#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mi0 s PHE 6 N 0.00 2.67 0.19 -0.72 0.08 -1.26 -5.13 117.98 113.82 3mi0 s PHE 6 Ca 0.00 -0.42 0.08 0.00 0.12 0.00 0.00 56.93 56.71 3mi0 s PHE 6 Cb 0.00 -1.68 -0.05 0.00 -0.57 0.00 0.00 43.02 40.72 3mi0 s PHE 6 CO 0.00 -0.02 -0.16 0.42 -0.10 0.00 0.00 175.22 175.37 3mi0 s ILE 7 N -0.30 1.78 0.75 0.64 1.01 -1.26 -5.13 121.20 118.68 3mi0 s ILE 7 Ca 0.02 -2.12 -0.11 0.00 0.00 0.00 0.00 60.65 58.43 3mi0 s ILE 7 Cb -0.13 -1.98 0.04 0.00 0.01 0.00 0.00 42.46 40.41 3mi0 s ILE 7 CO 0.03 -0.50 1.09 -0.94 0.00 0.00 0.00 174.94 174.61 3mi0 s SER 8 N -3.11 4.69 0.30 3.58 1.04 -1.26 -4.81 113.70 114.13 3mi0 s SER 8 Ca 0.20 1.83 -0.02 0.00 0.48 0.00 0.00 55.95 58.45 3mi0 s SER 8 Cb -0.02 -2.52 0.45 0.00 0.10 0.00 0.00 66.02 64.02 3mi0 s SER 8 CO 0.07 -1.91 1.97 1.55 0.98 0.00 0.00 173.24 175.90 3mi0 h PRO 9 N -0.89 1.08 -0.57 4.02 0.13 -2.00 -0.92 132.00 132.84 3mi0 h PRO 9 Ca -0.44 -0.07 -0.01 0.00 -0.87 0.00 0.00 66.00 64.62 3mi0 h PRO 9 Cb 1.23 -0.24 -0.03 0.00 0.13 0.00 0.00 31.00 32.09 3mi0 h PRO 9 CO 0.52 0.72 0.33 1.49 -0.23 0.00 0.00 178.00 180.83 3mi0 h GLU 10 N 1.11 0.79 -0.56 0.86 4.81 -2.00 -1.03 114.58 118.56 3mi0 h GLU 10 Ca 0.30 -0.08 -0.08 0.00 -0.13 0.00 0.00 59.36 59.37 3mi0 h GLU 10 Cb -0.12 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.08 3mi0 h GLU 10 CO -0.06 0.58 0.04 0.37 -0.73 0.00 0.00 179.01 179.21 3mi0 h GLN 11 N 0.77 0.96 -0.78 1.92 4.15 -1.75 -2.58 115.11 117.80 3mi0 h GLN 11 Ca 0.20 -0.29 -0.02 0.00 0.77 0.00 0.00 58.65 59.31 3mi0 h GLN 11 Cb 0.01 -0.10 -0.04 0.00 0.21 0.00 0.00 27.48 27.57 3mi0 h GLN 11 CO -0.04 0.94 0.39 0.00 -1.93 0.00 0.00 178.83 178.20 3mi0 h ALA 12 N 0.98 1.21 -0.21 3.38 0.00 -0.89 0.01 119.26 123.73 3mi0 h ALA 12 Ca 0.16 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 54.95 3mi0 h ALA 12 Cb 0.49 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 3mi0 h ALA 12 CO 0.02 0.61 0.07 1.98 0.00 0.00 0.00 179.25 181.93 3mi0 h MET 13 N 1.11 0.16 -0.28 0.00 1.85 -1.02 -0.60 114.93 116.15 3mi0 h MET 13 Ca 0.27 -0.01 -0.11 0.00 -0.61 0.00 0.00 59.70 59.24 3mi0 h MET 13 Cb 0.09 -0.04 -0.01 0.00 0.43 0.00 0.00 31.60 32.07 3mi0 h MET 13 CO -0.04 0.10 -0.30 -0.09 -0.40 0.00 0.00 176.91 176.19 3mi0 h ARG 14 N 0.16 0.57 -0.34 0.39 2.43 -1.03 -1.95 114.38 114.62 3mi0 h ARG 14 Ca 0.09 -0.24 -0.05 0.00 -0.81 0.00 0.00 59.98 58.97 3mi0 h ARG 14 Cb 0.07 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.59 3mi0 h ARG 14 CO -0.10 0.81 0.02 1.49 -1.51 0.00 0.00 179.97 180.67 3mi0 h GLU 15 N 0.49 0.58 -0.03 0.20 4.81 -0.65 -1.07 114.58 118.91 3mi0 h GLU 15 Ca 0.06 -0.18 -0.00 0.00 -0.13 0.00 0.00 59.36 59.11 3mi0 h GLU 15 Cb 0.77 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 30.09 3mi0 h GLU 15 CO 0.06 0.70 0.01 0.00 -0.73 0.00 0.00 179.01 179.05 3mi0 h ARG 16 N 0.40 0.05 -0.93 1.92 3.08 -1.00 0.25 114.38 118.14 3mi0 h ARG 16 Ca 0.10 -0.01 0.12 0.00 0.07 0.00 0.00 59.98 60.26 3mi0 h ARG 16 Cb 0.42 -0.01 -0.07 0.00 0.08 0.00 0.00 29.97 30.39 3mi0 h ARG 16 CO 0.01 0.21 0.60 1.03 -1.07 0.00 0.00 179.97 180.75 3mi0 h SER 17 N -0.12 0.80 -0.04 7.04 0.87 -1.31 0.04 113.55 120.83 3mi0 h SER 17 Ca 0.01 0.04 -0.10 0.00 -1.23 0.00 0.00 61.79 60.51 3mi0 h SER 17 Cb 0.18 -0.13 0.01 0.00 -0.44 0.00 0.00 62.40 62.02 3mi0 h SER 17 CO -0.00 0.44 -0.36 -0.33 -0.53 0.00 0.00 176.83 176.04 3mi0 h GLU 18 N 0.87 0.32 -0.92 2.24 4.39 -0.86 0.19 114.58 120.81 3mi0 h GLU 18 Ca 0.45 -0.29 0.16 0.00 0.34 0.00 0.00 59.36 60.02 3mi0 h GLU 18 Cb 0.53 0.07 -0.10 0.00 -0.10 0.00 0.00 28.75 29.15 3mi0 h GLU 18 CO -0.22 0.95 0.53 1.25 -1.16 0.00 0.00 179.01 180.36 3mi0 h LEU 19 N -0.20 0.68 0.21 1.33 6.46 0.34 0.27 115.31 124.40 3mi0 h LEU 19 Ca -0.03 0.09 -0.33 0.00 -0.12 0.00 0.00 57.88 57.49 3mi0 h LEU 19 Cb 1.04 -0.03 0.02 0.00 -0.73 0.00 0.00 40.66 40.97 3mi0 h LEU 19 CO 0.07 0.28 -1.53 0.00 -0.62 0.00 0.00 178.44 176.65 3mi0 h ALA 20 N 1.58 -0.02 -0.76 1.25 0.00 -1.01 -2.97 119.26 117.34 3mi0 h ALA 20 Ca 0.51 -0.97 0.07 0.00 0.00 0.00 0.00 54.91 54.51 3mi0 h ALA 20 Cb 0.70 0.30 -0.05 0.00 0.00 0.00 0.00 17.79 18.75 3mi0 h ALA 20 CO -0.35 0.80 0.50 -0.09 0.00 0.00 0.00 179.25 180.11 3mi0 h ARG 21 N 0.06 0.78 0.80 0.00 2.43 0.10 -0.71 114.38 117.84 3mi0 h ARG 21 Ca -0.29 -0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 58.80 3mi0 h ARG 21 Cb 2.07 -0.17 0.01 0.00 -0.42 0.00 0.00 29.97 31.46 3mi0 h ARG 21 CO 0.21 0.51 -0.39 0.87 -1.51 0.00 0.00 179.97 179.67 3mi0 h LYS 22 N 0.80 -1.04 -1.03 0.20 1.57 -0.56 -1.85 116.57 114.66 3mi0 h LYS 22 Ca 0.33 0.07 0.26 0.00 -1.87 0.00 0.00 60.65 59.44 3mi0 h LYS 22 Cb 0.26 0.24 -0.11 0.00 0.08 0.00 0.00 32.23 32.69 3mi0 h LYS 22 CO -0.11 -0.69 0.63 0.78 -0.57 0.00 0.00 179.45 179.48 3mi0 h GLY 23 N -1.22 1.65 0.95 3.86 0.00 -1.20 0.13 103.07 107.25 3mi0 h GLY 23 Ca -0.11 -0.27 -0.17 0.00 0.00 0.00 0.00 47.33 46.79 3mi0 h GLY 23 CO 0.18 -0.22 -0.57 -2.22 0.00 0.00 0.00 176.54 173.71 3mi0 h ILE 24 N 0.49 1.34 -0.93 2.60 2.04 -1.14 -3.17 117.51 118.75 3mi0 h ILE 24 Ca 0.64 -1.86 0.01 0.00 1.00 0.00 0.00 64.86 64.64 3mi0 h ILE 24 Cb 1.38 2.14 -0.05 0.00 -0.74 0.00 0.00 36.82 39.56 3mi0 h ILE 24 CO -0.42 0.57 0.61 0.00 0.00 0.00 0.00 178.15 178.92 3mi0 h ALA 25 N 0.49 1.18 0.00 1.87 0.00 -0.11 -1.04 119.26 121.65 3mi0 h ALA 25 Ca -0.04 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3mi0 h ALA 25 Cb 1.21 -0.38 0.00 0.00 0.00 0.00 0.00 17.79 18.63 3mi0 h ALA 25 CO 0.12 0.58 0.00 -2.13 0.00 0.00 0.00 179.25 177.82 3mi0 n ARG 26 N -4.44 0.13 -3.25 0.00 0.63 0.24 -3.04 116.66 106.93 3mi0 n ARG 26 Ca 0.10 0.54 -0.19 0.00 -0.92 0.00 0.00 57.85 57.39 3mi0 n ARG 26 Cb 0.01 -1.86 0.00 0.00 0.45 0.00 0.00 32.46 31.07 3mi0 n ARG 26 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3mi0 s ALA 27 N -3.39 4.19 1.00 5.13 0.00 -0.65 -4.91 121.76 123.12 3mi0 s ALA 27 Ca 0.00 -1.42 -0.12 0.00 0.00 0.00 0.00 51.96 50.42 3mi0 s ALA 27 Cb 0.06 -1.77 0.14 0.00 0.00 0.00 0.00 23.12 21.56 3mi0 s ALA 27 CO 0.23 -0.18 0.82 1.63 0.00 0.00 0.00 175.76 178.25 3mi0 n LYS 28 N -1.80 -0.92 -4.10 0.00 4.76 -1.26 -0.96 118.16 113.87 3mi0 n LYS 28 Ca 0.02 -0.22 -0.26 0.00 -2.87 0.00 0.00 58.31 54.98 3mi0 n LYS 28 Cb 0.58 -2.13 -0.06 0.00 -1.84 0.00 0.00 35.03 31.58 3mi0 n LYS 28 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 3mi0 s SER 29 N -2.35 5.42 0.01 4.39 0.01 -1.26 -3.86 113.70 116.06 3mi0 s SER 29 Ca 0.64 -0.18 0.01 0.00 1.31 0.00 0.00 55.95 57.73 3mi0 s SER 29 Cb -0.22 -1.38 -0.01 0.00 0.21 0.00 0.00 66.02 64.62 3mi0 s SER 29 CO 0.63 0.06 -0.04 -0.69 0.41 0.00 0.00 173.24 173.61 3mi0 s VAL 30 N -1.79 0.26 0.03 3.43 1.01 0.73 -1.82 120.40 122.25 3mi0 s VAL 30 Ca 0.31 -0.56 0.03 0.00 0.00 0.00 0.00 61.98 61.75 3mi0 s VAL 30 Cb -0.10 -0.30 -0.02 0.00 0.00 0.00 0.00 36.38 35.96 3mi0 s VAL 30 CO 0.23 -0.20 -0.09 0.68 0.00 0.00 0.00 175.10 175.72 3mi0 s VAL 31 N -0.76 0.64 -0.04 2.92 -7.23 -0.11 -1.02 120.40 114.80 3mi0 s VAL 31 Ca -0.06 -0.88 0.02 0.00 -1.81 0.00 0.00 61.98 59.24 3mi0 s VAL 31 Cb -0.06 -0.64 0.01 0.00 0.56 0.00 0.00 36.38 36.26 3mi0 s VAL 31 CO -0.00 -0.20 -0.07 0.00 -0.31 0.00 0.00 175.10 174.52 3mi0 s ALA 32 N -1.00 0.80 -0.02 1.32 0.00 -0.44 -1.27 121.76 121.15 3mi0 s ALA 32 Ca -0.05 -0.20 -0.05 0.00 0.00 0.00 0.00 51.96 51.66 3mi0 s ALA 32 Cb -0.08 -0.39 0.00 0.00 0.00 0.00 0.00 23.12 22.66 3mi0 s ALA 32 CO 0.01 0.07 0.11 -0.48 0.00 0.00 0.00 175.76 175.47 3mi0 