#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nd4 n SER 11 N 0.00 -1.43 -4.68 1.61 2.88 -1.26 -4.79 113.62 105.96 1nd4 n SER 11 Ca 0.00 0.99 -0.48 0.00 -1.33 0.00 0.00 58.87 58.05 1nd4 n SER 11 Cb 0.00 -1.00 -0.05 0.00 -0.75 0.00 0.00 64.21 62.42 1nd4 n SER 11 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 1nd4 n PRO 12 N 0.99 2.15 -0.27 -1.46 -0.02 -1.26 -4.87 135.00 130.25 1nd4 n PRO 12 Ca 0.14 0.78 0.06 0.00 -2.02 0.00 0.00 63.50 62.46 1nd4 n PRO 12 Cb 0.34 -2.60 0.28 0.00 -0.02 0.00 0.00 33.50 31.50 1nd4 n PRO 12 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1nd4 h ALA 13 N 8.19 1.60 0.00 3.55 0.00 -2.01 -0.41 119.26 130.18 1nd4 h ALA 13 Ca -0.47 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1nd4 h ALA 13 Cb 1.27 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1nd4 h ALA 13 CO 0.93 0.25 0.00 0.00 0.00 0.00 0.00 179.25 180.43 1nd4 n ALA 14 N -2.41 1.21 0.59 0.00 0.00 -1.26 -1.98 120.51 116.66 1nd4 n ALA 14 Ca 0.14 -0.01 0.06 0.00 0.00 0.00 0.00 53.44 53.63 1nd4 n ALA 14 Cb 0.24 -1.07 -0.00 0.00 0.00 0.00 0.00 19.45 18.63 1nd4 n ALA 14 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 1nd4 n TRP 15 N -1.48 0.00 -0.24 0.00 8.01 -0.16 -4.66 117.44 118.91 1nd4 n TRP 15 Ca 0.01 0.00 0.11 0.00 -1.31 0.00 0.00 57.50 56.31 1nd4 n TRP 15 Cb 0.05 0.00 0.39 0.00 -2.01 0.00 0.00 31.31 29.73 1nd4 n TRP 15 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.69 176.96 1nd4 h VAL 16 N 1.49 0.87 0.07 -0.99 2.07 -1.40 -0.38 116.25 117.99 1nd4 h VAL 16 Ca 0.00 -0.23 -0.00 0.00 0.82 0.00 0.00 66.70 67.29 1nd4 h VAL 16 Cb 0.45 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.36 1nd4 h VAL 16 CO 0.00 0.12 -0.04 -0.08 0.02 0.00 0.00 177.57 177.60 1nd4 h GLU 17 N 0.67 -0.10 0.00 1.57 4.81 -1.83 -2.79 114.58 116.92 1nd4 h GLU 17 Ca 0.41 0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.61 1nd4 h GLU 17 Cb 0.64 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.04 1nd4 h GLU 17 CO -0.17 0.45 -0.20 0.07 -0.73 0.00 0.00 179.01 178.43 1nd4 h ARG 18 N -0.76 0.00 -0.68 1.92 0.11 -1.81 -2.67 114.38 110.48 1nd4 h ARG 18 Ca -0.01 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.07 1nd4 h ARG 18 Cb 0.60 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.68 1nd4 h ARG 18 CO 0.02 0.20 0.00 1.28 0.10 0.00 0.00 179.97 181.57 1nd4 n LEU 19 N -3.73 3.87 -4.71 0.08 4.77 -0.17 -4.97 117.00 112.14 1nd4 n LEU 19 Ca -0.01 -1.89 -0.43 0.00 -0.03 0.00 0.00 56.01 53.64 1nd4 n LEU 19 Cb 0.31 -0.45 -0.03 0.00 -2.33 0.00 0.00 43.42 40.92 1nd4 n LEU 19 CO 0.33 0.95 1.29 0.33 -1.33 0.00 0.00 177.39 178.95 1nd4 n PHE 20 N 1.63 2.63 -0.41 -1.77 7.35 -1.01 -2.06 117.46 123.82 1nd4 n PHE 20 Ca 0.24 0.15 0.00 0.00 -0.76 0.00 0.00 57.45 57.08 1nd4 n PHE 20 Cb 0.62 -2.62 0.00 0.00 0.35 0.00 0.00 39.48 37.83 1nd4 n PHE 20 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1nd4 n GLY 21 N 3.42 1.15 3.82 7.13 0.00 -1.26 -5.05 105.19 114.40 1nd4 n GLY 21 Ca 0.15 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.79 1nd4 n GLY 21 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1nd4 s TYR 22 N -3.03 3.75 -0.12 1.61 2.02 -0.87 -4.77 117.35 115.94 1nd4 s TYR 22 Ca 0.00 1.21 -0.16 0.00 -0.37 0.00 0.00 57.07 57.75 1nd4 s TYR 22 Cb 0.00 -2.46 -0.05 0.00 -0.40 0.00 0.00 41.96 39.05 1nd4 s TYR 22 CO 0.00 0.54 0.40 -0.51 -1.57 0.00 0.00 175.55 174.41 1nd4 s ASP 23 N -1.29 6.61 -0.13 2.29 1.01 0.19 -4.90 116.67 120.45 1nd4 s ASP 23 Ca 0.32 0.72 -0.07 0.00 0.71 0.00 0.00 52.55 54.23 1nd4 s ASP 23 Cb -0.18 -2.24 -0.04 0.00 1.01 0.00 0.00 42.92 41.47 1nd4 s ASP 23 CO 0.19 0.08 0.11 0.26 0.21 0.00 0.00 175.17 176.02 1nd4 s TRP 24 N 0.33 3.48 -0.13 4.23 0.52 -1.26 -1.32 118.94 124.78 1nd4 s TRP 24 Ca 0.22 0.41 -0.04 0.00 0.02 0.00 0.00 56.10 56.72 1nd4 s TRP 24 Cb -0.14 -1.96 0.05 0.00 -1.15 0.00 0.00 33.47 30.26 1nd4 s TRP 24 CO 0.08 0.59 0.07 0.00 0.02 0.00 0.00 176.95 177.70 1nd4 s ALA 25 N -0.69 0.48 0.11 0.98 0.00 -0.60 -4.97 121.76 117.07 1nd4 s ALA 25 Ca 0.13 -0.21 -0.31 0.00 0.00 0.00 0.00 51.96 51.56 1nd4 s ALA 25 Cb -0.12 -0.92 -0.09 0.00 0.00 0.00 0.00 23.12 22.00 1nd4 s ALA 25 CO 0.03 -0.92 1.53 -1.14 0.00 0.00 0.00 175.76 175.25 1nd4 s GLN 26 N 2.09 4.24 0.01 0.00 0.74 -1.26 -0.75 119.66 124.74 1nd4 s GLN 26 Ca 0.03 2.24 0.22 0.00 0.05 0.00 0.00 55.36 57.90 1nd4 s GLN 26 Cb -0.15 -3.33 -0.13 0.00 1.10 0.00 0.00 33.01 30.50 1nd4 s GLN 26 CO -0.07 -0.59 0.86 1.04 -0.55 0.00 0.00 175.29 175.98 1nd4 n GLN 27 N 4.52 0.28 -2.62 1.67 1.13 0.17 -4.92 117.38 117.60 1nd4 n GLN 27 Ca 0.14 -0.05 -0.15 0.00 -1.94 0.00 0.00 57.00 54.99 1nd4 n GLN 27 Cb 0.40 -1.54 0.04 0.00 0.11 0.00 0.00 30.24 29.25 1nd4 n GLN 27 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 1nd4 n THR 28 N -1.87 0.00 -2.62 5.09 -2.24 -1.24 -4.99 114.28 106.41 1nd4 n THR 28 Ca 0.01 -1.45 -0.43 0.00 -2.27 0.00 0.00 64.05 59.91 1nd4 n THR 28 Cb 0.43 -0.53 -0.02 0.00 -2.10 0.00 0.00 70.33 68.11 1nd4 n THR 28 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 1nd4 s ILE 29 N -1.71 4.56 -0.47 2.28 1.10 -1.26 -4.93 121.20 120.77 1nd4 s ILE 29 Ca 0.39 1.85 -0.05 0.00 -0.51 0.00 0.00 60.65 62.34 1nd4 s ILE 29 Cb -0.03 -4.31 -0.10 0.00 0.15 0.00 0.00 42.46 38.16 1nd4 s ILE 29 CO 0.25 -0.29 2.23 0.61 -2.11 0.00 0.00 174.94 175.63 1nd4 n GLY 30 N 3.58 2.66 0.00 1.50 0.00 -1.26 -3.32 105.19 108.35 1nd4 n GLY 30 Ca 0.12 -0.78 0.00 0.00 0.00 0.00 0.00 46.02 45.36 1nd4 n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nd4 s SER 32 N -1.04 6.56 0.56 0.00 0.01 -1.21 -4.96 113.70 113.63 1nd4 s SER 32 Ca 0.00 1.21 0.26 0.00 1.31 0.00 0.00 55.95 58.74 1nd4 s SER 32 Cb 0.00 -2.36 1.65 0.00 0.21 0.00 0.00 66.02 65.53 1nd4 s SER 32 CO 0.00 -0.41 2.21 -0.78 0.41 0.00 0.00 173.24 174.67 1nd4 h ASP 33 N 1.32 0.00 -3.07 2.44 3.58 -1.97 -3.41 116.42 115.31 1nd4 h ASP 33 Ca -0.47 0.00 -0.60 0.00 0.42 0.00 0.00 57.03 56.38 1nd4 h ASP 33 Cb 1.19 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 42.19 1nd4 h ASP 33 CO 0.64 0.02 -0.21 0.00 -2.88 0.00 0.00 179.24 176.80 1nd4 s ALA 34 N -4.67 3.70 0.06 -0.78 0.00 -1.26 -4.46 121.76 114.36 1nd4 s ALA 34 Ca -0.05 -0.28 -0.11 0.00 0.00 0.00 0.00 51.96 51.52 1nd4 s ALA 34 Cb 0.15 -2.34 0.01 0.00 0.00 0.00 0.00 23.12 20.94 1nd4 s ALA 34 CO 0.58 0.51 0.24 0.00 0.00 0.00 0.00 175.76 177.10 1nd4 s ALA 35 N -1.23 -0.47 -0.07 0.00 0.00 -0.68 -4.90 121.76 114.40 1nd4 s ALA 35 Ca 0.28 -0.27 0.01 0.00 0.00 0.00 0.00 51.96 51.99 1nd4 s ALA 35 Cb -0.15 0.38 0.02 0.00 0.00 0.00 0.00 23.12 23.36 1nd4 s ALA 35 CO 0.15 -0.44 -0.10 0.08 0.00 0.00 0.00 175.76 175.45 1nd4 s VAL 36 N -3.00 1.04 0.02 0.00 1.01 -1.26 -1.90 120.40 116.31 1nd4 s VAL 36 Ca -0.02 -0.39 0.08 0.00 0.00 0.00 0.00 61.98 61.65 1nd4 s VAL 36 Cb 0.01 -0.99 -0.02 0.00 0.00 0.00 0.00 36.38 35.38 1nd4 s VAL 36 CO -0.06 0.34 -0.25 -0.36 0.00 0.00 0.00 175.10 174.77 1nd4 s PHE 37 N 0.95 2.23 -0.24 5.22 0.40 0.91 0.46 117.98 127.91 1nd4 s PHE 37 Ca -0.09 -0.41 -0.07 0.00 -0.60 0.00 0.00 56.93 55.75 1nd4 s PHE 37 Cb -0.15 -1.37 -0.03 0.00 0.51 0.00 0.00 43.02 41.98 1nd4 s PHE 37 CO 0.00 0.06 0.07 0.50 0.70 0.00 0.00 175.22 176.55 1nd4 s ARG 38 N -0.97 3.68 -0.16 0.44 3.52 0.07 -0.67 118.95 124.86 1nd4 s ARG 38 Ca 0.10 -0.47 -0.06 0.00 -0.13 0.00 0.00 55.73 55.17 1nd4 s ARG 38 Cb -0.10 -3.32 -0.04 0.00 -1.56 0.00 0.00 34.95 29.94 1nd4 s ARG 38 CO 0.01 -0.15 0.06 -0.51 -0.81 0.00 0.00 175.30 173.89 1nd4 s LEU 39 N 1.52 3.83 0.05 -0.88 1.43 0.91 -1.56 118.68 123.98 1nd4 s LEU 39 Ca 0.06 0.13 -0.04 0.00 -1.03 0.00 0.00 54.13 53.25 1nd4 s LEU 39 Cb -0.15 -1.95 -0.02 0.00 0.03 0.00 0.00 46.19 44.10 1nd4 s LEU 39 CO 0.04 0.23 0.06 -0.94 0.23 0.00 0.00 176.35 175.96 1nd4 s SER 40 N 0.03 0.28 -0.24 2.29 1.04 -0.44 -1.41 113.70 115.26 1nd4 s SER 40 Ca 0.06 -0.72 -0.26 0.00 0.48 0.00 0.00 55.95 55.51 1nd4 s SER 40 Cb -0.12 0.23 0.08 0.00 0.10 0.00 0.00 66.02 66.30 1nd4 s SER 40 CO 0.01 -0.56 0.75 0.00 0.98 0.00 0.00 173.24 174.42 1nd4 s ALA 41 N -3.19 -1.80 -0.00 5.32 0.00 -1.26 -0.64 121.76 120.18 1nd4 s ALA 41 Ca 0.00 1.92 -0.36 0.00 0.00 0.00 0.00 51.96 53.52 1nd4 s ALA 41 Cb 0.02 -1.06 -0.14 0.00 0.00 0.00 0.00 23.12 21.94 1nd4 s ALA 41 CO -0.07 -0.33 1.64 0.94 0.00 0.00 0.00 175.76 177.93 1nd4 n GLN 42 N 2.39 1.75 -1.24 0.00 -0.06 -1.26 -1.87 117.38 117.09 1nd4 n GLN 42 Ca -0.14 0.64 -0.08 0.00 -2.00 0.00 0.00 57.00 55.41 1nd4 n GLN 42 Cb 0.55 -2.38 -0.04 0.00 -4.06 0.00 0.00 30.24 24.31 1nd4 n GLN 42 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1nd4 n GLY 43 N 3.62 0.95 3.38 1.69 0.00 -1.26 -5.00 105.19 108.58 1nd4 n GLY 