Ca -0.13 -0.95 -0.12 0.00 -0.03 0.00 0.00 54.58 53.35 1n3t n ASN 169 Cb 0.63 0.97 -0.06 0.00 -0.61 0.00 0.00 39.78 40.72 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 -1.36 3.54 -4.16 6.41 3.02 -1.26 0.21 115.26 121.66 1n3t n ASN 170 Ca 0.04 -2.14 -0.23 0.00 -0.03 0.00 0.00 54.58 52.22 1n3t n ASN 170 Cb 0.29 -0.88 -0.14 0.00 -0.61 0.00 0.00 39.78 38.43 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 2.61 1.27 -0.01 2.41 1.01 -1.26 -1.33 120.40 125.11 1n3t s VAL 171 Ca 0.36 -0.86 0.05 0.00 0.00 0.00 0.00 61.98 61.53 1n3t s VAL 171 Cb 0.14 -1.09 -0.01 0.00 0.00 0.00 0.00 36.38 35.41 1n3t s VAL 171 CO -0.01 0.22 -0.16 0.00 0.00 0.00 0.00 175.10 175.14 1n3t s ALA 172 N -0.58 1.35 -0.03 5.51 0.00 0.69 -0.84 121.76 127.86 1n3t s ALA 172 Ca 0.05 -0.72 0.02 0.00 0.00 0.00 0.00 51.96 51.30 1n3t s ALA 172 Cb -0.07 -0.33 0.01 0.00 0.00 0.00 0.00 23.12 22.73 1n3t s ALA 172 CO 0.00 0.32 -0.06 0.08 0.00 0.00 0.00 175.76 176.11 1n3t s VAL 173 N -0.44 0.56 -0.05 0.00 1.01 0.10 -1.68 120.40 119.90 1n3t s VAL 173 Ca 0.06 -0.21 -0.02 0.00 0.00 0.00 0.00 61.98 61.81 1n3t s VAL 173 Cb -0.06 -0.53 0.04 0.00 0.00 0.00 0.00 36.38 35.82 1n3t s VAL 173 CO -0.00 0.20 0.10 -0.55 0.00 0.00 0.00 175.10 174.84 1n3t s SER 174 N 0.40 0.51 -0.10 3.32 0.15 0.00 -0.63 113.70 117.36 1n3t s SER 174 Ca -0.05 0.19 0.03 0.00 0.70 0.00 0.00 55.95 56.82 1n3t s SER 174 Cb -0.09 0.06 -0.01 0.00 -1.71 0.00 0.00 66.02 64.27 1n3t s SER 174 CO 0.00 -0.20 -0.21 -0.63 1.20 0.00 0.00 173.24 173.40 1n3t s ILE 175 N 1.74 2.33 -0.24 6.45 1.01 -0.77 0.69 121.20 132.41 1n3t s ILE 175 Ca -0.02 -0.93 0.02 0.00 0.00 0.00 0.00 60.65 59.72 1n3t s ILE 175 Cb -0.12 -1.90 0.05 0.00 0.01 0.00 0.00 42.46 40.50 1n3t s ILE 175 CO -0.04 0.55 -0.11 -0.62 0.00 0.00 0.00 174.94 174.72 1n3t s ASP 176 N 0.21 4.12 0.20 3.58 2.15 -0.65 -1.34 116.67 124.95 1n3t s ASP 176 Ca -0.13 -1.24 0.01 0.00 0.43 0.00 0.00 52.55 51.62 1n3t s ASP 176 Cb -0.16 -1.45 -0.05 0.00 -0.30 0.00 0.00 42.92 40.96 1n3t s ASP 176 CO 0.07 -0.17 0.07 0.00 -0.17 0.00 0.00 175.17 174.96 1n3t s ALA 177 N 1.20 1.40 -0.12 3.66 0.00 0.21 -1.99 121.76 126.11 1n3t s ALA 177 Ca -0.06 -1.70 -0.01 0.00 0.00 0.00 0.00 51.96 50.19 1n3t s ALA 177 Cb -0.19 0.92 -0.02 0.00 0.00 0.00 0.00 23.12 23.83 1n3t s ALA 177 CO -0.06 -0.44 -0.09 0.08 0.00 