s LEU 33 N 0.59 1.61 0.32 0.00 0.05 -0.61 -0.08 118.68 120.56 3mi0 s LEU 33 Ca -0.09 -0.02 -0.28 0.00 0.05 0.00 0.00 54.13 53.79 3mi0 s LEU 33 Cb -0.12 0.50 -0.09 0.00 -2.05 0.00 0.00 46.19 44.43 3mi0 s LEU 33 CO 0.01 -0.21 1.09 0.00 -0.55 0.00 0.00 176.35 176.69 3mi0 s ALA 34 N -0.71 3.30 0.34 1.48 0.00 -0.25 -1.24 121.76 124.68 3mi0 s ALA 34 Ca -0.08 0.85 0.02 0.00 0.00 0.00 0.00 51.96 52.75 3mi0 s ALA 34 Cb -0.05 -3.32 -0.01 0.00 0.00 0.00 0.00 23.12 19.74 3mi0 s ALA 34 CO 0.01 -0.21 0.39 1.52 0.00 0.00 0.00 175.76 177.47 3mi0 s TYR 35 N -1.32 1.40 0.22 0.00 -0.85 -0.72 -4.71 117.35 111.37 3mi0 s TYR 35 Ca 0.49 -1.48 -0.08 0.00 -0.52 0.00 0.00 57.07 55.49 3mi0 s TYR 35 Cb -0.29 -0.37 0.35 0.00 0.38 0.00 0.00 41.96 42.03 3mi0 s TYR 35 CO 0.37 -1.03 1.71 0.00 -1.52 0.00 0.00 175.55 175.09 3mi0 h ALA 36 N 2.11 0.83 -0.12 9.51 0.00 -1.31 -2.72 119.26 127.55 3mi0 h ALA 36 Ca -0.27 0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.77 3mi0 h ALA 36 Cb 1.24 0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.17 3mi0 h ALA 36 CO 0.38 -0.27 0.00 0.41 0.00 0.00 0.00 179.25 179.76 3mi0 n GLY 37 N -1.32 0.01 0.00 0.00 0.00 -1.26 -5.02 105.19 97.59 3mi0 n GLY 37 Ca 0.11 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.77 3mi0 n GLY 37 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mi0 n GLY 38 N 1.07 0.57 3.11 -0.02 0.00 -1.03 -1.70 105.19 107.18 3mi0 n GLY 38 Ca 0.16 -0.60 -0.20 0.00 0.00 0.00 0.00 46.02 45.38 3mi0 n GLY 38 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3mi0 s VAL 39 N 0.00 1.00 -0.08 1.61 1.01 -0.88 -1.76 120.40 121.31 3mi0 s VAL 39 Ca 0.00 -0.81 0.03 0.00 0.00 0.00 0.00 61.98 61.20 3mi0 s VAL 39 Cb 0.00 -0.89 -0.02 0.00 0.00 0.00 0.00 36.38 35.47 3mi0 s VAL 39 CO 0.00 0.08 -0.17 -0.22 0.00 0.00 0.00 175.10 174.79 3mi0 s LEU 40 N -0.83 2.54 -0.16 3.92 2.96 -0.37 -0.89 118.68 125.86 3mi0 s LEU 40 Ca 0.02 -0.34 0.00 0.00 -0.22 0.00 0.00 54.13 53.60 3mi0 s LEU 40 Cb -0.07 -1.53 -0.00 0.00 0.50 0.00 0.00 46.19 45.09 3mi0 s LEU 40 CO 0.01 0.25 -0.15 -0.36 -1.32 0.00 0.00 176.35 174.77 3mi0 s PHE 41 N -0.14 2.79 -0.04 5.38 0.08 0.89 -1.58 117.98 125.36 3mi0 s PHE 41 Ca -0.02 -1.02 -0.01 0.00 0.12 0.00 0.00 56.93 56.00 3mi0 s PHE 41 Cb -0.14 -1.89 0.03 0.00 -0.57 0.00 0.00 43.02 40.45 3mi0 s PHE 41 CO 0.04 -0.47 0.02 0.08 -0.10 0.00 0.00 175.22 174.79 3mi0 s VAL 42 N 0.82 0.16 0.07 -0.44 1.01 -0.40 -1.93 120.40 119.69 3mi0 s VAL 42 Ca -0.05 0.19 0.05 0.00 0.00 0.00 0.00 61.98 62.17 3mi0 s VAL 42 Cb -0.15 -0.32 -0.03 0.00 0.00 0.00 0.00 36.38 35.88 3mi0 s VAL 42 CO -0.00 0.19 -0.13 0.00 0.00 0.00 0.00 175.10 175.16 3mi0 s ALA 43 N 1.62 1.09 -0.56 5.51 0.00 -0.55 -0.93 121.76 127.93 3mi0 s ALA 43 Ca -0.01 -0.96 -0.28 0.00 0.00 0.00 0.00 51.96 50.71 3mi0 s ALA 43 Cb -0.13 -0.08 0.03 0.00 0.00 0.00 0.00 23.12 22.94 3mi0 s ALA 43 CO -0.03 0.14 1.18 -2.00 0.00 0.00 0.00 175.76 175.05 3mi0 s GLU 44 N -1.68 3.55 -0.24 0.00 2.12 -0.75 -1.37 118.70 120.33 3mi0 s GLU 44 Ca -0.03 0.30 -0.03 0.00 0.36 0.00 0.00 54.97 55.58 3mi0 s GLU 44 Cb -0.10 -3.99 0.11 0.00 0.26 0.00 0.00 34.13 30.41 3mi0 s GLU 44 CO 0.02 -1.62 0.27 1.21 -0.54 0.00 0.00 175.26 174.60 3mi0 s ASN 45 N 2.86 1.31 0.13 -1.70 2.47 -0.31 -4.66 114.94 115.03 3mi0 s ASN 45 Ca 0.44 -0.33 -0.14 0.00 0.42 0.00 0.00 52.86 53.25 3mi0 s ASN 45 Cb -0.07 0.54 -0.02 0.00 -1.45 0.00 0.00 41.25 40.25 3mi0 s ASN 45 CO 0.27 -0.34 1.55 1.55 -3.72 0.00 0.00 177.10 176.41 3mi0 h PRO 46 N 8.27 0.76 -6.88 0.43 0.13 -1.81 -3.29 132.00 129.60 3mi0 h PRO 46 Ca -0.16 -0.27 -0.56 0.00 -0.87 0.00 0.00 66.00 64.14 3mi0 h PRO 46 Cb 1.13 -0.06 0.17 0.00 0.13 0.00 0.00 31.00 32.37 3mi0 h PRO 46 CO 0.30 0.86 0.07 0.45 -0.23 0.00 0.00 178.00 179.45 3mi0 n SER 47 N -4.38 0.45 -0.04 1.44 2.88 -1.26 -4.78 113.62 107.93 3mi0 n SER 47 Ca -0.01 0.71 0.01 0.00 -1.33 0.00 0.00 58.87 58.26 3mi0 n SER 47 Cb 0.33 -1.38 -0.13 0.00 -0.75 0.00 0.00 64.21 62.27 3mi0 n SER 47 CO 0.00 0.00 0.00 -2.11 -1.23 0.00 0.00 175.04 171.70 3mi0 n ARG 48 N -1.44 0.89 -0.13 -1.46 1.85 -1.26 -4.69 116.66 110.42 3mi0 n ARG 48 Ca 0.13 -0.09 -0.20 0.00 -1.00 0.00 0.00 57.85 56.69 3mi0 n ARG 48 Cb 0.49 -1.42 -0.12 0.00 -1.05 0.00 0.00 32.46 30.36 3mi0 n ARG 48 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 3mi0 n SER 49 N -2.33 1.98 -4.66 2.89 7.64 -1.26 -4.92 113.62 112.96 3mi0 n SER 49 Ca -0.14 -0.05 -0.42 0.00 1.01 0.00 0.00 58.87 59.27 3mi0 n SER 49 Cb 0.72 -0.49 -0.04 0.00 -1.01 0.00 0.00 64.21 63.39 3mi0 n SER 49 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3mi0 s LEU 50 N -6.70 4.12 0.08 -3.43 1.43 -1.26 -5.04 118.68 107.88 3mi0 s LEU 50 Ca -0.35 1.16 0.06 0.00 -1.03 0.00 0.00 54.13 53.97 3mi0 s LEU 50 Cb 0.10 -3.29 -0.04 0.00 0.03 0.00 0.00 46.19 42.99 3mi0 s LEU 50 CO 0.59 -0.51 -0.05 -1.10 0.23 0.00 0.00 176.35 175.50 3mi0 s GLN 51 N 2.68 2.37 0.00 1.70 -0.21 -1.26 -4.78 119.66 120.16 3mi0 s GLN 51 Ca 0.38 -0.90 0.08 0.00 0.02 0.00 0.00 55.36 54.94 3mi0 s GLN 51 Cb -0.16 -2.43 -0.07 0.00 1.00 0.00 0.00 33.01 31.35 3mi0 s GLN 51 CO 0.09 0.54 0.40 1.63 -2.12 0.00 0.00 175.29 175.83 3mi0 n LYS 52 N 0.77 3.78 -5.09 2.91 5.02 -1.26 -4.98 118.16 119.31 3mi0 n LYS 52 Ca -0.13 -0.14 -0.29 0.00 -2.02 0.00 0.00 58.31 55.73 3mi0 n LYS 52 Cb 0.52 -0.92 -0.16 0.00 -0.02 0.00 0.00 35.03 34.45 3mi0 n LYS 52 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3mi0 s ILE 53 N -1.62 1.79 0.09 -0.18 1.01 -1.26 -1.31 121.20 119.71 3mi0 s ILE 53 Ca 0.04 -0.93 -0.19 0.00 0.00 0.00 0.00 60.65 59.57 3mi0 s ILE 53 Cb 0.06 -1.51 0.04 0.00 0.01 0.00 0.00 42.46 41.07 3mi0 s ILE 53 CO 0.30 0.50 0.45 -0.55 0.00 0.00 0.00 174.94 175.65 3mi0 s SER 54 N -0.18 -0.33 0.32 3.58 0.15 0.98 -4.99 113.70 113.23 3mi0 s SER 54 Ca -0.01 -0.08 -0.27 0.00 0.70 0.00 0.00 55.95 56.30 3mi0 s SER 54 Cb -0.12 0.48 -0.09 0.00 -1.71 0.00 0.00 66.02 64.57 3mi0 s SER 54 CO 0.02 -0.78 1.00 -0.70 1.20 0.00 0.00 173.24 173.98 3mi0 s GLU 55 N -3.11 4.52 -0.09 5.44 2.12 -1.26 -0.41 118.70 125.91 3mi0 s GLU 55 Ca -0.01 1.48 -0.07 0.00 0.36 0.00 0.00 54.97 56.72 3mi0 s GLU 55 Cb 0.00 -2.86 -0.04 0.00 0.26 0.00 0.00 34.13 31.49 3mi0 s GLU 55 CO -0.07 0.19 -0.16 1.28 -0.54 0.00 0.00 175.26 175.96 3mi0 n LEU 56 N 0.62 1.06 0.00 2.70 4.77 -0.11 -4.81 117.00 121.23 3mi0 n LEU 56 Ca 0.02 0.17 -0.08 0.00 -0.03 0.00 0.00 56.01 56.09 3mi0 n LEU 56 Cb 0.49 -0.41 -0.02 0.00 -2.33 0.00 0.00 43.42 41.15 3mi0 n LEU 56 CO 0.47 0.00 0.05 0.00 -1.33 0.00 0.00 177.39 176.58 3mi0 n TYR 57 N -3.67 -0.78 -0.28 -1.77 9.36 -0.92 -4.71 117.16 114.40 3mi0 n TYR 57 Ca -0.19 -1.17 -0.02 0.00 3.32 0.00 0.00 57.90 59.84 3mi0 n TYR 57 Cb 0.53 0.23 0.04 0.00 -0.63 0.00 0.00 39.34 39.51 3mi0 n TYR 57 CO 0.00 0.00 0.00 -0.44 0.22 0.00 0.00 176.86 176.64 3mi0 h ASP 58 N 0.95 -1.17 -0.08 2.98 3.32 -1.95 -2.65 116.42 117.82 3mi0 h ASP 58 Ca -0.12 0.26 0.00 0.00 0.02 0.00 0.00 57.03 57.18 3mi0 h ASP 58 Cb 0.57 0.62 0.00 0.00 0.22 0.00 0.00 39.33 40.74 3mi0 h ASP 58 CO 0.17 -0.29 0.00 0.54 -1.72 0.00 0.00 179.24 177.94 3mi0 n ARG 59 N -5.47 2.10 -5.15 3.56 5.12 -1.26 -1.09 116.66 114.47 3mi0 n ARG 59 Ca 0.08 -2.37 -0.32 0.00 -1.93 0.00 0.00 57.85 53.30 3mi0 n ARG 59 Cb 0.38 -1.45 -0.16 0.00 -1.16 0.00 0.00 32.46 30.07 3mi0 n ARG 59 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 3mi0 s VAL 60 N -2.33 2.23 0.31 1.55 1.01 -1.00 -2.15 120.40 120.02 3mi0 s VAL 60 Ca 0.27 -0.97 0.10 0.00 0.00 0.00 0.00 61.98 61.38 3mi0 s