43 Ca 0.21 -0.26 -0.20 0.00 0.00 0.00 0.00 46.02 45.77 1nd4 n GLY 43 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1nd4 s ARG 44 N -2.43 1.44 0.52 1.61 0.52 -0.78 -5.12 118.95 114.71 1nd4 s ARG 44 Ca 0.00 -1.66 -0.22 0.00 -0.52 0.00 0.00 55.73 53.33 1nd4 s ARG 44 Cb 0.00 -1.25 -0.06 0.00 0.52 0.00 0.00 34.95 34.16 1nd4 s ARG 44 CO 0.00 0.18 1.31 -2.30 0.02 0.00 0.00 175.30 174.51 1nd4 n PRO 45 N -0.47 1.69 -2.95 3.54 -0.02 -1.26 -4.62 135.00 130.92 1nd4 n PRO 45 Ca -0.07 0.62 -0.40 0.00 -2.02 0.00 0.00 63.50 61.63 1nd4 n PRO 45 Cb 0.61 -2.51 -0.06 0.00 -0.02 0.00 0.00 33.50 31.53 1nd4 n PRO 45 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1nd4 s VAL 46 N -1.29 4.48 0.23 -1.45 1.01 -1.26 -4.66 120.40 117.46 1nd4 s VAL 46 Ca 0.69 1.73 0.06 0.00 0.00 0.00 0.00 61.98 64.47 1nd4 s VAL 46 Cb -0.43 -4.16 -0.05 0.00 0.00 0.00 0.00 36.38 31.74 1nd4 s VAL 46 CO 0.51 0.45 -0.09 -0.76 0.00 0.00 0.00 175.10 175.22 1nd4 s LEU 47 N -0.71 2.47 0.01 3.92 1.43 -0.50 -3.31 118.68 121.99 1nd4 s LEU 47 Ca 0.38 -1.11 0.04 0.00 -1.03 0.00 0.00 54.13 52.40 1nd4 s LEU 47 Cb -0.22 -0.56 -0.01 0.00 0.03 0.00 0.00 46.19 45.42 1nd4 s LEU 47 CO 0.26 -0.30 -0.11 -0.36 0.23 0.00 0.00 176.35 176.07 1nd4 s PHE 48 N -3.09 0.99 -0.10 0.29 0.40 -0.25 -0.06 117.98 116.15 1nd4 s PHE 48 Ca 0.25 -0.25 0.02 0.00 -0.60 0.00 0.00 56.93 56.35 1nd4 s PHE 48 Cb 0.02 -0.62 0.01 0.00 0.51 0.00 0.00 43.02 42.95 1nd4 s PHE 48 CO 0.08 -0.01 -0.14 0.08 0.70 0.00 0.00 175.22 175.93 1nd4 s VAL 49 N -0.51 1.40 -0.07 -0.44 1.01 0.16 -0.74 120.40 121.21 1nd4 s VAL 49 Ca 0.02 -0.59 0.04 0.00 0.00 0.00 0.00 61.98 61.45 1nd4 s VAL 49 Cb -0.06 -1.28 -0.02 0.00 0.00 0.00 0.00 36.38 35.03 1nd4 s VAL 49 CO 0.00 0.42 -0.19 -0.54 0.00 0.00 0.00 175.10 174.79 1nd4 s LYS 50 N 0.93 2.69 0.06 2.72 1.02 -0.00 -0.06 119.74 127.10 1nd4 s LYS 50 Ca -0.08 -0.79 -0.10 0.00 0.02 0.00 0.00 55.97 55.02 1nd4 s LYS 50 Cb -0.15 -2.33 0.00 0.00 -0.52 0.00 0.00 37.83 34.83 1nd4 s LYS 50 CO -0.00 0.44 0.21 -0.08 -0.92 0.00 0.00 175.35 175.00 1nd4 s THR 51 N -0.28 0.12 -0.18 2.17 -1.32 -0.80 0.12 115.64 115.47 1nd4 s THR 51 Ca 0.01 -0.98 -0.34 0.00 -1.21 0.00 0.00 61.69 59.17 1nd4 s THR 51 Cb -0.13 -1.09 0.14 0.00 -1.51 0.00 0.00 72.50 69.91 1nd4 s THR 51 CO 0.03 -0.54 1.17 -0.62 -2.21 0.00 0.00 174.62 172.45 1nd4 s ASP 52 N -2.41 -0.17 0.40 8.08 2.15 -1.06 -1.69 116.67 121.96 1nd4 s ASP 52 Ca -0.01 0.04 -0.27 0.00 0.43 0.00 0.00 52.55 52.74 1nd4 s ASP 52 Cb 0.01 0.17 -0.10 0.00 -0.30 0.00 0.00 42.92 42.70 1nd4 s ASP 52 CO -0.07 -0.26 1.36 0.18 -0.17 0.00 0.00 175.17 176.21 1nd4 n LEU 53 N 0.01 4.32 -4.50 -1.34 4.77 -1.26 -1.15 117.00 117.85 1nd4 n LEU 53 Ca -0.01 1.17 -0.36 0.00 -0.03 0.00 0.00 56.01 56.77 1nd4 n LEU 53 Cb 0.59 -1.55 0.07 0.00 -2.33 0.00 0.00 43.42 40.19 1nd4 n LEU 53 CO 0.10 -0.30 0.16 -1.20 -1.33 0.00 0.00 177.39 174.82 1nd4 n SER 54 N 0.33 -0.81 0.00 -1.43 7.64 -1.25 -4.67 113.62 113.44 1nd4 n SER 54 Ca 0.04 0.63 0.00 0.00 1.01 0.00 0.00 58.87 60.56 1nd4 n SER 54 Cb 0.39 -1.25 0.00 0.00 -1.01 0.00 0.00 64.21 62.34 1nd4 n SER 54 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1nd4 n GLY 55 N 1.56 4.15 0.00 0.23 0.00 -1.26 -4.95 105.19 104.93 1nd4 n GLY 55 Ca 0.11 -0.42 0.03 0.00 0.00 0.00 0.00 46.02 45.75 1nd4 n GLY 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nd4 n ALA 56 N -1.22 1.49 0.70 4.61 0.00 -1.26 -2.41 120.51 122.42 1nd4 n ALA 56 Ca 0.00 -0.03 0.08 0.00 0.00 0.00 0.00 53.44 53.49 1nd4 n ALA 56 Cb 0.00 -1.11 0.04 0.00 0.00 0.00 0.00 19.45 18.38 1nd4 n ALA 56 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1nd4 n LEU 57 N -1.30 2.02 0.00 0.00 4.77 -1.26 -4.44 117.00 116.79 1nd4 n LEU 57 Ca 0.03 -0.89 0.14 0.00 -0.03 0.00 0.00 56.01 55.27 1nd4 n LEU 57 Cb 0.05 0.00 0.82 0.00 -2.33 0.00 0.00 43.42 41.96 1nd4 n LEU 57 CO 0.05 0.37 1.02 -0.46 -1.33 0.00 0.00 177.39 177.04 1nd4 n ASN 58 N 0.43 0.00 -0.69 -1.43 0.23 -1.01 -4.89 115.26 107.90 1nd4 n ASN 58 Ca 0.08 -0.68 -0.08 0.00 -0.53 0.00 0.00 54.58 53.38 1nd4 n ASN 58 Cb 0.38 -0.08 -0.03 0.00 -2.08 0.00 0.00 39.78 37.96 1nd4 n ASN 58 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 1nd4 n GLU 59 N -1.08 -1.70 -0.04 -3.83 1.02 -1.26 -4.84 120.64 108.91 1nd4 n GLU 59 Ca 0.19 0.65 -0.14 0.00 -0.02 0.00 0.00 57.16 57.84 1nd4 n GLU 59 Cb 0.14 -4.80 -0.11 0.00 -0.02 0.00 0.00 31.44 26.64 1nd4 n GLU 59 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1nd4 h LEU 60 N 0.00 0.09 -1.07 -4.62 3.38 -1.90 -2.20 115.31 108.98 1nd4 h LEU 60 Ca -0.15 -0.76 -0.06 0.00 0.09 0.00 0.00 57.88 57.00 1nd4 h LEU 60 Cb 0.90 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.60 1nd4 h LEU 60 CO 0.23 0.83 0.02 1.56 0.09 0.00 0.00 178.44 181.17 1nd4 h GLN 61 N -0.65 0.68 -0.36 1.13 1.08 -1.93 -2.09 115.11 112.97 1nd4 h GLN 61 Ca -0.01 -0.16 -0.00 0.00 -1.45 0.00 0.00 58.65 57.03 1nd4 h GLN 61 Cb 0.84 -0.09 -0.02 0.00 -0.05 0.00 0.00 27.48 28.16 1nd4 h GLN 61 CO 0.02 0.68 0.22 -0.44 -0.95 0.00 0.00 178.83 178.36 1nd4 h ASP 62 N 0.65 0.43 -0.51 1.46 3.32 -1.88 -1.78 116.42 118.11 1nd4 h ASP 62 Ca 0.14 -0.05 -0.06 0.00 0.02 0.00 0.00 57.03 57.08 1nd4 h ASP 62 Cb 0.37 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 39.79 1nd4 h ASP 62 CO 0.01 0.36 0.08 -0.08 -1.72 0.00 0.00 179.24 177.89 1nd4 h GLU 63 N 0.47 0.84 -0.07 3.56 4.81 -1.09 -0.17 114.58 122.94 1nd4 h GLU 63 Ca 0.13 -0.23 0.03 0.00 -0.13 0.00 0.00 59.36 59.17 1nd4 h GLU 63 Cb -0.00 -0.10 -0.04 0.00 0.63 0.00 0.00 28.75 29.24 1nd4 h GLU 63 CO -0.02 0.84 -0.16 0.00 -0.73 0.00 0.00 179.01 178.93 1nd4 h ALA 64 N 0.97 -0.13 -0.56 2.92 0.00 -1.20 0.86 119.26 122.13 1nd4 h ALA 64 Ca 0.15 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 1nd4 h ALA 64 Cb 0.40 0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 1nd4 h ALA 64 CO 0.01 -0.63 0.34 0.00 0.00 0.00 0.00 179.25 178.98 1nd4 h ALA 65 N 0.78 0.72 -0.33 0.00 0.00 -1.17 -0.65 119.26 118.61 1nd4 h ALA 65 Ca 0.08 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 1nd4 h ALA 65 Cb 0.33 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1nd4 h ALA 65 CO -0.20 0.19 -0.03 0.00 0.00 0.00 0.00 179.25 179.20 1nd4 h ARG 66 N 0.76 0.60 -0.60 0.00 3.08 -0.42 -1.72 114.38 116.08 1nd4 h ARG 66 Ca 0.20 -0.21 -0.00 0.00 0.07 0.00 0.00 59.98 60.04 1nd4 h ARG 66 Cb -0.03 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 29.95 1nd4 h ARG 66 CO -0.04 0.75 0.36 -0.07 -1.07 0.00 0.00 179.97 179.90 1nd4 h LEU 67 N 0.39 0.72 -1.06 3.04 3.38 0.89 0.11 115.31 122.79 1nd4 h LEU 67 Ca 0.09 -0.06 0.01 0.00 0.09 0.00 0.00 57.88 58.01 1nd4 h LEU 67 Cb 0.50 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 41.02 1nd4 h LEU 67 CO 0.02 0.57 0.63 0.28 0.09 0.00 0.00 178.44 180.04 1nd4 h SER 68 N 0.81 1.09 -0.03 -0.43 0.02 -1.00 -1.41 113.55 112.60 1nd4 h SER 68 Ca 0.21 -0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 61.12 1nd4 h SER 68 Cb -0.01 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 62.25 1nd4 h SER 68 CO -0.04 0.79 -0.07 -0.25 -1.14 0.00 0.00 176.83 176.12 1nd4 h TRP 69 N 1.29 0.12 -0.57 3.45 7.01 -0.70 -3.20 115.95 123.36 1nd4 h TRP 69 Ca 0.35 -0.05 0.11 0.00 2.11 0.00 0.00 58.89 61.41 1nd4 h TRP 69 Cb -0.14 -0.02 -0.03 0.00 -2.10 0.00 0.00 29.16 26.86 1nd4 h TRP 69 CO -0.00 0.66 0.39 1.25 -2.79 0.00 0.00 178.44 177.94 1nd4 h LEU 70 N -0.44 0.29 -1.52 0.65 5.85 -0.57 -1.03 115.31 118.54 1nd4 h LEU 70 Ca 0.00 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.72 1nd4 h LEU 70 Cb 0.65 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.61 1nd4 h LEU 70 CO 0.01 0.17 0.19 0.00 -0.34 0.00 0.00 178.44 178.48 1nd4 h ALA 71 N 1.71 1.63 0.00 1.25 0.00 -1.25 -1.58 119.26 121.02 1nd4 h ALA 71 Ca 0.26 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1nd4 h ALA 71 Cb 0.61 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1nd4 h ALA 71 CO -0.06 0.31 0.00 0.25 0.00 0.00 0.00 179.25 179.74 1nd4 n THR 72 N -4.43 0.77 0.75 0.00 -2.24 -0.39 -2.87 114.28 105.87 1nd4 n THR 72 Ca 0.02 0.15 0.12 0.00 -2.27 0.00 0.00 64.05 62.07 1nd4 n THR 72 Cb 0.11 -0.95 0.17 0.00 -2.10 0.00 0.00 70.33 67.55 1nd4 n THR 72 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1nd4 n THR 73 N -1.85 0.17 -0.01 4.28 -2.24 -0.60 -4.95 114.28 109.08 1nd4 n THR 73 Ca 0.04 -0.15 0.00 0.00 -2.27 0.00 0.00 64.05 61.67 1nd4 n THR 73 Cb 0.24 0.12 0.00 0.00 -2.10 0.00 0.00 70.33 68.59 1nd4 n THR 73 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1nd4 n GLY 74 N 1.41 0.34 3.67 3.38 0.00 -1.14 -5.05 105.19 107.81 1nd4 n GLY 74 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 