0.00 0.00 175.76 175.25 1n3t s VAL 178 N -3.83 3.41 -0.33 0.00 1.01 0.15 -0.93 120.40 119.88 1n3t s VAL 178 Ca 0.32 -0.54 -0.09 0.00 0.00 0.00 0.00 61.98 61.66 1n3t s VAL 178 Cb 0.07 -2.44 0.01 0.00 0.00 0.00 0.00 36.38 34.02 1n3t s VAL 178 CO 0.09 0.53 0.16 -1.00 0.00 0.00 0.00 175.10 174.87 1n3t s HIS 179 N 0.12 3.20 -0.58 5.22 3.76 -1.26 -1.57 115.29 124.18 1n3t s HIS 179 Ca -0.04 -0.85 0.21 0.00 -0.15 0.00 0.00 55.06 54.23 1n3t s HIS 179 Cb -0.14 -2.36 0.89 0.00 1.11 0.00 0.00 32.58 32.08 1n3t s HIS 179 CO 0.04 -0.57 1.63 0.66 -0.85 0.00 0.00 174.74 175.65 1n3t n TYR 180 N 4.95 0.61 1.57 1.40 4.02 -0.47 -1.07 117.16 128.17 1n3t n TYR 180 Ca -0.13 0.25 0.01 0.00 -0.01 0.00 0.00 57.90 58.02 1n3t n TYR 180 Cb 0.47 -0.90 0.04 0.00 -0.02 0.00 0.00 39.34 38.94 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 -2.06 0.65 0.00 7.72 3.41 -1.26 -1.35 113.62 120.72 1n3t n SER 181 Ca 0.02 -2.02 0.00 0.00 -0.26 0.00 0.00 58.87 56.61 1n3t n SER 181 Cb 0.19 -0.13 0.00 0.00 -0.26 0.00 0.00 64.21 64.01 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 -0.19 0.00 -0.06 -3.33 0.31 -0.23 -4.68 118.33 110.15 1n3t n VAL 182 Ca 0.03 0.00 -0.22 0.00 -0.01 0.00 0.00 64.34 64.14 1n3t n VAL 182 Cb 0.12 -0.52 -0.13 0.00 -0.91 0.00 0.00 33.84 32.40 1n3t n VAL 182 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 1n3t h LYS 183 N 0.00 0.11 -0.43 5.55 3.64 -1.09 0.54 116.57 124.89 1n3t h LYS 183 Ca 0.00 -0.19 -0.03 0.00 -1.27 0.00 0.00 60.65 59.16 1n3t h LYS 183 Cb 0.55 0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.42 1n3t h LYS 183 CO 0.00 1.09 0.03 0.00 -2.27 0.00 0.00 179.45 178.30 1n3t n ALA 184 N -3.25 3.56 -3.64 5.00 0.00 -0.46 -3.65 120.51 118.08 1n3t n ALA 184 Ca -0.32 -2.21 -0.03 0.00 0.00 0.00 0.00 53.44 50.88 1n3t n ALA 184 Cb 0.83 -0.93 -0.06 0.00 0.00 0.00 0.00 19.45 19.30 1n3t n ALA 184 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1n3t s ARG 185 N -2.85 0.09 3.41 0.00 3.00 -1.25 -5.00 118.95 116.35 1n3t s ARG 185 Ca 0.49 0.07 0.00 0.00 -1.00 0.00 0.00 55.73 55.28 1n3t s ARG 185 Cb 0.38 0.05 0.00 0.00 0.00 0.00 0.00 34.95 35.38 1n3t s ARG 185 CO 0.12 -0.02 0.00 0.41 0.00 0.00 0.00 175.30 175.81 1n3t n GLY 186 N 1.12 0.85 0.31 8.12 0.00 -1.26 -3.68 105.19 110.65 1n3t n GLY 186 Ca -0.06 -0.97 0.04 0.00 0.00 0.00 0.00 46.02 45.03 