#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nd3 n PRO 2 N 0.00 0.04 -0.05 3.52 -0.04 -1.26 -0.32 135.00 136.89 1nd3 n PRO 2 Ca 0.00 0.29 -0.11 0.00 -0.04 0.00 0.00 63.50 63.64 1nd3 n PRO 2 Cb 0.00 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 31.81 1nd3 n PRO 2 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1nd3 n VAL 3 N -1.44 1.55 0.13 0.52 0.31 -1.26 -2.91 118.33 115.23 1nd3 n VAL 3 Ca 0.03 -0.79 -0.01 0.00 -0.01 0.00 0.00 64.34 63.56 1nd3 n VAL 3 Cb 0.11 -0.93 0.16 0.00 -0.91 0.00 0.00 33.84 32.27 1nd3 n VAL 3 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 1nd3 h GLU 4 N 0.01 0.00 -0.36 5.55 4.57 -1.42 -1.91 114.58 121.02 1nd3 h GLU 4 Ca -0.40 0.00 -0.09 0.00 -1.18 0.00 0.00 59.36 57.70 1nd3 h GLU 4 Cb 2.09 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 30.67 1nd3 h GLU 4 CO 0.06 0.63 -0.11 -0.09 -1.18 0.00 0.00 179.01 178.31 1nd3 h ARG 5 N 0.00 0.70 -0.55 1.92 9.65 -0.77 -3.02 114.38 122.31 1nd3 h ARG 5 Ca -0.01 -0.28 -0.10 0.00 -1.10 0.00 0.00 59.98 58.50 1nd3 h ARG 5 Cb 1.12 -0.03 -0.02 0.00 -1.39 0.00 0.00 29.97 29.65 1nd3 h ARG 5 CO 0.08 0.87 -0.03 -0.92 2.80 0.00 0.00 179.97 182.77 1nd3 h TYR 6 N 0.49 1.06 -0.40 2.20 5.03 -1.35 -2.77 116.97 121.23 1nd3 h TYR 6 Ca 0.09 -0.18 -0.03 0.00 2.58 0.00 0.00 58.73 61.18 1nd3 h TYR 6 Cb 0.63 -0.28 -0.02 0.00 1.55 0.00 0.00 36.73 38.61 1nd3 h TYR 6 CO 0.05 0.96 0.11 0.28 -1.32 0.00 0.00 178.16 178.25 1nd3 h VAL 7 N 0.89 1.17 -0.14 1.81 2.07 -1.34 -1.98 116.25 118.74 1nd3 h VAL 7 Ca 0.16 -0.60 -0.11 0.00 0.82 0.00 0.00 66.70 66.97 1nd3 h VAL 7 Cb 0.57 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 31.07 1nd3 h VAL 7 CO 0.03 0.22 -0.39 0.44 0.02 0.00 0.00 177.57 177.89 1nd3 h ASP 8 N 0.57 0.32 -0.04 0.57 3.45 -1.37 -2.21 116.42 117.72 1nd3 h ASP 8 Ca 0.14 -0.13 -0.19 0.00 0.43 0.00 0.00 57.03 57.27 1nd3 h ASP 8 Cb 0.19 -0.09 0.00 0.00 -0.56 0.00 0.00 39.33 38.88 1nd3 h ASP 8 CO -0.01 0.69 -0.66 -0.33 -1.57 0.00 0.00 179.24 177.36 1nd3 h GLU 9 N 0.26 0.66 -0.38 3.56 5.08 -1.12 0.45 114.58 123.08 1nd3 h GLU 9 Ca 0.03 -0.48 -0.12 0.00 -1.00 0.00 0.00 59.36 57.79 1nd3 h GLU 9 Cb 0.81 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.12 1nd3 h GLU 9 CO 0.06 1.10 -0.24 0.28 -1.00 0.00 0.00 179.01 179.21 1nd3 h VAL 10 N 0.48 1.27 0.00 3.13 2.07 -1.27 -2.95 116.25 118.97 1nd3 h VAL 10 Ca -0.02 -1.36 0.00 0.00 0.82 0.00 0.00 66.70 66.14 1nd3 h VAL 10 Cb 1.24 1.24 0.00 0.00 -1.52 0.00 0.00 31.29 32.25 1nd3 h VAL 10 CO 0.13 0.45 -0.58 0.18 0.02 0.00 0.00 177.57 177.77 1nd3 n LEU 11 N -4.10 0.57 -2.92 2.57 4.77 -0.84 -4.97 117.00 112.07 1nd3 n LEU 11 Ca -0.00 0.09 -0.13 0.00 -0.03 0.00 0.00 56.01 55.93 1nd3 n LEU 11 Cb 0.45 -0.22 0.07 0.00 -2.33 0.00 0.00 43.42 41.39 1nd3 n LEU 11 CO 0.45 0.05 0.09 0.59 -1.33 0.00 0.00 177.39 177.24 1nd3 n ASN 12 N -1.75 -2.08 -2.38 -1.43 5.03 0.13 -4.96 115.26 107.81 1nd3 n ASN 12 Ca 0.04 -0.49 -0.18 0.00 0.87 0.00 0.00 54.58 54.82 1nd3 n ASN 12 Cb 0.38 -4.16 0.02 0.00 -1.02 0.00 0.00 39.78 35.00 1nd3 n ASN 12 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1nd3 n GLU 13 N -3.47 2.88 0.11 3.52 1.02 0.28 -4.74 120.64 120.24 1nd3 n GLU 13 Ca -0.23 -4.00 -0.22 0.00 -0.02 0.00 0.00 57.16 52.69 1nd3 n GLU 13 Cb 0.63 -2.01 -0.15 0.00 -0.02 0.00 0.00 31.44 29.90 1nd3 n GLU 13 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1nd3 h VAL 14 N 3.10 1.22 -3.52 2.62 2.07 -1.94 -3.42 116.25 116.39 1nd3 h VAL 14 Ca 0.19 -2.73 -0.68 0.00 0.82 0.00 0.00 66.70 64.30 1nd3 h VAL 14 Cb 1.29 2.93 -0.37 0.00 -1.52 0.00 0.00 31.29 33.62 1nd3 h VAL 14 CO 0.63 0.84 -0.52 -0.76 0.02 0.00 0.00 177.57 177.77 1nd3 s LEU 15 N -7.37 5.00 0.35 2.57 1.43 -1.26 -5.05 118.68 114.35 1nd3 s LEU 15 Ca -0.10 -2.54 -0.11 0.00 -1.03 0.00 0.00 54.13 50.36 1nd3 s LEU 15 Cb 0.05 -1.77 -0.07 0.00 0.03 0.00 0.00 46.19 44.43 1nd3 s LEU 15 CO 0.90 -0.40 0.72 0.68 0.23 0.00 0.00 176.35 178.48 1nd3 s VAL 16 N 0.40 4.80 0.08 -1.59 -7.23 -1.26 0.37 120.40 115.96 1nd3 s VAL 16 Ca 0.13 0.63 -0.03 0.00 -1.81 0.00 0.00 61.98 60.90 1nd3 s VAL 16 Cb -0.22 -3.69 -0.05 0.00 0.56 0.00 0.00 36.38 32.98 1nd3 s VAL 16 CO -0.04 -0.37 0.28 0.68 -0.31 0.00 0.00 175.10 175.34 1nd3 s VAL 17 N -2.19 5.30 0.79 1.32 -7.23 -1.07 -4.86 120.40 112.45 1nd3 s VAL 17 Ca 0.51 -0.13 -0.12 0.00 -1.81 0.00 0.00 61.98 60.42 1nd3 s VAL 17 Cb -0.10 -3.61 0.07 0.00 0.56 0.00 0.00 36.38 33.30 1nd3 s VAL 17 CO 0.27 0.15 1.15 -2.16 -0.31 0.00 0.00 175.10 174.20 1nd3 s PRO 18 N -2.42 1.86 0.67 4.82 0.04 -1.26 -4.76 135.00 133.96 1nd3 s PRO 18 Ca 0.36 1.52 -0.09 0.00 0.04 0.00 0.00 61.00 62.83 1nd3 s PRO 18 Cb -0.13 -1.82 0.02 0.00 0.04 0.00 0.00 34.50 32.61 1nd3 s PRO 18 CO 0.24 -2.00 1.02 -0.80 0.04 0.00 0.00 177.00 175.51 1nd3 s ASN 19 N -2.60 5.33 -0.20 6.66 0.01 -1.26 -4.64 114.94 118.24 1nd3 s ASN 19 Ca 0.68 0.86 -0.08 0.00 -0.71 0.00 0.00 52.86 53.61 1nd3 s ASN 19 Cb -0.23 -1.68 -0.04 0.00 0.41 0.00 0.00 41.25 39.70 1nd3 s ASN 19 CO 0.51 -1.33 0.09 -0.63 -1.51 0.00 0.00 177.10 174.24 1nd3 s ILE 20 N -3.23 4.92 0.28 0.60 -1.09 -0.94 -4.98 121.20 116.76 1nd3 s ILE 20 Ca 0.57 0.02 0.03 0.00 -2.23 0.00 0.00 60.65 59.04 1nd3 s ILE 20 Cb -0.11 -3.25 -0.03 0.00 -1.58 0.00 0.00 42.46 37.49 1nd3 s ILE 20 CO 0.48 0.42 0.43 0.20 -1.23 0.00 0.00 174.94 175.24 1nd3 s ASN 21 N 0.66 6.32 0.29 3.58 -0.87 -1.26 -0.86 114.94 122.80 1nd3 s ASN 21 Ca 0.05 0.24 -0.29 0.00 -1.57 0.00 0.00 52.86 51.29 1nd3 s ASN 21 Cb -0.13 -1.94 -0.10 0.00 -0.02 0.00 0.00 41.25 39.07 1nd3 s ASN 21 CO 0.01 -0.15 1.22 -1.58 -2.57 0.00 0.00 177.10 174.03 1nd3 s GLN 22 N -4.05 4.48 0.38 -0.60 0.74 -1.24 -4.47 119.66 114.91 1nd3 s GLN 22 Ca 0.37 2.01 0.05 0.00 0.05 0.00 0.00 55.36 57.84 1nd3 s GLN 22 Cb -0.09 -3.14 -0.07 0.00 1.10 0.00 0.00 33.01 30.81 1nd3 s GLN 22 CO 0.32 -0.02 0.04 -1.54 -0.55 0.00 0.00 175.29 173.53 1nd3 s SER 23 N -0.54 3.18 0.22 6.67 1.04 -0.65 -4.91 113.70 118.70 1nd3 s SER 23 Ca 0.48 -1.41 0.02 0.00 0.48 0.00 0.00 55.95 55.52 1nd3 s SER 23 Cb -0.36 -0.15 -0.05 0.00 0.10 0.00 0.00 66.02 65.56 1nd3 s SER 23 CO 0.46 -0.57 0.05 -1.00 0.98 0.00 0.00 173.24 173.15 1nd3 s HIS 24 N -3.00 1.41 0.48 5.02 0.09 -1.26 -4.15 115.29 113.88 1nd3 s HIS 24 Ca 0.33 -1.08 -0.24 0.00 -0.00 0.00 0.00 55.06 54.07 1nd3 s HIS 24 Cb 0.09 -0.82 -0.07 0.00 -0.00 0.00 0.00 32.58 31.78 1nd3 s HIS 24 CO 0.16 -0.24 1.38 -1.25 -0.00 0.00 0.00 174.74 174.79 1nd3 s PRO 25 N -3.96 3.50 0.09 8.40 0.04 -1.26 -4.86 135.00 136.95 1nd3 s PRO 25 Ca 0.31 2.31 0.02 0.00 0.04 0.00 0.00 61.00 63.67 1nd3 s PRO 25 Cb 0.07 -2.50 -0.04 0.00 0.04 0.00 0.00 34.50 32.07 1nd3 s PRO 25 CO 0.09 -0.93 -0.06 0.95 0.04 0.00 0.00 177.00 177.09 1nd3 s THR 26 N -1.26 0.65 -0.29 1.26 -4.23 -1.26 -5.12 115.64 105.39 1nd3 s THR 26 Ca 0.65 -1.86 0.00 0.00 -1.18 0.00 0.00 61.69 59.30 1nd3 s THR 26 Cb -0.41 -1.59 0.14 0.00 1.34 0.00 0.00 72.50 71.98 1nd3 s THR 26 CO 0.52 -0.84 0.34 -0.89 -0.54 0.00 0.00 174.62 173.20 1nd3 s THR 27 N -3.46 -0.48 0.27 3.99 2.01 -1.26 -5.15 115.64 111.55 1nd3 s THR 27 Ca 0.10 -0.43 -0.15 0.00 0.31 0.00 0.00 61.69 61.52 1nd3 s THR 27 Cb 0.04 -0.98 0.00 0.00 0.01 0.00 0.00 72.50 71.58 1nd3 s THR 27 CO -0.05 -0.41 0.55 -0.94 -0.69 0.00 0.00 174.62 173.09 1nd3 s SER 28 N 2.40 -0.08 -0.12 3.53 1.04 -1.26 -5.02 113.70 114.18 1nd3 s SER 28 Ca 0.10 -0.88 0.12 0.00 0.48 0.00 0.00 55.95 55.76 1nd3 s SER 28 Cb -0.13 0.64 0.56 0.00 0.10 0.00 0.00 66.02 67.18 1nd3 s SER 28 CO -0.31 -1.23 1.39 -0.46 0.98 0.00 0.00 173.24 173.61 1nd3 n ASN 29 N -0.50 3.98 -4.45 7.02 0.23 -1.26 -4.69 115.26 115.59 1nd3 n ASN 29 Ca -0.02 -2.49 -0.43 0.00 -0.53 0.00 0.00 54.58 51.11 1nd3 n ASN 29 Cb 0.61 -0.56 -0.09 0.00 -2.08 0.00 0.00 39.78 37.66 1nd3 n ASN 29 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1nd3 s ALA 30 N -2.00 3.49 -0.73 -2.53 0.00 -1.26 -5.02 121.76 113.72 1nd3 s ALA 30 Ca 0.38 -1.78 -0.02 0.00 0.00 0.00 0.00 51.96 50.54 1nd3 s ALA 30 Cb 0.27 -2.93 0.18 0.00 0.00 0.00 0.00 23.12 20.64 1nd3 s ALA 30 CO 0.15 -1.52 0.57 0.00 0.00 0.00 0.00 175.76 174.96 1nd3 s ALA 31 N 1.70 3.84 0.34 0.00 0.00 -1.26 -4.93 121.76 121.45 1nd3 s ALA 31 Ca 0.05 -3.51 0.05 0.00 0.00 0.00 0.00 51.96 48.55 1nd3 s ALA 31 Cb -0.20 -2.70 0.69 0.00 0.00 0.00 0.00 23.12 20.91 1nd3 s ALA 31 CO 0.10 -2.13 1.94 -1.35 0.00 0.00 0.00 175.76 174.31 1nd3 h PRO 32 N 6.57 0.80 0.00 0.00 0.11 -1.95 -1.91 132.00 135.62 1nd3 h PRO 32 Ca 0.06 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.12 1nd3 h PRO 32 Cb 0.89 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 31.82 1nd3 h PRO 32 CO 0.76 0.53 0.00 1.33 -0.21 0.00 0.00 178.00 180.41 1nd3 n VAL 33 N -4.49 1.01 -3.79 3.15 0.24 -1.26 -4.64 118.33 108.55 1nd3 n VAL 33 Ca 0.12 0.41 -0.36 0.00 -2.04 0.00 0.00 64.34 62.48 1nd3 n VAL 33 Cb 0.24 -1.35 -0.06 0.00 -1.47 0.00 0.00 33.84 31.20 1nd3 n VAL 33 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1nd3 s LEU 34 N -4.21 4.39 0.00 1.34 1.43 -0.72 -5.06 118.68 115.85 1nd3 s LEU 34 Ca 0.02 0.55 0.00 0.00 -1.03 0.00 0.00 54.13 53.67 1nd3 s LEU 34 Cb 0.08 -2.43 0.00 0.00 0.03 0.00 0.00 46.19 43.87 1nd3 s LEU 34 CO 0.28 0.32 0.00 -0.67 0.23 0.00 0.00 176.35 176.52 1nd3 n ASP 35 N 1.51 0.00 -3.57 2.29 -0.08 -1.26 -4.96 116.55 110.48 1nd3 n ASP 35 Ca -0.15 -0.17 -0.26 0.00 -1.51 0.00 0.00 54.79 52.70 1nd3 n ASP 35 Cb 0.54 0.00 -0.16 0.00 2.34 0.00 0.00 41.12 43.84 1nd3 n ASP 35 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1nd3 s ALA 36 N -1.00 0.43 -0.20 -1.67 0.00 -1.26 -4.99 121.76 113.08 1nd3 s ALA 36 Ca 0.00 -0.61 0.26 0.00 0.00 0.00 0.00 51.96 51.62 1nd3 s ALA 36 Cb 0.00 -1.23 1.24 0.00 0.00 0.00 0.00 23.12 23.13 1nd3 s ALA 