1nd4 n GLY 74 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nd4 s VAL 75 N -2.12 4.78 0.32 1.61 1.01 -1.24 -5.00 120.40 119.76 1nd4 s VAL 75 Ca 0.00 1.92 -0.29 0.00 0.00 0.00 0.00 61.98 63.61 1nd4 s VAL 75 Cb 0.00 -4.26 -0.11 0.00 0.00 0.00 0.00 36.38 32.01 1nd4 s VAL 75 CO 0.00 -0.05 1.51 -2.16 0.00 0.00 0.00 175.10 174.40 1nd4 s PRO 76 N 2.45 4.15 0.21 2.72 0.04 -1.26 -4.45 135.00 138.86 1nd4 s PRO 76 Ca 0.44 2.51 -0.16 0.00 0.04 0.00 0.00 61.00 63.83 1nd4 s PRO 76 Cb -0.17 -3.02 0.06 0.00 0.04 0.00 0.00 34.50 31.41 1nd4 s PRO 76 CO 0.12 -0.53 0.77 0.00 0.04 0.00 0.00 177.00 177.40 1nd4 s ALA 78 N -1.86 3.45 0.18 0.00 0.00 -1.25 -4.85 121.76 117.43 1nd4 s ALA 78 Ca 0.17 0.98 -0.30 0.00 0.00 0.00 0.00 51.96 52.80 1nd4 s ALA 78 Cb -0.03 -3.42 -0.08 0.00 0.00 0.00 0.00 23.12 19.60 1nd4 s ALA 78 CO 0.06 -0.39 1.11 0.00 0.00 0.00 0.00 175.76 176.54 1nd4 s ALA 79 N -0.16 3.37 -0.45 0.00 0.00 -1.26 -4.81 121.76 118.45 1nd4 s ALA 79 Ca 0.52 0.82 -0.25 0.00 0.00 0.00 0.00 51.96 53.06 1nd4 s ALA 79 Cb -0.33 -3.36 0.03 0.00 0.00 0.00 0.00 23.12 19.46 1nd4 s ALA 79 CO 0.38 -0.22 0.87 0.08 0.00 0.00 0.00 175.76 176.87 1nd4 s VAL 80 N -0.22 4.54 -0.05 0.00 1.01 -1.26 -0.81 120.40 123.61 1nd4 s VAL 80 Ca 0.50 0.63 -0.03 0.00 0.00 0.00 0.00 61.98 63.07 1nd4 s VAL 80 Cb -0.30 -4.39 -0.27 0.00 0.00 0.00 0.00 36.38 31.42 1nd4 s VAL 80 CO 0.35 -0.78 0.65 -0.07 0.00 0.00 0.00 175.10 175.25 1nd4 h LEU 81 N 10.39 0.39 -7.00 3.92 3.38 -1.34 -3.49 115.31 121.56 1nd4 h LEU 81 Ca -0.24 -0.66 0.27 0.00 0.09 0.00 0.00 57.88 57.33 1nd4 h LEU 81 Cb 1.08 -0.13 -0.22 0.00 0.09 0.00 0.00 40.66 41.48 1nd4 h LEU 81 CO 1.00 1.57 0.89 -0.62 0.09 0.00 0.00 178.44 181.37 1nd4 s ASP 82 N -6.93 -0.08 -0.02 -0.43 2.15 -1.12 -5.00 116.67 105.23 1nd4 s ASP 82 Ca -0.14 0.03 0.01 0.00 0.43 0.00 0.00 52.55 52.88 1nd4 s ASP 82 Cb 0.07 0.08 0.02 0.00 -0.30 0.00 0.00 42.92 42.78 1nd4 s ASP 82 CO 0.82 -0.12 -0.01 -0.69 -0.17 0.00 0.00 175.17 175.01 1nd4 s VAL 83 N -1.83 0.22 -0.00 1.11 1.01 -1.26 -1.03 120.40 118.62 1nd4 s VAL 83 Ca 0.09 -0.00 -0.11 0.00 0.00 0.00 0.00 61.98 61.96 1nd4 s VAL 83 Cb -0.01 -0.26 0.01 0.00 0.00 0.00 0.00 36.38 36.12 1nd4 s VAL 83 CO -0.04 0.12 0.23 0.54 0.00 0.00 0.00 175.10 175.94 1nd4 s VAL 84 N 0.61 0.07 -0.30 2.92 0.11 -0.21 -4.99 120.40 118.61 1nd4 s VAL 84 Ca -0.06 -0.58 0.03 0.00 -2.93 0.00 0.00 61.98 58.43 1nd4 s VAL 84 Cb -0.09 -0.53 0.08 0.00 -1.53 0.00 0.00 36.38 34.31 1nd4 s VAL 84 CO -0.01 -0.32 -0.03 -0.89 -3.33 0.00 0.00 175.10 170.52 1nd4 s THR 85 N -1.37 2.30 -0.20 5.04 2.01 -1.26 0.59 115.64 122.75 1nd4 s THR 85 Ca -0.14 -1.93 0.01 0.00 0.31 0.00 0.00 61.69 59.94 1nd4 s THR 85 Cb -0.06 -2.50 0.03 0.00 0.01 0.00 0.00 72.50 69.98 1nd4 s THR 85 CO 0.03 -0.29 -0.16 -0.70 -0.69 0.00 0.00 174.62 172.81 1nd4 s GLU 86 N 1.03 2.63 -1.13 4.92 2.12 -0.10 -4.83 118.70 123.33 1nd4 s GLU 86 Ca -0.00 -0.93 -0.09 0.00 0.36 0.00 0.00 54.97 54.31 1nd4 s GLU 86 Cb -0.20 -2.58 -0.03 0.00 0.26 0.00 0.00 34.13 31.58 1nd4 s GLU 86 CO -0.06 -0.32 0.85 0.00 -0.54 0.00 0.00 175.26 175.19 1nd4 n ALA 87 N 4.60 -2.38 -3.40 6.30 0.00 -1.26 -3.23 120.51 121.13 1nd4 n ALA 87 Ca -0.18 -0.04 -0.18 0.00 0.00 0.00 0.00 53.44 53.04 1nd4 n ALA 87 Cb 0.48 -4.35 0.08 0.00 0.00 0.00 0.00 19.45 15.66 1nd4 n ALA 87 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nd4 n GLY 88 N -1.41 -0.36 3.64 0.00 0.00 -1.26 -5.01 105.19 100.79 1nd4 n GLY 88 Ca -0.14 0.11 -0.04 0.00 0.00 0.00 0.00 46.02 45.95 1nd4 n GLY 88 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1nd4 s ARG 89 N -5.56 0.50 0.04 1.61 3.52 -1.20 -3.77 118.95 114.08 1nd4 s ARG 89 Ca 0.16 0.84 -0.09 0.00 -0.13 0.00 0.00 55.73 56.51 1nd4 s ARG 89 Cb -0.07 0.11 -0.05 0.00 -1.56 0.00 0.00 34.95 33.37 1nd4 s ARG 89 CO 0.69 -0.10 0.34 -0.51 -0.81 0.00 0.00 175.30 174.90 1nd4 s ASP 90 N 1.36 6.58 -0.03 -2.12 1.01 -0.30 -0.93 116.67 122.24 1nd4 s ASP 90 Ca -0.09 0.70 0.03 0.00 0.71 0.00 0.00 52.55 53.90 1nd4 s ASP 90 Cb -0.04 -2.14 0.00 0.00 1.01 0.00 0.00 42.92 41.75 1nd4 s ASP 90 CO -0.16 0.22 -0.11 0.26 0.21 0.00 0.00 175.17 175.59 1nd4 s TRP 91 N -1.33 1.16 -0.13 4.23 0.52 0.20 -2.56 118.94 121.04 1nd4 s TRP 91 Ca 0.30 -0.31 0.01 0.00 0.02 0.00 0.00 56.10 56.12 1nd4 s TRP 91 Cb -0.14 -0.82 0.02 0.00 -1.15 0.00 0.00 33.47 31.38 1nd4 s TRP 91 CO 0.17 -0.13 -0.16 -1.17 0.02 0.00 0.00 176.95 175.68 1nd4 s LEU 92 N 0.22 1.77 -0.23 2.99 2.96 0.12 -1.05 118.68 125.45 1nd4 s LEU 92 Ca -0.04 -0.47 -0.07 0.00 -0.22 0.00 0.00 54.13 53.33 1nd4 s LEU 92 Cb -0.10 -1.17 -0.03 0.00 0.50 0.00 0.00 46.19 45.39 1nd4 s LEU 92 CO 0.01 0.00 0.06 -0.22 -1.32 0.00 0.00 176.35 174.88 1nd4 s LEU 93 N 1.12 3.43 0.11 -0.68 0.20 -0.20 -0.82 118.68 121.84 1nd4 s LEU 93 Ca -0.03 -0.19 0.07 0.00 0.69 0.00 0.00 54.13 54.68 1nd4 s LEU 93 Cb -0.14 -1.91 -0.04 0.00 -0.43 0.00 0.00 46.19 43.68 1nd4 s LEU 93 CO -0.05 0.00 -0.18 -0.76 -0.29 0.00 0.00 176.35 175.07 1nd4 s LEU 94 N 1.40 2.34 0.91 -0.68 1.43 0.08 -0.84 118.68 123.32 1nd4 s LEU 94 Ca 0.05 -0.73 -0.14 0.00 -1.03 0.00 0.00 54.13 52.27 1nd4 s LEU 94 Cb -0.15 -0.75 0.16 0.00 0.03 0.00 0.00 46.19 45.48 1nd4 s LEU 94 CO 0.03 -0.02 1.27 -0.83 0.23 0.00 0.00 176.35 177.03 1nd4 s GLY 95 N -2.14 1.72 0.19 -3.19 0.00 0.01 -1.09 107.32 102.82 1nd4 s GLY 95 Ca 0.07 -1.05 -0.17 0.00 0.00 0.00 0.00 44.72 43.57 1nd4 s GLY 95 CO 0.04 -0.37 0.65 1.85 0.00 0.00 0.00 173.10 175.27 1nd4 s GLU 96 N -5.78 4.14 -0.31 2.90 2.12 -1.21 -4.34 118.70 116.21 1nd4 s GLU 96 Ca 0.70 0.71 -0.10 0.00 0.36 0.00 0.00 54.97 56.64 1nd4 s GLU 96 Cb -0.06 -2.91 -0.01 0.00 0.26 0.00 0.00 34.13 31.41 1nd4 s GLU 96 CO 0.52 0.43 0.17 0.08 -0.54 0.00 0.00 175.26 175.92 1nd4 s VAL 97 N -1.49 4.78 0.43 3.70 1.01 -1.26 -4.78 120.40 122.80 1nd4 s VAL 97 Ca 0.41 -0.33 -0.23 0.00 0.00 0.00 0.00 61.98 61.83 1nd4 s VAL 97 Cb -0.16 -3.42 -0.11 0.00 0.00 0.00 0.00 36.38 32.69 1nd4 s VAL 97 CO 0.20 0.07 0.76 -2.65 0.00 0.00 0.00 175.10 173.48 1nd4 n PRO 98 N 5.01 0.88 0.00 2.72 -0.02 -1.26 -4.83 135.00 137.51 1nd4 n PRO 98 Ca -0.14 0.32 0.00 0.00 -2.02 0.00 0.00 63.50 61.67 1nd4 n PRO 98 Cb 0.49 -1.76 0.00 0.00 -0.02 0.00 0.00 33.50 32.22 1nd4 n PRO 98 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1nd4 n GLY 99 N 1.52 -0.85 3.35 -1.23 0.00 -1.26 -4.45 105.19 102.27 1nd4 n GLY 99 Ca 0.11 -1.72 -0.21 0.00 0.00 0.00 0.00 46.02 44.20 1nd4 n GLY 99 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1nd4 s GLN 100 N 0.00 1.33 0.52 1.61 -0.21 -0.72 -4.91 119.66 117.29 1nd4 s GLN 100 Ca 0.00 -1.50 -0.19 0.00 0.02 0.00 0.00 55.36 53.69 1nd4 s GLN 100 Cb 0.00 -1.31 -0.07 0.00 1.00 0.00 0.00 33.01 32.63 1nd4 s GLN 100 CO 0.00 0.25 1.05 0.16 -2.12 0.00 0.00 175.29 174.63 1nd4 s ASP 101 N -2.95 6.13 0.43 5.90 -4.77 -1.26 -0.44 116.67 119.70 1nd4 s ASP 101 Ca 0.19 1.91 0.13 0.00 -3.30 0.00 0.00 52.55 51.48 1nd4 s ASP 101 Cb -0.04 -2.55 1.01 0.00 -1.09 0.00 0.00 42.92 40.24 1nd4 s ASP 101 CO 0.07 -0.93 1.96 -0.07 0.70 0.00 0.00 175.17 176.91 1nd4 h LEU 102 N 1.17 0.40 -0.23 2.11 3.38 -0.36 -1.55 115.31 120.23 1nd4 h LEU 102 Ca -0.49 0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.45 1nd4 h LEU 102 Cb 1.22 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.89 1nd4 h LEU 102 CO 0.58 0.24 -0.04 0.25 0.09 0.00 0.00 178.44 179.56 1nd4 h LEU 103 N 0.44 0.42 -0.52 1.67 5.85 -1.85 -3.25 115.31 118.08 1nd4 h LEU 103 Ca 0.30 -0.35 -0.16 0.00 0.84 0.00 0.00 57.88 58.51 1nd4 h LEU 103 Cb 0.58 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.48 1nd4 h LEU 103 CO -0.09 0.67 -0.72 0.28 -0.34 0.00 0.00 178.44 178.24 1nd4 h SER 104 N 0.17 0.18 -3.53 1.25 0.02 -1.83 -3.46 113.55 106.36 1nd4 h SER 104 Ca 0.06 -0.12 -0.57 0.00 -0.84 0.00 0.00 61.79 60.32 1nd4 h SER 104 Cb 0.48 -0.05 0.16 0.00 0.14 0.00 0.00 62.40 63.13 1nd4 h SER 104 CO 0.02 0.84 0.08 -1.54 -1.14 0.00 0.00 176.83 175.09 1nd4 n SER 105 N -3.75 0.61 -1.32 3.07 3.41 -0.62 -4.87 113.62 110.14 1nd4 n SER 105 Ca -0.02 0.80 0.05 0.00 -0.26 0.00 0.00 58.87 59.44 1nd4 n SER 105 Cb 0.70 -1.37 0.26 0.00 -0.26 0.00 0.00 64.21 63.54 1nd4 n SER 105 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1nd4 n HIS 106 N -1.74 1.24 -1.68 7.33 -0.00 -1.26 -4.95 115.22 114.16 1nd4 n HIS 106 Ca 0.14 -0.45 -0.35 0.00 -0.00 0.00 0.00 57.72 57.06 1nd4 n HIS 106 Cb 0.47 -0.30 0.07 0.00 -0.00 0.00 0.00 29.99 30.23 1nd4 n HIS 106 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 1nd4 s LEU 107 N -1.66 3.45 0.70 2.41 1.43 -1.26 -4.99 118.68 118.76 1nd4 s LEU 107 Ca 0.36 2.34 -0.13 0.00 -1.03 0.00 0.00 54.13 55.67 1nd4 s LEU 107 