VAL 60 Cb 0.22 -1.86 -0.05 0.00 0.00 0.00 0.00 36.38 34.69 3mi0 s VAL 60 CO 0.05 0.56 -0.06 -0.83 0.00 0.00 0.00 175.10 174.81 3mi0 s GLY 61 N 0.23 1.96 0.00 4.51 0.00 0.90 -0.93 107.32 113.99 3mi0 s GLY 61 Ca -0.14 -1.90 0.02 0.00 0.00 0.00 0.00 44.72 42.69 3mi0 s GLY 61 CO 0.07 -1.90 -0.05 -0.12 0.00 0.00 0.00 173.10 171.10 3mi0 s PHE 62 N -2.49 0.47 -0.06 1.90 5.36 0.46 -1.49 117.98 122.13 3mi0 s PHE 62 Ca 0.33 -0.15 -0.08 0.00 -0.96 0.00 0.00 56.93 56.06 3mi0 s PHE 62 Cb -0.02 -0.30 0.02 0.00 -0.34 0.00 0.00 43.02 42.38 3mi0 s PHE 62 CO 0.18 -0.02 0.22 0.00 -1.46 0.00 0.00 175.22 174.14 3mi0 s ALA 63 N -0.31 -0.54 0.11 11.12 0.00 -0.62 -0.01 121.76 131.50 3mi0 s ALA 63 Ca -0.00 0.47 -0.07 0.00 0.00 0.00 0.00 51.96 52.36 3mi0 s ALA 63 Cb -0.03 -0.24 -0.01 0.00 0.00 0.00 0.00 23.12 22.83 3mi0 s ALA 63 CO -0.00 -0.14 0.17 0.00 0.00 0.00 0.00 175.76 175.79 3mi0 s ALA 64 N -0.29 0.06 0.03 0.00 0.00 -0.43 -0.58 121.76 120.55 3mi0 s ALA 64 Ca -0.04 -0.87 0.02 0.00 0.00 0.00 0.00 51.96 51.07 3mi0 s ALA 64 Cb -0.03 0.59 -0.02 0.00 0.00 0.00 0.00 23.12 23.67 3mi0 s ALA 64 CO 0.01 -0.52 -0.06 0.00 0.00 0.00 0.00 175.76 175.18 3mi0 s ALA 65 N -3.92 0.46 0.00 0.00 0.00 -0.69 -4.86 121.76 112.76 3mi0 s ALA 65 Ca 0.10 -0.58 0.00 0.00 0.00 0.00 0.00 51.96 51.48 3mi0 s ALA 65 Cb 0.05 0.02 0.00 0.00 0.00 0.00 0.00 23.12 23.19 3mi0 s ALA 65 CO -0.07 -0.00 0.00 0.41 0.00 0.00 0.00 175.76 176.10 3mi0 n GLY 66 N 1.90 0.54 3.66 0.00 0.00 -1.26 -1.40 105.19 108.62 3mi0 n GLY 66 Ca -0.20 -1.86 -0.43 0.00 0.00 0.00 0.00 46.02 43.53 3mi0 n GLY 66 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3mi0 s LYS 67 N -1.02 4.20 0.12 1.61 2.20 -0.14 -4.92 119.74 121.77 3mi0 s LYS 67 Ca 0.00 1.49 -0.31 0.00 -0.36 0.00 0.00 55.97 56.80 3mi0 s LYS 67 Cb 0.00 -3.74 -0.09 0.00 -1.51 0.00 0.00 37.83 32.49 3mi0 s LYS 67 CO 0.00 -0.74 1.58 0.35 -0.36 0.00 0.00 175.35 176.19 3mi0 h PHE 68 N 8.07 -1.23 -0.86 4.03 3.57 -1.95 -1.65 116.94 126.92 3mi0 h PHE 68 Ca -0.24 0.04 0.21 0.00 3.53 0.00 0.00 57.97 61.51 3mi0 h PHE 68 Cb 1.09 0.53 -0.05 0.00 2.79 0.00 0.00 35.95 40.31 3mi0 h PHE 68 CO 0.79 -0.51 0.59 -2.95 -2.23 0.00 0.00 178.31 174.00 3mi0 h ASN 69 N -0.61 0.25 0.04 0.41 -0.00 -1.99 0.89 115.58 114.58 3mi0 h ASN 69 Ca 0.04 0.03 -0.14 0.00 -0.00 0.00 0.00 56.30 56.22 3mi0 h ASN 69 Cb 0.67 -0.02 0.01 0.00 -0.00 0.00 0.00 38.32 38.98 3mi0 h ASN 69 CO -0.30 0.10 -0.58 -0.33 -0.00 0.00 0.00 177.43 176.32 3mi0 h GLU 70 N 0.25 0.32 0.00 4.14 5.08 -1.73 -2.84 114.58 119.80 3mi0 h GLU 70 Ca 0.44 -0.40 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 3mi0 h GLU 70 Cb 1.30 0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.68 3mi0 h GLU 70 CO -0.11 1.11 0.00 0.27 -1.00 0.00 0.00 179.01 179.28 3mi0 h PHE 71 N -0.29 0.00 -0.04 4.33 -5.15 -0.63 -2.53 116.94 112.63 3mi0 h PHE 71 Ca -0.08 0.00 -0.19 0.00 -0.20 0.00 0.00 57.97 57.49 3mi0 h PHE 71 Cb 1.34 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 37.51 3mi0 h PHE 71 CO 0.17 0.00 -0.79 0.22 -2.00 0.00 0.00 178.31 175.91 3mi0 h ASP 72 N 0.00 0.43 0.14 -0.68 3.58 -0.94 0.63 116.42 119.57 3mi0 h ASP 72 Ca 0.00 -0.30 0.01 0.00 0.42 0.00 0.00 57.03 57.16 3mi0 h ASP 72 Cb 0.84 -0.13 -0.02 0.00 1.72 0.00 0.00 39.33 41.75 3mi0 h ASP 72 CO 0.00 1.06 -0.17 -1.13 -2.88 0.00 0.00 179.24 176.12 3mi0 h ASN 73 N 0.22 -0.46 -0.41 2.28 -0.73 -1.27 -0.89 115.58 114.32 3mi0 h ASN 73 Ca -0.04 0.05 -0.02 0.00 1.87 0.00 0.00 56.30 58.16 3mi0 h ASN 73 Cb 1.38 0.17 -0.02 0.00 0.27 0.00 0.00 38.32 40.12 3mi0 h ASN 73 CO 0.13 -0.25 0.19 -0.07 -0.37 0.00 0.00 177.43 177.06 3mi0 h LEU 74 N -0.35 0.58 -0.11 0.34 4.07 -1.24 -1.22 115.31 117.39 3mi0 h LEU 74 Ca 0.01 -0.06 -0.00 0.00 0.08 0.00 0.00 57.88 57.91 3mi0 h LEU 74 Cb 0.35 -0.15 -0.00 0.00 1.08 0.00 0.00 40.66 41.94 3mi0 h LEU 74 CO -0.07 0.52 0.05 -0.09 -1.08 0.00 0.00 178.44 177.78 3mi0 h ARG 75 N 0.64 0.15 -0.16 1.13 2.43 -0.19 -0.92 114.38 117.47 3mi0 h ARG 75 Ca 0.16 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.31 3mi0 h ARG 75 Cb 0.12 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.63 3mi0 h ARG 75 CO -0.02 0.24 0.10 0.00 -1.51 0.00 0.00 179.97 178.78 3mi0 h ARG 76 N 0.03 0.20 -0.76 0.20 3.08 -0.88 -1.15 114.38 115.11 3mi0 h ARG 76 Ca 0.04 -0.01 0.09 0.00 0.07 0.00 0.00 59.98 60.16 3mi0 h ARG 76 Cb 0.14 -0.05 -0.05 0.00 0.08 0.00 0.00 29.97 30.09 3mi0 h ARG 76 CO -0.00 0.13 0.50 0.78 -1.07 0.00 0.00 179.97 180.30 3mi0 h GLY 77 N 0.21 0.97 0.97 0.04 0.00 -1.07 -0.26 103.07 103.92 3mi0 h GLY 77 Ca 0.06 -0.28 -0.11 0.00 0.00 0.00 0.00 47.33 47.00 3mi0 h GLY 77 CO -0.02 0.17 -0.24 -1.33 0.00 0.00 0.00 176.54 175.12 3mi0 h GLY 78 N 0.69 0.77 1.13 4.60 0.00 -0.36 -0.68 103.07 109.23 3mi0 h GLY 78 Ca 0.35 -0.75 -0.06 0.00 0.00 0.00 0.00 47.33 46.86 3mi0 h GLY 78 CO -0.13 0.68 0.19 -2.22 0.00 0.00 0.00 176.54 175.07 3mi0 h ILE 79 N 0.46 1.26 -0.10 2.60 2.04 -0.64 -0.46 117.51 122.67 3mi0 h ILE 79 Ca 0.06 -0.91 0.00 0.00 1.00 0.00 0.00 64.86 65.00 3mi0 h ILE 79 Cb 0.80 0.52 -0.00 0.00 -0.74 0.00 0.00 36.82 37.40 3mi0 h ILE 79 CO 0.06 0.35 0.06 -0.61 0.00 0.00 0.00 178.15 178.02 3mi0 h GLN 80 N 1.03 0.13 -0.16 2.37 5.75 -0.90 -0.93 115.11 122.41 3mi0 h GLN 80 Ca 0.22 -0.01 -0.00 0.00 -0.15 0.00 0.00 58.65 58.71 3mi0 h GLN 80 Cb 0.33 -0.03 -0.01 0.00 1.07 0.00 0.00 27.48 28.84 3mi0 h GLN 80 CO -0.00 0.09 0.08 0.35 -2.65 0.00 0.00 178.83 176.70 3mi0 h PHE 81 N 0.13 0.22 -0.32 3.99 3.57 -0.80 -1.84 116.94 121.89 3mi0 h PHE 81 Ca 0.04 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.51 3mi0 h PHE 81 Cb -0.01 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 38.65 3mi0 h PHE 81 CO -0.07 0.23 0.13 0.00 -2.23 0.00 0.00 178.31 176.38 3mi0 h ALA 82 N 0.97 0.41 -0.80 2.41 0.00 -0.95 -0.75 119.26 120.54 3mi0 h ALA 82 Ca 0.06 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 3mi0 h ALA 82 Cb 0.09 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 3mi0 h ALA 82 CO -0.01 0.00 0.34 -0.44 0.00 0.00 0.00 179.25 179.15 3mi0 h ASP 83 N 0.37 1.09 -0.53 0.00 3.32 -1.13 -0.50 116.42 119.05 3mi0 h ASP 83 Ca 0.11 -0.16 -0.06 0.00 0.02 0.00 0.00 57.03 56.93 3mi0 h ASP 83 Cb 0.17 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.41 3mi0 h ASP 83 CO -0.01 0.95 0.08 0.74 -1.72 0.00 0.00 179.24 179.28 3mi0 h THR 84 N 1.16 1.25 -0.37 0.35 2.02 -1.17 -1.80 112.91 114.35 3mi0 h THR 84 Ca 0.27 -0.96 -0.05 0.00 0.77 0.00 0.00 66.41 66.44 3mi0 h THR 84 Cb 0.18 0.85 -0.01 0.00 -1.74 0.00 0.00 68.15 67.43 3mi0 h THR 84 CO -0.03 0.35 0.04 0.03 0.37 0.00 0.00 175.52 176.28 3mi0 h ARG 85 N 0.77 0.62 -0.10 6.66 2.47 -0.85 -0.94 114.38 123.00 3mi0 h ARG 85 Ca 0.16 -0.17 -0.05 0.00 -1.26 0.00 0.00 59.98 58.65 3mi0 h ARG 85 Cb 0.41 -0.07 -0.01 0.00 -1.65 0.00 0.00 29.97 28.66 3mi0 h ARG 85 CO 0.01 0.69 -0.18 0.78 0.56 0.00 0.00 179.97 181.83 3mi0 h GLY 86 N 0.45 0.18 0.97 0.04 0.00 -0.98 -1.23 103.07 102.50 3mi0 h GLY 86 Ca 0.11 -0.12 -0.23 0.00 0.00 0.00 0.00 47.33 47.09 3mi0 h GLY 86 CO 0.01 0.11 -0.98 -1.82 0.00 0.00 0.00 176.54 173.86 3mi0 h TYR 87 N 0.16 0.79 0.00 5.60 3.20 -1.14 -3.00 116.97 122.58 3mi0 h TYR 87 Ca 0.03 -0.50 -0.07 0.00 3.14 0.00 0.00 58.73 61.33 3mi0 h TYR 87 Cb 0.42 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.62 3mi0 h TYR 87 CO 0.00 1.35 -0.34 0.00 -1.64 0.00 0.00 178.16 177.54 3mi0 h ALA 88 N 0.24 1.14 -3.00 1.82 0.00 -1.00 -3.44 119.26 115.01 3mi0 h ALA 88 Ca -0.15 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.45 