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 1.10 -5.05 -0.61 2.04 -1.88 -3.47 117.51 109.64 1n3t h ILE 187 Ca 0.00 -0.20 0.00 0.00 1.00 0.00 0.00 64.86 65.66 1n3t h ILE 187 Cb 0.00 0.48 0.00 0.00 -0.74 0.00 0.00 36.82 36.56 1n3t h ILE 187 CO 0.00 0.10 -0.02 0.54 0.00 0.00 0.00 178.15 178.77 1n3t n ARG 188 N -4.47 -1.20 -3.52 2.37 1.74 -1.05 -4.98 116.66 105.55 1n3t n ARG 188 Ca 0.04 1.40 -0.42 0.00 -0.77 0.00 0.00 57.85 58.10 1n3t n ARG 188 Cb 0.07 -5.20 -0.11 0.00 -1.02 0.00 0.00 32.46 26.20 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 -2.84 5.95 0.00 0.55 -1.08 0.15 -4.94 116.67 114.47 1n3t s ASP 189 Ca 0.01 -0.84 0.31 0.00 -0.52 0.00 0.00 52.55 51.51 1n3t s ASP 189 Cb -0.00 -2.10 1.73 0.00 -1.46 0.00 0.00 42.92 41.09 1n3t s ASP 189 CO 0.65 -0.38 2.13 0.00 0.52 0.00 0.00 175.17 178.09 1n3t n ALA 190 N 5.09 2.66 0.00 3.66 0.00 -1.26 -4.11 120.51 126.55 1n3t n ALA 190 Ca -0.12 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.09 1n3t n ALA 190 Cb 0.47 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.46 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 -0.85 0.00 -0.85 0.00 -2.24 -1.26 -5.09 114.28 103.99 1n3t n THR 191 Ca 0.22 -0.15 -0.29 0.00 -2.27 0.00 0.00 64.05 61.57 1n3t n THR 191 Cb 0.16 0.64 0.21 0.00 -2.10 0.00 0.00 70.33 69.23 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 -0.96 1.96 -0.20 3.42 1.04 -1.26 -5.07 113.70 112.64 1n3t s SER 192 Ca 0.00 1.45 -0.29 0.00 0.48 0.00 0.00 55.95 57.59 1n3t s SER 192 Cb 0.00 -2.16 0.13 0.00 0.10 0.00 0.00 66.02 64.09 1n3t s SER 192 CO 0.00 -3.58 1.02 0.00 0.98 0.00 0.00 173.24 171.65 1n3t s ALA 193 N -2.70 -1.95 -0.07 5.32 0.00 -1.26 -4.87 121.76 116.23 1n3t s ALA 193 Ca 0.67 1.67 0.01 0.00 0.00 0.00 0.00 51.96 54.31 1n3t s ALA 193 Cb -0.22 -0.94 -0.03 0.00 0.00 0.00 0.00 23.12 21.94 1n3t s ALA 193 CO 0.61 -0.28 -0.09 0.99 0.00 0.00 0.00 175.76 176.98 1n3t s THR 194 N -0.71 3.47 -0.12 0.00 2.01 -0.10 -4.95 115.64 115.24 1n3t s THR 194 Ca -0.00 -0.56 0.03 0.00 0.31 0.00 0.00 61.69 61.46 1n3t s THR 194 Cb -0.02 -2.41 0.01 0.00 0.01 0.00 0.00 72.50 70.09 1n3t s THR 194 CO -0.01 0.59 -0.20 -0.89 -0.69 0.00 0.00 174.62 173.41 1n3t s THR 195 N -0.65 1.88 0.04 -0.82 2.01 -1.26 -0.62 115.64 116.21 1n3t s THR 195 Ca 0.10 -0.89 0.06 0.00 0.31 0.00 0.00 61.69 61.27 