Cb 0.25 -4.59 0.02 0.00 0.03 0.00 0.00 46.19 41.90 1nd4 s LEU 107 CO 0.13 -1.95 1.09 0.00 0.23 0.00 0.00 176.35 175.84 1nd4 s ALA 108 N -1.86 2.47 0.19 4.21 0.00 -1.26 -4.79 121.76 120.71 1nd4 s ALA 108 Ca 0.75 0.34 -0.16 0.00 0.00 0.00 0.00 51.96 52.88 1nd4 s ALA 108 Cb -0.29 -3.26 0.15 0.00 0.00 0.00 0.00 23.12 19.72 1nd4 s ALA 108 CO 0.40 -1.38 1.64 -1.35 0.00 0.00 0.00 175.76 175.07 1nd4 h PRO 109 N -0.47 -0.05 -0.83 0.00 0.11 -1.99 -1.36 132.00 127.42 1nd4 h PRO 109 Ca -0.45 0.00 0.14 0.00 0.11 0.00 0.00 66.00 65.80 1nd4 h PRO 109 Cb 1.23 0.01 -0.06 0.00 0.11 0.00 0.00 31.00 32.29 1nd4 h PRO 109 CO 0.54 -0.03 0.54 0.00 -0.21 0.00 0.00 178.00 178.84 1nd4 h ALA 110 N 1.39 1.92 -0.09 -0.75 0.00 -2.00 -0.21 119.26 119.52 1nd4 h ALA 110 Ca 0.24 0.01 -0.16 0.00 0.00 0.00 0.00 54.91 55.00 1nd4 h ALA 110 Cb 0.41 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.10 1nd4 h ALA 110 CO -0.54 -0.14 -0.56 0.93 0.00 0.00 0.00 179.25 178.95 1nd4 h GLU 111 N 0.60 0.54 0.20 0.00 3.07 -1.65 -2.77 114.58 114.57 1nd4 h GLU 111 Ca 0.41 -0.46 -0.01 0.00 -0.50 0.00 0.00 59.36 58.80 1nd4 h GLU 111 Cb 0.72 0.10 -0.00 0.00 -0.84 0.00 0.00 28.75 28.73 1nd4 h GLU 111 CO -0.16 1.09 -0.11 0.87 -1.40 0.00 0.00 179.01 179.29 1nd4 h LYS 112 N 0.15 -0.28 0.00 2.33 1.57 -0.21 -0.47 116.57 119.65 1nd4 h LYS 112 Ca -0.04 0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.72 1nd4 h LYS 112 Cb 1.21 0.06 -0.00 0.00 0.08 0.00 0.00 32.23 33.58 1nd4 h LYS 112 CO 0.11 -0.19 -0.16 -0.39 -0.57 0.00 0.00 179.45 178.25 1nd4 h VAL 113 N -0.29 1.08 -0.23 0.50 -1.51 -1.20 0.31 116.25 114.90 1nd4 h VAL 113 Ca -0.02 -0.56 -0.19 0.00 -1.23 0.00 0.00 66.70 64.70 1nd4 h VAL 113 Cb 0.24 1.31 0.00 0.00 -2.13 0.00 0.00 31.29 30.70 1nd4 h VAL 113 CO 0.03 0.16 -0.61 -1.28 -1.23 0.00 0.00 177.57 174.64 1nd4 h SER 114 N 0.00 0.89 -0.34 4.19 0.87 -1.16 -0.31 113.55 117.69 1nd4 h SER 114 Ca -0.00 -0.51 -0.14 0.00 -1.23 0.00 0.00 61.79 59.91 1nd4 h SER 114 Cb 0.29 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 61.99 1nd4 h SER 114 CO 0.02 1.29 -0.34 0.40 -0.53 0.00 0.00 176.83 177.67 1nd4 h ILE 115 N 0.59 1.28 -0.58 2.23 2.04 -0.58 -0.59 117.51 121.90 1nd4 h ILE 115 Ca -0.00 -1.52 -0.02 0.00 1.00 0.00 0.00 64.86 64.32 1nd4 h ILE 115 Cb 1.21 1.47 -0.03 0.00 -0.74 0.00 0.00 36.82 38.73 1nd4 h ILE 115 CO 0.13 0.50 0.30 -0.03 0.00 0.00 0.00 178.15 179.04 1nd4 h MET 116 N 0.63 0.83 -0.68 2.37 4.05 -0.88 -0.37 114.93 120.87 1nd4 h MET 116 Ca 0.05 -0.11 -0.08 0.00 -0.28 0.00 0.00 59.70 59.28 1nd4 h MET 116 Cb 0.93 -0.15 -0.03 0.00 -0.80 0.00 0.00 31.60 31.55 1nd4 h MET 116 CO 0.09 0.66 0.11 0.00 0.23 0.00 0.00 176.91 178.00 1nd4 h ALA 117 N 1.13 0.90 -0.28 0.39 0.00 -0.92 -1.64 119.26 118.83 1nd4 h ALA 117 Ca 0.20 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.85 1nd4 h ALA 117 Cb 0.09 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 1nd4 h ALA 117 CO -0.03 0.67 0.17 -0.44 0.00 0.00 0.00 179.25 179.62 1nd4 h ASP 118 N 1.05 0.28 0.16 0.00 3.32 -0.68 -0.81 116.42 119.75 1nd4 h ASP 118 Ca 0.21 -0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.25 1nd4 h ASP 118 Cb 0.44 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.93 1nd4 h ASP 118 CO 0.01 0.20 -0.08 0.00 -1.72 0.00 0.00 179.24 177.66 1nd4 h ALA 119 N 1.12 -0.22 -0.01 3.45 0.00 -0.85 -2.04 119.26 120.71 1nd4 h ALA 119 Ca 0.11 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1nd4 h ALA 119 Cb -0.01 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 1nd4 h ALA 119 CO -0.04 -0.59 -0.00 0.52 0.00 0.00 0.00 179.25 179.13 1nd4 h MET 120 N -0.29 -0.00 -0.52 0.00 2.86 -1.22 -1.88 114.93 113.88 1nd4 h MET 120 Ca -0.02 0.00 0.05 0.00 -2.06 0.00 0.00 59.70 57.66 1nd4 h MET 120 Cb 0.22 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 31.84 1nd4 h MET 120 CO 0.04 -0.00 0.26 0.00 1.06 0.00 0.00 176.91 178.27 1nd4 h ARG 121 N -0.00 0.50 0.06 1.72 3.08 -1.15 0.64 114.38 119.22 1nd4 h ARG 121 Ca 0.01 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.02 1nd4 h ARG 121 Cb 0.01 -0.11 -0.00 0.00 0.08 0.00 0.00 29.97 29.95 1nd4 h ARG 121 CO -0.01 0.33 -0.03 -0.09 -1.07 0.00 0.00 179.97 179.09 1nd4 h ARG 122 N 0.51 -0.09 -0.58 0.04 2.43 -1.19 -1.82 114.38 113.69 1nd4 h ARG 122 Ca 0.23 0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.37 1nd4 h ARG 122 Cb 0.14 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.68 1nd4 h ARG 122 CO -0.16 -0.06 0.24 1.25 -1.51 0.00 0.00 179.97 179.74 1nd4 h LEU 123 N -0.09 0.79 0.00 3.80 5.85 -1.14 -2.28 115.31 122.24 1nd4 h LEU 123 Ca -0.00 -0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.55 1nd4 h LEU 123 Cb 0.08 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 40.90 1nd4 h LEU 123 CO 0.00 0.73 0.00 1.41 -0.34 0.00 0.00 178.44 180.25 1nd4 n HIS 124 N -4.50 0.00 0.16 1.25 8.25 0.20 -2.32 115.22 118.27 1nd4 n HIS 124 Ca 0.03 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.60 1nd4 n HIS 124 Cb 0.15 -0.10 -0.08 0.00 1.12 0.00 0.00 29.99 31.09 1nd4 n HIS 124 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 1nd4 n THR 125 N -1.10 0.23 -1.72 1.59 -1.04 -0.70 -4.72 114.28 106.83 1nd4 n THR 125 Ca 0.11 -0.45 -0.37 0.00 -2.04 0.00 0.00 64.05 61.30 1nd4 n THR 125 Cb 0.09 -0.04 0.07 0.00 -1.82 0.00 0.00 70.33 68.62 1nd4 n THR 125 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1nd4 n LEU 126 N -2.32 5.71 -4.62 -4.42 4.77 -0.98 -4.88 117.00 110.26 1nd4 n LEU 126 Ca -0.01 0.84 -0.43 0.00 -0.03 0.00 0.00 56.01 56.38 1nd4 n LEU 126 Cb 0.53 -1.54 -0.02 0.00 -2.33 0.00 0.00 43.42 40.06 1nd4 n LEU 126 CO 0.43 -1.07 1.31 -0.62 -1.33 0.00 0.00 177.39 176.11 1nd4 s ASP 127 N -1.32 6.39 0.62 -1.43 -1.08 -1.26 -4.57 116.67 114.01 1nd4 s ASP 127 Ca 0.81 1.35 0.37 0.00 -0.52 0.00 0.00 52.55 54.56 1nd4 s ASP 127 Cb -0.39 -2.53 2.05 0.00 -1.46 0.00 0.00 42.92 40.58 1nd4 s ASP 127 CO 0.42 -1.30 2.28 1.55 0.52 0.00 0.00 175.17 178.64 1nd4 h PRO 128 N 10.63 0.00 0.00 4.34 0.13 -1.89 -1.47 132.00 143.73 1nd4 h PRO 128 Ca -0.31 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.79 1nd4 h PRO 128 Cb 1.13 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.26 1nd4 h PRO 128 CO 1.03 0.01 -0.15 0.00 -0.23 0.00 0.00 178.00 178.66 1nd4 h ALA 129 N 1.99 1.25 -0.00 -0.56 0.00 -1.96 -1.99 119.26 117.98 1nd4 h ALA 129 Ca -0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1nd4 h ALA 129 Cb 0.07 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1nd4 h ALA 129 CO 0.00 0.19 -0.11 0.25 0.00 0.00 0.00 179.25 179.58 1nd4 n THR 130 N -3.63 0.00 -3.44 0.00 -2.24 -0.55 -4.80 114.28 99.62 1nd4 n THR 130 Ca -0.01 -0.03 -0.38 0.00 -2.27 0.00 0.00 64.05 61.35 1nd4 n THR 130 Cb 0.28 -0.22 -0.08 0.00 -2.10 0.00 0.00 70.33 68.20 1nd4 n THR 130 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1nd4 n PRO 132 N 4.78 1.24 -3.64 0.00 -0.04 -1.26 -4.77 135.00 131.31 1nd4 n PRO 132 Ca -0.10 -0.35 -0.40 0.00 -0.04 0.00 0.00 63.50 62.62 1nd4 n PRO 132 Cb 0.51 -1.42 -0.11 0.00 -0.04 0.00 0.00 33.50 32.44 1nd4 n PRO 132 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1nd4 s PHE 133 N -1.97 3.22 -0.56 0.54 0.08 -1.26 -5.04 117.98 112.99 1nd4 s PHE 133 Ca 0.38 -0.89 -0.23 0.00 0.12 0.00 0.00 56.93 56.31 1nd4 s PHE 133 Cb 0.18 -2.39 0.05 0.00 -0.57 0.00 0.00 43.02 40.29 1nd4 s PHE 133 CO 0.30 -0.60 0.87 0.34 -0.10 0.00 0.00 175.22 176.03 1nd4 s ASP 134 N 1.55 6.28 -0.33 1.36 -1.08 -1.26 -0.50 116.67 122.69 1nd4 s ASP 134 Ca 0.02 -0.61 0.07 0.00 -0.52 0.00 0.00 52.55 51.52 1nd4 s ASP 134 Cb -0.18 -2.40 0.53 0.00 -1.46 0.00 0.00 42.92 39.41 1nd4 s ASP 134 CO 0.06 -1.18 1.55 1.41 0.52 0.00 0.00 175.17 177.52 1nd4 n HIS 135 N 7.19 1.54 -1.46 -5.34 8.25 -0.01 -4.88 115.22 120.50 1nd4 n HIS 135 Ca -0.01 -1.73 -0.36 0.00 -0.26 0.00 0.00 57.72 55.36 1nd4 n HIS 135 Cb 0.47 -0.59 0.09 0.00 1.12 0.00 0.00 29.99 31.07 1nd4 n HIS 135 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1nd4 n GLN 136 N -1.11 0.70 -0.29 -0.41 10.64 -1.04 -4.46 117.38 121.41 1nd4 n GLN 136 Ca 0.39 0.30 0.10 0.00 -1.83 0.00 0.00 57.00 55.96 1nd4 n GLN 136 Cb 1.12 -2.39 0.24 0.00 -0.86 0.00 0.00 30.24 28.35 1nd4 n GLN 136 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1nd4 h ALA 137 N -0.05 1.06 -0.55 2.61 0.00 -1.96 -0.85 119.26 119.52 1nd4 h ALA 137 Ca -0.49 0.25 0.09 0.00 0.00 0.00 0.00 54.91 54.76 1nd4 h ALA 137 Cb 1.33 0.40 -0.07 0.00 0.00 0.00 0.00 17.79 19.45 1nd4 h ALA 137 CO 0.49 -0.47 0.17 -0.22 0.00 0.00 0.00 179.25 179.23 1nd4 h LYS 138 N 0.13 0.33 -0.40 0.00 3.64 -1.98 -0.39 116.57 117.90 1nd4 h LYS 138 Ca 0.50 -0.02 -0.13 0.00 -1.27 0.00 0.00 