3mi0 h ALA 88 Cb 1.70 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.44 3mi0 h ALA 88 CO 0.19 0.42 0.00 0.66 0.00 0.00 0.00 179.25 180.52 3mi0 n TYR 89 N -3.69 0.00 -3.90 0.00 4.01 -0.48 -5.08 117.16 108.02 3mi0 n TYR 89 Ca -0.01 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.64 3mi0 n TYR 89 Cb 0.44 0.00 -0.08 0.00 -0.31 0.00 0.00 39.34 39.39 3mi0 n TYR 89 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 3mi0 s ASP 90 N 1.00 0.16 0.21 7.72 2.15 -1.14 -4.95 116.67 121.82 3mi0 s ASP 90 Ca 0.00 -0.60 -0.10 0.00 0.43 0.00 0.00 52.55 52.28 3mi0 s ASP 90 Cb 0.00 0.29 0.28 0.00 -0.30 0.00 0.00 42.92 43.19 3mi0 s ASP 90 CO 0.00 -0.62 1.73 0.03 -0.17 0.00 0.00 175.17 176.13 3mi0 h ARG 91 N 3.17 0.32 0.00 4.34 3.08 -1.89 -0.37 114.38 123.04 3mi0 h ARG 91 Ca -0.33 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.70 3mi0 h ARG 91 Cb 1.19 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.16 3mi0 h ARG 91 CO 0.54 0.21 0.00 0.54 -1.07 0.00 0.00 179.97 180.20 3mi0 n ARG 92 N -5.06 0.25 0.00 0.04 1.74 -1.26 -1.57 116.66 110.81 3mi0 n ARG 92 Ca 0.09 0.06 0.11 0.00 -0.77 0.00 0.00 57.85 57.34 3mi0 n ARG 92 Cb 0.29 -1.50 0.09 0.00 -1.02 0.00 0.00 32.46 30.32 3mi0 n ARG 92 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 3mi0 n ASP 93 N -1.09 0.69 -4.73 0.55 8.00 -0.15 -4.87 116.55 114.95 3mi0 n ASP 93 Ca 0.06 -0.50 -0.40 0.00 0.71 0.00 0.00 54.79 54.66 3mi0 n ASP 93 Cb 0.05 0.59 -0.04 0.00 -0.02 0.00 0.00 41.12 41.69 3mi0 n ASP 93 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3mi0 s VAL 94 N -3.03 4.84 0.07 2.53 1.01 -0.61 -5.01 120.40 120.21 3mi0 s VAL 94 Ca 0.09 1.68 0.01 0.00 0.00 0.00 0.00 61.98 63.76 3mi0 s VAL 94 Cb 0.17 -4.14 -0.04 0.00 0.00 0.00 0.00 36.38 32.37 3mi0 s VAL 94 CO 0.77 0.29 -0.06 0.42 0.00 0.00 0.00 175.10 176.52 3mi0 s THR 95 N 0.40 0.56 0.24 3.92 -4.23 -1.26 -5.00 115.64 110.27 3mi0 s THR 95 Ca 0.41 -1.68 -0.06 0.00 -1.18 0.00 0.00 61.69 59.18 3mi0 s THR 95 Cb -0.20 -1.35 0.23 0.00 1.34 0.00 0.00 72.50 72.52 3mi0 s THR 95 CO 0.23 -0.77 1.90 1.23 -0.54 0.00 0.00 174.62 176.67 3mi0 h GLY 96 N 3.42 1.32 0.79 3.99 0.00 -1.93 -1.84 103.07 108.82 3mi0 h GLY 96 Ca -0.35 -0.46 0.04 0.00 0.00 0.00 0.00 47.33 46.56 3mi0 h GLY 96 CO 0.58 0.41 0.43 -0.09 0.00 0.00 0.00 176.54 177.87 3mi0 h ARG 97 N 1.18 0.79 -0.28 4.80 2.43 -1.96 -0.47 114.38 120.86 3mi0 h ARG 97 Ca 0.36 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.47 3mi0 h ARG 97 Cb -0.03 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.32 3mi0 h ARG 97 CO -0.11 0.52 0.14 1.96 -1.51 0.00 0.00 179.97 180.97 3mi0 h GLN 98 N 0.81 0.41 -0.31 0.20 4.20 -1.78 -0.27 115.11 118.37 3mi0 h GLN 98 Ca 0.30 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.95 3mi0 h GLN 98 Cb 0.10 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 27.79 3mi0 h GLN 98 CO -0.14 0.39 0.20 -0.07 -0.67 0.00 0.00 178.83 178.55 3mi0 h LEU 99 N 0.33 0.35 -0.33 1.46 -0.00 -0.93 -1.18 115.31 115.01 3mi0 h LEU 99 Ca 0.10 -0.01 0.02 0.00 -0.00 0.00 0.00 57.88 57.99 3mi0 h LEU 99 Cb 0.12 -0.09 -0.03 0.00 -0.00 0.00 0.00 40.66 40.66 3mi0 h LEU 99 CO -0.01 0.26 0.16 0.00 -0.00 0.00 0.00 178.44 178.84 3mi0 h ALA 100 N 1.12 0.40 -0.47 1.53 0.00 -0.94 -0.13 119.26 120.78 3mi0 h ALA 100 Ca 0.12 0.01 0.08 0.00 0.00 0.00 0.00 54.91 55.11 3mi0 h ALA 100 Cb -0.04 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.63 3mi0 h ALA 100 CO -0.03 -0.22 0.09 -0.97 0.00 0.00 0.00 179.25 178.13 3mi0 h ASN 101 N 0.33 -0.00 -0.62 0.00 -0.73 -0.87 0.23 115.58 113.93 3mi0 h ASN 101 Ca 0.14 0.08 -0.06 0.00 1.87 0.00 0.00 56.30 58.33 3mi0 h ASN 101 Cb 0.05 0.11 -0.03 0.00 0.27 0.00 0.00 38.32 38.73 3mi0 h ASN 101 CO -0.10 0.03 0.15 0.58 -0.37 0.00 0.00 177.43 177.72 3mi0 h VAL 102 N 0.22 1.25 -0.48 2.57 2.07 -0.59 -1.39 116.25 119.90 3mi0 h VAL 102 Ca 0.23 -0.92 -0.13 0.00 0.82 0.00 0.00 66.70 66.70 3mi0 h VAL 102 Cb 0.30 0.59 -0.01 0.00 -1.52 0.00 0.00 31.29 30.65 3mi0 h VAL 102 CO -0.31 0.35 -0.23 1.88 0.02 0.00 0.00 177.57 179.29 3mi0 h TYR 103 N 0.97 1.15 -0.37 1.57 0.05 -0.29 -1.04 116.97 119.01 3mi0 h TYR 103 Ca 0.20 -0.28 0.03 0.00 0.05 0.00 0.00 58.73 58.73 3mi0 h TYR 103 Cb 0.35 -0.27 -0.03 0.00 1.01 0.00 0.00 36.73 37.78 3mi0 h TYR 103 CO 0.02 1.11 0.16 0.00 -1.05 0.00 0.00 178.16 178.41 3mi0 h ALA 104 N 0.87 0.44 -0.52 3.88 0.00 -0.16 0.82 119.26 124.59 3mi0 h ALA 104 Ca 0.11 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 3mi0 h ALA 104 Cb 0.81 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 3mi0 h ALA 104 CO 0.07 -0.22 0.01 0.37 0.00 0.00 0.00 179.25 179.48 3mi0 h GLN 105 N 0.34 0.88 -0.05 0.00 4.15 -1.12 -0.88 115.11 118.42 3mi0 h GLN 105 Ca 0.16 -0.24 -0.02 0.00 0.77 0.00 0.00 58.65 59.31 3mi0 h GLN 105 Cb 0.10 -0.10 -0.00 0.00 0.21 0.00 0.00 27.48 27.69 3mi0 h GLN 105 CO -0.13 0.87 -0.06 1.15 -1.93 0.00 0.00 178.83 178.72 3mi0 h THR 106 N 0.81 1.39 -0.84 2.39 2.02 -0.49 -2.04 112.91 116.16 3mi0 h THR 106 Ca 0.16 -1.25 -0.04 0.00 0.77 0.00 0.00 66.41 66.04 3mi0 h THR 106 Cb 0.47 2.11 -0.04 0.00 -1.74 0.00 0.00 68.15 68.96 3mi0 h THR 106 CO 0.02 0.34 0.37 -0.07 0.37 0.00 0.00 175.52 176.56 3mi0 h LEU 107 N -0.33 1.12 -0.52 2.58 3.38 -0.87 0.04 115.31 120.71 3mi0 h LEU 107 Ca 0.01 -0.15 0.07 0.00 0.09 0.00 0.00 57.88 57.89 3mi0 h LEU 107 Cb 0.58 -0.29 -0.06 0.00 0.09 0.00 0.00 40.66 40.99 3mi0 h LEU 107 CO 0.01 0.96 0.21 1.23 0.09 0.00 0.00 178.44 180.95 3mi0 h GLY 108 N 1.20 0.71 1.03 0.83 0.00 -1.13 0.32 103.07 106.04 3mi0 h GLY 108 Ca 0.28 -0.13 -0.10 0.00 0.00 0.00 0.00 47.33 47.39 3mi0 h GLY 108 CO -0.03 0.04 -0.09 -0.84 0.00 0.00 0.00 176.54 175.62 3mi0 h THR 109 N 0.41 1.27 0.02 4.70 2.02 -0.79 -2.54 112.91 118.00 3mi0 h THR 109 Ca 0.25 -1.20 -0.00 0.00 0.77 0.00 0.00 66.41 66.22 3mi0 h THR 109 Cb 0.24 1.09 0.00 0.00 -1.74 0.00 0.00 68.15 67.74 3mi0 h THR 109 CO -0.23 0.41 -0.01 0.40 0.37 0.00 0.00 175.52 176.47 3mi0 h ILE 110 N 0.73 1.04 -0.82 3.11 2.04 -0.29 0.31 117.51 123.63 3mi0 h ILE 110 Ca 0.12 -0.19 0.17 0.00 1.00 0.00 0.00 64.86 65.96 3mi0 h ILE 110 Cb 0.63 1.17 -0.06 0.00 -0.74 0.00 0.00 36.82 37.82 3mi0 h ILE 110 CO 0.04 0.05 0.55 0.15 0.00 0.00 0.00 178.15 178.94 3mi0 h PHE 111 N -0.10 0.53 0.09 1.37 3.57 -0.35 -1.06 116.94 120.99 3mi0 h PHE 111 Ca -0.00 0.02 -0.36 0.00 3.53 0.00 0.00 57.97 61.15 3mi0 h PHE 111 Cb 0.10 -0.16 -0.03 0.00 2.79 0.00 0.00 35.95 38.64 3mi0 h PHE 111 CO -0.05 0.18 -2.07 2.41 -2.23 0.00 0.00 178.31 176.54 3mi0 n THR 112 N -4.49 1.70 0.18 4.41 -1.04 -0.96 -4.67 114.28 109.40 3mi0 n THR 112 Ca 0.17 -0.66 0.10 0.00 -2.04 0.00 0.00 64.05 61.62 3mi0 n THR 112 Cb 0.59 -1.57 -0.16 0.00 -1.82 0.00 0.00 70.33 67.38 3mi0 n THR 112 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3mi0 n GLU 113 N -3.37 0.56 -3.90 -2.82 -0.58 0.11 -4.97 120.64 105.66 3mi0 n GLU 113 Ca -0.33 -0.16 -0.32 0.00 -0.42 0.00 0.00 57.16 55.93 3mi0 n GLU 113 Cb 1.04 -1.50 -0.04 0.00 -0.57 0.00 0.00 31.44 30.37 3mi0 n GLU 113 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 3mi0 s GLN 114 N -3.37 3.45 0.27 3.49 -0.21 -0.42 -4.97 119.66 117.90 3mi0 s GLN 114 Ca -0.05 -0.38 -0.02 0.00 0.02 0.00 0.00 55.36 54.94 3mi0 s GLN 114 Cb 0.14 -3.06 0.59 0.00 1.00 0.00 0.00 33.01 31.68 3mi0 s GLN 114 CO 0.88 0.63 1.64 0.00 -2.12 0.00 0.00 175.29 176.31 3mi0 h ALA 115 N 3.38 1.05 -4.18 6.09 0.00 -1.93 -3.39 119.26 120.28 3mi0 h ALA 115 Ca -0.47 0.24 -0.69 0.00 0.00 0.00 0.00 