1n3t s THR 195 Cb -0.11 -1.67 -0.02 0.00 0.01 0.00 0.00 72.50 70.71 1n3t s THR 195 CO 0.01 0.52 -0.17 0.42 -0.69 0.00 0.00 174.62 174.71 1n3t s THR 196 N 0.73 1.40 0.08 -0.82 -4.23 -0.45 -5.01 115.64 107.34 1n3t s THR 196 Ca -0.10 -1.07 0.01 0.00 -1.18 0.00 0.00 61.69 59.35 1n3t s THR 196 Cb -0.16 -1.23 -0.04 0.00 1.34 0.00 0.00 72.50 72.41 1n3t s THR 196 CO 0.01 0.13 -0.06 0.42 -0.54 0.00 0.00 174.62 174.58 1n3t s THR 197 N -0.79 0.56 -0.14 3.99 -4.23 -1.26 -1.84 115.64 111.93 1n3t s THR 197 Ca 0.05 -1.74 -0.04 0.00 -1.18 0.00 0.00 61.69 58.77 1n3t s THR 197 Cb -0.08 -1.43 0.05 0.00 1.34 0.00 0.00 72.50 72.38 1n3t s THR 197 CO 0.01 -0.81 0.08 -0.44 -0.54 0.00 0.00 174.62 172.93 1n3t s SER 198 N -2.73 2.10 -0.26 3.99 0.01 0.20 -4.99 113.70 112.02 1n3t s SER 198 Ca 0.07 -0.47 -0.08 0.00 1.31 0.00 0.00 55.95 56.77 1n3t s SER 198 Cb 0.03 -0.24 -0.04 0.00 0.21 0.00 0.00 66.02 65.99 1n3t s SER 198 CO -0.05 -0.33 0.10 -0.76 0.41 0.00 0.00 173.24 172.62 1n3t s LEU 199 N 2.13 3.62 0.31 2.44 1.43 -1.26 -0.72 118.68 126.63 1n3t s LEU 199 Ca 0.03 -0.14 0.08 0.00 -1.03 0.00 0.00 54.13 53.06 1n3t s LEU 199 Cb -0.15 -1.98 -0.04 0.00 0.03 0.00 0.00 46.19 44.05 1n3t s LEU 199 CO -0.08 -0.03 0.15 -0.83 0.23 0.00 0.00 176.35 175.79 1n3t s GLY 200 N 1.63 1.76 0.00 -3.19 0.00 -0.02 -4.48 107.32 103.03 1n3t s GLY 200 Ca 0.06 -1.69 0.00 0.00 0.00 0.00 0.00 44.72 43.09 1n3t s GLY 200 CO 0.06 -1.66 0.00 0.61 0.00 0.00 0.00 173.10 172.10 1n3t n GLY 201 N -1.15 2.88 0.35 0.20 0.00 0.13 -1.45 105.19 106.16 1n3t n GLY 201 Ca -0.04 -0.02 -0.01 0.00 0.00 0.00 0.00 46.02 45.94 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 0.96 -0.43 0.99 3.38 -1.92 -2.34 115.31 115.94 1n3t h LEU 202 Ca 0.00 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1n3t h LEU 202 Cb 0.00 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.51 1n3t h LEU 202 CO 0.00 0.72 0.26 0.49 0.09 0.00 0.00 178.44 180.00 1n3t n PHE 203 N -4.38 0.22 -0.05 1.13 3.72 -0.53 -0.38 117.46 117.19 1n3t n PHE 203 Ca 0.09 0.12 -0.09 0.00 -0.05 0.00 0.00 57.45 57.52 1n3t n PHE 203 Cb 0.06 -0.48 -0.04 0.00 -0.94 0.00 0.00 39.48 38.08 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 -1.67 0.24 -0.06 -1.08 4.81 -0.90 -4.26 118.16 115.22 1n3t n LYS 204 Ca -0.00 0.07 -0.14 0.00 -0.87 0.00 0.00 58.31 57.37 