36 CO 0.00 -1.40 1.80 0.00 0.00 0.00 0.00 175.76 176.16 1nd3 h ALA 37 N 8.40 1.00 0.00 0.00 0.00 -2.01 -2.54 119.26 124.11 1nd3 h ALA 37 Ca -0.17 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 1nd3 h ALA 37 Cb 1.09 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 1nd3 h ALA 37 CO 0.36 0.00 -0.04 0.93 0.00 0.00 0.00 179.25 180.49 1nd3 h GLU 38 N 0.00 0.00 0.00 0.00 3.07 -1.94 -1.88 114.58 113.84 1nd3 h GLU 38 Ca 0.00 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.85 1nd3 h GLU 38 Cb 0.23 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.14 1nd3 h GLU 38 CO 0.00 0.04 -0.03 1.79 -1.40 0.00 0.00 179.01 179.41 1nd3 h THR 39 N 0.00 0.23 0.00 1.13 1.35 -1.90 -3.45 112.91 110.26 1nd3 h THR 39 Ca -0.00 -0.26 0.00 0.00 -0.55 0.00 0.00 66.41 65.60 1nd3 h THR 39 Cb 0.08 1.20 0.00 0.00 -1.73 0.00 0.00 68.15 67.70 1nd3 h THR 39 CO 0.01 0.03 0.00 0.61 -0.25 0.00 0.00 175.52 175.92 1nd3 n GLY 40 N -0.77 0.75 3.69 5.82 0.00 -0.71 -5.05 105.19 108.92 1nd3 n GLY 40 Ca -0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.70 1nd3 n GLY 40 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1nd3 s HIS 41 N -2.62 3.00 0.10 1.61 3.76 -1.26 -5.10 115.29 114.77 1nd3 s HIS 41 Ca 0.00 -0.02 -0.25 0.00 -0.15 0.00 0.00 55.06 54.65 1nd3 s HIS 41 Cb 0.00 -1.55 -0.07 0.00 1.11 0.00 0.00 32.58 32.08 1nd3 s HIS 41 CO 0.00 0.48 0.75 0.99 -0.85 0.00 0.00 174.74 176.11 1nd3 s THR 42 N -1.29 4.57 0.20 1.30 2.01 -1.26 -4.75 115.64 116.42 1nd3 s THR 42 Ca 0.25 1.62 -0.32 0.00 0.31 0.00 0.00 61.69 63.56 1nd3 s THR 42 Cb -0.12 -4.11 -0.12 0.00 0.01 0.00 0.00 72.50 68.17 1nd3 s THR 42 CO 0.18 0.45 1.74 -3.20 -0.69 0.00 0.00 174.62 173.10 1nd3 n ASN 43 N 2.16 4.02 -1.35 3.53 2.85 -1.26 -4.86 115.26 120.35 1nd3 n ASN 43 Ca -0.05 1.05 0.01 0.00 -0.11 0.00 0.00 54.58 55.49 1nd3 n ASN 43 Cb 0.50 -1.58 0.21 0.00 1.24 0.00 0.00 39.78 40.15 1nd3 n ASN 43 CO 0.00 0.00 0.00 1.17 -2.11 0.00 0.00 177.26 176.32 1nd3 n LYS 44 N 4.12 2.96 -1.96 1.20 3.00 -1.26 -4.95 118.16 121.27 1nd3 n LYS 44 Ca 0.16 -1.76 -0.40 0.00 -0.00 0.00 0.00 58.31 56.31 1nd3 n LYS 44 Cb 0.35 -1.89 -0.00 0.00 0.00 0.00 0.00 35.03 33.49 1nd3 n LYS 44 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.40 175.90 1nd3 s ILE 45 N -1.97 2.40 0.35 3.15 2.07 -1.26 -5.04 121.20 120.90 1nd3 s ILE 45 Ca 0.31 0.37 0.09 0.00 -1.41 0.00 0.00 60.65 60.01 1nd3 s ILE 45 Cb 0.24 -3.22 -0.06 0.00 0.13 0.00 0.00 42.46 39.55 1nd3 s ILE 45 CO 0.08 0.06 -0.02 -1.10 -1.91 0.00 0.00 174.94 172.06 1nd3 s GLN 46 N -2.20 1.99 0.44 3.50 -1.52 -1.26 -5.04 119.66 115.56 1nd3 s GLN 46 Ca 0.56 -1.84 0.18 0.00 -1.95 0.00 0.00 55.36 52.31 1nd3 s GLN 46 Cb -0.41 -1.84 1.12 0.00 -0.22 0.00 0.00 33.01 31.66 1nd3 s GLN 46 CO 0.54 0.12 1.89 -1.00 -0.25 0.00 0.00 175.29 176.59 1nd3 h PRO 47 N 1.86 0.35 0.00 2.91 0.13 -1.96 -0.86 132.00 134.43 1nd3 h PRO 47 Ca -0.43 -0.02 -0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1nd3 h PRO 47 Cb 1.25 -0.08 -0.00 0.00 0.13 0.00 0.00 31.00 32.30 1nd3 h PRO 47 CO 0.69 0.23 -0.00 0.93 -0.23 0.00 0.00 178.00 179.62 1nd3 h GLU 48 N 0.36 0.00 0.00 0.86 3.07 -1.89 -2.45 114.58 114.53 1nd3 h GLU 48 Ca 0.41 0.00 -0.05 0.00 -0.50 0.00 0.00 59.36 59.23 1nd3 h GLU 48 Cb 1.06 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.97 1nd3 h GLU 48 CO -0.13 0.00 -0.61 -0.44 -1.40 0.00 0.00 179.01 176.44 1nd3 h ASP 49 N 0.00 0.00 0.00 1.42 3.32 -1.56 -3.39 116.42 116.21 1nd3 h ASP 49 Ca -0.00 0.00 -0.28 0.00 0.02 0.00 0.00 57.03 56.77 1nd3 h ASP 49 Cb 0.02 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 39.52 1nd3 h ASP 49 CO 0.00 0.18 -2.06 0.35 -1.72 0.00 0.00 179.24 175.99 1nd3 n THR 50 N -2.97 1.06 -4.45 0.35 -2.24 -0.96 -4.92 114.28 100.16 1nd3 n THR 50 Ca 0.00 -0.61 -0.22 0.00 -2.27 0.00 0.00 64.05 60.95 1nd3 n THR 50 Cb 0.62 -0.69 -0.11 0.00 -2.10 0.00 0.00 70.33 68.05 1nd3 n THR 50 CO 0.00 0.00 0.00 0.27 -0.57 0.00 0.00 175.07 174.77 1nd3 s ILE 51 N -2.37 1.19 -0.46 2.28 -4.36 -1.01 -5.09 121.20 111.38 1nd3 s ILE 51 Ca -0.11 -2.00 -0.24 0.00 -0.26 0.00 0.00 60.65 58.05 1nd3 s ILE 51 Cb 0.05 -2.79 0.03 0.00 1.25 0.00 0.00 42.46 40.99 1nd3 s ILE 51 CO 0.60 0.00 0.82 -1.61 0.24 0.00 0.00 174.94 174.99 1nd3 s GLU 52 N -3.89 3.42 0.33 0.37 2.02 -1.26 -4.55 118.70 115.13 1nd3 s GLU 52 Ca 0.36 -0.07 0.04 0.00 0.02 0.00 0.00 54.97 55.32 1nd3 s GLU 52 Cb 0.09 -3.95 -0.02 0.00 0.10 0.00 0.00 34.13 30.35 1nd3 s GLU 52 CO 0.16 -1.17 0.48 0.95 0.02 0.00 0.00 175.26 175.69 1nd3 s THR 53 N 3.43 4.53 0.52 3.63 -4.23 -1.26 -4.88 115.64 117.38 1nd3 s THR 53 Ca 0.31 -0.86 0.08 0.00 -1.18 0.00 0.00 61.69 60.05 1nd3 s THR 53 Cb -0.12 -3.60 0.06 0.00 1.34 0.00 0.00 72.50 70.18 1nd3 s THR 53 CO 0.23 -0.28 0.72 0.00 -0.54 0.00 0.00 174.62 174.75 1nd3 s ARG 54 N -4.19 2.47 -0.13 3.99 1.70 -1.26 -1.64 118.95 119.88 1nd3 s ARG 54 Ca 0.42 -1.43 -0.21 0.00 -0.47 0.00 0.00 55.73 54.04 1nd3 s ARG 54 Cb -0.09 -2.66 -0.03 0.00 -0.57 0.00 0.00 34.95 31.59 1nd3 s ARG 54 CO 0.32 -0.67 0.63 -0.47 -1.08 0.00 0.00 175.30 174.03 1nd3 s TYR 55 N -2.58 3.48 -0.04 5.89 5.04 -1.26 -3.61 117.35 124.26 1nd3 s TYR 55 Ca 0.59 1.05 0.02 0.00 -2.44 0.00 0.00 57.07 56.29 1nd3 s TYR 55 Cb -0.07 -2.76 0.01 0.00 0.35 0.00 0.00 41.96 39.49 1nd3 s TYR 55 CO 0.37 -0.01 -0.08 0.08 -1.34 0.00 0.00 175.55 174.57 1nd3 s VAL 56 N 1.25 0.77 -0.58 3.14 1.01 -0.04 -4.95 120.40 121.01 1nd3 s VAL 56 Ca 0.32 -0.31 -0.20 0.00 0.00 0.00 0.00 61.98 61.78 1nd3 s VAL 56 Cb -0.16 -0.72 0.08 0.00 0.00 0.00 0.00 36.38 35.58 1nd3 s VAL 56 CO 0.13 0.26 0.75 -1.58 0.00 0.00 0.00 175.10 174.66 1nd3 s GLN 57 N 0.49 3.10 0.24 2.72 0.74 -1.26 -2.21 119.66 123.47 1nd3 s GLN 57 Ca -0.08 -1.04 -0.30 0.00 0.05 0.00 0.00 55.36 53.99 1nd3 s GLN 57 Cb -0.12 -4.20 -0.09 0.00 1.10 0.00 0.00 33.01 29.70 1nd3 s GLN 57 CO 0.01 -1.50 1.31 -1.12 -0.55 0.00 0.00 175.29 173.44 1nd3 s SER 58 N 3.33 6.87 -0.00 6.67 0.01 -1.26 -4.94 113.70 124.38 1nd3 s SER 58 Ca 0.16 2.49 0.05 0.00 1.31 0.00 0.00 55.95 59.95 1nd3 s SER 58 Cb -0.21 -2.62 -0.06 0.00 0.21 0.00 0.00 66.02 63.35 1nd3 s SER 58 CO 0.09 -0.52 0.17 -1.20 0.41 0.00 0.00 173.24 172.19 1nd3 n SER 59 N 2.10 1.29 -4.64 2.44 7.64 -1.26 -4.85 113.62 116.33 1nd3 n SER 59 Ca 0.04 -0.43 -0.36 0.00 1.01 0.00 0.00 58.87 59.13 1nd3 n SER 59 Cb 0.42 1.06 0.09 0.00 -1.01 0.00 0.00 64.21 64.77 1nd3 n SER 59 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1nd3 n GLN 60 N -1.27 0.59 -4.17 1.43 3.00 -1.26 -4.91 117.38 110.80 1nd3 n GLN 60 Ca 0.00 0.26 -0.15 0.00 -0.01 0.00 0.00 57.00 57.10 1nd3 n GLN 60 Cb 0.09 -2.29 -0.11 0.00 0.00 0.00 0.00 30.24 27.93 1nd3 n GLN 60 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.06 178.01 1nd3 s THR 61 N -1.76 0.95 -2.42 5.09 -4.23 -1.26 -2.61 115.64 109.40 1nd3 s THR 61 Ca 0.75 -1.55 0.22 0.00 -1.18 0.00 0.00 61.69 59.93 1nd3 s THR 61 Cb -0.35 -1.27 0.37 0.00 1.34 0.00 0.00 72.50 72.59 1nd3 s THR 61 CO 0.48 -0.49 1.35 0.18 -0.54 0.00 0.00 174.62 175.60 1nd3 n LEU 62 N 0.72 3.32 -0.26 4.79 4.77 0.16 -4.64 117.00 125.87 1nd3 n LEU 62 Ca -0.17 -1.43 0.00 0.00 -0.03 0.00 0.00 56.01 54.38 1nd3 n LEU 62 Cb 0.57 -0.20 0.07 0.00 -2.33 0.00 0.00 43.42 41.52 1nd3 n LEU 62 CO 0.25 0.70 0.69 0.44 -1.33 0.00 0.00 177.39 178.14 1nd3 h ASP 63 N 4.31 -0.85 0.53 -1.43 5.19 -1.85 0.46 116.42 122.77 1nd3 h ASP 63 Ca 0.00 0.23 0.00 0.00 -0.62 0.00 0.00 57.03 56.64 1nd3 h ASP 63 Cb 0.96 0.51 0.00 0.00 0.18 0.00 0.00 39.33 40.98 1nd3 h ASP 63 CO 0.00 -0.27 0.00 -0.08 -3.12 0.00 0.00 179.24 175.77 1nd3 h GLU 64 N -0.04 0.00 -0.11 3.56 4.81 -1.93 -1.97 114.58 118.90 1nd3 h GLU 64 Ca 0.34 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.57 1nd3 h GLU 64 Cb 0.56 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.94 1nd3 h GLU 64 CO -0.78 0.00 0.00 -1.33 -0.73 0.00 0.00 179.01 176.17 1nd3 n MET 65 N -2.35 1.98 -1.57 1.92 2.81 0.14 -4.39 117.12 115.67 1nd3 n MET 65 Ca 0.01 -1.44 -0.33 0.00 -1.81 0.00 0.00 57.70 54.12 1nd3 n MET 65 Cb 0.18 -1.46 0.07 0.00 -0.71 0.00 0.00 33.22 31.30 1nd3 n MET 65 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 1nd3 s SER 66 N -1.82 4.67 0.32 7.83 1.04 -0.74 -4.80 113.70 120.19 1nd3 s SER 66 Ca 0.34 2.11 -0.00 0.00 0.48 0.00 0.00 55.95 58.88 1nd3 s SER 66 Cb 0.20 -2.56 0.51 0.00 0.10 0.00 0.00 66.02 64.27 1nd3 s SER 66 CO 0.31 -1.93 1.96 0.58 0.98 0.00 0.00 173.24 175.14 1nd3 h VAL 67 N -0.25 1.19 -0.77 5.02 2.07 -1.92 -0.32 116.25 121.28 1nd3 h VAL 67 Ca -0.47 -0.42 0.04 0.00 0.82 0.00 0.00 66.70 66.67 1nd3 h VAL 67 Cb 1.26 0.21 -0.05 0.00 -1.52 0.00 0.00 31.29 31.19 1nd3 h VAL 67 CO 0.52 0.20 0.49 -0.08 0.02 0.00 0.00 177.57 178.72 1nd3 h GLU 68 N 0.96 0.91 -0.13 1.57 4.57 -1.91 -1.76 114.58 118.80 1nd3 h GLU 68 Ca 0.25 -0.05 -0.23 0.00 -1.18 0.00 0.00 59.36 58.15 1nd3 h GLU 68 Cb -0.04 -0.21 0.01 0.00 -0.16 0.00 0.00 28.75 28.35 1nd3 h GLU 68 CO -0.05 0.60 -0.82 1.03 -1.18 0.00 0.00 179.01 178.60 1nd3 h SER 69 N 0.94 0.94 -0.75 1.04 0.87 -1.67 -0.91 113.55 114.01 1nd3 h SER 69 Ca 0.31 -0.65 -0.04 0.00 -1.23 0.00 0.00 61.79 60.18 1nd3 h SER 69 Cb 0.04 -0.28 -0.03 0.00 -0.44 0.00 0.00 62.40 61.68 1nd3 h SER 69 CO -0.12 1.44 0.30 0.15 -0.53 0.00 0.00 176.83 178.07 1nd3 h PHE 70 N 0.51 1.14 -0.18 2.24 3.57 -0.76 -3.01 116.94 120.44 1nd3 h PHE 70 Ca -0.07 -0.09 0.00 0.00 3.53 0.00 0.00 57.97 61.35 1nd3 h PHE 70 Cb 1.45 -0.34 0.00 0.00 2.79 0.00 0.00 35.95 39.85 1nd3 h PHE 70 CO 0.09 0.87 0.00 1.28 -2.23 0.00 0.00 178.31 178.32 1nd3 n LEU 71 N -4.33 2.95 -2.02 0.59 4.77 -0.69 -4.64 117.00 113.64 1nd3 n LEU 71 Ca 0.06 -1.25 -0.22 0.00 -0.03 0.00 0.00 56.01 54.58 1nd3 n LEU 71 Cb 0.18 -0.11 0.05 0.00 -2.33 0.00 0.00 43.42 