60.65 59.73 1nd4 h LYS 138 Cb 0.98 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.71 1nd4 h LYS 138 CO -0.70 0.22 -0.28 0.45 -2.27 0.00 0.00 179.45 176.87 1nd4 h HIS 139 N 0.34 0.99 -0.16 1.91 3.86 -1.50 -2.66 115.15 117.92 1nd4 h HIS 139 Ca 0.28 -0.25 -0.13 0.00 -1.16 0.00 0.00 60.37 59.11 1nd4 h HIS 139 Cb 0.35 -0.23 -0.01 0.00 1.06 0.00 0.00 27.41 28.58 1nd4 h HIS 139 CO -0.19 1.03 -0.44 0.00 0.86 0.00 0.00 177.93 179.19 1nd4 h ARG 140 N 0.73 0.39 -0.39 2.45 2.47 -0.89 -0.03 114.38 119.10 1nd4 h ARG 140 Ca 0.09 -0.20 -0.03 0.00 -1.26 0.00 0.00 59.98 58.58 1nd4 h ARG 140 Cb 0.83 0.01 -0.02 0.00 -1.65 0.00 0.00 29.97 29.14 1nd4 h ARG 140 CO 0.07 0.76 0.14 0.82 0.56 0.00 0.00 179.97 182.32 1nd4 h ILE 141 N 0.32 1.20 -0.65 2.04 2.04 -1.04 0.18 117.51 121.59 1nd4 h ILE 141 Ca 0.02 -0.65 -0.05 0.00 1.00 0.00 0.00 64.86 65.18 1nd4 h ILE 141 Cb 0.91 0.89 -0.03 0.00 -0.74 0.00 0.00 36.82 37.85 1nd4 h ILE 141 CO 0.08 0.23 0.19 -0.08 0.00 0.00 0.00 178.15 178.57 1nd4 h GLU 142 N 0.49 1.02 -0.70 2.37 4.57 -1.19 -0.39 114.58 120.76 1nd4 h GLU 142 Ca 0.13 -0.23 -0.06 0.00 -1.18 0.00 0.00 59.36 58.03 1nd4 h GLU 142 Cb 0.22 -0.14 -0.03 0.00 -0.16 0.00 0.00 28.75 28.63 1nd4 h GLU 142 CO -0.01 0.90 0.21 -0.09 -1.18 0.00 0.00 179.01 178.84 1nd4 h ARG 143 N 0.95 1.08 -0.77 1.92 9.65 -0.68 -1.67 114.38 124.86 1nd4 h ARG 143 Ca 0.21 -0.23 -0.03 0.00 -1.10 0.00 0.00 59.98 58.83 1nd4 h ARG 143 Cb 0.31 -0.16 -0.04 0.00 -1.39 0.00 0.00 29.97 28.70 1nd4 h ARG 143 CO -0.00 0.92 0.35 0.00 2.80 0.00 0.00 179.97 184.04 1nd4 h ALA 144 N 1.19 1.17 -0.35 2.80 0.00 -0.03 -1.25 119.26 122.78 1nd4 h ALA 144 Ca 0.23 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1nd4 h ALA 144 Cb 0.30 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1nd4 h ALA 144 CO -0.01 0.62 0.18 -0.09 0.00 0.00 0.00 179.25 179.96 1nd4 h ARG 145 N 1.10 0.50 -0.54 0.00 2.43 -0.40 -0.93 114.38 116.53 1nd4 h ARG 145 Ca 0.26 -0.07 -0.08 0.00 -0.81 0.00 0.00 59.98 59.29 1nd4 h ARG 145 Cb 0.14 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.58 1nd4 h ARG 145 CO -0.03 0.44 0.02 1.15 -1.51 0.00 0.00 179.97 180.04 1nd4 h THR 146 N 0.44 1.25 -0.47 0.20 2.02 -0.99 -0.65 112.91 114.70 1nd4 h THR 146 Ca 0.12 -1.03 -0.07 0.00 0.77 0.00 0.00 66.41 66.20 1nd4 h THR 146 Cb 0.09 0.81 -0.02 0.00 -1.74 0.00 0.00 68.15 67.29 1nd4 h THR 146 CO -0.02 0.37 -0.00 0.03 0.37 0.00 0.00 175.52 176.27 1nd4 h ARG 147 N 0.83 0.79 -0.31 6.66 3.08 -1.01 -1.21 114.38 123.21 1nd4 h ARG 147 Ca 0.16 -0.21 -0.03 0.00 0.07 0.00 0.00 59.98 59.97 1nd4 h ARG 147 Cb 0.46 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.41 1nd4 h ARG 147 CO 0.02 0.79 0.09 1.98 -1.07 0.00 0.00 179.97 181.78 1nd4 h MET 148 N 0.73 0.49 -0.30 0.04 4.05 -0.57 -0.59 114.93 118.78 1nd4 h MET 148 Ca 0.14 -0.11 -0.02 0.00 -0.28 0.00 0.00 59.70 59.43 1nd4 h MET 148 Cb 0.45 -0.07 -0.02 0.00 -0.80 0.00 0.00 31.60 31.17 1nd4 h MET 148 CO 0.02 0.55 0.11 0.93 0.23 0.00 0.00 176.91 178.75 1nd4 h GLU 149 N 0.34 0.42 -0.00 0.39 4.39 -0.78 -0.64 114.58 118.69 1nd4 h GLU 149 Ca 0.10 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.75 1nd4 h GLU 149 Cb 0.27 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 28.84 1nd4 h GLU 149 CO -0.00 0.36 0.00 0.00 -1.16 0.00 0.00 179.01 178.21 1nd4 n ALA 150 N -2.49 2.62 -1.59 3.43 0.00 -0.49 -4.88 120.51 117.12 1nd4 n ALA 150 Ca 0.01 -0.14 -0.12 0.00 0.00 0.00 0.00 53.44 53.20 1nd4 n ALA 150 Cb 0.14 -1.34 -0.04 0.00 0.00 0.00 0.00 19.45 18.21 1nd4 n ALA 150 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nd4 n GLY 151 N 0.84 0.88 0.03 0.00 0.00 -0.25 -4.91 105.19 101.77 1nd4 n GLY 151 Ca 0.16 -0.47 0.14 0.00 0.00 0.00 0.00 46.02 45.85 1nd4 n GLY 151 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1nd4 n LEU 152 N -1.41 0.17 -4.64 0.99 4.77 -0.26 -4.85 117.00 111.78 1nd4 n LEU 152 Ca -0.12 0.27 -0.43 0.00 -0.03 0.00 0.00 56.01 55.70 1nd4 n LEU 152 Cb 0.44 -0.34 -0.02 0.00 -2.33 0.00 0.00 43.42 41.16 1nd4 n LEU 152 CO 0.17 0.04 1.31 -0.69 -1.33 0.00 0.00 177.39 176.89 1nd4 s VAL 153 N -2.78 3.79 -0.90 4.08 1.01 -1.26 -4.92 120.40 119.42 1nd4 s VAL 153 Ca 0.20 0.91 -0.24 0.00 0.00 0.00 0.00 61.98 62.85 1nd4 s VAL 153 Cb 0.19 -3.76 0.01 0.00 0.00 0.00 0.00 36.38 32.82 1nd4 s VAL 153 CO 0.53 -0.28 1.59 -0.62 0.00 0.00 0.00 175.10 176.32 1nd4 s ASP 154 N 3.74 5.96 0.30 3.32 -1.08 -1.26 -4.82 116.67 122.84 1nd4 s ASP 154 Ca 0.68 -0.90 0.24 0.00 -0.52 0.00 0.00 52.55 52.05 1nd4 s ASP 154 Cb -0.24 -2.56 1.10 0.00 -1.46 0.00 0.00 42.92 39.75 1nd4 s ASP 154 CO 0.27 -1.98 1.72 1.56 0.52 0.00 0.00 175.17 177.26 1nd4 h GLN 155 N 10.74 0.00 -0.00 4.34 4.20 -1.93 -2.29 115.11 130.17 1nd4 h GLN 155 Ca 0.05 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.76 1nd4 h GLN 155 Cb 1.03 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.81 1nd4 h GLN 155 CO 1.33 0.00 -0.50 -0.25 -0.67 0.00 0.00 178.83 178.74 1nd4 n ASP 156 N -2.30 0.69 -1.25 1.46 8.00 -1.26 -4.17 116.55 117.71 1nd4 n ASP 156 Ca 0.01 -0.48 -0.07 0.00 0.71 0.00 0.00 54.79 54.96 1nd4 n ASP 156 Cb 0.16 0.30 0.18 0.00 -0.02 0.00 0.00 41.12 41.74 1nd4 n ASP 156 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1nd4 n ASP 157 N -1.29 2.83 -4.85 -2.24 2.03 -0.86 -5.04 116.55 107.12 1nd4 n ASP 157 Ca 0.07 -3.81 -0.32 0.00 0.52 0.00 0.00 54.79 51.25 1nd4 n ASP 157 Cb 0.34 -0.62 -0.06 0.00 -0.72 0.00 0.00 41.12 40.07 1nd4 n ASP 157 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1nd4 s LEU 158 N -3.31 4.02 0.89 -2.67 1.43 -1.25 -5.04 118.68 112.74 1nd4 s LEU 158 Ca 0.46 1.28 -0.11 0.00 -1.03 0.00 0.00 54.13 54.72 1nd4 s LEU 158 Cb 0.41 -4.10 0.11 0.00 0.03 0.00 0.00 46.19 42.65 1nd4 s LEU 158 CO -0.01 -0.24 1.05 0.47 0.23 0.00 0.00 176.35 177.85 1nd4 n ASP 159 N -0.52 0.16 -0.32 2.29 8.00 -1.26 -4.68 116.55 120.21 1nd4 n ASP 159 Ca 0.04 0.45 0.08 0.00 0.71 0.00 0.00 54.79 56.07 1nd4 n ASP 159 Cb 0.53 -1.45 0.24 0.00 -0.02 0.00 0.00 41.12 40.43 1nd4 n ASP 159 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 1nd4 h GLU 160 N -1.58 0.75 -0.01 -1.24 3.07 -1.99 -1.05 114.58 112.53 1nd4 h GLU 160 Ca -0.44 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.38 1nd4 h GLU 160 Cb 1.28 -0.17 0.00 0.00 -0.84 0.00 0.00 28.75 29.02 1nd4 h GLU 160 CO 0.41 0.49 0.00 -0.85 -1.40 0.00 0.00 179.01 177.67 1nd4 n GLU 161 N -4.77 1.03 0.00 2.33 0.28 -1.26 -3.13 120.64 115.12 1nd4 n GLU 161 Ca 0.18 -0.04 0.02 0.00 -0.16 0.00 0.00 57.16 57.17 1nd4 n GLU 161 Cb 0.43 -1.28 -0.00 0.00 1.43 0.00 0.00 31.44 32.01 1nd4 n GLU 161 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 1nd4 n HIS 162 N -0.74 0.00 -1.71 -1.84 8.25 -0.43 -5.01 115.22 113.74 1nd4 n HIS 162 Ca 0.13 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.16 1nd4 n HIS 162 Cb 0.07 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.16 1nd4 n HIS 162 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1nd4 n GLN 163 N -0.48 2.47 0.00 -0.41 6.02 -1.03 -2.04 117.38 121.91 1nd4 n GLN 163 Ca 0.02 0.88 0.00 0.00 -0.01 0.00 0.00 57.00 57.89 1nd4 n GLN 163 Cb 0.09 -2.64 0.00 0.00 1.02 0.00 0.00 30.24 28.70 1nd4 n GLN 163 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1nd4 n GLY 164 N 2.60 2.59 3.76 1.08 0.00 -1.26 -5.02 105.19 108.95 1nd4 n GLY 164 Ca 0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.74 1nd4 n GLY 164 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nd4 s LEU 165 N 0.00 4.43 0.24 0.99 1.43 -0.86 -5.00 118.68 119.91 1nd4 s LEU 165 Ca 0.00 2.26 -0.30 0.00 -1.03 0.00 0.00 54.13 55.06 1nd4 s LEU 165 Cb 0.00 -3.78 -0.09 0.00 0.03 0.00 0.00 46.19 42.35 1nd4 s LEU 165 CO 0.00 -0.29 1.21 0.00 0.23 0.00 0.00 176.35 177.51 1nd4 s ALA 166 N -1.28 3.46 0.55 4.21 0.00 -1.26 -4.90 121.76 122.54 1nd4 s ALA 166 Ca 0.49 1.02 0.26 0.00 0.00 0.00 0.00 51.96 53.72 1nd4 s ALA 166 Cb -0.30 -3.42 1.46 0.00 0.00 0.00 0.00 23.12 20.86 1nd4 s ALA 166 CO 0.39 -0.39 2.03 -1.00 0.00 0.00 0.00 175.76 176.79 1nd4 h PRO 167 N 4.57 0.00 -0.26 0.00 0.13 -1.98 0.10 132.00 134.57 1nd4 h PRO 167 Ca -0.46 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.61 1nd4 h PRO 167 Cb 1.22 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.33 1nd4 h PRO 167 CO 0.71 0.00 -0.10 0.00 -0.23 0.00 0.00 178.00 178.39 1nd4 h ALA 168 N 1.75 1.35 -0.21 -0.56 0.00 -1.99 0.23 119.26 119.83 1nd4 h ALA 168 Ca 0.17 -0.23 -0.21 0.00 0.00 0.00 0.00 54.91 54.64 1nd4 h ALA 168 Cb 0.76 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.44 1nd4 h ALA 168 CO -0.00 0.44 -0.69 1.49 0.00 0.00 0.00 179.25 180.49 1nd4 h GLU 169 N 0.40 0.83 -0.69 0.00 4.57 -1.19 -1.45 114.58 117.04 1nd4 h GLU 169 Ca 0.08 -0.61 -0.07 0.00 -1.18 0.00 0.00 59.36 57.57 1nd4 h GLU 169 Cb 0.42 0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 29.09 1nd4 h GLU 169 CO 0.02 1.23 0.14 -0.07 -1.18 0.00 0.00 179.01 179.15 1nd4 h LEU 170 N 0.59 1.07 -0.87 1.64 -0.00 -0.74 -1.37 115.31 115.62 1nd4 h LEU 170 Ca -0.03 -0.24 -0.08 0.00 -0.00 0.00 0.00 57.88 57.53 1nd4 h LEU 170 Cb 1.31 -0.28 -0.02 0.00 -0.00 0.00 0.00 40.66 41.67 1nd4 h LEU 170 CO 0.15 1.04 -0.06 0.15 -0.00 0.00 0.00 178.44 179.72 1nd4 h PHE 171 N 1.05 0.83 -0.49 1.13 3.57 -0.48 0.20 116.94 122.76 1nd4 h PHE 171 Ca 0.21 -0.13 -0.04 0.00 3.53 0.00 0.00 57.97 61.54 1nd4 h PHE 171 Cb 0.41 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 38.91 1nd4 h PHE 171 CO 0.03 0.80 0.16 0.00 -2.23 0.00 0.00 178.31 177.07 1nd4 h ALA 172 N 1.22 0.63 -0.70 2.41 0.00 -0.79 -1.30 119.26 120.74 1nd4 h ALA 172 Ca 0.13 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1nd4 h ALA 172 Cb 0.52 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 1nd4 h ALA 172 CO 0.03 0.29 0.30 0.00 0.00 0.00 0.00 179.25 179.87 1nd4 h ARG 173 N 0.65 1.02 0.06 0.00 3.08 -0.87 -2.14 114.38 116.18 1nd4 h ARG 173 Ca 0.16 -0.17 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1nd4 h ARG 173 Cb 0.26 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 1nd4 h ARG 173 CO -0.01 0.83 -0.06 1.25 -1.07 0.00 0.00 179.97 180.92 1nd4 h LEU 174 N 0.98 -0.16 -0.59 3.04 5.85 -0.64 -2.43 115.31 121.36 1nd4 h LEU 174 Ca 0.24 0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.99 1nd4 h LEU 174 Cb 0.17 0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.22 1nd4 h LEU 174 CO -0.02 -0.10 0.37 0.11 -0.34 0.00 0.00 178.44 178.46 1nd4 h LYS 175 N -0.14 0.71 0.00 1.25 1.79 -1.14 -1.85 116.57 117.18 1nd4 h LYS 175 Ca 0.00 -0.04 -0.01 0.00 -2.18 0.00 0.00 60.65 58.43 1nd4 h LYS 175 Cb 0.13 -0.16 -0.00 0.00 -1.58 0.00 0.00 32.23 30.62 1nd4 h LYS 175 CO -0.02 0.47 -0.03 0.00 -1.08 0.00 0.00 179.45 178.79 1nd4 h ALA 176 N 1.25 1.74 -0.63 3.86 0.00 -1.19 -2.35 119.26 121.94 1nd4 h ALA 176 Ca 0.23 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1nd4 h ALA 176 Cb 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1nd4 h ALA 176 CO -0.09 0.03 0.00 0.54 0.00 0.00 0.00 179.25 179.73 1nd4 n ARG 177 N -4.19 3.48 -1.68 0.00 1.74 -0.71 -4.97 116.66 110.32 1nd4 n ARG 177 Ca -0.03 -2.69 -0.54 0.00 -0.77 0.00 0.00 57.85 53.81 1nd4 n ARG 177 Cb 0.11 -1.83 -0.06 0.00 -1.02 0.00 0.00 32.46 29.66 1nd4 n ARG 177 CO 0.00 0.00 0.00 -0.12 -1.52 0.00 0.00 177.63 175.99 1nd4 n MET 178 N 1.14 1.40 -1.77 5.56 0.00 -0.89 -4.88 117.12 117.68 1nd4 n MET 178 Ca 0.24 0.51 -0.36 0.00 -0.00 0.00 0.00 57.70 58.09 1nd4 n MET 178 Cb 0.82 -2.22 0.06 0.00 0.00 0.00 0.00 33.22 31.88 1nd4 n MET 178 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 175.97 174.72 1nd4 s PRO 179 N 3.02 2.60 -0.07 2.12 0.04 -1.26 -4.96 135.00 136.49 1nd4 s PRO 179 Ca 0.94 1.96 -0.15 0.00 0.04 0.00 0.00 61.00 63.79 1nd4 s PRO 179 Cb -0.96 -1.86 -0.11 0.00 0.04 0.00 0.00 34.50 31.60 1nd4 s PRO 179 CO 0.59 -1.53 0.57 0.22 0.04 0.00 0.00 177.00 176.88 1nd4 h ASP 180 N 0.51 -0.16 -1.80 6.66 1.82 -2.01 -3.47 116.42 117.97 1nd4 h ASP 180 Ca -0.50 -0.28 -0.57 0.00 -0.39 0.00 0.00 57.03 55.29 1nd4 h ASP 180 Cb 1.32 0.04 -0.09 0.00 0.68 0.00 0.00 39.33 41.28 1nd4 h ASP 180 CO 0.53 0.42 -0.56 -0.83 -1.61 0.00 0.00 179.24 177.19 1nd4 s GLY 181 N -3.42 2.13 -0.04 -0.78 0.00 -1.26 -5.14 107.32 98.81 1nd4 s GLY 181 Ca -0.09 -1.99 0.01 0.00 0.00 0.00 0.00 44.72 42.65 1nd4 s GLY 181 CO 0.33 -1.88 -0.03 -0.54 0.00 0.00 0.00 173.10 170.98 1nd4 s GLU 182 N -3.80 0.69 -1.00 2.90 2.02 -1.26 -5.07 118.70 113.18 1nd4 s GLU 182 Ca 0.37 -0.05 -0.14 0.00 0.02 0.00 0.00 54.97 55.17 1nd4 s GLU 182 Cb 0.01 -0.76 0.19 0.00 0.10 0.00 0.00 34.13 33.67 1nd4 s GLU 182 CO 0.21 -0.11 1.09 0.34 0.02 0.00 0.00 175.26 176.81 1nd4 s ASP 183 N 1.00 6.91 -0.08 -0.19 2.15 -1.26 -4.96 116.67 120.24 1nd4 s ASP 183 Ca -0.10 -2.75 -0.30 0.00 0.43 0.00 0.00 52.55 49.83 1nd4 s ASP 183 Cb -0.14 -2.31 -0.03 0.00 -0.30 0.00 0.00 42.92 40.14 1nd4 s ASP 183 CO -0.01 -0.70 1.32 -0.76 -0.17 0.00 0.00 175.17 174.85 1nd4 s LEU 184 N 0.93 4.26 0.25 -1.34 1.43 -1.26 -2.25 118.68 120.70 1nd4 s LEU 184 Ca 0.30 1.89 0.02 0.00 -1.03 0.00 0.00 54.13 55.31 1nd4 s LEU 184 Cb -0.07 -3.55 -0.04 0.00 0.03 0.00 0.00 46.19 42.57 1nd4 s LEU 184 CO -0.07 -0.71 0.19 0.68 0.23 0.00 0.00 176.35 176.67 1nd4 s VAL 185 N 2.87 0.01 -0.20 -1.59 -7.23 0.33 -4.84 120.40 109.75 1nd4 s VAL 185 Ca 0.59 -2.00 -0.29 0.00 -1.81 0.00 0.00 61.98 58.47 1nd4 s VAL 185 Cb -0.26 -2.50 -0.00 0.00 0.56 0.00 0.00 36.38 34.18 1nd4 s VAL 185 CO 0.21 0.00 1.12 -0.69 -0.31 0.00 0.00 175.10 175.43 1nd4 s VAL 186 N -3.86 4.54 0.08 1.32 1.01 -1.26 -1.27 120.40 120.96 1nd4 s VAL 186 Ca 0.40 1.86 0.07 0.00 0.00 0.00 0.00 61.98 64.31 1nd4 s VAL 186 Cb 0.05 -4.20 -0.04 0.00 0.00 0.00 0.00 36.38 32.20 1nd4 s VAL 186 CO 0.18 -0.15 -0.15 0.42 0.00 0.00 0.00 175.10 175.40 1nd4 s THR 187 N 3.22 3.03 0.16 3.92 -4.23 0.43 -4.02 115.64 118.16 1nd4 s THR 187 Ca 0.48 -1.28 -0.11 0.00 -1.18 0.00 0.00 61.69 59.61 1nd4 s THR 187 Cb -0.18 -2.36 0.04 0.00 1.34 0.00 0.00 72.50 71.35 1nd4 s THR 187 CO 0.10 0.21 1.62 -0.74 -0.54 0.00 0.00 174.62 175.27 1nd4 h HIS 188 N 4.03 1.05 0.00 3.99 -0.00 -1.87 -1.10 115.15 121.25 1nd4 h HIS 188 Ca -0.49 -0.18 0.00 0.00 -0.00 0.00 0.00 60.37 59.71 1nd4 h HIS 188 Cb 1.16 -0.28 0.00 0.00 -0.00 0.00 0.00 27.41 28.30 1nd4 h HIS 188 CO 0.58 0.95 0.00 0.41 -0.00 0.00 0.00 177.93 179.87 1nd4 n GLY 189 N -0.42 2.31 2.70 5.26 0.00 -1.25 -2.13 105.19 111.66 1nd4 n GLY 189 Ca 0.02 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.96 1nd4 n GLY 189 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1nd4 n ASP 190 N 0.00 -1.91 -3.40 1.61 -0.08 -1.26 -4.86 116.55 106.65 1nd4 n ASP 190 Ca 0.00 -3.01 -0.32 0.00 -1.51 0.00 0.00 54.79 49.95 1nd4 n ASP 190 Cb 0.00 1.31 -0.05 0.00 2.34 0.00 0.00 41.12 44.72 1nd4 n ASP 190 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1nd4 n ALA 191 N -0.15 2.82 -2.64 -1.67 0.00 -1.26 -4.78 120.51 112.82 1nd4 n ALA 191 Ca 0.02 -2.38 -0.22 0.00 0.00 0.00 0.00 53.44 50.86 1nd4 n ALA 191 Cb 0.78 -3.34 -0.05 0.00 0.00 0.00 0.00 19.45 16.84 1nd4 n ALA 191 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nd4 h LEU 193 N 1.52 0.28 0.00 0.00 3.38 -1.90 -2.00 115.31 116.58 1nd4 h LEU 193 Ca -0.46 0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.62 1nd4 h LEU 193 Cb 1.25 0.08 0.00 0.00 0.09 0.00 0.00 40.66 42.08 1nd4 h LEU 193 CO 0.61 0.12 0.00 -0.81 0.09 0.00 0.00 178.44 178.44 1nd4 n PRO 194 N -4.99 0.06 -0.17 1.13 -0.04 -1.26 -2.22 135.00 127.50 1nd4 n PRO 194 Ca 0.13 0.27 0.12 0.00 -0.04 0.00 0.00 63.50 63.98 1nd4 n PRO 194 Cb 0.39 -1.50 0.22 0.00 -0.04 0.00 0.00 33.50 32.57 1nd4 n PRO 194 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1nd4 n ASN 195 N -1.41 3.33 -4.38 3.54 3.02 -0.75 -4.71 115.26 113.90 1nd4 n ASN 195 Ca 0.03 -1.98 -0.33 0.00 -0.03 0.00 0.00 54.58 52.28 1nd4 n ASN 195 Cb 0.10 -0.23 -0.14 0.00 -0.61 0.00 0.00 39.78 38.90 1nd4 n ASN 195 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1nd4 s ILE 196 N -1.54 2.97 0.03 2.41 1.09 -0.94 -2.03 121.20 123.19 1nd4 s ILE 196 Ca 0.38 -0.70 0.00 0.00 -1.10 0.00 0.00 60.65 59.23 1nd4 s ILE 196 Cb 0.22 -2.22 -0.04 0.00 -1.06 0.00 0.00 42.46 39.36 1nd4 s ILE 196 CO 0.31 0.54 0.12 -0.04 -0.10 0.00 0.00 174.94 175.78 1nd4 s MET 197 N 0.13 3.15 -0.01 2.79 -1.94 -0.17 -0.16 119.30 123.08 1nd4 s MET 197 Ca -0.07 -0.50 0.02 0.00 -1.71 0.00 0.00 55.69 53.44 1nd4 s MET 197 Cb -0.15 -2.90 -0.00 0.00 2.01 0.00 0.00 34.83 33.79 1nd4 s MET 197 CO 0.05 0.63 -0.08 0.54 -0.01 0.00 0.00 175.02 176.14 1nd4 s VAL 198 N -1.32 0.68 -0.06 -6.03 0.11 0.41 0.01 120.40 114.20 1nd4 s VAL 198 Ca 0.27 -0.34 -0.02 0.00 -2.93 0.00 0.00 61.98 58.96 1nd4 s VAL 198 Cb -0.12 -0.58 0.04 0.00 -1.53 0.00 0.00 36.38 34.18 1nd4 s VAL 198 CO 0.19 0.20 0.11 -0.70 -3.33 0.00 0.00 175.10 171.58 1nd4 s GLU 199 N -0.05 0.02 -1.23 1.54 2.12 0.05 -1.75 118.70 119.40 1nd4 s GLU 199 Ca 0.01 0.39 -0.07 0.00 0.36 0.00 0.00 54.97 55.66 1nd4 s GLU 199 Cb -0.05 -0.28 0.01 0.00 0.26 0.00 0.00 34.13 34.07 1nd4 s GLU 199 CO -0.00 -0.24 1.07 0.09 -0.54 0.00 0.00 175.26 175.64 1nd4 n ASN 200 N 4.71 -5.66 -0.08 -1.70 5.03 -1.26 -2.23 115.26 114.08 1nd4 n ASN 200 Ca -0.17 -0.50 -0.01 0.00 0.87 0.00 0.00 54.58 54.78 1nd4 n ASN 200 Cb 0.50 -4.65 -0.00 0.00 -1.02 0.00 0.00 39.78 34.61 1nd4 n ASN 200 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1nd4 