54.91 53.99 3mi0 h ALA 115 Cb 1.17 0.38 -0.25 0.00 0.00 0.00 0.00 17.79 19.09 3mi0 h ALA 115 CO 0.73 -0.45 -0.81 0.21 0.00 0.00 0.00 179.25 178.93 3mi0 s LYS 116 N -6.02 2.33 0.65 0.00 2.20 -1.26 -5.10 119.74 112.53 3mi0 s LYS 116 Ca -0.13 -0.80 -0.10 0.00 -0.36 0.00 0.00 55.97 54.58 3mi0 s LYS 116 Cb 0.24 -2.26 -0.00 0.00 -1.51 0.00 0.00 37.83 34.30 3mi0 s LYS 116 CO 0.76 0.59 1.02 -1.25 -0.36 0.00 0.00 175.35 176.12 3mi0 s PRO 117 N -0.81 3.08 -0.02 4.03 0.04 -1.26 -4.81 135.00 135.25 3mi0 s PRO 117 Ca 0.12 0.41 -0.29 0.00 0.04 0.00 0.00 61.00 61.28 3mi0 s PRO 117 Cb -0.10 -2.11 -0.03 0.00 0.04 0.00 0.00 34.50 32.29 3mi0 s PRO 117 CO 0.01 -0.81 0.92 0.71 0.04 0.00 0.00 177.00 177.87 3mi0 s TYR 118 N -3.20 3.63 -1.27 0.56 1.51 -1.26 -4.90 117.35 112.42 3mi0 s TYR 118 Ca 0.56 1.60 -0.12 0.00 -1.01 0.00 0.00 57.07 58.09 3mi0 s TYR 118 Cb -0.11 -3.06 0.15 0.00 -0.11 0.00 0.00 41.96 38.83 3mi0 s TYR 118 CO 0.50 -0.00 1.72 0.39 -1.11 0.00 0.00 175.55 177.05 3mi0 n GLU 119 N 3.94 3.41 -3.86 -0.62 1.02 -1.26 -4.71 120.64 118.55 3mi0 n GLU 119 Ca 0.05 -3.55 -0.09 0.00 -0.02 0.00 0.00 57.16 53.54 3mi0 n GLU 119 Cb 0.51 -3.06 -0.06 0.00 -0.02 0.00 0.00 31.44 28.81 3mi0 n GLU 119 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 3mi0 s VAL 120 N 1.49 0.07 -0.08 2.62 -7.23 -1.26 -0.97 120.40 115.05 3mi0 s VAL 120 Ca 0.43 -1.15 -0.03 0.00 -1.81 0.00 0.00 61.98 59.42 3mi0 s VAL 120 Cb 0.05 -1.62 0.04 0.00 0.56 0.00 0.00 36.38 35.40 3mi0 s VAL 120 CO 0.00 -0.33 0.17 -0.70 -0.31 0.00 0.00 175.10 173.93 3mi0 s GLU 121 N -3.91 0.12 0.16 4.82 2.12 -0.50 -3.19 118.70 118.33 3mi0 s GLU 121 Ca 0.12 0.41 0.11 0.00 0.36 0.00 0.00 54.97 55.97 3mi0 s GLU 121 Cb 0.03 -0.17 -0.04 0.00 0.26 0.00 0.00 34.13 34.21 3mi0 s GLU 121 CO -0.04 -0.17 -0.22 -0.51 -0.54 0.00 0.00 175.26 173.79 3mi0 s LEU 122 N 1.20 2.52 -0.07 2.70 1.43 -0.17 -1.70 118.68 124.60 3mi0 s LEU 122 Ca -0.09 -0.74 0.01 0.00 -1.03 0.00 0.00 54.13 52.27 3mi0 s LEU 122 Cb -0.11 -1.31 0.02 0.00 0.03 0.00 0.00 46.19 44.81 3mi0 s LEU 122 CO -0.07 0.14 -0.09 0.00 0.23 0.00 0.00 176.35 176.57 3mi0 s VAL 124 N 1.08 2.88 0.09 0.00 1.01 -0.48 -1.59 120.40 123.38 3mi0 s VAL 124 Ca -0.07 -0.73 0.06 0.00 0.00 0.00 0.00 61.98 61.24 3mi0 s VAL 124 Cb -0.14 -2.19 -0.03 0.00 0.00 0.00 0.00 36.38 34.02 3mi0 s VAL 124 CO -0.01 0.53 -0.17 0.00 0.00 0.00 0.00 175.10 175.46 3mi0 s ALA 125 N 0.29 1.42 -0.01 5.51 0.00 -0.55 -0.72 121.76 127.69 3mi0 s ALA 125 Ca -0.11 -1.10 -0.01 0.00 0.00 0.00 0.00 51.96 50.73 3mi0 s ALA 125 Cb -0.16 -0.15 0.01 0.00 0.00 0.00 0.00 23.12 22.82 3mi0 s ALA 125 CO 0.06 0.23 0.03 -2.00 0.00 0.00 0.00 175.76 174.09 3mi0 s GLU 126 N -1.85 0.03 0.37 0.00 2.12 -0.64 -0.07 118.70 118.66 3mi0 s GLU 126 Ca 0.02 0.07 0.08 0.00 0.36 0.00 0.00 54.97 55.50 3mi0 s GLU 126 Cb -0.10 -0.02 -0.06 0.00 0.26 0.00 0.00 34.13 34.21 3mi0 s GLU 126 CO 0.03 -0.03 0.01 0.14 -0.54 0.00 0.00 175.26 174.88 3mi0 s VAL 127 N 0.16 2.30 0.87 3.70 -7.23 -0.91 -0.92 120.40 118.37 3mi0 s VAL 127 Ca -0.01 -1.99 -0.10 0.00 -1.81 0.00 0.00 61.98 58.06 3mi0 s VAL 127 Cb -0.02 -2.85 0.12 0.00 0.56 0.00 0.00 36.38 34.19 3mi0 s VAL 127 CO -0.00 -0.11 1.13 0.00 -0.31 0.00 0.00 175.10 175.80 3mi0 s ALA 128 N -2.61 1.70 0.58 1.32 0.00 -1.26 -4.85 121.76 116.64 3mi0 s ALA 128 Ca 0.35 0.48 -0.16 0.00 0.00 0.00 0.00 51.96 52.64 3mi0 s ALA 128 Cb 0.04 -3.39 -0.04 0.00 0.00 0.00 0.00 23.12 19.72 3mi0 s ALA 128 CO 0.19 -2.47 1.04 -1.01 0.00 0.00 0.00 175.76 173.51 3mi0 s HIS 129 N -2.73 3.11 0.16 0.00 3.76 -1.26 -4.78 115.29 113.55 3mi0 s HIS 129 Ca 0.65 1.49 -0.33 0.00 -0.15 0.00 0.00 55.06 56.73 3mi0 s HIS 129 Cb -0.21 -2.95 -0.16 0.00 1.11 0.00 0.00 32.58 30.37 3mi0 s HIS 129 CO 0.57 -0.95 1.04 0.98 -0.85 0.00 0.00 174.74 175.53 3mi0 n TYR 130 N -2.01 0.93 -1.34 1.40 9.36 -1.26 -0.91 117.16 123.34 3mi0 n TYR 130 Ca 0.08 0.78 -0.12 0.00 3.32 0.00 0.00 57.90 61.96 3mi0 n TYR 130 Cb 0.53 -2.20 -0.05 0.00 -0.63 0.00 0.00 39.34 36.99 3mi0 n TYR 130 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3mi0 n GLY 131 N 1.88 1.13 3.83 2.98 0.00 -1.26 -4.97 105.19 108.77 3mi0 n GLY 131 Ca 0.16 -0.03 -0.22 0.00 0.00 0.00 0.00 46.02 45.93 3mi0 n GLY 131 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3mi0 s GLU 132 N -2.94 2.60 -0.11 1.61 2.12 -0.08 -5.12 118.70 116.78 3mi0 s GLU 132 Ca 0.00 -1.40 0.00 0.00 0.36 0.00 0.00 54.97 53.94 3mi0 s GLU 132 Cb 0.00 -2.38 0.02 0.00 0.26 0.00 0.00 34.13 32.03 3mi0 s GLU 132 CO 0.00 0.05 -0.11 0.95 -0.54 0.00 0.00 175.26 175.62 3mi0 s THR 133 N -2.36 1.22 -0.25 -1.70 -4.23 -1.26 -4.76 115.64 102.29 3mi0 s THR 133 Ca 0.41 -0.44 -0.26 0.00 -1.18 0.00 0.00 61.69 60.22 3mi0 s THR 133 Cb -0.04 -1.17 0.12 0.00 1.34 0.00 0.00 72.50 72.74 3mi0 s THR 133 CO 0.26 0.39 1.01 -0.75 -0.54 0.00 0.00 174.62 174.99 3mi0 s LYS 134 N 1.39 0.54 0.18 3.99 2.20 -1.26 -5.06 119.74 121.72 3mi0 s LYS 134 Ca 0.00 0.51 -0.30 0.00 -0.36 0.00 0.00 55.97 55.82 3mi0 s LYS 134 Cb -0.13 0.26 -0.08 0.00 -1.51 0.00 0.00 37.83 36.37 3mi0 s LYS 134 CO -0.06 -0.09 1.21 0.50 -0.36 0.00 0.00 175.35 176.55 3mi0 s ARG 135 N -0.07 4.48 0.85 4.03 3.52 -1.26 -4.38 118.95 126.13 3mi0 s ARG 135 Ca 0.02 1.89 -0.14 0.00 -0.13 0.00 0.00 55.73 57.36 3mi0 s ARG 135 Cb -0.04 -3.24 -0.00 0.00 -1.56 0.00 0.00 34.95 30.10 3mi0 s ARG 135 CO -0.04 -0.12 0.42 -2.30 -0.81 0.00 0.00 175.30 172.45 3mi0 n PRO 136 N 2.63 -0.02 -4.82 5.12 -0.02 -1.26 -4.85 135.00 131.78 3mi0 n PRO 136 Ca 0.05 0.04 -0.26 0.00 -2.02 0.00 0.00 63.50 61.31 3mi0 n PRO 136 Cb 0.45 -1.82 -0.15 0.00 -0.02 0.00 0.00 33.50 31.96 3mi0 n PRO 136 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 3mi0 s GLU 137 N -3.20 1.51 -0.02 -0.52 2.02 -0.10 -4.98 118.70 113.41 3mi0 s GLU 137 Ca 0.60 -0.83 0.02 0.00 0.02 0.00 0.00 54.97 54.78 3mi0 s GLU 137 Cb -0.27 -1.54 0.01 0.00 0.10 0.00 0.00 34.13 32.43 3mi0 s GLU 137 CO 0.64 0.41 -0.05 -0.51 0.02 0.00 0.00 175.26 175.76 3mi0 s LEU 138 N -0.81 1.69 0.05 1.80 1.43 -1.23 -1.62 118.68 119.98 3mi0 s LEU 138 Ca 0.08 -0.11 0.05 0.00 -1.03 0.00 0.00 54.13 53.11 3mi0 s LEU 138 Cb -0.08 -0.37 -0.02 0.00 0.03 0.00 0.00 46.19 45.75 3mi0 s LEU 138 CO 0.00 0.02 -0.14 -0.31 0.23 0.00 0.00 176.35 176.15 3mi0 s TYR 139 N 0.34 1.25 -0.08 0.29 2.02 0.10 -1.38 117.35 119.89 3mi0 s TYR 139 Ca -0.04 -0.38 0.04 0.00 -0.37 0.00 0.00 57.07 56.33 3mi0 s TYR 139 Cb -0.08 -0.74 -0.00 0.00 -0.40 0.00 0.00 41.96 40.74 3mi0 s TYR 139 CO -0.00 0.04 -0.23 0.50 -1.57 0.00 0.00 175.55 174.30 3mi0 s ARG 140 N -1.28 2.74 -0.09 -0.62 3.52 -0.50 -1.39 118.95 121.34 3mi0 s ARG 140 Ca 0.01 -0.83 0.05 0.00 -0.13 0.00 0.00 55.73 54.83 3mi0 s ARG 140 Cb -0.08 -2.14 -0.00 0.00 -1.56 0.00 0.00 34.95 31.16 3mi0 s ARG 140 CO 0.02 0.22 -0.24 0.42 -0.81 0.00 0.00 175.30 174.90 3mi0 s ILE 141 N 0.24 2.02 0.39 4.11 1.09 0.51 -0.89 121.20 128.66 3mi0 s ILE 141 Ca -0.14 -1.01 0.08 0.00 -1.10 0.00 0.00 60.65 58.47 3mi0 s ILE 141 Cb -0.16 -1.73 -0.01 0.00 -1.06 0.00 0.00 42.46 39.49 3mi0 s ILE 141 CO 0.07 0.55 0.42 0.42 -0.10 0.00 0.00 174.94 176.30 3mi0 s THR 142 N 0.19 3.05 0.32 2.92 -4.23 -0.15 -1.00 115.64 116.75 3mi0 s THR 142 Ca -0.14 -1.23 0.16 0.00 -1.18 0.00 0.00 61.69 59.30 3mi0 s THR 142 Cb -0.17 -3.08 0.16 0.00 1.34 0.00 0.00 72.50 70.76 3mi0 s THR 142 CO 0.07 -0.05 1.43 0.10 -0.54 0.00 0.00 174.62 175.63 3mi0 h TYR 143 N 0.96 0.00 -0.20 3.99 -0.00 -1.83 0.18 116.97 120.08 3mi0 h TYR 143 Ca -0.42 