41.21 1nd3 n LEU 71 CO 0.40 0.58 1.29 0.61 -1.33 0.00 0.00 177.39 178.94 1nd3 n GLY 72 N 1.20 4.61 3.03 -0.72 0.00 -0.35 -2.74 105.19 110.22 1nd3 n GLY 72 Ca 0.14 -1.44 -0.22 0.00 0.00 0.00 0.00 46.02 44.50 1nd3 n GLY 72 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1nd3 s ARG 73 N -2.40 1.26 0.05 1.61 0.52 -1.26 -4.85 118.95 113.88 1nd3 s ARG 73 Ca 0.41 -0.37 -0.31 0.00 -0.52 0.00 0.00 55.73 54.94 1nd3 s ARG 73 Cb 0.32 -1.13 -0.07 0.00 0.52 0.00 0.00 34.95 34.59 1nd3 s ARG 73 CO -0.01 0.11 1.57 -1.12 0.02 0.00 0.00 175.30 175.88 1nd3 s SER 74 N 0.30 6.68 0.13 0.23 0.01 -1.25 -4.57 113.70 115.22 1nd3 s SER 74 Ca -0.06 2.37 0.06 0.00 1.31 0.00 0.00 55.95 59.63 1nd3 s SER 74 Cb -0.11 -2.56 -0.04 0.00 0.21 0.00 0.00 66.02 63.52 1nd3 s SER 74 CO 0.01 -0.83 -0.13 -0.83 0.41 0.00 0.00 173.24 171.87 1nd3 s GLY 75 N 2.20 1.09 0.27 3.44 0.00 -0.36 -4.87 107.32 109.09 1nd3 s GLY 75 Ca 0.71 -1.35 -0.29 0.00 0.00 0.00 0.00 44.72 43.78 1nd3 s GLY 75 CO 0.30 -1.42 1.14 0.00 0.00 0.00 0.00 173.10 173.13 1nd3 n ILE 77 N 1.41 0.00 -3.60 0.00 -5.35 0.04 -4.73 119.36 107.14 1nd3 n ILE 77 Ca 0.00 -0.32 -0.08 0.00 -0.27 0.00 0.00 62.75 62.07 1nd3 n ILE 77 Cb 0.44 1.13 -0.05 0.00 -1.74 0.00 0.00 39.64 39.43 1nd3 n ILE 77 CO 0.00 0.00 0.00 -2.28 -1.76 0.00 0.00 176.55 172.51 1nd3 s HIS 78 N -0.41 -0.29 -0.32 4.28 5.04 -1.22 -4.53 115.29 117.84 1nd3 s HIS 78 Ca 0.00 0.52 -0.00 0.00 -1.54 0.00 0.00 55.06 54.03 1nd3 s HIS 78 Cb 0.00 0.46 0.10 0.00 0.04 0.00 0.00 32.58 33.18 1nd3 s HIS 78 CO 0.00 -0.26 0.11 -1.21 -2.34 0.00 0.00 174.74 171.04 1nd3 s GLU 79 N -0.99 0.78 0.08 2.88 2.02 -1.26 -0.99 118.70 121.22 1nd3 s GLU 79 Ca 0.01 -1.17 -0.27 0.00 0.02 0.00 0.00 54.97 53.56 1nd3 s GLU 79 Cb -0.01 -2.05 -0.06 0.00 0.10 0.00 0.00 34.13 32.11 1nd3 s GLU 79 CO -0.01 -1.00 0.83 0.45 0.02 0.00 0.00 175.26 175.55 1nd3 s SER 80 N 1.49 7.32 -0.10 -0.19 0.15 0.72 -4.90 113.70 118.20 1nd3 s SER 80 Ca 0.10 1.58 0.04 0.00 0.70 0.00 0.00 55.95 58.37 1nd3 s SER 80 Cb -0.18 -2.51 0.00 0.00 -1.71 0.00 0.00 66.02 61.62 1nd3 s SER 80 CO -0.22 0.01 -0.22 -0.69 1.20 0.00 0.00 173.24 173.31 1nd3 s VAL 81 N -0.14 1.94 -0.34 4.45 1.01 -1.26 -0.56 120.40 125.50 1nd3 s VAL 81 Ca 0.41 -0.95 0.02 0.00 0.00 0.00 0.00 61.98 61.47 1nd3 s VAL 81 Cb -0.22 -1.69 0.10 0.00 0.00 0.00 0.00 36.38 34.58 1nd3 s VAL 81 CO 0.26 0.53 0.08 -0.76 0.00 0.00 0.00 175.10 175.21 1nd3 s LEU 82 N 0.42 3.81 -0.34 3.92 1.43 -0.14 -4.95 118.68 122.84 1nd3 s LEU 82 Ca -0.17 -2.04 -0.06 0.00 -1.03 0.00 0.00 54.13 50.83 1nd3 s LEU 82 Cb -0.18 -1.35 0.05 0.00 0.03 0.00 0.00 46.19 44.74 1nd3 s LEU 82 CO 0.07 -0.38 0.11 -0.62 0.23 0.00 0.00 176.35 175.76 1nd3 s ASP 83 N 1.07 5.29 -0.49 2.29 2.15 -1.26 -0.70 116.67 125.02 1nd3 s ASP 83 Ca 0.11 -1.21 -0.29 0.00 0.43 0.00 0.00 52.55 51.59 1nd3 s ASP 83 Cb -0.19 -1.86 0.03 0.00 -0.30 0.00 0.00 42.92 40.60 1nd3 s ASP 83 CO -0.13 -0.34 1.20 -0.63 -0.17 0.00 0.00 175.17 175.10 1nd3 s ILE 84 N 1.38 4.11 -0.12 4.11 -1.09 -0.81 -4.84 121.20 123.94 1nd3 s ILE 84 Ca -0.01 1.11 -0.09 0.00 -2.23 0.00 0.00 60.65 59.43 1nd3 s ILE 84 Cb -0.20 -4.56 -0.05 0.00 -1.58 0.00 0.00 42.46 36.07 1nd3 s ILE 84 CO 0.02 -1.03 -0.21 0.52 -1.23 0.00 0.00 174.94 173.02 1nd3 n VAL 85 N 6.87 1.10 -1.30 2.92 0.31 -1.26 -4.54 118.33 122.44 1nd3 n VAL 85 Ca 0.12 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.43 1nd3 n VAL 85 Cb 0.49 -1.85 0.00 0.00 -0.91 0.00 0.00 33.84 31.57 1nd3 n VAL 85 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 1nd3 n ASP 86 N -3.87 0.00 -3.43 4.52 5.68 -1.26 -5.06 116.55 113.14 1nd3 n ASP 86 Ca -0.22 -0.79 -0.19 0.00 -0.50 0.00 0.00 54.79 53.10 1nd3 n ASP 86 Cb 0.54 0.00 -0.11 0.00 -1.14 0.00 0.00 41.12 40.42 1nd3 n ASP 86 CO 0.00 0.00 0.00 0.21 -1.33 0.00 0.00 177.20 176.08 1nd3 s ASN 87 N 0.00 1.85 0.13 -1.12 3.84 -1.26 -5.04 114.94 113.34 1nd3 s ASN 87 Ca 0.00 -0.75 -0.19 0.00 0.21 0.00 0.00 52.86 52.13 1nd3 s ASN 87 Cb 0.00 0.40 -0.04 0.00 -0.55 0.00 0.00 41.25 41.06 1nd3 s ASN 87 CO 0.00 -0.39 1.76 0.22 -2.79 0.00 0.00 177.10 175.91 1nd3 h TYR 88 N 8.28 0.21 -0.71 0.43 3.20 -1.97 -0.78 116.97 125.63 1nd3 h TYR 88 Ca -0.15 0.01 0.12 0.00 3.14 0.00 0.00 58.73 61.85 1nd3 h TYR 88 Cb 1.08 -0.06 -0.05 0.00 1.54 0.00 0.00 36.73 39.24 1nd3 h TYR 88 CO 0.26 0.12 0.47 -0.91 -1.64 0.00 0.00 178.16 176.46 1nd3 h ASN 89 N 0.24 0.46 0.50 -2.11 -0.26 -1.99 -0.78 115.58 111.64 1nd3 h ASN 89 Ca 0.09 0.02 -0.27 0.00 -0.56 0.00 0.00 56.30 55.58 1nd3 h ASN 89 Cb 0.02 -0.08 -0.05 0.00 -1.06 0.00 0.00 38.32 37.15 1nd3 h ASN 89 CO -0.06 0.27 -1.69 0.47 -1.06 0.00 0.00 177.43 175.35 1nd3 n ASP 90 N -4.49 0.80 -0.40 5.81 8.00 -1.06 -4.23 116.55 120.98 1nd3 n ASP 90 Ca 0.12 0.37 0.11 0.00 0.71 0.00 0.00 54.79 56.11 1nd3 n ASP 90 Cb 0.41 0.09 0.05 0.00 -0.02 0.00 0.00 41.12 41.65 1nd3 n ASP 90 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1nd3 n GLN 91 N -2.98 1.01 -0.18 -1.24 6.02 -0.32 -4.41 117.38 115.28 1nd3 n GLN 91 Ca -0.16 -0.80 0.06 0.00 -0.01 0.00 0.00 57.00 56.08 1nd3 n GLN 91 Cb 1.01 -1.48 0.16 0.00 1.02 0.00 0.00 30.24 30.94 1nd3 n GLN 91 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 1nd3 n SER 92 N -0.30 1.88 -3.69 1.08 3.41 -0.32 -4.11 113.62 111.57 1nd3 n SER 92 Ca 0.09 -2.00 -0.11 0.00 -0.26 0.00 0.00 58.87 56.60 1nd3 n SER 92 Cb 0.43 -0.23 -0.06 0.00 -0.26 0.00 0.00 64.21 64.09 1nd3 n SER 92 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1nd3 s PHE 93 N -1.53 -0.15 0.36 7.33 -0.71 -1.26 -1.25 117.98 120.78 1nd3 s PHE 93 Ca 0.24 -0.11 -0.16 0.00 -1.04 0.00 0.00 56.93 55.85 1nd3 s PHE 93 Cb 0.12 0.18 0.06 0.00 -1.21 0.00 0.00 43.02 42.18 1nd3 s PHE 93 CO 0.16 -0.63 0.83 -0.08 -1.34 0.00 0.00 175.22 174.17 1nd3 s THR 94 N -3.40 0.00 0.05 -4.49 -1.32 -0.47 -5.00 115.64 101.02 1nd3 s THR 94 Ca 0.01 -0.94 -0.08 0.00 -1.21 0.00 0.00 61.69 59.47 1nd3 s THR 94 Cb 0.01 -2.97 -0.00 0.00 -1.51 0.00 0.00 72.50 68.04 1nd3 s THR 94 CO -0.09 0.00 0.16 -1.59 -2.21 0.00 0.00 174.62 170.89 1nd3 s LYS 95 N -2.14 0.70 -0.04 7.08 -2.85 -1.26 -1.91 119.74 119.32 1nd3 s LYS 95 Ca 0.17 -0.76 -0.01 0.00 -1.00 0.00 0.00 55.97 54.36 1nd3 s LYS 95 Cb -0.05 0.28 0.03 0.00 -2.06 0.00 0.00 37.83 36.04 1nd3 s LYS 95 CO 0.11 -0.20 0.08 -0.46 0.10 0.00 0.00 175.35 174.98 1nd3 s TRP 96 N -2.95 -0.04 -0.67 1.78 -0.00 -0.34 -4.96 118.94 111.74 1nd3 s TRP 96 Ca -0.02 0.28 -0.28 0.00 -0.00 0.00 0.00 56.10 56.09 1nd3 s TRP 96 Cb 0.01 -0.20 0.03 0.00 -0.00 0.00 0.00 33.47 33.31 1nd3 s TRP 96 CO -0.06 -0.13 1.24 1.21 -0.00 0.00 0.00 176.95 179.21 1nd3 s ASN 97 N 1.23 6.28 0.27 5.86 3.84 -1.26 -0.48 114.94 130.68 1nd3 s ASN 97 Ca -0.08 -0.22 -0.30 0.00 0.21 0.00 0.00 52.86 52.48 1nd3 s ASN 97 Cb -0.12 -2.56 -0.14 0.00 -0.55 0.00 0.00 41.25 37.88 1nd3 s ASN 97 CO -0.04 -1.69 1.19 -0.38 -2.79 0.00 0.00 177.10 173.39 1nd3 n ILE 98 N 6.50 1.55 -3.61 -5.21 5.41 -0.88 -5.00 119.36 118.12 1nd3 n ILE 98 Ca 0.05 -0.39 -0.01 0.00 1.00 0.00 0.00 62.75 63.40 1nd3 n ILE 98 Cb 0.49 -1.20 -0.01 0.00 -0.71 0.00 0.00 39.64 38.21 1nd3 n ILE 98 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 1nd3 s ASN 99 N -0.21 -0.10 -0.30 4.38 2.20 -1.26 -4.39 114.94 115.26 1nd3 s ASN 99 Ca 0.63 -0.09 0.08 0.00 -0.94 0.00 0.00 52.86 52.54 1nd3 s ASN 99 Cb -0.69 0.17 0.49 0.00 -2.00 0.00 0.00 41.25 39.22 1nd3 s ASN 99 CO 0.57 -0.30 1.43 0.18 -2.94 0.00 0.00 177.10 176.03 1nd3 n LEU 100 N -0.31 4.27 -0.00 3.54 4.77 -1.26 -4.67 117.00 123.33 1nd3 n LEU 100 Ca -0.05 -3.97 0.08 0.00 -0.03 0.00 0.00 56.01 52.04 1nd3 n LEU 100 Cb 0.61 -0.61 -0.10 0.00 -2.33 0.00 0.00 43.42 40.99 1nd3 n LEU 100 CO 0.11 1.42 -0.23 0.00 -1.33 0.00 0.00 177.39 177.36 1nd3 n GLN 101 N -1.06 1.36 0.21 3.23 1.13 -1.26 -4.35 117.38 116.64 1nd3 n GLN 101 Ca 0.35 -0.04 0.12 0.00 -1.94 0.00 0.00 57.00 55.48 1nd3 n GLN 101 Cb 0.97 -1.30 0.18 0.00 0.11 0.00 0.00 30.24 30.20 1nd3 n GLN 101 CO 0.00 0.00 0.00 0.93 -1.44 0.00 0.00 177.06 176.55 1nd3 h GLU 102 N 0.00 0.00 -4.97 -1.09 5.08 -1.83 -3.44 114.58 108.33 1nd3 h GLU 102 Ca 0.00 0.00 -0.67 0.00 -1.00 0.00 0.00 59.36 57.69 1nd3 h GLU 102 Cb 0.49 0.00 -0.32 0.00 0.50 0.00 0.00 28.75 29.42 1nd3 h GLU 102 CO 0.00 0.00 -0.77 -1.64 -1.00 0.00 0.00 179.01 175.60 1nd3 s MET 103 N -3.20 3.00 0.24 2.33 -1.94 -1.26 -5.02 119.30 113.43 1nd3 s MET 103 Ca 0.07 -0.86 -0.05 0.00 -1.71 0.00 0.00 55.69 53.14 1nd3 s MET 103 Cb 0.06 -2.87 0.41 0.00 2.01 0.00 0.00 34.83 34.43 1nd3 s MET 103 CO 0.67 -0.30 1.76 0.00 -0.01 0.00 0.00 175.02 177.14 1nd3 h ALA 104 N 8.01 1.06 -0.06 3.03 0.00 -1.92 -2.72 119.26 126.66 1nd3 h ALA 104 Ca -0.38 0.08 0.03 0.00 0.00 0.00 0.00 54.91 54.64 1nd3 h ALA 104 Cb 1.13 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.88 1nd3 h ALA 104 CO 0.60 -0.10 -0.18 1.96 0.00 0.00 0.00 179.25 181.52 1nd3 h GLN 105 N 0.56 -0.26 0.00 0.00 4.20 -1.95 -1.27 115.11 116.38 1nd3 h GLN 105 Ca 0.39 0.02 -0.21 0.00 0.06 0.00 0.00 58.65 58.91 1nd3 h GLN 105 Cb 0.50 0.06 -0.03 0.00 0.30 0.00 0.00 27.48 28.31 1nd3 h GLN 105 CO -0.33 -0.17 -1.01 -0.84 -0.67 0.00 0.00 178.83 175.81 1nd3 h ILE 106 N -0.27 1.63 -0.53 2.54 3.07 -1.86 -3.26 117.51 118.84 1nd3 h ILE 106 Ca 0.07 -3.32 0.01 0.00 1.55 0.00 0.00 64.86 63.18 1nd3 h ILE 106 Cb 0.37 2.80 -0.03 0.00 -0.27 0.00 0.00 36.82 39.69 1nd3 h ILE 106 CO -0.21 0.93 0.34 -0.09 -1.05 0.00 0.00 178.15 178.06 1nd3 h ARG 107 N 0.00 0.66 -0.78 0.16 2.43 -1.28 -2.32 114.38 113.25 1nd3 h ARG 107 Ca -0.02 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.09 1nd3 h ARG 107 Cb 1.76 -0.15 -0.04 0.00 -0.42 0.00 0.00 29.97 31.13 1nd3 h ARG 107 CO 0.12 0.43 0.41 -0.09 -1.51 0.00 0.00 179.97 179.34 1nd3 h ARG 108 N 0.68 