#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3m8n n LEU 1 N 0.00 1.58 -4.79 -3.43 4.77 -1.26 -4.70 117.00 109.18 3m8n n LEU 1 Ca 0.00 0.26 -0.38 0.00 -0.03 0.00 0.00 56.01 55.86 3m8n n LEU 1 Cb 0.00 -0.60 -0.06 0.00 -2.33 0.00 0.00 43.42 40.43 3m8n n LEU 1 CO 0.00 -0.14 0.13 -0.31 -1.33 0.00 0.00 177.39 175.75 3m8n s TYR 2 N -2.54 3.65 -0.32 -1.77 2.02 -1.18 -4.99 117.35 112.22 3m8n s TYR 2 Ca -0.23 0.96 -0.12 0.00 -0.37 0.00 0.00 57.07 57.31 3m8n s TYR 2 Cb 0.05 -2.39 -0.03 0.00 -0.40 0.00 0.00 41.96 39.20 3m8n s TYR 2 CO 0.31 0.46 0.22 0.21 -1.57 0.00 0.00 175.55 175.19 3m8n s LYS 3 N -0.45 3.62 -0.14 -0.62 2.20 -1.26 -0.47 119.74 122.62 3m8n s LYS 3 Ca 0.24 -0.56 0.02 0.00 -0.36 0.00 0.00 55.97 55.32 3m8n s LYS 3 Cb -0.16 -3.76 0.01 0.00 -1.51 0.00 0.00 37.83 32.40 3m8n s LYS 3 CO 0.12 -0.37 -0.20 -1.17 -0.36 0.00 0.00 175.35 173.37 3m8n s LEU 4 N 1.73 2.21 -0.16 5.43 2.96 -0.76 -2.00 118.68 128.09 3m8n s LEU 4 Ca 0.06 -0.56 -0.23 0.00 -0.22 0.00 0.00 54.13 53.18 3m8n s LEU 4 Cb -0.17 -1.47 -0.02 0.00 0.50 0.00 0.00 46.19 45.02 3m8n s LEU 4 CO 0.11 0.09 0.70 -0.31 -1.32 0.00 0.00 176.35 175.62 3m8n s TYR 5 N 0.76 3.44 0.00 5.38 2.02 -0.14 -0.29 117.35 128.52 3m8n s TYR 5 Ca -0.08 1.10 0.00 0.00 -0.37 0.00 0.00 57.07 57.72 3m8n s TYR 5 Cb -0.16 -2.86 0.00 0.00 -0.40 0.00 0.00 41.96 38.54 3m8n s TYR 5 CO -0.00 -0.13 0.00 0.45 -1.57 0.00 0.00 175.55 174.30 3m8n n SER 6 N 4.79 0.03 -0.09 2.29 2.88 -0.18 -2.01 113.62 121.33 3m8n n SER 6 Ca 0.00 0.00 -0.15 0.00 -1.33 0.00 0.00 58.87 57.39 3m8n n SER 6 Cb 0.50 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.88 3m8n n SER 6 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 3m8n n GLN 8 N 0.00 0.42 -1.00 -1.46 -0.06 -1.26 -0.89 117.38 113.14 3m8n n GLN 8 Ca 0.00 0.13 -0.13 0.00 -2.00 0.00 0.00 57.00 55.00 3m8n n GLN 8 Cb 0.00 -1.28 0.19 0.00 -4.06 0.00 0.00 30.24 25.09 3m8n n GLN 8 CO 0.00 0.00 0.00 0.54 -0.20 0.00 0.00 177.06 177.40 3m8n n ARG 9 N -3.35 2.02 -3.59 3.69 1.74 -1.26 -4.74 116.66 111.16 3m8n n ARG 9 Ca -0.34 -3.14 -0.37 0.00 -0.77 0.00 0.00 57.85 53.23 3m8n n ARG 9 Cb 0.80 -1.97 -0.06 0.00 -1.02 0.00 0.00 32.46 30.21 3m8n