1n3t n LYS 204 Cb 0.27 -1.07 -0.13 0.00 0.02 0.00 0.00 35.03 34.12 1n3t n LYS 204 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1n3t h SER 205 N -0.15 0.00 -1.14 3.14 4.64 -1.08 -3.43 113.55 115.54 1n3t h SER 205 Ca -0.24 -0.96 -0.39 0.00 -0.47 0.00 0.00 61.79 59.74 1n3t h SER 205 Cb 1.30 -0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.34 1n3t h SER 205 CO -0.08 0.96 0.98 -0.55 -0.87 0.00 0.00 176.83 177.27 1n3t s SER 206 N -6.18 5.35 0.19 4.97 0.15 0.49 -4.86 113.70 113.80 1n3t s SER 206 Ca -0.19 -0.49 -0.08 0.00 0.70 0.00 0.00 55.95 55.90 1n3t s SER 206 Cb -0.03 -2.55 0.29 0.00 -1.71 0.00 0.00 66.02 62.02 1n3t s SER 206 CO 0.69 -2.49 1.12 1.67 1.20 0.00 0.00 173.24 175.43 1n3t n GLN 207 N 8.96 -0.09 0.00 5.44 -0.06 -1.26 -0.26 117.38 130.11 1n3t n GLN 207 Ca 0.33 1.12 0.00 0.00 -2.00 0.00 0.00 57.00 56.45 1n3t n GLN 207 Cb 0.49 -1.66 0.00 0.00 -4.06 0.00 0.00 30.24 25.00 1n3t n GLN 207 CO 0.00 0.00 0.00 0.09 -0.20 0.00 0.00 177.06 176.95 1n3t n ASN 208 N -5.14 0.00 -0.43 1.69 3.02 -1.26 -1.97 115.26 111.16 1n3t n ASN 208 Ca 0.10 0.60 0.33 0.00 -0.03 0.00 0.00 54.58 55.59 1n3t n ASN 208 Cb 0.34 -0.10 0.51 0.00 -0.61 0.00 0.00 39.78 39.92 1n3t n ASN 208 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 1n3t n THR 209 N -0.84 -0.02 0.17 3.41 -1.04 -0.41 -0.71 114.28 114.83 1n3t n THR 209 Ca 0.00 0.98 -0.07 0.00 -2.04 0.00 0.00 64.05 62.92 1n3t n THR 209 Cb 0.00 -1.63 -0.03 0.00 -1.82 0.00 0.00 70.33 66.84 1n3t n THR 209 CO 0.00 0.00 0.00 -0.09 -0.64 0.00 0.00 175.07 174.34 1n3t h ARG 210 N 0.00 -0.45 0.00 -2.82 2.43 -0.23 -3.02 114.38 110.30 1n3t h ARG 210 Ca 0.60 0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.78 1n3t h ARG 210 Cb 2.34 0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 31.99 1n3t h ARG 210 CO -0.05 -0.30 -0.09 0.45 -1.51 0.00 0.00 179.97 178.48 1n3t h HIS 211 N -0.81 0.00 -0.68 2.20 3.86 -0.26 -0.85 115.15 118.61 1n3t h HIS 211 Ca -0.05 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.15 1n3t h HIS 211 Cb 0.36 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.79 1n3t h HIS 211 CO 0.04 0.09 0.36 0.93 0.86 0.00 0.00 177.93 180.21 1n3t h GLU 212 N 0.00 0.94 0.08 2.45 5.08 -1.31 -0.11 114.58 121.71 1n3t h GLU 212 Ca -0.00 -0.10 -0.00 0.00 -1.00 0.00 0.00 59.36 58.25 1n3t h GLU 212 Cb 0.20 