1.10 -0.01 0.20 2.43 -1.31 -1.31 114.38 116.15 1nd3 h ARG 108 Ca 0.20 -0.13 -0.00 0.00 -0.81 0.00 0.00 59.98 59.24 1nd3 h ARG 108 Cb -0.03 -0.21 -0.00 0.00 -0.42 0.00 0.00 29.97 29.31 1nd3 h ARG 108 CO -0.07 0.82 0.00 0.87 -1.51 0.00 0.00 179.97 180.08 1nd3 h LYS 109 N 1.10 0.02 -0.30 0.20 1.57 -1.49 -2.94 116.57 114.73 1nd3 h LYS 109 Ca 0.27 -0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 59.01 1nd3 h LYS 109 Cb 0.05 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.34 1nd3 h LYS 109 CO -0.04 0.25 -0.00 0.74 -0.57 0.00 0.00 179.45 179.83 1nd3 h PHE 110 N -0.21 0.46 0.00 -1.35 -1.00 -1.30 -2.43 116.94 111.11 1nd3 h PHE 110 Ca 0.00 -0.04 0.00 0.00 2.81 0.00 0.00 57.97 60.74 1nd3 h PHE 110 Cb 0.24 -0.14 0.00 0.00 3.61 0.00 0.00 35.95 39.66 1nd3 h PHE 110 CO 0.01 0.47 0.00 0.39 -1.61 0.00 0.00 178.31 177.56 1nd3 n GLU 111 N -4.30 0.86 -0.21 1.51 1.02 -0.51 -2.39 120.64 116.62 1nd3 n GLU 111 Ca 0.01 0.00 0.10 0.00 -0.02 0.00 0.00 57.16 57.25 1nd3 n GLU 111 Cb 0.23 -1.27 0.26 0.00 -0.02 0.00 0.00 31.44 30.64 1nd3 n GLU 111 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 1nd3 n MET 112 N -0.14 2.20 -4.11 3.49 2.81 -0.92 -4.77 117.12 115.68 1nd3 n MET 112 Ca 0.00 -1.84 -0.11 0.00 -1.81 0.00 0.00 57.70 53.94 1nd3 n MET 112 Cb 0.14 -1.44 -0.11 0.00 -0.71 0.00 0.00 33.22 31.10 1nd3 n MET 112 CO 0.00 0.00 0.00 -0.06 1.51 0.00 0.00 175.97 177.42 1nd3 s PHE 113 N -1.46 0.72 -0.05 2.03 0.40 -1.01 -1.28 117.98 117.34 1nd3 s PHE 113 Ca 0.36 -0.75 -0.12 0.00 -0.60 0.00 0.00 56.93 55.82 1nd3 s PHE 113 Cb 0.20 -0.44 -0.30 0.00 0.51 0.00 0.00 43.02 42.98 1nd3 s PHE 113 CO 0.27 -0.15 0.66 1.15 0.70 0.00 0.00 175.22 177.85 1nd3 h THR 114 N 3.69 0.96 -3.95 0.64 2.02 -0.36 -3.43 112.91 112.48 1nd3 h THR 114 Ca -0.35 -2.50 -0.37 0.00 0.77 0.00 0.00 66.41 63.96 1nd3 h THR 114 Cb 1.18 2.77 -0.21 0.00 -1.74 0.00 0.00 68.15 70.14 1nd3 h THR 114 CO 0.54 0.84 -0.77 -0.31 0.37 0.00 0.00 175.52 176.19 1nd3 s TYR 115 N -2.56 1.05 -0.14 3.16 1.51 -1.14 -0.82 117.35 118.41 1nd3 s TYR 115 Ca -0.16 -0.47 -0.16 0.00 -1.01 0.00 0.00 57.07 55.27 1nd3 s TYR 115 Cb 0.05 -0.60 0.04 0.00 -0.11 0.00 0.00 41.96 41.34 1nd3 s TYR 115 CO 0.84 0.02 0.43 0.00 -1.11 0.00 0.00 175.55 175.73 1nd3 s ALA 116 N -1.30 -1.08 -0.10 3.71 0.00 -1.03 -1.00 121.76 120.96 1nd3 s ALA 116 Ca -0.04 1.12 0.01 0.00 0.00 0.00 0.00 51.96 53.05 1nd3 s ALA 116 Cb -0.10 -0.58 0.02 0.00 0.00 0.00 0.00 23.12 22.45 1nd3 s ALA 116 CO 0.02 -0.22 -0.13 0.50 0.00 0.00 0.00 175.76 175.93 1nd3 s ARG 117 N -0.04 1.90 0.09 0.00 3.52 0.35 -0.32 118.95 124.46 1nd3 s ARG 117 Ca -0.02 -0.45 -0.26 0.00 -0.13 0.00 0.00 55.73 54.87 1nd3 s ARG 117 Cb -0.03 -1.67 0.08 0.00 -1.56 0.00 0.00 34.95 31.77 1nd3 s ARG 117 CO 0.02 -0.08 0.83 -0.59 -0.81 0.00 0.00 175.30 174.66 1nd3 s PHE 118 N 1.05 -0.33 0.33 5.12 -0.12 -1.26 -1.26 117.98 121.51 1nd3 s PHE 118 Ca -0.06 0.12 0.02 0.00 -0.05 0.00 0.00 56.93 56.96 1nd3 s PHE 118 Cb -0.15 0.58 -0.03 0.00 -0.63 0.00 0.00 43.02 42.79 1nd3 s PHE 118 CO -0.02 -0.72 0.51 -0.51 -0.05 0.00 0.00 175.22 174.43 1nd3 s ASP 119 N -2.67 6.22 0.08 1.98 1.01 -0.03 -3.77 116.67 119.49 1nd3 s ASP 119 Ca 0.06 0.30 0.09 0.00 0.71 0.00 0.00 52.55 53.71 1nd3 s ASP 119 Cb -0.01 -1.88 -0.03 0.00 1.01 0.00 0.00 42.92 42.01 1nd3 s ASP 119 CO -0.06 -0.30 -0.24 -0.44 0.21 0.00 0.00 175.17 174.33 1nd3 s SER 120 N -4.05 2.94 -0.22 0.27 0.01 0.53 -0.80 113.70 112.37 1nd3 s SER 120 Ca 0.40 -0.64 0.01 0.00 1.31 0.00 0.00 55.95 57.03 1nd3 s SER 120 Cb -0.09 -0.22 0.03 0.00 0.21 0.00 0.00 66.02 65.95 1nd3 s SER 120 CO 0.34 0.18 -0.15 -0.70 0.41 0.00 0.00 173.24 173.31 1nd3 s GLU 121 N -1.59 2.71 -0.18 12.44 2.12 -0.26 -0.22 118.70 133.70 1nd3 s GLU 121 Ca 0.10 -1.03 -0.08 0.00 0.36 0.00 0.00 54.97 54.33 1nd3 s GLU 121 Cb -0.10 -2.73 -0.04 0.00 0.26 0.00 0.00 34.13 31.52 1nd3 s GLU 121 CO 0.04 -0.36 0.08 0.42 -0.54 0.00 0.00 175.26 174.90 1nd3 s ILE 122 N 1.23 4.95 -0.05 -3.70 1.09 -0.12 -2.13 121.20 122.47 1nd3 s ILE 122 Ca -0.00 0.02 0.04 0.00 -1.10 0.00 0.00 60.65 59.61 1nd3 s ILE 122 Cb -0.16 -3.24 -0.00 0.00 -1.06 0.00 0.00 42.46 38.00 1nd3 s ILE 122 CO -0.09 0.46 -0.17 -0.89 -0.10 0.00 0.00 174.94 174.15 1nd3 s THR 123 N 0.33 1.45 -0.11 2.92 2.01 -0.57 -1.67 115.64 120.00 1nd3 s THR 123 Ca 0.04 -0.72 0.01 0.00 0.31 0.00 0.00 61.69 61.34 1nd3 s THR 123 Cb -0.12 -1.25 -0.02 0.00 0.01 0.00 0.00 72.50 71.12 1nd3 s THR 123 CO -0.00 0.42 -0.13 -0.04 -0.69 0.00 0.00 174.62 174.17 1nd3 s MET 124 N 0.12 3.13 -0.51 4.92 -1.94 -0.31 -0.37 119.30 124.35 1nd3 s MET 124 Ca -0.06 -0.69 -0.01 0.00 -1.71 0.00 0.00 55.69 53.23 1nd3 s MET 124 Cb -0.12 -2.56 0.13 0.00 2.01 0.00 0.00 34.83 34.29 1nd3 s MET 124 CO 0.03 0.33 0.29 0.08 -0.01 0.00 0.00 175.02 175.74 1nd3 s VAL 125 N 0.03 3.21 0.11 -6.03 1.01 -0.03 -3.62 120.40 115.09 1nd3 s VAL 125 Ca -0.04 -2.68 -0.18 0.00 0.00 0.00 0.00 61.98 59.07 1nd3 s VAL 125 Cb -0.14 -3.17 -0.07 0.00 0.00 0.00 0.00 36.38 32.99 1nd3 s VAL 125 CO 0.04 -0.77 0.59 -2.84 0.00 0.00 0.00 175.10 172.11 1nd3 s PRO 126 N 0.37 4.15 -0.04 2.72 0.02 -1.26 -1.59 135.00 139.38 1nd3 s PRO 126 Ca 0.14 0.69 -0.01 0.00 0.02 0.00 0.00 61.00 61.83 1nd3 s PRO 126 Cb -0.22 -3.11 0.03 0.00 0.02 0.00 0.00 34.50 31.22 1nd3 s PRO 126 CO -0.04 0.56 0.05 -1.54 -0.33 0.00 0.00 177.00 175.71 1nd3 s SER 127 N -1.35 0.85 -0.36 2.53 1.04 -0.64 -5.00 113.70 110.78 1nd3 s SER 127 Ca 0.33 0.06 -0.15 0.00 0.48 0.00 0.00 55.95 56.68 1nd3 s SER 127 Cb -0.18 -0.13 -0.01 0.00 0.10 0.00 0.00 66.02 65.80 1nd3 s SER 127 CO 0.19 -0.21 0.32 -0.69 0.98 0.00 0.00 173.24 173.83 1nd3 s VAL 128 N 1.84 5.21 -0.17 5.02 1.01 -1.26 -1.91 120.40 130.14 1nd3 s VAL 128 Ca 0.01 -0.17 -0.17 0.00 0.00 0.00 0.00 61.98 61.65 1nd3 s VAL 128 Cb -0.12 -3.82 -0.04 0.00 0.00 0.00 0.00 36.38 32.40 1nd3 s VAL 128 CO -0.03 -0.12 0.45 0.00 0.00 0.00 0.00 175.10 175.40 1nd3 s ALA 129 N 1.89 3.53 -0.65 5.51 0.00 -0.18 -4.94 121.76 126.92 1nd3 s ALA 129 Ca 0.09 -0.39 -0.24 0.00 0.00 0.00 0.00 51.96 51.42 1nd3 s ALA 129 Cb -0.17 -2.68 0.05 0.00 0.00 0.00 0.00 23.12 20.32 1nd3 s ALA 129 CO 0.11 -0.24 1.04 0.00 0.00 0.00 0.00 175.76 176.68 1nd3 s ALA 130 N 1.17 3.03 0.15 0.00 0.00 -1.26 -1.70 121.76 123.16 1nd3 s ALA 130 Ca 0.22 -1.53 0.10 0.00 0.00 0.00 0.00 51.96 50.76 1nd3 s ALA 130 Cb -0.15 -3.93 0.12 0.00 0.00 0.00 0.00 23.12 19.16 1nd3 s ALA 130 CO 0.09 -2.79 1.47 0.87 0.00 0.00 0.00 175.76 175.39 1nd3 h LYS 131 N 9.61 0.00 -0.00 0.00 1.57 -1.80 -3.33 116.57 122.61 1nd3 h LYS 131 Ca -0.28 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.50 1nd3 h LYS 131 Cb 1.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.38 1nd3 h LYS 131 CO 1.18 0.74 -0.21 -0.25 -0.57 0.00 0.00 179.45 180.34 1nd3 n ASP 132 N -3.52 0.77 0.00 0.86 8.00 -1.22 -4.99 116.55 116.44 1nd3 n ASP 132 Ca -0.00 -0.88 0.00 0.00 0.71 0.00 0.00 54.79 54.61 1nd3 n ASP 132 Cb 0.76 0.66 0.00 0.00 -0.02 0.00 0.00 41.12 42.52 1nd3 n ASP 132 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1nd3 n GLY 133 N 0.92 2.43 3.85 0.44 0.00 -1.25 -5.00 105.19 106.58 1nd3 n GLY 133 Ca 0.02 -0.46 -0.21 0.00 0.00 0.00 0.00 46.02 45.37 1nd3 n GLY 133 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1nd3 s HIS 134 N 0.00 2.69 0.00 1.61 3.76 -1.26 -4.83 115.29 117.26 1nd3 s HIS 134 Ca 0.00 -0.51 0.00 0.00 -0.15 0.00 0.00 55.06 54.40 1nd3 s HIS 134 Cb 0.00 -2.14 0.00 0.00 1.11 0.00 0.00 32.58 31.55 1nd3 s HIS 134 CO 0.00 -0.07 0.00 0.44 -0.85 0.00 0.00 174.74 174.26 1nd3 n ILE 135 N -1.50 0.00 -2.88 0.60 -5.35 -1.26 -4.75 119.36 104.21 1nd3 n ILE 135 Ca 0.03 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.51 1nd3 n ILE 135 Cb 0.62 0.04 0.00 0.00 -1.74 0.00 0.00 39.64 38.57 1nd3 n ILE 135 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1nd3 n GLY 136 N 1.17 2.75 3.02 3.28 0.00 -1.26 -4.11 105.19 110.05 1nd3 n GLY 136 Ca 0.00 -0.36 -0.32 0.00 0.00 0.00 0.00 46.02 45.34 1nd3 n GLY 136 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1nd3 s HIS 137 N 0.00 3.56 -0.21 1.61 2.46 -1.26 -5.08 115.29 116.37 1nd3 s HIS 137 Ca 0.00 -2.94 -0.22 0.00 0.47 0.00 0.00 55.06 52.38 1nd3 s HIS 137 Cb 0.00 -2.97 -0.02 0.00 -0.13 0.00 0.00 32.58 29.46 1nd3 s HIS 137 CO 0.00 -0.89 0.69 0.42 -2.47 0.00 0.00 174.74 172.49 1nd3 s ILE 138 N 0.55 4.97 -0.10 0.89 -1.09 -1.26 -4.75 121.20 120.40 1nd3 s ILE 138 Ca 0.13 1.30 0.02 0.00 -2.23 0.00 0.00 60.65 59.87 1nd3 s ILE 138 Cb -0.22 -4.00 0.01 0.00 -1.58 0.00 0.00 42.46 36.68 1nd3 s ILE 138 CO -0.05 0.06 -0.17 -0.69 -1.23 0.00 0.00 174.94 172.86 1nd3 s VAL 139 N 2.17 1.60 0.15 2.92 1.01 -1.26 -1.15 120.40 125.84 1nd3 s VAL 139 Ca 0.31 -0.72 0.06 0.00 0.00 0.00 0.00 61.98 61.63 1nd3 s VAL 139 Cb -0.16 -1.44 -0.04 0.00 0.00 0.00 0.00 36.38 34.74 1nd3 s VAL 139 CO 0.10 0.46 0.02 -0.04 0.00 0.00 0.00 175.10 175.64 1nd3 s MET 140 N 0.81 2.50 -0.09 2.72 -1.94 0.39 0.62 119.30 124.30 1nd3 s MET 140 Ca -0.10 -1.00 0.00 0.00 -1.71 0.00 0.00 55.69 52.88 1nd3 s MET 140 Cb -0.16 -2.44 0.02 0.00 2.01 0.00 0.00 34.83 34.26 1nd3 s MET 140 CO 0.01 0.48 -0.07 -1.14 -0.01 0.00 0.00 175.02 174.29 1nd3 s GLN 141 N -2.79 1.41 -0.20 2.03 0.74 -0.59 -1.39 119.66 118.87 1nd3 s GLN 141 Ca 0.27 -0.23 -0.02 0.00 0.05 0.00 0.00 55.36 55.43 1nd3 s GLN 141 Cb -0.10 -1.43 -0.00 0.00 1.10 0.00 0.00 33.01 32.58 1nd3 s GLN 141 CO 0.19 -0.20 -0.10 0.71 -0.55 0.00 0.00 175.29 175.35 1nd3 s TYR 142 N 1.47 2.89 -0.07 1.67 2.02 -0.39 -1.84 117.35 123.09 1nd3 s TYR 142 Ca -0.00 -1.07 0.04 0.00 -0.37 0.00 0.00 57.07 55.67 1nd3 s TYR 142 Cb -0.13 -2.02 -0.00 0.00 -0.40 0.00 0.00 41.96 39.41 1nd3 s TYR 142 CO -0.05 -0.56 -0.21 1.41 -1.57 0.00 0.00 