n GLY 201 N -1.82 0.32 3.11 7.41 0.00 -1.26 -4.99 105.19 107.95 1nd4 n GLY 201 Ca -0.02 -0.04 -0.17 0.00 0.00 0.00 0.00 46.02 45.79 1nd4 n GLY 201 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1nd4 s ARG 202 N -1.28 0.72 -0.03 1.61 0.52 -0.94 -4.98 118.95 114.57 1nd4 s ARG 202 Ca 0.00 -0.75 -0.38 0.00 -0.52 0.00 0.00 55.73 54.08 1nd4 s ARG 202 Cb 0.00 -0.65 -0.16 0.00 0.52 0.00 0.00 34.95 34.65 1nd4 s ARG 202 CO 0.00 0.15 1.47 0.34 0.02 0.00 0.00 175.30 177.28 1nd4 n PHE 203 N 1.70 1.69 0.36 -0.53 7.35 -1.26 -0.77 117.46 126.00 1nd4 n PHE 203 Ca -0.20 0.60 0.04 0.00 -0.76 0.00 0.00 57.45 57.13 1nd4 n PHE 203 Cb 0.55 -2.37 -0.01 0.00 0.35 0.00 0.00 39.48 38.00 1nd4 n PHE 203 CO 0.00 0.00 0.00 -1.13 -0.76 0.00 0.00 176.76 174.87 1nd4 n SER 204 N 3.47 0.96 0.00 -2.13 3.41 0.10 -4.77 113.62 114.66 1nd4 n SER 204 Ca 0.21 -0.98 0.00 0.00 -0.26 0.00 0.00 58.87 57.84 1nd4 n SER 204 Cb 0.17 0.56 0.00 0.00 -0.26 0.00 0.00 64.21 64.68 1nd4 n SER 204 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1nd4 n GLY 205 N 0.88 3.53 3.93 5.00 0.00 -1.24 -4.65 105.19 112.63 1nd4 n GLY 205 Ca 0.03 -1.49 -0.29 0.00 0.00 0.00 0.00 46.02 44.27 1nd4 n GLY 205 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1nd4 s PHE 206 N -2.00 3.50 0.23 1.61 0.08 -0.68 -1.00 117.98 119.72 1nd4 s PHE 206 Ca 0.00 0.24 0.02 0.00 0.12 0.00 0.00 56.93 57.31 1nd4 s PHE 206 Cb 0.00 -1.75 -0.05 0.00 -0.57 0.00 0.00 43.02 40.64 1nd4 s PHE 206 CO 0.00 0.54 0.04 0.96 -0.10 0.00 0.00 175.22 176.66 1nd4 s ILE 207 N -1.62 0.78 -1.11 0.64 -4.36 -0.86 -3.82 121.20 110.85 1nd4 s ILE 207 Ca 0.36 -2.01 -0.17 0.00 -0.26 0.00 0.00 60.65 58.57 1nd4 s ILE 207 Cb -0.12 -2.42 -0.02 0.00 1.25 0.00 0.00 42.46 41.15 1nd4 s ILE 207 CO 0.28 -0.23 0.82 0.47 0.24 0.00 0.00 174.94 176.53 1nd4 n ASP 208 N -0.41 -5.68 -1.77 4.36 8.00 -1.26 -4.83 116.55 114.96 1nd4 n ASP 208 Ca -0.03 -0.94 0.02 0.00 0.71 0.00 0.00 54.79 54.55 1nd4 n ASP 208 Cb 0.65 -3.81 0.33 0.00 -0.02 0.00 0.00 41.12 38.27 1nd4 n ASP 208 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1nd4 h GLY 210 N 3.76 0.00 -1.53 0.00 0.00 -1.86 -2.46 103.07 100.99 1nd4 h GLY 210 Ca 0.08 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.37 1nd4 h GLY 210 CO 0.51 0.00 -0.01 0.54 0.00 0.00 0.00 176.54 177.58 1nd4 n ARG 211 N -2.63 2.54 -2.34 4.80 1.74 -1.26 -4.34 116.66 115.17 1nd4 n ARG 211 Ca -0.01 -2.88 -0.36 0.00 -0.77 0.00 0.00 57.85 53.82 1nd4 n ARG 211 Cb 0.11 -1.81 -0.02 0.00 -1.02 0.00 0.00 32.46 29.72 1nd4 n ARG 211 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1nd4 s LEU 212 N -2.92 3.96 0.00 0.55 0.20 -0.90 -3.82 118.68 115.75 1nd4 s LEU 212 Ca 0.42 2.19 0.00 0.00 0.69 0.00 0.00 54.13 57.43 1nd4 s LEU 212 Cb 0.35 -4.33 0.00 0.00 -0.43 0.00 0.00 46.19 41.77 1nd4 s LEU 212 CO 0.07 -0.89 0.00 0.61 -0.29 0.00 0.00 176.35 175.85 1nd4 n GLY 213 N 0.29 0.35 3.68 7.98 0.00 -0.42 -4.90 105.19 112.17 1nd4 n GLY 213 Ca 0.08 -1.15 -0.43 0.00 0.00 0.00 0.00 46.02 44.52 1nd4 n GLY 213 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nd4 s VAL 214 N -2.00 4.56 0.36 1.61 1.01 0.34 -0.43 120.40 125.85 1nd4 s VAL 214 Ca 0.00 1.86 -0.15 0.00 0.00 0.00 0.00 61.98 63.68 1nd4 s VAL 214 Cb 0.00 -4.19 0.04 0.00 0.00 0.00 0.00 36.38 32.23 1nd4 s VAL 214 CO 0.00 -0.06 0.74 0.00 0.00 0.00 0.00 175.10 175.78 1nd4 s ALA 215 N 2.56 -0.67 0.47 5.51 0.00 -0.39 -0.83 121.76 128.40 1nd4 s ALA 215 Ca 0.50 -0.75 -0.23 0.00 0.00 0.00 0.00 51.96 51.48 1nd4 s ALA 215 Cb -0.20 0.76 -0.07 0.00 0.00 0.00 0.00 23.12 23.61 1nd4 s ALA 215 CO 0.16 -0.97 1.27 0.34 0.00 0.00 0.00 175.76 176.55 1nd4 s ASP 216 N -3.06 5.93 0.56 0.00 -1.08 -1.26 -0.51 116.67 117.25 1nd4 s ASP 216 Ca 0.16 2.56 0.24 0.00 -0.52 0.00 0.00 52.55 54.99 1nd4 s ASP 216 Cb -0.05 -2.62 1.52 0.00 -1.46 0.00 0.00 42.92 40.31 1nd4 s ASP 216 CO 0.11 -1.10 2.12 0.08 0.52 0.00 0.00 175.17 176.90 1nd4 h ARG 217 N 2.05 0.00 0.00 4.34 0.11 -1.78 -0.62 114.38 118.49 1nd4 h ARG 217 Ca -0.50 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.58 1nd4 h ARG 217 Cb 1.26 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.34 1nd4 h ARG 217 CO 0.60 0.00 0.00 0.66 0.10 0.00 0.00 179.97 181.33 1nd4 n TYR 218 N -4.14 0.78 -0.35 4.08 4.02 -1.26 -1.12 117.16 119.17 1nd4 n TYR 218 Ca 0.01 0.36 -0.01 0.00 -0.01 0.00 0.00 57.90 58.25 1nd4 n TYR 218 Cb 0.27 -1.08 0.12 0.00 -0.02 0.00 0.00 39.34 38.63 1nd4 n TYR 218 CO 0.00 0.00 0.00 0.37 -1.01 0.00 0.00 176.86 176.22 1nd4 h GLN 219 N 0.00 1.20 0.04 -0.72 5.75 -1.46 0.12 115.11 120.04 1nd4 h GLN 219 Ca 0.00 -0.07 -0.13 0.00 -0.15 0.00 0.00 58.65 58.29 1nd4 h GLN 219 Cb 0.16 -0.27 -0.00 0.00 1.07 0.00 0.00 27.48 28.43 1nd4 h GLN 219 CO 0.00 0.79 -0.68 -0.44 -2.65 0.00 0.00 178.83 175.85 1nd4 h ASP 220 N 1.23 0.15 -0.95 -0.69 3.32 -1.30 -3.33 116.42 114.85 1nd4 h ASP 220 Ca 0.36 -0.85 0.07 0.00 0.02 0.00 0.00 57.03 56.63 1nd4 h ASP 220 Cb -0.06 -0.05 -0.06 0.00 0.22 0.00 0.00 39.33 39.38 1nd4 h ASP 220 CO -0.10 1.29 0.61 0.40 -1.72 0.00 0.00 179.24 179.72 1nd4 h ILE 221 N -0.77 1.07 -0.55 0.35 1.08 -1.17 -0.01 117.51 117.51 1nd4 h ILE 221 Ca -0.16 -0.37 -0.03 0.00 -0.39 0.00 0.00 64.86 63.91 1nd4 h ILE 221 Cb 1.31 -0.11 -0.02 0.00 -3.07 0.00 0.00 36.82 34.93 1nd4 h ILE 221 CO -0.01 0.20 0.24 0.00 -0.69 0.00 0.00 178.15 177.88 1nd4 h ALA 222 N 1.49 0.71 0.15 1.87 0.00 -0.93 -1.39 119.26 121.15 1nd4 h ALA 222 Ca 0.41 -0.15 -0.30 0.00 0.00 0.00 0.00 54.91 54.87 1nd4 h ALA 222 Cb 0.20 -0.21 0.03 0.00 0.00 0.00 0.00 17.79 17.80 1nd4 h ALA 222 CO -0.16 0.30 -1.28 -0.07 0.00 0.00 0.00 179.25 178.03 1nd4 h LEU 223 N 0.74 0.77 -0.34 0.00 3.38 -1.59 -2.58 115.31 115.68 1nd4 h LEU 223 Ca 0.18 -0.75 0.00 0.00 0.09 0.00 0.00 57.88 57.41 1nd4 h LEU 223 Cb 0.17 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 1nd4 h LEU 223 CO -0.02 1.57 0.22 0.00 0.09 0.00 0.00 178.44 180.30 1nd4 h ALA 224 N 0.34 0.44 -0.42 1.53 0.00 -0.48 -0.74 119.26 119.92 1nd4 h ALA 224 Ca -0.19 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.60 1nd4 h ALA 224 Cb 1.97 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 19.60 1nd4 h ALA 224 CO 0.24 -0.08 -0.07 1.79 0.00 0.00 0.00 179.25 181.12 1nd4 h THR 225 N 0.46 1.25 -0.30 0.00 1.35 -1.34 -0.16 112.91 114.16 1nd4 h THR 225 Ca 0.13 -1.08 -0.01 0.00 -0.55 0.00 0.00 66.41 64.90 1nd4 h THR 225 Cb -0.03 1.00 -0.01 0.00 -1.73 0.00 0.00 68.15 67.38 1nd4 h THR 225 CO -0.03 0.37 0.15 -0.09 -0.25 0.00 0.00 175.52 175.68 1nd4 h ARG 226 N 0.67 0.42 -0.18 4.72 2.43 -1.04 0.53 114.38 121.94 1nd4 h ARG 226 Ca 0.12 -0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 59.20 1nd4 h ARG 226 Cb 0.52 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.99 1nd4 h ARG 226 CO 0.03 0.38 -0.05 0.22 -1.51 0.00 0.00 179.97 179.04 1nd4 h ASP 227 N 0.35 0.35 -0.81 -3.80 3.58 -0.97 -1.99 116.42 113.12 1nd4 h ASP 227 Ca 0.10 -0.37 -0.04 0.00 0.42 0.00 0.00 57.03 57.14 1nd4 h ASP 227 Cb 0.09 -0.09 -0.04 0.00 1.72 0.00 0.00 39.33 41.01 1nd4 h ASP 227 CO -0.02 0.64 0.36 0.40 -2.88 0.00 0.00 179.24 177.75 1nd4 h ILE 228 N 0.05 1.26 -0.31 2.25 2.04 -0.96 -0.15 117.51 121.68 1nd4 h ILE 228 Ca 0.04 -0.77 -0.03 0.00 1.00 0.00 0.00 64.86 65.10 1nd4 h ILE 228 Cb 0.49 0.25 -0.01 0.00 -0.74 0.00 0.00 36.82 36.81 1nd4 h ILE 228 CO 0.02 0.32 0.07 0.00 0.00 0.00 0.00 178.15 178.56 1nd4 h ALA 229 N 1.19 0.41 -0.47 1.87 0.00 -0.86 0.15 119.26 121.55 1nd4 h ALA 229 Ca 0.28 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1nd4 h ALA 229 Cb 0.17 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1nd4 h ALA 229 CO -0.03 0.08 0.20 1.49 0.00 0.00 0.00 179.25 180.99 1nd4 h GLU 230 N 0.34 0.70 0.10 0.00 4.57 -1.10 -0.27 114.58 118.92 1nd4 h GLU 230 Ca 0.10 -0.12 -0.30 0.00 -1.18 0.00 0.00 59.36 57.86 1nd4 h GLU 230 Cb 0.30 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 28.76 1nd4 h GLU 230 CO 0.00 0.62 -1.54 0.93 -1.18 0.00 0.00 179.01 177.84 1nd4 h GLU 231 N 0.62 0.21 0.00 1.92 4.39 -0.99 -3.41 114.58 117.32 1nd4 h GLU 231 Ca 0.16 -0.36 -0.05 0.00 0.34 0.00 0.00 59.36 59.45 1nd4 h GLU 231 Cb 0.17 0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.94 1nd4 h GLU 231 CO -0.02 1.05 -1.38 1.28 -1.16 0.00 0.00 179.01 178.79 1nd4 n LEU 232 N -3.41 0.00 0.00 1.33 4.77 0.48 -5.08 117.00 115.10 1nd4 n LEU 232 Ca -0.16 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.82 1nd4 n LEU 232 Cb 1.04 0.07 0.00 0.00 -2.33 0.00 0.00 43.42 42.20 1nd4 n LEU 232 CO 0.49 0.07 0.00 0.61 -1.33 0.00 0.00 177.39 177.23 1nd4 n GLY 233 N 2.30 3.29 0.35 -0.72 0.00 -0.11 -4.76 105.19 105.53 1nd4 n GLY 