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.31 3mi0 h TYR 143 Cb 1.27 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.00 3mi0 h TYR 143 CO 0.48 0.00 0.00 -0.40 -0.00 0.00 0.00 178.16 178.24 3mi0 n ASP 144 N -2.34 2.64 0.00 0.10 3.85 -1.26 -4.49 116.55 115.04 3mi0 n ASP 144 Ca -0.01 -1.77 0.00 0.00 -0.71 0.00 0.00 54.79 52.30 3mi0 n ASP 144 Cb 0.44 -0.12 0.00 0.00 -1.35 0.00 0.00 41.12 40.08 3mi0 n ASP 144 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3mi0 n GLY 145 N 0.84 0.51 3.78 6.12 0.00 0.63 -3.99 105.19 113.07 3mi0 n GLY 145 Ca 0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.77 3mi0 n GLY 145 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3mi0 s SER 146 N -2.97 6.36 0.01 1.61 0.01 -1.25 -4.66 113.70 112.82 3mi0 s SER 146 Ca 0.00 2.19 0.02 0.00 1.31 0.00 0.00 55.95 59.47 3mi0 s SER 146 Cb 0.00 -2.59 -0.01 0.00 0.21 0.00 0.00 66.02 63.63 3mi0 s SER 146 CO 0.00 -0.77 -0.08 -0.51 0.41 0.00 0.00 173.24 172.29 3mi0 s ILE 147 N -1.62 0.59 -0.00 1.44 2.07 -1.26 -0.97 121.20 121.45 3mi0 s ILE 147 Ca 0.62 -0.49 0.01 0.00 -1.41 0.00 0.00 60.65 59.38 3mi0 s ILE 147 Cb -0.25 -0.53 -0.00 0.00 0.13 0.00 0.00 42.46 41.80 3mi0 s ILE 147 CO 0.31 0.05 -0.03 0.00 -1.91 0.00 0.00 174.94 173.36 3mi0 s ALA 148 N -0.43 0.22 -0.52 1.50 0.00 -0.07 -4.97 121.76 117.48 3mi0 s ALA 148 Ca 0.00 -0.13 -0.21 0.00 0.00 0.00 0.00 51.96 51.63 3mi0 s ALA 148 Cb -0.04 -0.05 0.05 0.00 0.00 0.00 0.00 23.12 23.08 3mi0 s ALA 148 CO -0.00 0.05 0.73 0.34 0.00 0.00 0.00 175.76 176.88 3mi0 s ASP 149 N -0.09 6.26 -0.14 0.00 -1.08 -1.26 -1.42 116.67 118.94 3mi0 s ASP 149 Ca 0.01 -0.75 -0.11 0.00 -0.52 0.00 0.00 52.55 51.17 3mi0 s ASP 149 Cb -0.01 -2.34 -0.05 0.00 -1.46 0.00 0.00 42.92 39.06 3mi0 s ASP 149 CO -0.00 -1.01 0.23 -1.61 0.52 0.00 0.00 175.17 173.30 3mi0 s GLU 150 N 3.06 4.00 0.14 4.34 0.41 -0.48 -5.02 118.70 125.15 3mi0 s GLU 150 Ca 0.20 0.01 0.16 0.00 -0.41 0.00 0.00 54.97 54.93 3mi0 s GLU 150 Cb -0.17 -3.34 -0.07 0.00 -1.78 0.00 0.00 34.13 28.77 3mi0 s GLU 150 CO 0.14 0.45 1.04 -1.00 -0.49 0.00 0.00 175.26 175.40 3mi0 h PRO 151 N 6.00 0.00 0.00 0.39 0.13 -1.95 -3.25 132.00 133.31 3mi0 h PRO 151 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 3mi0 h PRO 151 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 3mi0 h PRO 151 CO 0.70 0.37 -0.99 0.72 -0.23 0.00 0.00 178.00 178.57 3mi0 n HIS 152 N -3.01 0.00 -3.67 1.56 8.25 -1.26 -4.86 115.22 112.23 3mi0 n HIS 152 Ca -0.05 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.31 3mi0 n HIS 152 Cb 0.80 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.89 3mi0 n HIS 152 CO 0.00 0.00 0.00 -0.59 0.64 0.00 0.00 176.34 176.39 3mi0 s PHE 153 N -2.00 -0.31 0.01 4.41 -0.12 -1.26 -1.09 117.98 117.62 3mi0 s PHE 153 Ca 0.00 -0.03 0.01 0.00 -0.05 0.00 0.00 56.93 56.86 3mi0 s PHE 153 Cb 0.00 0.61 -0.01 0.00 -0.63 0.00 0.00 43.02 42.99 3mi0 s PHE 153 CO 0.00 -1.04 -0.04 0.08 -0.05 0.00 0.00 175.22 174.16 3mi0 s VAL 154 N -3.85 0.32 -0.04 -2.49 1.01 0.89 -4.89 120.40 111.35 3mi0 s VAL 154 Ca 0.07 -0.46 0.02 0.00 0.00 0.00 0.00 61.98 61.61 3mi0 s VAL 154 Cb -0.03 -0.33 0.01 0.00 0.00 0.00 0.00 36.38 36.03 3mi0 s VAL 154 CO -0.02 -0.10 -0.10 -0.69 0.00 0.00 0.00 175.10 174.19 3mi0 s VAL 155 N -0.55 0.95 0.01 2.92 1.01 -1.26 -1.33 120.40 122.14 3mi0 s VAL 155 Ca -0.03 -0.41 -0.07 0.00 0.00 0.00 0.00 61.98 61.47 3mi0 s VAL 155 Cb -0.04 -0.86 -0.00 0.00 0.00 0.00 0.00 36.38 35.47 3mi0 s VAL 155 CO -0.00 0.30 0.12 -0.04 0.00 0.00 0.00 175.10 175.48 3mi0 s MET 156 N 0.45 0.49 0.00 2.72 -1.94 -0.19 -4.99 119.30 115.83 3mi0 s MET 156 Ca -0.09 -0.46 0.00 0.00 -1.71 0.00 0.00 55.69 53.43 3mi0 s MET 156 Cb -0.12 0.20 0.00 0.00 2.01 0.00 0.00 34.83 36.92 3mi0 s MET 156 CO 0.02 -0.12 0.00 0.41 -0.01 0.00 0.00 175.02 175.32 3mi0 n GLY 157 N 1.36 -0.65 7.00 -0.03 0.00 -1.26 -0.19 105.19 111.42 3mi0 n GLY 157 Ca -0.22 -1.42 0.00 0.00 0.00 0.00 0.00 46.02 44.38 3mi0 n GLY 157 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mi0 n GLY 158 N 0.20 2.78 3.43 -0.02 0.00 -0.13 -4.15 105.19 107.30 3mi0 n GLY 158 Ca 0.00 -0.32 -0.44 0.00 0.00 0.00 0.00 46.02 45.26 3mi0 n GLY 158 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3mi0 s THR 159 N 0.00 5.05 0.01 2.61 -4.23 -1.26 -4.45 115.64 113.37 3mi0 s THR 159 Ca 0.00 -0.71 -0.12 0.00 -1.18 0.00 0.00 61.69 59.68 3mi0 s THR 159 Cb 0.00 -4.20 -0.33 0.00 1.34 0.00 0.00 72.50 69.31 3mi0 s THR 159 CO 0.00 -0.67 0.91 0.71 -0.54 0.00 0.00 174.62 175.03 3mi0 h THR 160 N 5.80 1.19 -0.77 3.99 1.35 -1.96 -3.39 112.91 119.12 3mi0 h THR 160 Ca -0.28 -2.69 0.07 0.00 -0.55 0.00 0.00 66.41 62.96 3mi0 h THR 160 Cb 1.10 2.93 -0.09 0.00 -1.73 0.00 0.00 68.15 70.36 3mi0 h THR 160 CO 0.91 0.83 -0.46 -0.62 -0.25 0.00 0.00 175.52 175.94 3mi0 n GLU 161 N -3.64 -0.34 -0.10 4.72 -0.58 -1.26 0.65 120.64 120.09 3mi0 n GLU 161 Ca -0.18 1.20 -0.05 0.00 -0.42 0.00 0.00 57.16 57.70 3mi0 n GLU 161 Cb 1.09 -1.76 0.02 0.00 -0.57 0.00 0.00 31.44 30.21 3mi0 n GLU 161 CO 0.00 0.00 0.00 -1.35 -0.48 0.00 0.00 177.13 175.30 3mi0 h PRO 162 N 0.00 0.12 -0.47 3.49 0.11 -1.97 -1.06 132.00 132.21 3mi0 h PRO 162 Ca 0.12 -0.01 -0.10 0.00 0.11 0.00 0.00 66.00 66.12 3mi0 h PRO 162 Cb 0.32 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 31.38 3mi0 h PRO 162 CO -0.73 0.08 -0.12 0.82 -0.21 0.00 0.00 178.00 177.84 3mi0 h ILE 163 N 0.12 1.26 0.91 4.15 2.04 -1.26 -1.03 117.51 123.70 3mi0 h ILE 163 Ca 0.17 -1.22 -0.04 0.00 1.00 0.00 0.00 64.86 64.77 3mi0 h ILE 163 Cb 0.23 1.03 0.00 0.00 -0.74 0.00 0.00 36.82 37.34 3mi0 h ILE 163 CO -0.27 0.42 -0.48 0.00 0.00 0.00 0.00 178.15 177.82 3mi0 h ALA 164 N 1.08 -1.32 -0.35 1.87 0.00 0.67 -2.25 119.26 118.96 3mi0 h ALA 164 Ca 0.13 -0.27 0.04 0.00 0.00 0.00 0.00 54.91 54.80 3mi0 h ALA 164 Cb 0.64 0.56 -0.04 0.00 0.00 0.00 0.00 17.79 18.94 3mi0 h ALA 164 CO 0.04 -1.25 0.12 -0.91 0.00 0.00 0.00 179.25 177.25 3mi0 h ASN 165 N -1.28 0.12 -1.01 0.00 2.35 -1.20 0.13 115.58 114.69 3mi0 h ASN 165 Ca -0.12 0.04 0.26 0.00 -0.55 0.00 0.00 56.30 55.93 3mi0 h ASN 165 Cb 1.00 0.03 -0.08 0.00 0.05 0.00 0.00 38.32 39.32 3mi0 h ASN 165 CO 0.17 0.11 0.68 0.00 -1.65 0.00 0.00 177.43 176.74 3mi0 h ALA 166 N 1.23 2.41 0.14 -0.83 0.00 -1.13 0.97 119.26 122.05 3mi0 h ALA 166 Ca 0.16 0.03 -0.32 0.00 0.00 0.00 0.00 54.91 54.77 3mi0 h ALA 166 Cb 0.14 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 3mi0 h ALA 166 CO -0.17 -0.77 -1.60 -0.07 0.00 0.00 0.00 179.25 176.65 3mi0 h LEU 167 N 0.30 0.47 -2.00 0.00 3.38 -0.60 -2.25 115.31 114.62 3mi0 h LEU 167 Ca 0.54 -0.66 0.16 0.00 0.09 0.00 0.00 57.88 58.01 3mi0 h LEU 167 Cb 1.56 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 42.13 3mi0 h LEU 167 CO -0.20 1.55 0.39 0.11 0.09 0.00 0.00 178.44 180.38 3mi0 h LYS 168 N 0.08 0.00 0.00 1.13 1.57 0.17 1.00 116.57 120.52 3mi0 h LYS 168 Ca -0.27 -0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.24 3mi0 h LYS 168 Cb 2.05 -0.00 -0.04 0.00 0.08 0.00 0.00 32.23 34.31 3mi0 h LYS 168 CO 0.17 0.00 -1.48 0.39 -0.57 0.00 0.00 179.45 177.96 3mi0 n GLU 169 N -4.37 0.57 -0.08 3.15 -0.58 -0.62 -4.40 120.64 114.31 3mi0 n GLU 169 Ca 0.10 0.52 -0.08 0.00 -0.42 0.00 0.00 57.16 57.28 3mi0 n GLU 169 Cb 0.62 -1.70 0.07 0.00 -0.57 0.00 0.00 31.44 29.86 3mi0 n GLU 169 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 3mi0 h SER 170 N -1.00 0.79 -2.39 1.62 0.87 -1.09 -3.46 113.55 108.89 3mi0 h SER 170 Ca -0.41 -0.31 -0.58 0.00 -1.23 0.00 0.00 61.79 59.26 3mi0 h SER 