175.55 174.57 1nd3 s MET 143 N 1.26 2.44 -0.31 -0.62 -2.45 0.15 -0.59 119.30 119.18 1nd3 s MET 143 Ca 0.03 -0.76 -0.20 0.00 -1.25 0.00 0.00 55.69 53.51 1nd3 s MET 143 Cb -0.14 -1.97 -0.01 0.00 1.25 0.00 0.00 34.83 33.96 1nd3 s MET 143 CO -0.04 0.22 0.60 -0.47 1.05 0.00 0.00 175.02 176.38 1nd3 s TYR 144 N 0.19 3.21 -0.47 4.11 6.04 -0.35 -0.83 117.35 129.25 1nd3 s TYR 144 Ca -0.11 0.52 -0.08 0.00 0.04 0.00 0.00 57.07 57.44 1nd3 s TYR 144 Cb -0.15 -2.96 0.12 0.00 -1.04 0.00 0.00 41.96 37.93 1nd3 s TYR 144 CO 0.05 -0.47 0.33 0.08 -1.54 0.00 0.00 175.55 174.00 1nd3 s VAL 145 N 2.55 4.02 0.75 3.14 1.01 0.62 -4.10 120.40 128.39 1nd3 s VAL 145 Ca 0.24 -1.90 -0.15 0.00 0.00 0.00 0.00 61.98 60.18 1nd3 s VAL 145 Cb -0.15 -3.67 0.05 0.00 0.00 0.00 0.00 36.38 32.61 1nd3 s VAL 145 CO 0.12 -0.77 1.20 -2.84 0.00 0.00 0.00 175.10 172.81 1nd3 s PRO 146 N 1.25 2.05 0.07 2.72 0.02 -1.26 -0.74 135.00 139.10 1nd3 s PRO 146 Ca 0.07 1.74 -0.35 0.00 0.02 0.00 0.00 61.00 62.47 1nd3 s PRO 146 Cb -0.25 -1.82 -0.15 0.00 0.02 0.00 0.00 34.50 32.30 1nd3 s PRO 146 CO -0.02 -1.90 1.56 -0.35 -0.33 0.00 0.00 177.00 175.96 1nd3 n PRO 147 N -2.85 1.79 0.00 5.54 -0.04 -1.26 -1.81 135.00 136.36 1nd3 n PRO 147 Ca 0.13 0.65 0.00 0.00 -0.04 0.00 0.00 63.50 64.24 1nd3 n PRO 147 Cb 0.50 -2.38 0.00 0.00 -0.04 0.00 0.00 33.50 31.58 1nd3 n PRO 147 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1nd3 n GLY 148 N 3.34 2.03 3.78 0.55 0.00 -1.26 -5.07 105.19 108.56 1nd3 n GLY 148 Ca 0.19 -0.26 -0.34 0.00 0.00 0.00 0.00 46.02 45.61 1nd3 n GLY 148 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nd3 s ALA 149 N -1.58 2.57 0.17 4.61 0.00 -0.75 -4.96 121.76 121.81 1nd3 s ALA 149 Ca 0.00 0.60 -0.31 0.00 0.00 0.00 0.00 51.96 52.25 1nd3 s ALA 149 Cb 0.00 -3.32 -0.09 0.00 0.00 0.00 0.00 23.12 19.71 1nd3 s ALA 149 CO 0.00 -1.07 1.49 -1.25 0.00 0.00 0.00 175.76 174.93 1nd3 s PRO 150 N -3.86 4.26 -0.19 0.00 0.04 -1.26 -4.92 135.00 129.06 1nd3 s PRO 150 Ca 0.68 2.27 -0.15 0.00 0.04 0.00 0.00 61.00 63.83 1nd3 s PRO 150 Cb -0.21 -3.17 -0.04 0.00 0.04 0.00 0.00 34.50 31.12 1nd3 s PRO 150 CO 0.37 -0.51 0.38 0.42 0.04 0.00 0.00 177.00 177.69 1nd3 s ILE 151 N 0.83 5.22 0.32 0.56 1.01 -1.26 -4.90 121.20 122.98 1nd3 s ILE 151 Ca 0.66 0.67 -0.29 0.00 0.00 0.00 0.00 60.65 61.69 1nd3 s ILE 151 Cb -0.41 -3.71 -0.11 0.00 0.01 0.00 0.00 42.46 38.24 1nd3 s ILE 151 CO 0.34 0.28 1.49 -2.16 0.00 0.00 0.00 174.94 174.89 1nd3 s PRO 152 N 1.14 4.17 0.00 2.79 0.04 -1.26 -4.93 135.00 136.96 1nd3 s PRO 152 Ca 0.18 2.48 0.08 0.00 0.04 0.00 0.00 61.00 63.78 1nd3 s PRO 152 Cb -0.14 -3.02 0.10 0.00 0.04 0.00 0.00 34.50 31.47 1nd3 s PRO 152 CO 0.07 -0.50 0.85 0.25 0.04 0.00 0.00 177.00 177.71 1nd3 n THR 153 N 1.37 0.24 -3.85 1.26 -2.24 -1.26 -5.02 114.28 104.78 1nd3 n THR 153 Ca 0.04 -0.62 -0.10 0.00 -2.27 0.00 0.00 64.05 61.10 1nd3 n THR 153 Cb 0.39 1.00 -0.06 0.00 -2.10 0.00 0.00 70.33 69.56 1nd3 n THR 153 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1nd3 s THR 154 N -0.73 0.07 -0.89 4.28 -4.23 -1.26 -5.02 115.64 107.86 1nd3 s THR 154 Ca 0.11 -1.12 0.17 0.00 -1.18 0.00 0.00 61.69 59.67 1nd3 s THR 154 Cb 0.07 -1.63 0.15 0.00 1.34 0.00 0.00 72.50 72.42 1nd3 s THR 154 CO 0.10 -0.30 1.52 -2.11 -0.54 0.00 0.00 174.62 173.29 1nd3 n ARG 155 N -0.23 0.04 -0.14 3.99 1.85 -1.26 -2.55 116.66 118.36 1nd3 n ARG 155 Ca -0.10 0.28 0.08 0.00 -1.00 0.00 0.00 57.85 57.12 1nd3 n ARG 155 Cb 0.63 -1.58 0.15 0.00 -1.05 0.00 0.00 32.46 30.61 1nd3 n ARG 155 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 1nd3 n ASP 156 N -1.66 2.64 -4.62 2.89 8.00 -1.26 -5.02 116.55 117.52 1nd3 n ASP 156 Ca 0.03 -2.91 -0.40 0.00 0.71 0.00 0.00 54.79 52.23 1nd3 n ASP 156 Cb 0.19 -0.39 0.03 0.00 -0.02 0.00 0.00 41.12 40.92 1nd3 n ASP 156 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1nd3 n ASP 157 N -1.07 1.17 0.28 -2.24 -0.08 -1.06 -4.86 116.55 108.70 1nd3 n ASP 157 Ca 0.15 0.93 0.15 0.00 -1.51 0.00 0.00 54.79 54.51 1nd3 n ASP 157 Cb 0.64 -1.39 0.84 0.00 2.34 0.00 0.00 41.12 43.55 1nd3 n ASP 157 CO 0.00 0.00 0.00 0.10 0.12 0.00 0.00 177.20 177.42 1nd3 h TYR 158 N 1.12 0.00 -0.00 -0.67 -0.00 -1.97 -2.40 116.97 113.05 1nd3 h TYR 158 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.26 1nd3 h TYR 158 Cb 1.34 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 38.07 1nd3 h TYR 158 CO 0.41 0.06 0.01 0.00 -0.00 0.00 0.00 178.16 178.64 1nd3 h ALA 159 N 1.94 1.20 0.00 0.10 0.00 -1.90 -1.08 119.26 119.52 1nd3 h ALA 159 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1nd3 h ALA 159 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1nd3 h ALA 159 CO 0.01 -0.01 0.00 0.91 0.00 0.00 0.00 179.25 180.16 1nd3 n TRP 160 N -3.35 0.23 0.26 0.00 7.02 -0.91 -2.44 117.44 118.26 1nd3 n TRP 160 Ca -0.03 0.09 0.09 0.00 -1.02 0.00 0.00 57.50 56.62 1nd3 n TRP 160 Cb 0.08 -0.64 0.66 0.00 -2.42 0.00 0.00 31.31 28.99 1nd3 n TRP 160 CO 0.00 0.00 0.00 1.96 -2.02 0.00 0.00 177.69 177.63 1nd3 h GLN 161 N 0.00 0.00 -6.08 -0.99 4.20 -1.41 -3.46 115.11 107.38 1nd3 h GLN 161 Ca 0.00 0.00 -0.43 0.00 0.06 0.00 0.00 58.65 58.28 1nd3 h GLN 161 Cb 0.31 0.00 0.05 0.00 0.30 0.00 0.00 27.48 28.14 1nd3 h GLN 161 CO 0.00 0.00 -0.77 0.45 -0.67 0.00 0.00 178.83 177.84 1nd3 n SER 162 N -4.48 -3.56 0.22 1.46 2.88 -1.02 -4.87 113.62 104.25 1nd3 n SER 162 Ca -0.03 -0.73 0.14 0.00 -1.33 0.00 0.00 58.87 56.92 1nd3 n SER 162 Cb 0.09 -4.29 0.77 0.00 -0.75 0.00 0.00 64.21 60.03 1nd3 n SER 162 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 1nd3 h GLY 163 N -2.11 0.00 0.00 0.46 0.00 -1.89 -3.34 103.07 96.19 1nd3 h GLY 163 Ca -0.59 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.74 1nd3 h GLY 163 CO 0.60 0.00 -0.31 2.41 0.00 0.00 0.00 176.54 179.23 1nd3 n THR 164 N -4.13 0.00 -1.19 4.70 -1.04 -1.26 -5.09 114.28 106.27 1nd3 n THR 164 Ca 0.00 0.00 -0.31 0.00 -2.04 0.00 0.00 64.05 61.70 1nd3 n THR 164 Cb 0.23 -0.29 0.11 0.00 -1.82 0.00 0.00 70.33 68.56 1nd3 n THR 164 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 1nd3 s ASN 165 N -1.58 4.01 -0.13 8.00 0.02 -1.25 -5.00 114.94 119.01 1nd3 s ASN 165 Ca 0.00 1.74 -0.19 0.00 -1.02 0.00 0.00 52.86 53.39 1nd3 s ASN 165 Cb 0.00 -2.41 -0.04 0.00 0.02 0.00 0.00 41.25 38.82 1nd3 s ASN 165 CO 0.00 -2.34 0.52 0.00 0.02 0.00 0.00 177.10 175.30 1nd3 s ALA 166 N -2.89 3.47 0.06 0.60 0.00 -1.26 -4.88 121.76 116.87 1nd3 s ALA 166 Ca 0.62 -0.18 0.06 0.00 0.00 0.00 0.00 51.96 52.46 1nd3 s ALA 166 Cb -0.18 -2.73 -0.03 0.00 0.00 0.00 0.00 23.12 20.19 1nd3 s ALA 166 CO 0.57 -0.11 -0.17 -1.12 0.00 0.00 0.00 175.76 174.92 1nd3 s SER 167 N 0.76 2.07 -0.13 0.00 0.01 -1.26 -1.21 113.70 113.94 1nd3 s SER 167 Ca 0.27 -0.55 0.02 0.00 1.31 0.00 0.00 55.95 57.00 1nd3 s SER 167 Cb -0.16 -0.13 0.01 0.00 0.21 0.00 0.00 66.02 65.96 1nd3 s SER 167 CO 0.11 0.05 -0.19 -0.69 0.41 0.00 0.00 173.24 172.93 1nd3 s VAL 168 N -0.98 1.82 -0.17 3.43 1.01 0.25 -4.97 120.40 120.79 1nd3 s VAL 168 Ca 0.04 -0.83 -0.07 0.00 0.00 0.00 0.00 61.98 61.12 1nd3 s VAL 168 Cb -0.09 -1.63 -0.04 0.00 0.00 0.00 0.00 36.38 34.62 1nd3 s VAL 168 CO 0.02 0.50 0.05 -0.36 0.00 0.00 0.00 175.10 175.32 1nd3 s PHE 169 N 0.90 3.24 -0.02 5.22 0.40 -1.26 -1.26 117.98 125.20 1nd3 s PHE 169 Ca -0.07 0.07 0.07 0.00 -0.60 0.00 0.00 56.93 56.40 1nd3 s PHE 169 Cb -0.15 -2.03 -0.02 0.00 0.51 0.00 0.00 43.02 41.33 1nd3 s PHE 169 CO -0.02 0.20 -0.23 -0.46 0.70 0.00 0.00 175.22 175.41 1nd3 s TRP 170 N 0.18 2.04 -0.13 0.36 -0.00 -0.49 -4.98 118.94 115.93 1nd3 s TRP 170 Ca 0.04 -0.41 -0.00 0.00 -0.00 0.00 0.00 56.10 55.73 1nd3 s TRP 170 Cb -0.12 -1.32 -0.02 0.00 -0.00 0.00 0.00 33.47 32.01 1nd3 s TRP 170 CO 0.01 -0.05 -0.12 -1.14 -0.00 0.00 0.00 176.95 175.64 1nd3 s GLN 171 N -0.49 3.40 0.20 5.86 0.74 -1.26 -0.47 119.66 127.64 1nd3 s GLN 171 Ca 0.08 -0.68 -0.33 0.00 0.05 0.00 0.00 55.36 54.48 1nd3 s GLN 171 Cb -0.09 -2.65 -0.13 0.00 1.10 0.00 0.00 33.01 31.23 1nd3 s GLN 171 CO -0.01 0.21 1.52 1.58 -0.55 0.00 0.00 175.29 178.05 1nd3 n HIS 172 N 3.53 2.30 0.00 1.67 -0.00 -0.30 -1.54 115.22 120.88 1nd3 n HIS 172 Ca -0.18 0.32 0.00 0.00 -0.00 0.00 0.00 57.72 57.86 1nd3 n HIS 172 Cb 0.53 -2.52 0.00 0.00 -0.00 0.00 0.00 29.99 27.99 1nd3 n HIS 172 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1nd3 n GLY 173 N 2.91 2.51 3.95 1.57 0.00 -1.26 -4.92 105.19 109.94 1nd3 n GLY 173 Ca 0.14 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.93 1nd3 n GLY 173 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1nd3 s GLN 174 N -0.79 3.11 0.92 1.61 -1.52 -0.59 -5.07 119.66 117.34 1nd3 s GLN 174 Ca 0.00 -0.44 -0.11 0.00 -1.95 0.00 0.00 55.36 52.85 1nd3 s GLN 174 Cb 0.00 -2.56 0.09 0.00 -0.22 0.00 0.00 33.01 30.33 1nd3 s GLN 174 CO 0.00 -0.24 0.81 -2.30 -0.25 0.00 0.00 175.29 173.30 1nd3 n PRO 175 N -2.07 -0.35 -1.86 2.91 -0.02 -1.26 -4.90 135.00 127.45 1nd3 n PRO 175 Ca 0.01 -0.04 -0.42 0.00 -2.02 0.00 0.00 63.50 61.03 1nd3 n PRO 175 Cb 0.57 -2.14 -0.02 0.00 -0.02 0.00 0.00 33.50 31.90 1nd3 n PRO 175 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 1nd3 s PHE 176 N -2.49 2.90 0.56 6.00 0.08 -1.26 -4.95 117.98 118.82 1nd3 s PHE 176 Ca 0.63 0.74 -0.19 0.00 0.12 0.00 0.00 56.93 58.23 1nd3 s PHE 176 Cb -0.23 -3.99 -0.05 0.00 -0.57 0.00 0.00 43.02 38.18 1nd3 s PHE 176 CO 0.62 -3.45 1.16 -1.25 -0.10 0.00 0.00 175.22 172.19 1nd3 s PRO 177 N 0.11 3.20 -0.11 0.24 0.04 -1.24 -4.84 135.00 132.41 1nd3 s PRO 177 Ca 0.65 1.68 -0.26 0.00 0.04 0.00 0.00 61.00 63.12 1nd3 s PRO 177 Cb -0.46 -1.98 0.06 0.00 0.04 0.00 0.00 34.50 32.17 1nd3 s PRO 177 CO 0.41 -0.98 0.62 0.50 0.04 0.00 0.00 177.00 177.59 1nd3 s ARG 178 N -3.32 0.91 0.18 4.56 3.52 -1.26 -1.16 118.95 122.37 