233 Ca -0.05 -1.80 0.04 0.00 0.00 0.00 0.00 46.02 44.20 1nd4 n GLY 233 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1nd4 h GLY 234 N 0.00 1.02 2.00 -0.02 0.00 -1.85 -2.03 103.07 102.19 1nd4 h GLY 234 Ca 0.00 -0.35 -0.01 0.00 0.00 0.00 0.00 47.33 46.97 1nd4 h GLY 234 CO 0.00 0.30 -0.06 1.05 0.00 0.00 0.00 176.54 177.83 1nd4 h GLU 235 N 0.88 0.00 0.00 4.80 9.09 -1.94 -0.73 114.58 126.68 1nd4 h GLU 235 Ca 0.30 0.00 -0.17 0.00 0.05 0.00 0.00 59.36 59.53 1nd4 h GLU 235 Cb 0.08 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 27.15 1nd4 h GLU 235 CO -0.09 0.06 -0.87 -1.49 0.05 0.00 0.00 179.01 176.68 1nd4 h TRP 236 N 0.00 0.00 -0.16 2.06 4.06 -1.67 -2.33 115.95 117.91 1nd4 h TRP 236 Ca -0.00 0.00 -0.11 0.00 2.06 0.00 0.00 58.89 60.84 1nd4 h TRP 236 Cb 0.11 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.25 1nd4 h TRP 236 CO 0.00 0.79 -0.38 0.00 -3.56 0.00 0.00 178.44 175.29 1nd4 h ALA 237 N 1.21 1.06 -0.22 1.49 0.00 -0.93 -0.19 119.26 121.68 1nd4 h ALA 237 Ca -0.03 -0.40 -0.20 0.00 0.00 0.00 0.00 54.91 54.27 1nd4 h ALA 237 Cb 1.63 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.33 1nd4 h ALA 237 CO 0.10 0.59 -0.66 -0.44 0.00 0.00 0.00 179.25 178.84 1nd4 h ASP 238 N 0.29 0.96 -0.72 0.00 3.32 -1.17 -2.75 116.42 116.35 1nd4 h ASP 238 Ca 0.03 -0.57 -0.05 0.00 0.02 0.00 0.00 57.03 56.46 1nd4 h ASP 238 Cb 0.80 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 40.04 1nd4 h ASP 238 CO 0.06 1.37 0.26 -0.09 -1.72 0.00 0.00 179.24 179.13 1nd4 h ARG 239 N 0.61 1.10 -0.46 3.56 9.65 -1.14 -1.86 114.38 125.84 1nd4 h ARG 239 Ca -0.02 -0.21 0.04 0.00 -1.10 0.00 0.00 59.98 58.69 1nd4 h ARG 239 Cb 1.28 -0.17 -0.04 0.00 -1.39 0.00 0.00 29.97 29.65 1nd4 h ARG 239 CO 0.14 0.91 0.24 0.35 2.80 0.00 0.00 179.97 184.41 1nd4 h PHE 240 N 1.07 0.44 -0.46 2.20 3.57 -0.93 -0.89 116.94 121.93 1nd4 h PHE 240 Ca 0.24 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.77 1nd4 h PHE 240 Cb 0.24 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 38.83 1nd4 h PHE 240 CO 0.02 0.23 0.30 -0.07 -2.23 0.00 0.00 178.31 176.56 1nd4 h LEU 241 N 0.47 0.52 -0.18 0.59 3.38 -1.12 0.25 115.31 119.22 1nd4 h LEU 241 Ca 0.20 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.17 1nd4 h LEU 241 Cb 0.09 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 1nd4 h LEU 241 CO -0.13 0.38 0.06 0.58 0.09 0.00 0.00 178.44 179.42 1nd4 h VAL 242 N 0.62 0.96 -0.26 1.22 2.07 -0.95 0.16 116.25 120.06 1nd4 h VAL 242 Ca 0.17 -0.05 -0.10 0.00 0.82 0.00 0.00 66.70 67.54 1nd4 h VAL 242 Cb -0.06 0.80 -0.01 0.00 -1.52 0.00 0.00 31.29 30.49 1nd4 h VAL 242 CO -0.04 0.03 -0.25 -0.07 0.02 0.00 0.00 177.57 177.25 1nd4 h LEU 243 N 0.15 0.50 -0.69 2.57 3.38 -0.88 -2.64 115.31 117.69 1nd4 h LEU 243 Ca 0.08 -0.17 -0.14 0.00 0.09 0.00 0.00 57.88 57.74 1nd4 h LEU 243 Cb 0.04 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 1nd4 h LEU 243 CO -0.08 0.74 -0.46 0.22 0.09 0.00 0.00 178.44 178.95 1nd4 h TYR 244 N 0.43 0.55 0.00 1.13 3.20 -0.14 -3.47 116.97 118.67 1nd4 h TYR 244 Ca 0.06 -0.17 0.00 0.00 3.14 0.00 0.00 58.73 61.76 1nd4 h TYR 244 Cb 0.68 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 38.83 1nd4 h TYR 244 CO 0.02 0.84 0.00 0.41 -1.64 0.00 0.00 178.16 177.79 1nd4 n GLY 245 N 0.05 1.46 2.97 1.82 0.00 0.24 -4.88 105.19 106.85 1nd4 n GLY 245 Ca -0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.70 1nd4 n GLY 245 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1nd4 s ILE 246 N -2.00 1.45 -0.08 -0.61 1.01 0.29 -4.99 121.20 116.28 1nd4 s ILE 246 Ca 0.00 -0.74 0.22 0.00 0.00 0.00 0.00 60.65 60.13 1nd4 s ILE 246 Cb 0.00 -1.49 -0.30 0.00 0.01 0.00 0.00 42.46 40.68 1nd4 s ILE 246 CO 0.00 0.28 0.55 0.00 0.00 0.00 0.00 174.94 175.77 1nd4 n ALA 247 N 4.78 2.83 -3.64 9.38 0.00 -1.26 -3.98 120.51 128.61 1nd4 n ALA 247 Ca -0.15 -0.49 -0.28 0.00 0.00 0.00 0.00 53.44 52.52 1nd4 n ALA 247 Cb 0.48 -0.79 -0.11 0.00 0.00 0.00 0.00 19.45 19.03 1nd4 n ALA 247 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nd4 s ALA 248 N -3.49 2.53 0.08 0.00 0.00 -1.26 -5.10 121.76 114.51 1nd4 s ALA 248 Ca -0.07 -3.07 -0.36 0.00 0.00 0.00 0.00 51.96 48.46 1nd4 s ALA 248 Cb 0.14 -1.87 -0.15 0.00 0.00 0.00 0.00 23.12 21.23 1nd4 s ALA 248 CO 0.90 -2.04 1.50 -2.30 0.00 0.00 0.00 175.76 173.82 1nd4 n PRO 249 N 2.52 1.61 -2.87 0.00 -0.02 -1.26 -4.89 135.00 130.10 1nd4 n PRO 249 Ca 0.23 0.58 -0.43 0.00 -2.02 0.00 0.00 63.50 61.86 1nd4 n PRO 249 Cb 0.41 -2.29 -0.03 0.00 -0.02 0.00 0.00 33.50 31.57 1nd4 n PRO 249 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1nd4 s ASP 250 N 1.10 6.62 0.44 2.55 -1.08 -1.26 -4.87 116.67 120.18 1nd4 s ASP 250 Ca 0.84 -1.98 0.17 0.00 -0.52 0.00 0.00 52.55 51.05 1nd4 s ASP 250 Cb -0.84 -2.43 1.09 0.00 -1.46 0.00 0.00 42.92 39.29 1nd4 s ASP 250 CO 0.45 -1.12 1.94 0.28 0.52 0.00 0.00 175.17 177.23 1nd4 h SER 251 N 8.93 0.34 -0.10 -0.34 0.02 -1.99 -1.40 113.55 119.00 1nd4 h SER 251 Ca 0.17 0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 61.12 1nd4 h SER 251 Cb 1.02 -0.05 -0.00 0.00 0.14 0.00 0.00 62.40 63.50 1nd4 h SER 251 CO 1.16 0.18 -0.00 1.56 -1.14 0.00 0.00 176.83 178.59 1nd4 h GLN 252 N 0.37 0.18 -0.64 3.45 4.20 -1.99 -1.54 115.11 119.14 1nd4 h GLN 252 Ca 0.34 -0.06 -0.08 0.00 0.06 0.00 0.00 58.65 58.91 1nd4 h GLN 252 Cb 0.82 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.56 1nd4 h GLN 252 CO -0.10 0.44 0.09 0.00 -0.67 0.00 0.00 178.83 178.59 1nd4 h ARG 253 N -0.10 1.06 -0.08 1.46 3.08 -1.83 -1.15 114.38 116.83 1nd4 h ARG 253 Ca 0.03 -0.28 0.03 0.00 0.07 0.00 0.00 59.98 59.82 1nd4 h ARG 253 Cb 0.36 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.26 1nd4 h ARG 253 CO 0.01 0.98 -0.08 0.82 -1.07 0.00 0.00 179.97 180.62 1nd4 h ILE 254 N 0.99 0.76 -0.68 2.04 2.04 -1.20 -0.17 117.51 121.30 1nd4 h ILE 254 Ca 0.19 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.04 1nd4 h ILE 254 Cb 0.45 0.76 -0.03 0.00 -0.74 0.00 0.00 36.82 37.26 1nd4 h ILE 254 CO 0.01 0.00 0.38 0.00 0.00 0.00 0.00 178.15 178.54 1nd4 h ALA 255 N 0.95 1.39 -0.39 1.87 0.00 -1.08 -1.64 119.26 120.35 1nd4 h ALA 255 Ca 0.06 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 1nd4 h ALA 255 Cb 0.19 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1nd4 h ALA 255 CO -0.14 0.51 0.01 0.35 0.00 0.00 0.00 179.25 179.97 1nd4 h PHE 256 N 0.94 0.74 0.00 0.00 3.57 -0.45 -1.93 116.94 119.81 1nd4 h PHE 256 Ca 0.24 -0.12 0.00 0.00 3.53 0.00 0.00 57.97 61.62 1nd4 h PHE 256 Cb 0.02 -0.19 0.00 0.00 2.79 0.00 0.00 35.95 38.56 1nd4 h PHE 256 CO 0.01 0.76 0.00 1.88 -2.23 0.00 0.00 178.31 178.72 1nd4 h TYR 257 N 0.50 0.00 0.01 0.41 0.05 -0.75 -0.65 116.97 116.54 1nd4 h TYR 257 Ca 0.11 0.00 -0.19 0.00 0.05 0.00 0.00 58.73 58.70 1nd4 h TYR 257 Cb 0.46 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.17 1nd4 h TYR 257 CO 0.04 0.00 -0.90 0.00 -1.05 0.00 0.00 178.16 176.25 1nd4 h ARG 258 N 0.00 0.06 -0.23 4.88 3.08 -1.25 -2.08 114.38 118.84 1nd4 h ARG 258 Ca 0.00 -0.08 -0.13 0.00 0.07 0.00 0.00 59.98 59.85 1nd4 h ARG 258 Cb 0.96 0.02 -0.00 0.00 0.08 0.00 0.00 29.97 31.03 1nd4 h ARG 258 CO 0.00 0.91 -0.35 1.25 -1.07 0.00 0.00 179.97 180.72 1nd4 h LEU 259 N 0.03 0.71 -0.71 3.04 6.46 -0.86 -3.06 115.31 120.92 1nd4 h LEU 259 Ca -0.02 -0.52 0.03 0.00 -0.12 0.00 0.00 57.88 57.25 1nd4 h LEU 259 Cb 1.56 -0.20 -0.05 0.00 -0.73 0.00 0.00 40.66 41.24 1nd4 h LEU 259 CO 0.12 1.09 0.44 0.25 -0.62 0.00 0.00 178.44 179.72 1nd4 h LEU 260 N 0.35 0.72 -1.24 2.25 5.85 -1.04 -1.90 115.31 120.29 1nd4 h LEU 260 Ca 0.02 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.75 1nd4 h LEU 260 Cb 0.93 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.81 1nd4 h LEU 260 CO 0.08 0.49 0.00 -0.67 -0.34 0.00 0.00 178.44 178.00 1nd4 n ASP 261 N -4.67 0.58 0.30 1.25 2.03 -0.79 -1.49 116.55 113.75 1nd4 n ASP 261 Ca 0.08 0.74 0.18 0.00 0.52 0.00 0.00 54.79 56.31 1nd4 n ASP 261 Cb 0.10 -0.82 0.87 0.00 -0.72 0.00 0.00 41.12 40.54 1nd4 n ASP 261 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 1nd4 h GLU 262 N 0.00 0.00 -0.02 -0.67 4.39 -1.31 -2.47 114.58 114.51 1nd4 h GLU 262 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1nd4 h GLU 262 Cb 0.09 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.74 1nd4 h GLU 262 CO 0.00 0.03 -0.07 1.19 -1.16 0.00 0.00 179.01 178.99 1nd4 n PHE 263 N -3.18 0.00 0.02 4.33 3.01 -0.56 -4.51 117.46 116.57 1nd4 n PHE 263 Ca -0.01 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.45 1nd4 n PHE 263 Cb 0.22 -0.03 0.00 0.00 -0.01 0.00 0.00 39.48 39.67 1nd4 n PHE 263 CO 0.00 0.00 0.00 1.19 1.01 0.00 0.00 176.76 178.96