170 Cb 1.35 -0.22 0.06 0.00 -0.44 0.00 0.00 62.40 63.16 3mi0 h SER 170 CO -0.25 1.02 0.74 0.00 -0.53 0.00 0.00 176.83 177.82 3mi0 n TYR 171 N -4.09 2.24 -4.41 2.24 9.36 0.34 -4.98 117.16 117.86 3mi0 n TYR 171 Ca -0.00 0.32 -0.22 0.00 3.32 0.00 0.00 57.90 61.32 3mi0 n TYR 171 Cb 0.46 -2.52 -0.16 0.00 -0.63 0.00 0.00 39.34 36.50 3mi0 n TYR 171 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 3mi0 s ALA 172 N 0.62 0.95 0.37 2.98 0.00 -1.26 -4.97 121.76 120.45 3mi0 s ALA 172 Ca 0.76 -0.30 -0.26 0.00 0.00 0.00 0.00 51.96 52.15 3mi0 s ALA 172 Cb -0.67 -0.41 -0.09 0.00 0.00 0.00 0.00 23.12 21.95 3mi0 s ALA 172 CO 0.41 0.11 1.21 -2.00 0.00 0.00 0.00 175.76 175.49 3mi0 s GLU 173 N 0.46 4.17 -0.29 0.00 2.12 -1.26 -3.12 118.70 120.78 3mi0 s GLU 173 Ca -0.08 1.96 0.00 0.00 0.36 0.00 0.00 54.97 57.20 3mi0 s GLU 173 Cb -0.12 -2.82 0.00 0.00 0.26 0.00 0.00 34.13 31.45 3mi0 s GLU 173 CO 0.01 -0.26 0.00 0.09 -0.54 0.00 0.00 175.26 174.56 3mi0 n ASN 174 N 0.35 -4.23 -4.68 -1.70 4.13 -1.26 -4.96 115.26 102.91 3mi0 n ASN 174 Ca 0.03 0.07 -0.38 0.00 1.68 0.00 0.00 54.58 55.98 3mi0 n ASN 174 Cb 0.45 -1.97 0.06 0.00 -1.54 0.00 0.00 39.78 36.78 3mi0 n ASN 174 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3mi0 n ALA 175 N 1.05 0.79 -1.33 5.41 0.00 -1.18 -4.13 120.51 121.13 3mi0 n ALA 175 Ca -0.03 0.02 -0.30 0.00 0.00 0.00 0.00 53.44 53.14 3mi0 n ALA 175 Cb 0.24 -2.24 0.22 0.00 0.00 0.00 0.00 19.45 17.67 3mi0 n ALA 175 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3mi0 s SER 176 N -1.25 1.70 0.09 0.00 1.04 -1.26 -1.21 113.70 112.82 3mi0 s SER 176 Ca 0.78 0.58 -0.24 0.00 0.48 0.00 0.00 55.95 57.55 3mi0 s SER 176 Cb -0.40 -0.81 -0.14 0.00 0.10 0.00 0.00 66.02 64.76 3mi0 s SER 176 CO 0.44 -3.64 1.72 0.25 0.98 0.00 0.00 173.24 173.00 3mi0 h LEU 177 N -2.25 -0.12 -0.50 2.42 5.85 -1.99 -0.73 115.31 117.99 3mi0 h LEU 177 Ca -0.46 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.29 3mi0 h LEU 177 Cb 1.28 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 42.32 3mi0 h LEU 177 CO 0.38 -0.08 0.30 0.74 -0.34 0.00 0.00 178.44 179.44 3mi0 h THR 178 N -0.12 1.06 -0.66 1.05 2.02 -1.92 0.20 112.91 114.54 3mi0 h THR 178 Ca -0.00 -0.21 -0.02 0.00 0.77 0.00 0.00 66.41 66.95 3mi0 h THR 178 Cb 0.11 0.41 -0.03 0.00 -1.74 0.00 0.00 68.15 66.89 3mi0 h THR 178 CO -0.00 0.11 0.33 0.44 0.37 0.00 0.00 175.52 176.77 3mi0 h ASP 179 N 0.60 0.85 -0.42 4.18 3.32 -1.89 -1.61 116.42 121.45 3mi0 h ASP 179 Ca 0.20 -0.12 -0.04 0.00 0.02 0.00 0.00 57.03 57.08 3mi0 h ASP 179 Cb 0.00 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.32 3mi0 h ASP 179 CO -0.08 0.73 0.09 0.00 -1.72 0.00 0.00 179.24 178.26 3mi0 h ALA 180 N 1.15 0.56 0.31 3.45 0.00 -0.64 -1.10 119.26 122.99 3mi0 h ALA 180 Ca 0.23 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 3mi0 h ALA 180 Cb 0.09 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 3mi0 h ALA 180 CO -0.03 0.25 -0.28 1.25 0.00 0.00 0.00 179.25 180.44 3mi0 h LEU 181 N 0.54 -0.73 0.17 0.00 5.85 -0.37 -0.86 115.31 119.90 3mi0 h LEU 181 Ca 0.13 0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.93 3mi0 h LEU 181 Cb 0.33 0.24 -0.04 0.00 0.37 0.00 0.00 40.66 41.56 3mi0 h LEU 181 CO 0.00 -0.41 -0.45 0.03 -0.34 0.00 0.00 178.44 177.27 3mi0 h ARG 182 N -0.61 -0.69 -0.88 1.25 -0.00 -1.23 0.21 114.38 112.44 3mi0 h ARG 182 Ca -0.02 0.05 0.23 0.00 -0.50 0.00 0.00 59.98 59.74 3mi0 h ARG 182 Cb 0.54 0.16 -0.13 0.00 0.00 0.00 0.00 29.97 30.54 3mi0 h ARG 182 CO -0.04 -0.46 0.30 0.82 0.00 0.00 0.00 179.97 180.59 3mi0 h ILE 183 N -0.72 0.39 0.01 2.04 2.04 -1.08 -0.81 117.51 119.38 3mi0 h ILE 183 Ca 0.01 -0.10 -0.00 0.00 1.00 0.00 0.00 64.86 65.77 3mi0 h ILE 183 Cb 0.72 0.08 0.00 0.00 -0.74 0.00 0.00 36.82 36.88 3mi0 h ILE 183 CO -0.23 0.05 -0.00 0.00 0.00 0.00 0.00 178.15 177.97 3mi0 h ALA 184 N 1.74 -0.01 -0.86 1.87 0.00 -0.31 -2.63 119.26 119.07 3mi0 h ALA 184 Ca 0.55 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 55.24 3mi0 h ALA 184 Cb 1.09 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.84 3mi0 h ALA 184 CO -0.59 -0.28 0.55 0.28 0.00 0.00 0.00 179.25 179.20 3mi0 h VAL 185 N -0.46 1.23 0.55 0.00 2.07 0.24 0.24 116.25 120.11 3mi0 h VAL 185 Ca -0.00 -0.45 -0.03 0.00 0.82 0.00 0.00 66.70 67.04 3mi0 h VAL 185 Cb 0.45 -0.02 0.01 0.00 -1.52 0.00 0.00 31.29 30.21 3mi0 h VAL 185 CO 0.00 0.23 -0.26 0.00 0.02 0.00 0.00 177.57 177.56 3mi0 h ALA 186 N 1.43 -0.73 -0.23 1.67 0.00 -1.23 0.27 119.26 120.43 3mi0 h ALA 186 Ca 0.31 -0.20 0.06 0.00 0.00 0.00 0.00 54.91 55.08 3mi0 h ALA 186 Cb -0.10 0.28 -0.07 0.00 0.00 0.00 0.00 17.79 17.90 3mi0 h ALA 186 CO -0.06 -0.79 -0.36 0.00 0.00 0.00 0.00 179.25 178.04 3mi0 h ALA 187 N -0.68 -0.38 -0.32 0.00 0.00 -1.29 0.17 119.26 116.76 3mi0 h ALA 187 Ca -0.08 0.04 0.07 0.00 0.00 0.00 0.00 54.91 54.95 3mi0 h ALA 187 Cb 0.63 0.71 -0.08 0.00 0.00 0.00 0.00 17.79 19.05 3mi0 h ALA 187 CO 0.12 -0.82 -0.30 1.25 0.00 0.00 0.00 179.25 179.50 3mi0 h LEU 188 N -0.37 -0.99 -1.50 0.00 5.85 -0.95 0.94 115.31 118.29 3mi0 h LEU 188 Ca 0.12 0.17 0.26 0.00 0.84 0.00 0.00 57.88 59.27 3mi0 h LEU 188 Cb 0.57 0.46 -0.08 0.00 0.37 0.00 0.00 40.66 41.98 3mi0 h LEU 188 CO -0.44 -0.32 0.68 -0.09 -0.34 0.00 0.00 178.44 177.93 3mi0 h ARG 189 N -0.27 0.32 -0.72 1.25 2.43 0.14 0.30 114.38 117.82 3mi0 h ARG 189 Ca 0.15 -0.02 0.18 0.00 -0.81 0.00 0.00 59.98 59.48 3mi0 h ARG 189 Cb 0.52 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 29.96 3mi0 h ARG 189 CO -0.47 0.21 0.50 0.00 -1.51 0.00 0.00 179.97 178.70 3mi0 h ALA 190 N 1.59 2.37 -3.00 2.80 0.00 0.19 -3.34 119.26 119.87 3mi0 h ALA 190 Ca 0.56 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.46 3mi0 h ALA 190 Cb 1.54 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.33 3mi0 h ALA 190 CO -0.23 -0.58 0.00 0.41 0.00 0.00 0.00 179.25 178.85 3mi0 n GLY 191 N -1.59 -0.35 0.71 0.00 0.00 0.11 -4.92 105.19 99.13 3mi0 n GLY 191 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 3mi0 n GLY 191 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3mi0 n SER 192 N 0.00 -4.34 0.00 1.61 7.64 -1.26 -5.09 113.62 112.18 3mi0 n SER 192 Ca 0.00 0.57 0.00 0.00 1.01 0.00 0.00 58.87 60.45 3mi0 n SER 192 Cb 0.00 -1.58 0.00 0.00 -1.01 0.00 0.00 64.21 61.62 3mi0 n SER 192 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3mi0 n LEU 203 N -1.02 0.00 0.00 -3.43 4.77 -1.26 -5.16 117.00 110.90 3mi0 n LEU 203 Ca 0.00 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.85 3mi0 n LEU 203 Cb 0.01 0.00 0.09 0.00 -2.33 0.00 0.00 43.42 41.19 3mi0 n LEU 203 CO 0.00 0.00 0.37 0.61 -1.33 0.00 0.00 177.39 177.04 3mi0 n GLY 204 N 0.00 -0.70 0.35 -0.72 0.00 -1.26 -4.84 105.19 98.01 3mi0 n GLY 204 Ca 0.00 -1.78 0.01 0.00 0.00 0.00 0.00 46.02 44.25 3mi0 n GLY 204 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3mi0 h VAL 205 N -1.10 1.18 -0.73 1.61 2.07 -1.94 -1.73 116.25 115.61 3mi0 h VAL 205 Ca -0.19 -0.34 -0.02 0.00 0.82 0.00 0.00 66.70 66.97 3mi0 h VAL 205 Cb 0.57 0.11 -0.03 0.00 -1.52 0.00 0.00 31.29 30.41 3mi0 h VAL 205 CO 0.15 0.18 0.36 0.00 0.02 0.00 0.00 177.57 178.28 3mi0 h ALA 206 N 1.54 1.27 -0.20 1.67 0.00 -1.94 -3.09 119.26 118.51 3mi0 h ALA 206 Ca 0.28 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3mi0 h ALA 206 Cb -0.09 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.41 3mi0 h ALA 206 CO -0.06 0.57 0.00 -1.13 0.00 0.00 0.00 179.25 178.63 3mi0 n SER 207 N -4.34 2.46 -4.36 0.00 3.41 -0.71 -4.59 113.62 105.49 