1nd3 s ARG 178 Ca 0.74 0.42 -0.23 0.00 -0.13 0.00 0.00 55.73 56.53 1nd3 s ARG 178 Cb -0.26 0.43 0.06 0.00 -1.56 0.00 0.00 34.95 33.62 1nd3 s ARG 178 CO 0.29 -0.23 0.70 -0.59 -0.81 0.00 0.00 175.30 174.66 1nd3 s PHE 179 N -0.69 -0.38 0.15 5.12 -0.12 -0.67 -5.01 117.98 116.38 1nd3 s PHE 179 Ca -0.08 0.09 0.05 0.00 -0.05 0.00 0.00 56.93 56.95 1nd3 s PHE 179 Cb -0.02 0.61 -0.04 0.00 -0.63 0.00 0.00 43.02 42.94 1nd3 s PHE 179 CO 0.06 -0.94 0.08 -1.12 -0.05 0.00 0.00 175.22 173.26 1nd3 s SER 180 N -2.79 5.28 -0.02 1.98 0.01 -1.26 -0.95 113.70 115.96 1nd3 s SER 180 Ca 0.05 -0.19 0.03 0.00 1.31 0.00 0.00 55.95 57.15 1nd3 s SER 180 Cb -0.03 -1.31 -0.00 0.00 0.21 0.00 0.00 66.02 64.89 1nd3 s SER 180 CO -0.05 0.09 -0.09 -0.76 0.41 0.00 0.00 173.24 172.84 1nd3 s LEU 181 N -2.91 1.86 0.71 2.44 1.43 0.69 -4.97 118.68 117.92 1nd3 s LEU 181 Ca 0.29 -0.19 -0.10 0.00 -1.03 0.00 0.00 54.13 53.11 1nd3 s LEU 181 Cb -0.10 -0.54 0.03 0.00 0.03 0.00 0.00 46.19 45.61 1nd3 s LEU 181 CO 0.22 0.08 1.07 -2.16 0.23 0.00 0.00 176.35 175.79 1nd3 s PRO 182 N 0.06 2.59 -0.13 1.29 0.04 -1.26 -0.35 135.00 137.24 1nd3 s PRO 182 Ca -0.01 0.21 -0.35 0.00 0.04 0.00 0.00 61.00 60.88 1nd3 s PRO 182 Cb -0.07 -2.07 -0.12 0.00 0.04 0.00 0.00 34.50 32.27 1nd3 s PRO 182 CO 0.00 -1.12 1.87 0.34 0.04 0.00 0.00 177.00 178.13 1nd3 n PHE 183 N -2.98 2.27 1.02 0.56 7.35 -1.25 -4.70 117.46 119.74 1nd3 n PHE 183 Ca 0.07 0.09 0.11 0.00 -0.76 0.00 0.00 57.45 56.96 1nd3 n PHE 183 Cb 0.58 -2.63 0.04 0.00 0.35 0.00 0.00 39.48 37.83 1nd3 n PHE 183 CO 0.00 0.00 0.00 1.28 -0.76 0.00 0.00 176.76 177.28 1nd3 n LEU 184 N 6.51 1.00 -4.73 -2.13 4.77 -1.26 -5.02 117.00 116.14 1nd3 n LEU 184 Ca 0.24 -0.37 -0.32 0.00 -0.03 0.00 0.00 56.01 55.52 1nd3 n LEU 184 Cb 0.26 -0.08 0.11 0.00 -2.33 0.00 0.00 43.42 41.38 1nd3 n LEU 184 CO 0.75 0.23 0.73 -0.55 -1.33 0.00 0.00 177.39 177.21 1nd3 s SER 185 N -2.89 4.00 0.00 -1.43 0.15 -1.26 -4.91 113.70 107.36 1nd3 s SER 185 Ca 0.12 2.11 0.27 0.00 0.70 0.00 0.00 55.95 59.14 1nd3 s SER 185 Cb 0.17 -2.56 0.91 0.00 -1.71 0.00 0.00 66.02 62.83 1nd3 s SER 185 CO 0.75 -2.38 1.66 2.30 1.20 0.00 0.00 173.24 176.77 1nd3 n ILE 186 N -3.38 0.00 -3.73 6.45 -5.35 -1.26 -4.86 119.36 107.23 1nd3 n ILE 186 Ca 0.11 -0.19 -0.16 0.00 -0.27 0.00 0.00 62.75 62.24 1nd3 n ILE 186 Cb 0.52 0.44 0.00 0.00 -1.74 0.00 0.00 39.64 38.86 1nd3 n ILE 186 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1nd3 n ALA 187 N -0.24 0.54 0.50 -1.28 0.00 -1.26 -5.04 120.51 113.73 1nd3 n ALA 187 Ca 0.16 -1.40 0.13 0.00 0.00 0.00 0.00 53.44 52.33 1nd3 n ALA 187 Cb 0.35 0.57 0.31 0.00 0.00 0.00 0.00 19.45 20.69 1nd3 n ALA 187 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1nd3 h SER 188 N 0.41 0.00 -5.08 0.00 0.02 -2.00 -3.47 113.55 103.43 1nd3 h SER 188 Ca -0.22 -0.02 -0.05 0.00 -0.84 0.00 0.00 61.79 60.66 1nd3 h SER 188 Cb 0.81 0.00 -0.13 0.00 0.14 0.00 0.00 62.40 63.22 1nd3 h SER 188 CO 0.34 0.01 -0.05 0.00 -1.14 0.00 0.00 176.83 175.99 1nd3 s ALA 189 N -3.14 -0.93 0.36 3.77 0.00 -1.26 -4.82 121.76 115.73 1nd3 s ALA 189 Ca 0.09 -0.07 -0.24 0.00 0.00 0.00 0.00 51.96 51.73 1nd3 s ALA 189 Cb 0.10 0.73 -0.10 0.00 0.00 0.00 0.00 23.12 23.85 1nd3 s ALA 189 CO 0.63 -0.67 0.94 0.71 0.00 0.00 0.00 175.76 177.37 1nd3 s TYR 190 N -3.82 3.56 -0.23 0.00 2.02 0.56 -4.88 117.35 114.56 1nd3 s TYR 190 Ca 0.04 1.71 -0.18 0.00 -0.37 0.00 0.00 57.07 58.27 1nd3 s TYR 190 Cb 0.01 -2.89 -0.03 0.00 -0.40 0.00 0.00 41.96 38.65 1nd3 s TYR 190 CO -0.11 0.10 0.53 0.71 -1.57 0.00 0.00 175.55 175.21 1nd3 s TYR 191 N -1.81 3.32 -0.10 2.71 1.51 -1.26 -2.48 117.35 119.24 1nd3 s TYR 191 Ca 0.54 0.71 0.14 0.00 -1.01 0.00 0.00 57.07 57.46 1nd3 s TYR 191 Cb -0.15 -2.71 -0.08 0.00 -0.11 0.00 0.00 41.96 38.91 1nd3 s TYR 191 CO 0.20 -0.20 1.10 0.52 -1.11 0.00 0.00 175.55 176.06 1nd3 h MET 192 N 7.75 0.00 -3.76 -0.62 2.86 -1.25 -3.46 114.93 116.45 1nd3 h MET 192 Ca -0.31 0.00 -0.16 0.00 -2.06 0.00 0.00 59.70 57.17 1nd3 h MET 192 Cb 1.15 0.00 -0.21 0.00 0.06 0.00 0.00 31.60 32.60 1nd3 h MET 192 CO 0.73 0.48 -0.60 -0.06 1.06 0.00 0.00 176.91 178.52 1nd3 s PHE 193 N -2.88 0.16 -0.25 -0.22 0.40 -1.23 -4.95 117.98 109.01 1nd3 s PHE 193 Ca 0.00 -0.35 -0.02 0.00 -0.60 0.00 0.00 56.93 55.96 1nd3 s PHE 193 Cb 0.08 -0.12 0.13 0.00 0.51 0.00 0.00 43.02 43.62 1nd3 s PHE 193 CO 0.79 -0.24 0.33 -0.47 0.70 0.00 0.00 175.22 176.33 1nd3 s TYR 194 N -1.45 -0.66 -1.42 0.36 6.14 -1.26 -4.94 117.35 114.11 1nd3 s TYR 194 Ca -0.15 0.46 -0.08 0.00 0.64 0.00 0.00 57.07 57.94 1nd3 s TYR 194 Cb -0.09 -0.17 0.05 0.00 0.42 0.00 0.00 41.96 42.18 1nd3 s TYR 194 CO 0.00 -0.76 2.49 -3.47 0.64 0.00 0.00 175.55 174.45 1nd3 n ASP 195 N 5.34 7.61 -3.64 4.32 4.64 -1.26 -3.61 116.55 129.95 1nd3 n ASP 195 Ca -0.03 -2.94 -0.11 0.00 -1.38 0.00 0.00 54.79 50.33 1nd3 n ASP 195 Cb 0.49 -1.46 -0.04 0.00 -1.04 0.00 0.00 41.12 39.07 1nd3 n ASP 195 CO 0.00 0.00 0.00 -0.83 -0.82 0.00 0.00 177.20 175.55 1nd3 s GLY 196 N 1.20 0.89 0.34 0.27 0.00 -1.26 -5.02 107.32 103.74 1nd3 s GLY 196 Ca 0.57 -1.12 0.04 0.00 0.00 0.00 0.00 44.72 44.21 1nd3 s GLY 196 CO -0.07 -0.76 0.05 -0.19 0.00 0.00 0.00 173.10 172.13 1nd3 s TYR 197 N -3.52 2.05 -0.27 1.90 2.02 -1.26 -1.98 117.35 116.29 1nd3 s TYR 197 Ca 0.25 -0.92 0.13 0.00 -0.37 0.00 0.00 57.07 56.16 1nd3 s TYR 197 Cb -0.01 -1.37 0.78 0.00 -0.40 0.00 0.00 41.96 40.97 1nd3 s TYR 197 CO 0.13 0.08 1.76 -0.40 -1.57 0.00 0.00 175.55 175.54 1nd3 n ASP 198 N -0.76 5.34 0.00 2.29 5.68 -1.03 -4.97 116.55 123.10 1nd3 n ASP 198 Ca -0.03 -3.05 0.00 0.00 -0.50 0.00 0.00 54.79 51.21 1nd3 n ASP 198 Cb 0.67 -0.70 0.00 0.00 -1.14 0.00 0.00 41.12 39.95 1nd3 n ASP 198 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1nd3 n GLY 199 N 0.29 -1.24 1.34 6.12 0.00 -1.26 -4.90 105.19 105.54 1nd3 n GLY 199 Ca 0.32 -0.85 -0.00 0.00 0.00 0.00 0.00 46.02 45.48 1nd3 n GLY 199 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1nd3 n ASP 200 N 0.14 2.05 -4.57 1.61 5.68 -1.26 -4.92 116.55 115.28 1nd3 n ASP 200 Ca 0.00 -3.14 -0.26 0.00 -0.50 0.00 0.00 54.79 50.89 1nd3 n ASP 200 Cb 0.00 -0.43 -0.11 0.00 -1.14 0.00 0.00 41.12 39.44 1nd3 n ASP 200 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 1nd3 s THR 201 N -2.62 1.84 -0.54 2.12 -4.23 -1.26 -5.01 115.64 105.93 1nd3 s THR 201 Ca 0.38 -2.03 0.15 0.00 -1.18 0.00 0.00 61.69 59.02 1nd3 s THR 201 Cb 0.38 -2.90 0.15 0.00 1.34 0.00 0.00 72.50 71.47 1nd3 s THR 201 CO -0.08 -0.03 1.47 0.00 -0.54 0.00 0.00 174.62 175.44 1nd3 n TYR 202 N -0.88 0.48 -0.10 3.99 0.18 -1.26 -1.68 117.16 117.89 1nd3 n TYR 202 Ca -0.04 0.23 0.08 0.00 1.88 0.00 0.00 57.90 60.05 1nd3 n TYR 202 Cb 0.66 -0.87 0.20 0.00 -0.38 0.00 0.00 39.34 38.95 1nd3 n TYR 202 CO 0.00 0.00 0.00 0.36 -2.08 0.00 0.00 176.86 175.14 1nd3 n LYS 203 N -1.98 2.56 -2.54 -3.48 2.85 -1.26 -4.99 118.16 109.32 1nd3 n LYS 203 Ca -0.00 -2.19 -0.36 0.00 -1.05 0.00 0.00 58.31 54.71 1nd3 n LYS 203 Cb 0.07 -1.39 -0.04 0.00 -0.65 0.00 0.00 35.03 33.02 1nd3 n LYS 203 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 177.40 176.23 1nd3 s SER 204 N -1.06 6.66 0.43 -5.58 0.01 -0.68 -5.03 113.70 108.45 1nd3 s SER 204 Ca 0.32 2.01 -0.21 0.00 1.31 0.00 0.00 55.95 59.38 1nd3 s SER 204 Cb 0.17 -2.58 -0.11 0.00 0.21 0.00 0.00 66.02 63.72 1nd3 s SER 204 CO 0.23 -0.56 0.96 -0.13 0.41 0.00 0.00 173.24 174.14 1nd3 s ARG 205 N -2.68 4.20 0.08 12.44 0.52 -1.26 -4.88 118.95 127.38 1nd3 s ARG 205 Ca 0.60 1.14 0.10 0.00 -0.52 0.00 0.00 55.73 57.05 1nd3 s ARG 205 Cb -0.21 -2.18 -0.03 0.00 0.52 0.00 0.00 34.95 33.05 1nd3 s ARG 205 CO 0.26 -0.06 -0.26 -0.47 0.02 0.00 0.00 175.30 174.79 1nd3 s TYR 206 N -2.16 2.22 0.00 -0.53 5.04 -1.26 -2.48 117.35 118.18 1nd3 s TYR 206 Ca 0.62 -0.40 0.00 0.00 -2.44 0.00 0.00 57.07 54.86 1nd3 s TYR 206 Cb -0.10 -1.26 0.00 0.00 0.35 0.00 0.00 41.96 40.95 1nd3 s TYR 206 CO 0.14 0.22 0.00 0.41 -1.34 0.00 0.00 175.55 174.97 1nd3 n GLY 207 N 1.37 -2.49 0.17 8.97 0.00 -0.84 -4.52 105.19 107.85 1nd3 n GLY 207 Ca -0.18 -1.89 0.12 0.00 0.00 0.00 0.00 46.02 44.07 1nd3 n GLY 207 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1nd3 h THR 208 N 0.00 0.00 0.00 2.61 1.35 -1.75 -1.64 112.91 113.48 1nd3 h THR 208 Ca 0.00 -0.01 -0.02 0.00 -0.55 0.00 0.00 66.41 65.83 1nd3 h THR 208 Cb 0.00 0.53 -0.00 0.00 -1.73 0.00 0.00 68.15 66.94 1nd3 h THR 208 CO 0.00 0.00 -0.10 1.62 -0.25 0.00 0.00 175.52 176.79 1nd3 h VAL 209 N 0.00 0.54 -0.04 6.82 3.04 -1.79 0.24 116.25 125.06 1nd3 h VAL 209 Ca 0.00 -0.48 -0.15 0.00 -1.01 0.00 0.00 66.70 65.06 1nd3 h VAL 209 Cb 0.02 1.31 -0.01 0.00 -2.01 0.00 0.00 31.29 30.59 1nd3 h VAL 209 CO 0.00 0.10 -0.65 0.58 -1.01 0.00 0.00 177.57 176.59 1nd3 h VAL 210 N 0.00 1.42 0.00 1.51 2.07 -1.59 -3.37 116.25 116.29 1nd3 h VAL 210 Ca -0.00 -2.12 0.00 0.00 0.82 0.00 0.00 66.70 65.40 1nd3 h VAL 210 Cb 0.30 2.11 0.00 0.00 -1.52 0.00 0.00 31.29 32.18 1nd3 h VAL 210 CO 0.01 0.62 -1.11 0.35 0.02 0.00 0.00 177.57 177.46 1nd3 n THR 211 N -3.82 0.00 -1.44 2.57 -2.24 -0.75 -4.78 114.28 103.82 1nd3 n THR 211 Ca -0.02 -0.24 -0.34 0.00 -2.27 0.00 0.00 64.05 61.18 1nd3 n THR 211 Cb 0.65 0.51 0.07 0.00 -2.10 0.00 0.00 70.33 69.46 1nd3 n THR 211 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1nd3 n ASN 212 N -1.63 7.42 -4.64 3.42 4.13 0.77 -4.96 115.26 119.76 1nd3 n ASN 212 Ca -0.01 -3.79 -0.43 0.00 1.68 0.00 0.00 54.58 52.04 1nd3 n ASN 212 Cb 0.21 -0.92 -0.02 0.00 -1.54 0.00 0.00 39.78 37.51 1nd3 n ASN 212 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1nd3 s ASP 213 N -1.96 6.81 0.00 6.41 3.68 -1.26 -4.86 116.67 125.48 1nd3 s ASP 213 Ca 0.63 1.35 0.12 0.00 2.13 0.00 0.00 52.55 56.78 1nd3 s ASP 213 Cb 0.49 -2.54 0.04 