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.26 1n3t h GLU 212 CO 0.01 0.69 -0.04 0.35 -1.00 0.00 0.00 179.01 179.03 1n3t h PHE 213 N 0.94 -0.09 -0.48 4.33 3.57 -1.06 -3.29 116.94 120.86 1n3t h PHE 213 Ca 0.24 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.76 1n3t h PHE 213 Cb 0.03 0.03 -0.03 0.00 2.79 0.00 0.00 35.95 38.78 1n3t h PHE 213 CO 0.01 0.47 0.32 -0.07 -2.23 0.00 0.00 178.31 176.81 1n3t h LEU 214 N -0.85 0.49 -1.22 0.59 3.38 -1.18 -2.13 115.31 114.38 1n3t h LEU 214 Ca -0.01 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 1n3t h LEU 214 Cb 0.61 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 1n3t h LEU 214 CO 0.02 0.34 -0.05 -0.09 0.09 0.00 0.00 178.44 178.75 1n3t h ARG 215 N 0.57 0.47 -1.00 1.13 2.43 -1.13 -2.54 114.38 114.31 1n3t h ARG 215 Ca 0.19 -0.11 -0.29 0.00 -0.81 0.00 0.00 59.98 58.96 1n3t h ARG 215 Cb 0.06 -0.06 -0.17 0.00 -0.42 0.00 0.00 29.97 29.37 1n3t h ARG 215 CO -0.05 0.54 0.37 0.00 -1.51 0.00 0.00 179.97 179.32 1n3t n ALA 216 N -2.48 4.24 -2.59 2.80 0.00 -0.80 -4.90 120.51 116.78 1n3t n ALA 216 Ca 0.01 -1.62 -0.29 0.00 0.00 0.00 0.00 53.44 51.54 1n3t n ALA 216 Cb 0.27 -1.25 -0.09 0.00 0.00 0.00 0.00 19.45 18.37 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 -1.85 3.41 -0.26 0.00 1.01 -0.96 -4.85 120.40 116.90 1n3t s VAL 217 Ca 0.32 -1.37 -0.05 0.00 0.00 0.00 0.00 61.98 60.87 1n3t s VAL 217 Cb 0.27 -2.64 0.01 0.00 0.00 0.00 0.00 36.38 34.02 1n3t s VAL 217 CO 0.06 0.02 0.31 -1.14 0.00 0.00 0.00 175.10 174.36 1n3t n ARG 218 N 0.41 -1.02 -4.52 2.72 0.00 -1.26 -5.08 116.66 107.90 1n3t n ARG 218 Ca -0.12 1.21 -0.29 0.00 -0.00 0.00 0.00 57.85 58.64 1n3t n ARG 218 Cb 0.53 -3.60 -0.13 0.00 0.00 0.00 0.00 32.46 29.26 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 -2.19 2.35 -0.18 -0.14 3.76 -1.26 -5.14 115.29 112.48 1n3t s HIS 219 Ca 0.08 -0.37 -0.02 0.00 -0.15 0.00 0.00 55.06 54.61 1n3t s HIS 219 Cb -0.02 -1.31 -0.00 0.00 1.11 0.00 0.00 32.58 32.36 1n3t s HIS 219 CO 0.38 0.29 -0.10 -1.58 -0.85 0.00 0.00 174.74 172.87 1n3t s HIS 220 N -1.00 2.87 0.00 1.40 2.46 -1.26 -4.92 115.29 114.85 1n3t s HIS 220 Ca 0.14 -1.01 0.00 0.00 0.47 0.00 0.00 55.06 54.66 1n3t s HIS 220 Cb -0.10 -1.98 0.00 0.00 -0.13 0.00 0.00 32.58 30.36 1n3t s HIS 220 CO 0.05 -0.51 0.00 0.09 -2.47 0.00 0.00 174.74 171.91