3mi0 n SER 207 Ca 0.07 -1.82 -0.26 0.00 -0.26 0.00 0.00 58.87 56.60 3mi0 n SER 207 Cb 0.13 -0.12 -0.12 0.00 -0.26 0.00 0.00 64.21 63.83 3mi0 n SER 207 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3mi0 s LEU 208 N -1.67 2.37 -0.20 1.04 1.43 -0.83 -1.16 118.68 119.65 3mi0 s LEU 208 Ca 0.34 -0.79 -0.00 0.00 -1.03 0.00 0.00 54.13 52.66 3mi0 s LEU 208 Cb 0.20 -1.04 0.02 0.00 0.03 0.00 0.00 46.19 45.40 3mi0 s LEU 208 CO 0.30 0.09 -0.15 -0.70 0.23 0.00 0.00 176.35 176.11 3mi0 s GLU 209 N -2.34 3.00 -0.02 1.70 2.12 -0.47 -4.78 118.70 117.90 3mi0 s GLU 209 Ca 0.14 -0.84 0.04 0.00 0.36 0.00 0.00 54.97 54.67 3mi0 s GLU 209 Cb -0.09 -2.72 -0.01 0.00 0.26 0.00 0.00 34.13 31.58 3mi0 s GLU 209 CO 0.07 -0.25 -0.14 0.08 -0.54 0.00 0.00 175.26 174.48 3mi0 s VAL 210 N 1.32 1.12 0.12 3.70 1.01 -1.26 -1.48 120.40 124.93 3mi0 s VAL 210 Ca 0.04 -0.58 -0.23 0.00 0.00 0.00 0.00 61.98 61.21 3mi0 s VAL 210 Cb -0.14 -0.96 0.07 0.00 0.00 0.00 0.00 36.38 35.35 3mi0 s VAL 210 CO -0.10 0.33 0.59 0.00 0.00 0.00 0.00 175.10 175.92 3mi0 s ALA 211 N -0.09 -1.54 0.14 5.51 0.00 -0.81 -0.75 121.76 124.21 3mi0 s ALA 211 Ca 0.01 0.56 0.04 0.00 0.00 0.00 0.00 51.96 52.57 3mi0 s ALA 211 Cb -0.08 0.71 -0.04 0.00 0.00 0.00 0.00 23.12 23.71 3mi0 s ALA 211 CO 0.00 -0.68 -0.10 0.14 0.00 0.00 0.00 175.76 175.12 3mi0 s VAL 212 N -3.31 1.12 -0.31 0.00 -7.23 0.65 -0.07 120.40 111.25 3mi0 s VAL 212 Ca -0.01 -2.04 -0.09 0.00 -1.81 0.00 0.00 61.98 58.04 3mi0 s VAL 212 Cb -0.01 -1.82 0.00 0.00 0.56 0.00 0.00 36.38 35.12 3mi0 s VAL 212 CO -0.09 -0.75 0.13 -0.76 -0.31 0.00 0.00 175.10 173.32 3mi0 s LEU 213 N -3.13 4.10 -0.32 1.32 1.43 -0.06 -0.78 118.68 121.23 3mi0 s LEU 213 Ca 0.16 -0.65 -0.11 0.00 -1.03 0.00 0.00 54.13 52.49 3mi0 s LEU 213 Cb 0.03 -1.96 -0.02 0.00 0.03 0.00 0.00 46.19 44.27 3mi0 s LEU 213 CO 0.00 -0.22 0.20 -0.62 0.23 0.00 0.00 176.35 175.94 3mi0 s ASP 214 N 1.57 5.85 0.34 2.29 -1.08 -0.08 -2.07 116.67 123.48 3mi0 s ASP 214 Ca 0.04 -0.41 0.04 0.00 -0.52 0.00 0.00 52.55 51.69 3mi0 s ASP 214 Cb -0.17 -2.08 0.61 0.00 -1.46 0.00 0.00 42.92 39.82 3mi0 s ASP 214 CO 0.05 -0.20 1.91 0.00 0.52 0.00 0.00 175.17 177.45 3mi0 h ALA 215 N 8.42 1.41 -0.56 3.66 0.00 -1.63 -2.87 119.26 127.70 3mi0 h ALA 215 Ca -0.32 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.41 3mi0 h ALA 215 Cb 1.16 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.75 3mi0 h ALA 215 CO 0.62 0.43 0.25 -0.97 0.00 0.00 0.00 179.25 179.57 3mi0 h ASN 216 N 0.60 0.71 -3.69 0.00 -1.24 -1.93 -3.39 115.58 106.64 3mi0 h ASN 216 Ca 0.14 -0.07 -0.54 0.00 0.71 0.00 0.00 56.30 56.54 3mi0 h ASN 216 Cb 0.22 -0.18 0.10 0.00 0.73 0.00 0.00 38.32 39.19 3mi0 h ASN 216 CO -0.00 0.62 0.83 -0.13 -1.29 0.00 0.00 177.43 177.46 3mi0 s ARG 217 N -5.42 4.10 0.14 6.67 1.81 -1.08 -4.88 118.95 120.29 3mi0 s ARG 217 Ca -0.10 2.59 -0.15 0.00 -1.72 0.00 0.00 55.73 56.35 3mi0 s ARG 217 Cb 0.16 -2.99 0.00 0.00 -0.45 0.00 0.00 34.95 31.68 3mi0 s ARG 217 CO 0.78 -0.59 1.68 -1.00 -0.68 0.00 0.00 175.30 175.49 3mi0 h PRO 218 N 3.76 0.63 0.00 3.54 0.13 -1.89 -3.40 132.00 134.77 3mi0 h PRO 218 Ca -0.49 -0.12 0.00 0.00 -0.87 0.00 0.00 66.00 64.52 3mi0 h PRO 218 Cb 1.23 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.26 3mi0 h PRO 218 CO 0.71 0.59 -0.05 -2.13 -0.23 0.00 0.00 178.00 176.88 3mi0 n ARG 219 N -4.62 0.00 -3.16 0.86 0.63 -1.26 -4.23 116.66 104.87 3mi0 n ARG 219 Ca 0.00 0.00 -0.44 0.00 -0.92 0.00 0.00 57.85 56.49 3mi0 n ARG 219 Cb 0.15 -0.40 -0.06 0.00 0.45 0.00 0.00 32.46 32.59 3mi0 n ARG 219 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 3mi0 s ARG 220 N -2.00 3.12 0.20 -0.14 0.52 -1.26 -4.44 118.95 114.94 3mi0 s ARG 220 Ca 0.00 -0.92 -0.07 0.00 -0.52 0.00 0.00 55.73 54.22 3mi0 s ARG 220 Cb 0.00 -4.11 0.12 0.00 0.52 0.00 0.00 34.95 31.48 3mi0 s ARG 220 CO 0.00 -1.23 1.63 0.00 0.02 0.00 0.00 175.30 175.72 3mi0 h ALA 221 N 9.00 0.85 -2.67 2.13 0.00 -1.33 -3.46 119.26 123.77 3mi0 h ALA 221 Ca -0.28 -0.34 -0.52 0.00 0.00 0.00 0.00 54.91 53.77 3mi0 h ALA 221 Cb 1.09 -0.19 0.06 0.00 0.00 0.00 0.00 17.79 18.76 3mi0 h ALA 221 CO 0.97 0.65 1.01 0.12 0.00 0.00 0.00 179.25 182.00 3mi0 s PHE 222 N -4.83 2.88 -0.15 0.00 5.36 -1.26 -0.91 117.98 119.08 3mi0 s PHE 222 Ca -0.11 0.38 -0.06 0.00 -0.96 0.00 0.00 56.93 56.18 3mi0 s PHE 222 Cb 0.13 -4.14 0.07 0.00 -0.34 0.00 0.00 43.02 38.74 3mi0 s PHE 222 CO 0.85 -4.28 0.33 0.50 -1.46 0.00 0.00 175.22 171.16 3mi0 s ARG 223 N 1.01 0.26 0.15 10.12 3.52 0.04 -4.94 118.95 129.10 3mi0 s ARG 223 Ca 0.74 0.79 -0.23 0.00 -0.13 0.00 0.00 55.73 56.90 3mi0 s ARG 223 Cb -0.50 0.05 -0.08 0.00 -1.56 0.00 0.00 34.95 32.86 3mi0 s ARG 223 CO 0.34 -0.22 0.71 1.03 -0.81 0.00 0.00 175.30 176.35 3mi0 s ARG 224 N 2.02 4.43 -0.31 5.12 0.52 -1.26 -0.25 118.95 129.21 3mi0 s ARG 224 Ca -0.04 1.01 -0.01 0.00 -0.52 0.00 0.00 55.73 56.17 3mi0 s ARG 224 Cb -0.11 -3.21 0.06 0.00 0.52 0.00 0.00 34.95 32.21 3mi0 s ARG 224 CO -0.11 0.57 0.01 0.42 0.02 0.00 0.00 175.30 176.22 3mi0 s ILE 225 N -1.18 2.85 0.30 1.52 1.01 0.07 -4.95 121.20 120.82 3mi0 s ILE 225 Ca 0.35 -1.59 0.04 0.00 0.00 0.00 0.00 60.65 59.44 3mi0 s ILE 225 Cb -0.21 -2.72 -0.04 0.00 0.01 0.00 0.00 42.46 39.50 3mi0 s ILE 225 CO 0.24 -0.21 0.18 0.42 0.00 0.00 0.00 174.94 175.57 3mi0 s THR 226 N 1.19 0.21 0.00 2.92 -4.23 -1.26 -4.22 115.64 110.25 3mi0 s THR 226 Ca -0.03 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.48 3mi0 s THR 226 Cb -0.20 -2.50 0.00 0.00 1.34 0.00 0.00 72.50 71.14 3mi0 s THR 226 CO -0.03 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.66 3mi0 n GLY 227 N -0.57 2.40 0.23 3.99 0.00 -1.26 -2.03 105.19 107.95 3mi0 n GLY 227 Ca 0.02 -0.27 -0.00 0.00 0.00 0.00 0.00 46.02 45.77 3mi0 n GLY 227 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3mi0 h SER 228 N 4.47 0.06 -0.53 1.61 4.64 -1.99 0.15 113.55 121.96 3mi0 h SER 228 Ca 0.00 0.10 0.09 0.00 -0.47 0.00 0.00 61.79 61.51 3mi0 h SER 228 Cb 0.00 0.12 -0.07 0.00 -0.31 0.00 0.00 62.40 62.14 3mi0 h SER 228 CO 0.00 0.04 0.13 0.00 -0.87 0.00 0.00 176.83 176.13 3mi0 h ALA 229 N 1.45 0.62 -0.51 5.18 0.00 -1.90 0.11 119.26 124.21 3mi0 h ALA 229 Ca 0.30 0.10 -0.07 0.00 0.00 0.00 0.00 54.91 55.24 3mi0 h ALA 229 Cb 0.42 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 3mi0 h ALA 229 CO -0.37 -0.28 0.04 1.25 0.00 0.00 0.00 179.25 179.89 3mi0 h LEU 230 N 0.28 0.86 -0.22 0.00 5.85 -0.67 -3.00 115.31 118.40 3mi0 h LEU 230 Ca 0.27 -0.29 0.05 0.00 0.84 0.00 0.00 57.88 58.75 3mi0 h LEU 230 Cb 0.35 -0.23 -0.07 0.00 0.37 0.00 0.00 40.66 41.08 3mi0 h LEU 230 CO -0.33 0.93 -0.46 -0.61 -0.34 0.00 0.00 178.44 177.64 3mi0 h GLN 231 N 0.76 -0.45 -1.04 1.25 5.75 0.91 -0.44 115.11 121.84 3mi0 h GLN 231 Ca 0.15 0.03 0.27 0.00 -0.15 0.00 0.00 58.65 58.95 3mi0 h GLN 231 Cb 0.47 0.10 -0.10 0.00 1.07 0.00 0.00 27.48 29.03 3mi0 h GLN 231 CO 0.02 -0.30 0.66 0.00 -2.65 0.00 0.00 178.83 176.56 3mi0 h ALA 232 N 0.09 2.18 0.00 3.38 0.00 -0.75 1.02 119.26 125.17 3mi0 h ALA 232 Ca 0.08 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3mi0 h ALA 232 Cb 0.63 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.45 3mi0 h ALA 232 CO -0.47 -0.60 0.00 1.28 0.00 0.00 0.00 179.25 179.46 3mi0 n LEU 233 N -4.67 0.00 -0.31 0.00 4.77 -0.19 -5.12 117.00 111.48 3mi0 n LEU 233 Ca 0.26 0.24 0.04 0.00 -0.03 0.00 0.00 56.01 56.51 3mi0 n LEU 233 Cb 0.87 -0.24 0.03 0.00 -2.33 0.00 0.00 43.42 41.76 3mi0 n LEU 233 CO 0.24 -0.08 0.37 0.18 -1.33 0.00 0.00 177.39 176.77