0.00 -1.45 0.00 0.00 42.92 39.47 1nd3 s ASP 213 CO -0.03 -0.93 0.79 0.80 0.13 0.00 0.00 175.17 175.92 1nd3 n MET 214 N 6.98 1.44 0.00 4.34 1.56 -1.26 -4.96 117.12 125.22 1nd3 n MET 214 Ca 0.14 -0.92 0.00 0.00 -0.27 0.00 0.00 57.70 56.65 1nd3 n MET 214 Cb 0.46 -1.19 0.00 0.00 2.15 0.00 0.00 33.22 34.64 1nd3 n MET 214 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1nd3 n GLY 215 N 0.86 -1.77 3.32 -5.12 0.00 -1.26 -4.67 105.19 96.55 1nd3 n GLY 215 Ca 0.06 -1.95 -0.27 0.00 0.00 0.00 0.00 46.02 43.86 1nd3 n GLY 215 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1nd3 s THR 216 N 0.00 1.96 -0.33 2.61 2.01 0.08 -2.08 115.64 119.88 1nd3 s THR 216 Ca 0.00 -1.53 -0.07 0.00 0.31 0.00 0.00 61.69 60.40 1nd3 s THR 216 Cb 0.00 -1.73 0.03 0.00 0.01 0.00 0.00 72.50 70.81 1nd3 s THR 216 CO 0.00 0.11 0.12 -0.22 -0.69 0.00 0.00 174.62 173.93 1nd3 s LEU 217 N -1.71 4.26 -0.16 4.42 2.96 0.37 -0.28 118.68 128.55 1nd3 s LEU 217 Ca 0.10 -1.00 -0.06 0.00 -0.22 0.00 0.00 54.13 52.95 1nd3 s LEU 217 Cb -0.10 -1.90 -0.04 0.00 0.50 0.00 0.00 46.19 44.66 1nd3 s LEU 217 CO 0.04 -0.30 0.05 0.00 -1.32 0.00 0.00 176.35 174.82 1nd3 s SER 219 N -0.01 0.93 0.14 0.00 1.04 -0.80 0.30 113.70 115.30 1nd3 s SER 219 Ca 0.05 -0.87 -0.22 0.00 0.48 0.00 0.00 55.95 55.40 1nd3 s SER 219 Cb -0.12 0.10 0.06 0.00 0.10 0.00 0.00 66.02 66.15 1nd3 s SER 219 CO 0.01 -0.41 0.55 0.00 0.98 0.00 0.00 173.24 174.37 1nd3 s ARG 220 N -3.17 1.20 -0.29 4.02 1.70 -0.76 -1.36 118.95 120.29 1nd3 s ARG 220 Ca 0.04 -0.48 -0.24 0.00 -0.47 0.00 0.00 55.73 54.58 1nd3 s ARG 220 Cb 0.01 0.55 -0.00 0.00 -0.57 0.00 0.00 34.95 34.94 1nd3 s ARG 220 CO -0.04 -0.51 0.80 0.42 -1.08 0.00 0.00 175.30 174.90 1nd3 s ILE 221 N -3.58 4.80 0.17 4.99 1.01 -0.38 -1.55 121.20 126.66 1nd3 s ILE 221 Ca 0.01 1.31 -0.09 0.00 0.00 0.00 0.00 60.65 61.87 1nd3 s ILE 221 Cb -0.00 -4.14 0.01 0.00 0.01 0.00 0.00 42.46 38.34 1nd3 s ILE 221 CO -0.11 -0.20 1.57 0.58 0.00 0.00 0.00 174.94 176.78 1nd3 h VAL 222 N 5.55 1.27 -3.18 2.92 2.07 -0.14 -3.44 116.25 121.30 1nd3 h VAL 222 Ca -0.24 -1.36 -0.57 0.00 0.82 0.00 0.00 66.70 65.34 1nd3 h VAL 222 Cb 1.10 1.10 0.11 0.00 -1.52 0.00 0.00 31.29 32.08 1nd3 h VAL 222 CO 0.88 0.47 0.42 0.41 0.02 0.00 0.00 177.57 179.77 1nd3 n THR 223 N -4.11 2.08 -1.80 2.57 -1.04 -1.21 -4.97 114.28 105.80 1nd3 n THR 223 Ca 0.00 -0.50 -0.29 0.00 -2.04 0.00 0.00 64.05 61.22 1nd3 n THR 223 Cb 0.45 -1.45 0.12 0.00 -1.82 0.00 0.00 70.33 67.63 1nd3 n THR 223 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 1nd3 s SER 224 N -0.40 3.93 0.11 8.00 1.04 -1.26 -4.94 113.70 120.18 1nd3 s SER 224 Ca 0.57 0.73 -0.36 0.00 0.48 0.00 0.00 55.95 57.37 1nd3 s SER 224 Cb -0.58 -1.16 -0.17 0.00 0.10 0.00 0.00 66.02 64.21 1nd3 s SER 224 CO 0.61 -2.27 1.23 1.21 0.98 0.00 0.00 173.24 175.01 1nd3 n GLU 225 N -3.54 1.01 -4.38 4.02 2.13 -1.26 -5.00 120.64 113.62 1nd3 n GLU 225 Ca 0.09 0.36 -0.25 0.00 0.66 0.00 0.00 57.16 58.02 1nd3 n GLU 225 Cb 0.60 -1.93 -0.09 0.00 0.27 0.00 0.00 31.44 30.29 1nd3 n GLU 225 CO 0.00 0.00 0.00 -0.65 -0.41 0.00 0.00 177.13 176.07 1nd3 s GLN 226 N 0.11 1.89 0.14 5.31 -0.21 -1.26 -5.05 119.66 120.59 1nd3 s GLN 226 Ca 0.81 -1.52 -0.19 0.00 0.02 0.00 0.00 55.36 54.48 1nd3 s GLN 226 Cb -0.95 -1.97 0.00 0.00 1.00 0.00 0.00 33.01 31.09 1nd3 s GLN 226 CO 0.50 0.38 1.71 1.25 -2.12 0.00 0.00 175.29 177.01 1nd3 h LEU 227 N 2.49 -0.11 -9.39 2.90 5.85 -1.99 -3.41 115.31 111.66 1nd3 h LEU 227 Ca -0.44 0.06 -0.56 0.00 0.84 0.00 0.00 57.88 57.78 1nd3 h LEU 227 Cb 1.24 0.10 -0.05 0.00 0.37 0.00 0.00 40.66 42.31 1nd3 h LEU 227 CO 0.56 -0.02 0.06 -1.00 -0.34 0.00 0.00 178.44 177.71 1nd3 s HIS 228 N -6.19 3.59 0.35 1.25 3.76 -1.26 -5.05 115.29 111.74 1nd3 s HIS 228 Ca -0.13 1.23 -0.25 0.00 -0.15 0.00 0.00 55.06 55.76 1nd3 s HIS 228 Cb 0.11 -2.77 -0.10 0.00 1.11 0.00 0.00 32.58 30.93 1nd3 s HIS 228 CO 0.69 0.13 0.97 0.15 -0.85 0.00 0.00 174.74 175.83 1nd3 s LYS 229 N 0.62 4.47 0.21 1.40 1.02 -1.26 -4.91 119.74 121.30 1nd3 s LYS 229 Ca 0.36 1.35 0.05 0.00 0.02 0.00 0.00 55.97 57.74 1nd3 s LYS 229 Cb -0.18 -2.70 -0.05 0.00 -0.52 0.00 0.00 37.83 34.39 1nd3 s LYS 229 CO 0.18 0.17 -0.05 0.14 -0.92 0.00 0.00 175.35 174.87 1nd3 s VAL 230 N -1.67 1.21 -0.23 3.17 -7.23 -1.26 -2.59 120.40 111.80 1nd3 s VAL 230 Ca 0.53 -2.07 0.00 0.00 -1.81 0.00 0.00 61.98 58.63 1nd3 s VAL 230 Cb -0.18 -2.17 0.06 0.00 0.56 0.00 0.00 36.38 34.64 1nd3 s VAL 230 CO 0.24 -0.48 -0.04 -0.75 -0.31 0.00 0.00 175.10 173.75 1nd3 s LYS 231 N -3.79 1.51 -0.28 4.82 2.20 -0.69 -1.92 119.74 121.58 1nd3 s LYS 231 Ca 0.24 -0.89 -0.10 0.00 -0.36 0.00 0.00 55.97 54.85 1nd3 s LYS 231 Cb 0.04 -2.50 -0.04 0.00 -1.51 0.00 0.00 37.83 33.82 1nd3 s LYS 231 CO 0.06 -0.59 0.17 0.08 -0.36 0.00 0.00 175.35 174.71 1nd3 s VAL 232 N 1.46 5.05 -0.24 4.02 1.01 0.12 -1.01 120.40 130.81 1nd3 s VAL 232 Ca -0.05 0.01 -0.04 0.00 0.00 0.00 0.00 61.98 61.90 1nd3 s VAL 232 Cb -0.18 -3.43 0.00 0.00 0.00 0.00 0.00 36.38 32.76 1nd3 s VAL 232 CO -0.06 0.22 -0.03 -0.69 0.00 0.00 0.00 175.10 174.54 1nd3 s VAL 233 N 1.71 3.35 -0.25 2.92 1.01 -0.80 -0.96 120.40 127.37 1nd3 s VAL 233 Ca 0.07 -0.65 -0.06 0.00 0.00 0.00 0.00 61.98 61.33 1nd3 s VAL 233 Cb -0.16 -2.60 -0.01 0.00 0.00 0.00 0.00 36.38 33.61 1nd3 s VAL 233 CO 0.09 0.32 0.05 -0.89 0.00 0.00 0.00 175.10 174.66 1nd3 s THR 234 N 1.45 3.98 -0.21 3.92 2.01 0.28 -1.62 115.64 125.45 1nd3 s THR 234 Ca 0.04 -0.39 -0.11 0.00 0.31 0.00 0.00 61.69 61.53 1nd3 s THR 234 Cb -0.15 -2.91 -0.05 0.00 0.01 0.00 0.00 72.50 69.40 1nd3 s THR 234 CO -0.03 0.29 0.19 -0.13 -0.69 0.00 0.00 174.62 174.25 1nd3 s ARG 235 N 1.55 4.14 -0.18 4.92 0.52 -0.62 -0.20 118.95 129.09 1nd3 s ARG 235 Ca 0.05 -0.16 -0.13 0.00 -0.52 0.00 0.00 55.73 54.98 1nd3 s ARG 235 Cb -0.15 -3.49 -0.05 0.00 0.52 0.00 0.00 34.95 31.78 1nd3 s ARG 235 CO 0.02 0.15 0.25 0.42 0.02 0.00 0.00 175.30 176.15 1nd3 s ILE 236 N 0.78 5.33 0.00 1.52 -1.09 -0.16 -0.85 121.20 126.74 1nd3 s ILE 236 Ca 0.10 0.43 0.06 0.00 -2.23 0.00 0.00 60.65 59.01 1nd3 s ILE 236 Cb -0.13 -3.59 -0.03 0.00 -1.58 0.00 0.00 42.46 37.14 1nd3 s ILE 236 CO 0.03 0.39 -0.16 -0.31 -1.23 0.00 0.00 174.94 173.65 1nd3 s TYR 237 N 0.57 2.61 0.06 3.97 1.51 0.50 -0.78 117.35 125.80 1nd3 s TYR 237 Ca 0.14 -0.22 0.07 0.00 -1.01 0.00 0.00 57.07 56.05 1nd3 s TYR 237 Cb -0.13 -1.54 -0.03 0.00 -0.11 0.00 0.00 41.96 40.16 1nd3 s TYR 237 CO 0.03 0.21 -0.20 -1.58 -1.11 0.00 0.00 175.55 172.90 1nd3 s HIS 238 N -0.83 1.73 -0.09 2.71 2.46 0.09 -1.51 115.29 119.85 1nd3 s HIS 238 Ca 0.13 -0.39 -0.06 0.00 0.47 0.00 0.00 55.06 55.21 1nd3 s HIS 238 Cb -0.11 -1.00 0.03 0.00 -0.13 0.00 0.00 32.58 31.37 1nd3 s HIS 238 CO 0.03 0.12 0.22 0.21 -2.47 0.00 0.00 174.74 172.86 1nd3 s LYS 239 N -1.43 0.23 0.09 2.88 2.20 -0.90 -1.22 119.74 121.59 1nd3 s LYS 239 Ca 0.06 0.39 -0.16 0.00 -0.36 0.00 0.00 55.97 55.90 1nd3 s LYS 239 Cb -0.09 0.02 -0.07 0.00 -1.51 0.00 0.00 37.83 36.18 1nd3 s LYS 239 CO 0.03 -0.09 0.52 0.00 -0.36 0.00 0.00 175.35 175.45 1nd3 s ALA 240 N 0.59 3.61 0.02 3.13 0.00 -1.11 -1.11 121.76 126.89 1nd3 s ALA 240 Ca -0.04 -0.10 0.03 0.00 0.00 0.00 0.00 51.96 51.85 1nd3 s ALA 240 Cb -0.05 -2.52 -0.02 0.00 0.00 0.00 0.00 23.12 20.53 1nd3 s ALA 240 CO -0.03 0.45 -0.09 0.15 0.00 0.00 0.00 175.76 176.23 1nd3 s LYS 241 N -1.51 0.66 -1.17 0.00 1.02 0.02 -4.21 119.74 114.54 1nd3 s LYS 241 Ca 0.32 -0.53 -0.03 0.00 0.02 0.00 0.00 55.97 55.75 1nd3 s LYS 241 Cb -0.17 -0.60 -0.02 0.00 -0.52 0.00 0.00 37.83 36.53 1nd3 s LYS 241 CO 0.18 0.15 0.92 0.72 -0.92 0.00 0.00 175.35 176.40 1nd3 n HIS 242 N 2.23 -2.21 -3.25 3.18 8.25 -1.26 -0.85 115.22 121.31 1nd3 n HIS 242 Ca -0.17 0.88 -0.34 0.00 -0.26 0.00 0.00 57.72 57.83 1nd3 n HIS 242 Cb 0.56 -4.63 -0.06 0.00 1.12 0.00 0.00 29.99 26.98 1nd3 n HIS 242 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1nd3 s THR 243 N -3.42 4.75 -0.03 1.59 2.01 -1.26 -4.43 115.64 114.85 1nd3 s THR 243 Ca 0.15 0.89 -0.02 0.00 0.31 0.00 0.00 61.69 63.02 1nd3 s THR 243 Cb -0.02 -3.70 0.02 0.00 0.01 0.00 0.00 72.50 68.80 1nd3 s THR 243 CO 0.75 0.04 0.08 -0.54 -0.69 0.00 0.00 174.62 174.26 1nd3 s LYS 244 N -2.45 0.06 0.04 4.92 1.02 -0.39 -4.73 119.74 118.21 1nd3 s LYS 244 Ca 0.46 0.16 0.03 0.00 0.02 0.00 0.00 55.97 56.63 1nd3 s LYS 244 Cb -0.13 -0.04 -0.02 0.00 -0.52 0.00 0.00 37.83 37.11 1nd3 s LYS 244 CO 0.19 -0.06 -0.09 0.00 -0.92 0.00 0.00 175.35 174.48 1nd3 s ALA 245 N 0.39 0.67 0.08 5.17 0.00 -1.26 -0.49 121.76 126.32 1nd3 s ALA 245 Ca -0.03 -0.74 0.05 0.00 0.00 0.00 0.00 51.96 51.23 1nd3 s ALA 245 Cb -0.04 -0.00 -0.03 0.00 0.00 0.00 0.00 23.12 23.04 1nd3 s ALA 245 CO -0.01 0.03 -0.13 -1.58 0.00 0.00 0.00 175.76 174.07 1nd3 s TRP 246 N -1.21 1.16 -0.40 0.00 0.51 -0.17 -4.98 118.94 113.85 1nd3 s TRP 246 Ca -0.07 -0.51 -0.25 0.00 -2.12 0.00 0.00 56.10 53.15 1nd3 s TRP 246 Cb -0.09 -0.64 0.04 0.00 -0.81 0.00 0.00 33.47 31.96 1nd3 s TRP 246 CO 0.01 0.05 0.55 0.00 -0.51 0.00 0.00 176.95 177.04 1nd3 s PRO 248 N -2.37 2.11 0.23 0.00 0.04 -1.26 -1.66 135.00 132.10 1nd3 s PRO 248 Ca 0.28 1.62 -0.02 0.00 0.04 0.00 0.00 61.00 62.92 1nd3 s PRO 248 Cb -0.05 -1.84 -0.03 0.00 0.04 0.00 0.00 34.50 32.62 1nd3 s PRO 248 CO 0.77 -1.82 0.22 -0.98 0.04 0.00 0.00 177.00 175.23 1nd3 s ARG 249 N -4.12 1.36 0.40 4.56 1.70 -0.40 -4.86 118.95 117.60 1nd3 s ARG 249 Ca 0.71 -1.61 -0.27 0.00 -0.47 0.00 0.00 55.73 54.09 1nd3 s ARG 249 Cb -0.26 0.32 -0.10 0.00 -0.57 0.00 0.00 34.95 34.34 1nd3 s ARG 249 CO 0.47 -0.48 1.46 -2.14 -1.08 0.00 0.00 175.30 173.53 1nd3 s PRO 250 N -4.00 3.95 0.55 3.89 0.02 -1.26 -4.77 135.00 133.37 1nd3 s PRO 250 Ca 0.36 2.50 -0.19 0.00 0.02 0.00 0.00 61.00 63.69 1nd3 s PRO 250 Cb 0.05 -2.85 -0.06 0.00 0.02 0.00 0.00 34.50 31.66 1nd3 s PRO 250 CO 0.14 -0.64 1.11 -2.14 -0.33 0.00 0.00 177.00 175.14 1nd3 s PRO 251 N -2.23 3.38 0.07 5.54 0.02 -1.26 -4.86 135.00 135.67 1nd3 s PRO 251 Ca 0.56 1.52 -0.33 0.00 0.02 0.00 0.00 61.00 62.78 1nd3 s PRO 251 Cb -0.45 -2.02 -0.12 0.00 0.02 0.00 0.00 34.50 31.93 1nd3 s PRO 251 CO 0.60 -0.81 1.78 -2.13 -0.33 0.00 0.00 177.00 176.12 1nd3 n ARG 252 N -1.38 2.45 -0.01 5.54 3.00 -1.26 -4.89 116.66 120.11 1nd3 n ARG 252 Ca 0.11 0.89 0.10 0.00 -0.00 0.00 0.00 57.85 58.95 1nd3 n ARG 252 Cb 0.51 -2.74 -0.15 0.00 0.00 0.00 0.00 32.46 30.09 1nd3 n ARG 252 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1nd3 n ALA 253 N 5.33 3.46 -2.41 5.13 0.00 -1.26 -4.99 120.51 125.77 1nd3 n ALA 253 Ca 0.19 -0.54 -0.21 0.00 0.00 0.00 0.00 53.44 52.89 1nd3 n ALA 253 Cb 0.33 -0.74 -0.10 0.00 0.00 0.00 0.00 19.45 18.93 1nd3 n ALA 253 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1nd3 s VAL 254 N -3.30 1.58 0.77 0.00 -7.23 -1.26 -4.23 120.40 106.73 1nd3 s VAL 254 Ca -0.02 -2.12 -0.14 0.00 -1.81 0.00 0.00 61.98 57.88 1nd3 s VAL 254 Cb 0.14 -2.41 0.06 0.00 0.56 0.00 0.00 36.38 34.74 1nd3 s VAL 254 CO 0.88 -0.32 1.22 -1.10 -0.31 0.00 0.00 175.10 175.46 1nd3 s GLN 255 N -3.74 1.86 0.47 4.82 -0.21 -1.26 -5.00 119.66 116.61 1nd3 s GLN 255 Ca 0.29 1.81 -0.14 0.00 0.02 0.00 0.00 55.36 57.34 1nd3 s GLN 255 Cb 0.04 -1.80 -0.07 0.00 1.00 0.00 0.00 33.01 32.18 1nd3 s GLN 255 CO 0.11 -2.06 0.89 0.71 -2.12 0.00 0.00 175.29 172.83 1nd3 s TYR 256 N -2.00 3.47 -0.06 0.91 1.51 -1.26 -4.70 117.35 115.22 1nd3 s TYR 256 Ca 0.75 1.27 -0.05 0.00 -1.01 0.00 0.00 57.07 58.03 1nd3 s TYR 256 Cb -0.30 -2.63 -0.03 0.00 -0.11 0.00 0.00 41.96 38.88 1nd3 s TYR 256 CO 0.48 -0.27 -0.11 0.43 -1.11 0.00 0.00 175.55 174.96 1nd3 n SER 257 N -1.53 0.84 -4.19 2.29 7.64 -1.25 -5.00 113.62 112.42 1nd3 n SER 257 Ca 0.05 0.13 -0.11 0.00 1.01 0.00 0.00 58.87 59.95 1nd3 n SER 257 Cb 0.54 -0.32 -0.10 0.00 -1.01 0.00 0.00 64.21 63.32 1nd3 n SER 257 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 1nd3 s HIS 258 N -2.20 1.05 0.43 1.43 3.76 -1.26 -5.14 115.29 113.35 1nd3 s HIS 258 Ca -0.12 -1.27 -0.22 0.00 -0.15 0.00 0.00 55.06 53.30 1nd3 s HIS 258 Cb 0.04 -0.55 -0.09 0.00 1.11 0.00 0.00 32.58 33.08 1nd3 s HIS 258 CO 0.15 -0.53 1.01 0.95 -0.85 0.00 0.00 174.74 175.46 1nd3 s THR 259 N -4.05 3.98 -1.50 1.30 -4.23 -1.26 -3.80 115.64 106.09 1nd3 s THR 259 Ca 0.31 1.36 0.00 0.00 -1.18 0.00 0.00 61.69 62.18 1nd3 s THR 259 Cb 0.07 -3.62 0.00 0.00 1.34 0.00 0.00 72.50 70.29 1nd3 s THR 259 CO 0.07 -0.15 0.00 1.41 -0.54 0.00 0.00 174.62 175.41 1nd3 n HIS 260 N -0.44 0.00 -3.85 3.99 8.25 -1.26 -4.97 115.22 116.93 1nd3 n HIS 260 Ca 0.07 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.41 1nd3 n HIS 260 Cb 0.52 -2.77 -0.10 0.00 1.12 0.00 0.00 29.99 28.75 1nd3 n HIS 260 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 1nd3 s THR 261 N -2.34 0.07 -2.27 1.59 -1.32 -1.25 -3.92 115.64 106.20 1nd3 s THR 261 Ca 0.00 -0.57 0.20 0.00 -1.21 0.00 0.00 61.69 60.11 1nd3 s THR 261 Cb 0.00 -0.42 0.44 0.00 -1.51 0.00 0.00 72.50 71.01 1nd3 s THR 261 CO 0.00 -0.32 1.50 0.35 -2.21 0.00 0.00 174.62 173.95 1nd3 n THR 262 N 1.66 0.26 -1.48 5.08 -2.24 -1.26 -4.67 114.28 111.63 1nd3 n THR 262 Ca -0.21 -0.40 -0.38 0.00 -2.27 0.00 0.00 64.05 60.79 1nd3 n THR 262 Cb 0.56 0.42 0.04 0.00 -2.10 0.00 0.00 70.33 69.25 1nd3 n THR 262 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1nd3 n ASN 263 N 0.46 -0.76 -3.88 3.42 3.02 -1.26 -4.98 115.26 111.27 1nd3 n ASN 263 Ca 0.16 0.74 -0.09 0.00 -0.03 0.00 0.00 54.58 55.35 1nd3 n ASN 263 Cb 0.35 -1.21 -0.06 0.00 -0.61 0.00 0.00 39.78 38.25 1nd3 n ASN 263 CO 0.00 0.00 0.00 -0.72 -2.62 0.00 0.00 177.26 173.92 1nd3 s TYR 264 N -1.70 0.22 0.13 3.10 -0.85 -1.26 -3.96 117.35 113.03 1nd3 s TYR 264 Ca 0.70 -0.58 0.03 0.00 -0.52 0.00 0.00 57.07 56.70 1nd3 s TYR 264 Cb -0.43 0.05 -0.04 0.00 0.38 0.00 0.00 41.96 41.92 1nd3 s TYR 264 CO 0.53 -0.73 0.18 0.15 -1.52 0.00 0.00 175.55 174.17 1nd3 s LYS 265 N -3.92 3.14 -0.02 -3.49 1.02 -1.26 -5.07 119.74 110.14 1nd3 s LYS 265 Ca 0.13 -0.70 0.00 0.00 0.02 0.00 0.00 55.97 55.42 1nd3 s LYS 265 Cb 0.03 -2.81 0.03 0.00 -0.52 0.00 0.00 37.83 34.55 1nd3 s LYS 265 CO -0.03 0.52 0.02 -0.51 -0.92 0.00 0.00 175.35 174.43 1nd3 s LEU 266 N -2.96 1.10 0.00 3.17 1.43 -1.26 -4.95 118.68 115.22 1nd3 s LEU 266 Ca 0.32 0.02 -0.01 0.00 -1.03 0.00 0.00 54.13 53.43 1nd3 s LEU 266 Cb -0.11 -0.12 0.11 0.00 0.03 0.00 0.00 46.19 46.09 1nd3 s LEU 266 CO 0.25 -0.12 0.74 -1.54 0.23 0.00 0.00 176.35 175.91 1nd3 n SER 267 N 4.17 0.90 0.17 2.29 3.41 -1.26 -5.00 113.62 118.31 1nd3 n SER 267 Ca -0.27 -1.78 0.02 0.00 -0.26 0.00 0.00 58.87 56.57 1nd3 n SER 267 Cb 0.50 -0.48 0.29 0.00 -0.26 0.00 0.00 64.21 64.25 1nd3 n SER 267 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1nd3 h SER 268 N -0.49 0.00 -3.72 4.04 4.64 -2.05 -3.34 113.55 112.63 1nd3 h SER 268 Ca -0.24 0.00 -0.68 0.00 -0.47 0.00 0.00 61.79 60.39 1nd3 h SER 268 Cb 0.88 0.00 -0.37 0.00 -0.31 0.00 0.00 62.40 62.60 1nd3 h SER 268 CO 0.25 0.47 -0.31 -1.61 -0.87 0.00 0.00 176.83 174.76 1nd3 s GLU 269 N -3.79 2.79 0.57 4.77 0.41 -1.26 -4.97 118.70 117.22 1nd3 s GLU 269 Ca -0.01 -2.95 0.29 0.00 -0.41 0.00 0.00 54.97 51.89 1nd3 s GLU 269 Cb 0.13 -3.75 1.46 0.00 -1.78 0.00 0.00 34.13 30.19 1nd3 s GLU 269 CO 0.73 -1.22 1.89 -0.39 -0.49 0.00 0.00 175.26 175.77 1nd3 h VAL 270 N 4.69 0.44 0.00 2.63 -1.51 -1.98 -1.45 116.25 119.07 1nd3 h VAL 270 Ca 0.07 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.54 1nd3 h VAL 270 Cb 0.87 0.59 0.00 0.00 -2.13 0.00 0.00 31.29 30.62 1nd3 h VAL 270 CO 0.76 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 177.10 1nd3 n HIS 271 N -3.92 0.73 0.57 5.19 1.44 -1.26 -0.39 115.22 117.58 1nd3 n HIS 271 Ca 0.12 0.36 0.12 0.00 -2.01 0.00 0.00 57.72 56.32 1nd3 n HIS 271 Cb 0.78 -1.08 0.24 0.00 0.12 0.00 0.00 29.99 30.05 1nd3 n HIS 271 CO 0.00 0.00 0.00 -0.91 -2.81 0.00 0.00 176.34 172.62 1nd3 h ASN 272 N 0.00 0.00 0.55 4.39 2.35 -1.61 -3.31 115.58 117.96 1nd3 h ASN 272 Ca 0.00 -0.13 0.00 0.00 -0.55 0.00 0.00 56.30 55.62 1nd3 h ASN 272 Cb 0.07 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.44 1nd3 h ASN 272 CO 0.00 0.07 -0.60 0.47 -1.65 0.00 0.00 177.43 175.71 1nd3 n ASP 273 N -2.21 0.57 -4.50 5.81 8.00 0.48 -4.92 116.55 119.78 1nd3 n ASP 273 Ca 0.04 -0.19 -0.24 0.00 0.71 0.00 0.00 54.79 55.11 1nd3 n ASP 273 Cb 0.44 0.32 -0.10 0.00 -0.02 0.00 0.00 41.12 41.76 1nd3 n ASP 273 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1nd3 s VAL 274 N -3.06 2.12 -1.36 2.53 -7.23 -1.21 -4.45 120.40 107.74 1nd3 s VAL 274 Ca 0.09 -2.22 0.26 0.00 -1.81 0.00 0.00 61.98 58.30 1nd3 s VAL 274 Cb 0.16 -2.52 0.42 0.00 0.56 0.00 0.00 36.38 35.00 1nd3 s VAL 274 CO 0.72 -0.27 1.87 0.00 -0.31 0.00 0.00 175.10 177.10 1nd3 n ALA 275 N -0.70 2.28 -1.99 1.32 0.00 -1.26 -4.83 120.51 115.33 1nd3 n ALA 275 Ca -0.05 -0.12 -0.42 0.00 0.00 0.00 0.00 53.44 52.85 1nd3 n ALA 275 Cb 0.63 -1.42 -0.03 0.00 0.00 0.00 0.00 19.45 18.63 1nd3 n ALA 275 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1nd3 s ILE 276 N -2.64 2.82 -0.21 0.00 1.01 -1.26 -5.00 121.20 115.92 1nd3 s ILE 276 Ca 0.23 0.60 -0.10 0.00 0.00 0.00 0.00 60.65 61.38 1nd3 s ILE 276 Cb 0.17 -3.38 -0.05 0.00 0.01 0.00 0.00 42.46 39.21 1nd3 s ILE 276 CO 0.41 0.05 0.13 -0.13 0.00 0.00 0.00 174.94 175.39 1nd3 s ARG 277 N 0.95 4.08 0.22 2.79 0.52 -1.26 -4.90 118.95 121.36 1nd3 s ARG 277 Ca 0.67 -0.27 -0.32 0.00 -0.52 0.00 0.00 55.73 55.29 1nd3 s ARG 277 Cb -0.42 -3.43 -0.13 0.00 0.52 0.00 0.00 34.95 31.50 1nd3 s ARG 277 CO 0.32 0.18 1.52 -2.30 0.02 0.00 0.00 175.30 175.04 1nd3 n PRO 278 N 3.89 2.24 -3.55 3.54 -0.02 -1.26 -4.99 135.00 134.86 1nd3 n PRO 278 Ca -0.16 0.80 -0.34 0.00 -2.02 0.00 0.00 63.50 61.79 1nd3 n PRO 278 Cb 0.52 -2.53 -0.05 0.00 -0.02 0.00 0.00 33.50 31.42 1nd3 n PRO 278 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1nd3 s ARG 279 N 0.08 3.76 0.13 -0.52 0.52 -1.26 -4.99 118.95 116.67 1nd3 s ARG 279 Ca 0.71 0.16 -0.16 0.00 -0.52 0.00 0.00 55.73 55.92 1nd3 s ARG 279 Cb -0.62 -2.90 -0.01 0.00 0.52 0.00 0.00 34.95 31.95 1nd3 s ARG 279 CO 0.45 0.49 1.68 1.15 0.02 0.00 0.00 175.30 179.08 1nd3 h THR 280 N 2.52 1.20 -2.53 0.02 2.02 -1.94 -3.47 112.91 110.73 1nd3 h THR 280 Ca -0.48 -0.61 0.15 0.00 0.77 0.00 0.00 66.41 66.24 1nd3 h THR 280 Cb 1.18 0.85 -0.04 0.00 -1.74 0.00 0.00 68.15 68.41 1nd3 h THR 280 CO 0.68 0.22 0.55 0.54 0.37 0.00 0.00 175.52 177.88 1nd3 s ASN 281 N -5.86 -0.02 0.63 4.18 2.20 -1.26 -5.04 114.94 109.77 1nd3 s ASN 281 Ca -0.13 -0.67 0.36 0.00 -0.94 0.00 0.00 52.86 51.48 1nd3 s ASN 281 Cb 0.10 0.52 2.04 0.00 -2.00 0.00 0.00 41.25 41.91 1nd3 s ASN 281 CO 0.75 -1.03 2.26 -0.07 -2.94 0.00 0.00 177.10 176.08 1nd3 h LEU 282 N 2.00 0.00 -2.69 3.54 3.38 -2.05 -2.97 115.31 116.52 1nd3 h LEU 282 Ca -0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.70 1nd3 h LEU 282 Cb 1.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.97 1nd3 h LEU 282 CO 0.35 0.00 0.00 0.35 0.09 0.00 0.00 178.44 179.23 1nd3 n THR 283 N -3.48 0.87 -3.16 0.22 -2.24 -1.26 -4.89 114.28 100.35 1nd3 n THR 283 Ca -0.02 -0.93 -0.45 0.00 -2.27 0.00 0.00 64.05 60.38 1nd3 n THR 283 Cb 0.13 0.60 -0.05 0.00 -2.10 0.00 0.00 70.33 68.91 1nd3 n THR 283 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1nd3 s THR 284 N -0.99 4.90 -2.00 4.28 2.01 -1.13 -5.16 115.64 117.55 1nd3 s THR 284 Ca 0.21 -0.98 0.00 0.00 0.31 0.00 0.00 61.69 61.23 1nd3 s THR 284 Cb 0.11 -4.42 0.00 0.00 0.01 0.00 0.00 72.50 68.20 1nd3 s THR 284 CO 0.15 -1.02 0.50 1.33 -0.69 0.00 0.00 174.62 174.89