n ARG 9 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 3m8n s SER 10 N -2.08 6.59 0.20 0.55 1.04 -1.26 -4.98 113.70 113.77 3m8n s SER 10 Ca 0.50 0.70 -0.09 0.00 0.48 0.00 0.00 55.95 57.54 3m8n s SER 10 Cb 0.44 -2.19 0.14 0.00 0.10 0.00 0.00 66.02 64.51 3m8n s SER 10 CO 0.04 0.26 1.79 1.23 0.98 0.00 0.00 173.24 177.54 3m8n h GLY 11 N 5.47 1.18 0.73 7.32 0.00 -1.91 -1.25 103.07 114.61 3m8n h GLY 11 Ca -0.49 -0.59 0.06 0.00 0.00 0.00 0.00 47.33 46.31 3m8n h GLY 11 CO 0.66 0.56 0.61 3.43 0.00 0.00 0.00 176.54 181.80 3m8n h ASN 12 N 1.07 0.97 -0.28 0.19 2.35 -1.90 -1.20 115.58 116.77 3m8n h ASN 12 Ca 0.26 0.01 -0.17 0.00 -0.55 0.00 0.00 56.30 55.85 3m8n h ASN 12 Cb 0.13 -0.19 -0.00 0.00 0.05 0.00 0.00 38.32 38.31 3m8n h ASN 12 CO -0.03 0.62 -0.47 0.28 -1.65 0.00 0.00 177.43 176.18 3m8n h SER 13 N 1.10 0.93 -0.57 5.81 0.02 -1.78 -3.29 113.55 115.78 3m8n h SER 13 Ca 0.41 -0.46 -0.01 0.00 -0.84 0.00 0.00 61.79 60.89 3m8n h SER 13 Cb 0.17 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.42 3m8n h SER 13 CO -0.17 1.25 0.31 0.22 -1.14 0.00 0.00 176.83 177.29 3m8n h TYR 14 N 0.68 0.79 -0.69 3.45 3.20 -0.87 -2.04 116.97 121.49 3m8n h TYR 14 Ca 0.04 -0.02 0.12 0.00 3.14 0.00 0.00 58.73 62.01 3m8n h TYR 14 Cb 1.06 -0.25 -0.12 0.00 1.54 0.00 0.00 36.73 38.95 3m8n h TYR 14 CO 0.06 0.58 -0.21 1.63 -1.64 0.00 0.00 178.16 178.58 3m8n n LYS 15 N -4.59 -0.10 0.02 1.82 5.02 -0.49 -0.70 118.16 119.14 3m8n n LYS 15 Ca 0.03 1.06 -0.19 0.00 -2.02 0.00 0.00 58.31 57.20 3m8n n LYS 15 Cb 0.09 -1.59 -0.12 0.00 -0.02 0.00 0.00 35.03 33.40 3m8n n LYS 15 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3m8n h VAL 16 N 0.00 1.42 -0.80 -0.18 2.07 -1.46 -2.63 116.25 114.68 3m8n h VAL 16 Ca 0.29 -2.21 0.04 0.00 0.82 0.00 0.00 66.70 65.64 3m8n h VAL 16 Cb 0.46 2.70 -0.05 0.00 -1.52 0.00 0.00 31.29 32.88 3m8n h VAL 16 CO -0.70 0.65 0.50 0.03 0.02 0.00 0.00 177.57 178.07 3m8n h ARG 17 N -0.08 0.95 -0.39 1.57 3.08 -1.00 -2.24 114.38 116.26 3m8n h ARG 17 Ca -0.10 -0.06 0.04 0.00 0.07 0.00 0.00 59.98 59.94 3m8n h ARG 17 Cb 1.46 -0.21 -0.04 0.00 0.08 0.00 0.00 29.97 31.25 3m8n h ARG 17 CO 0.14 0.63 0.14 1.25 -1.07 0.00 0.00 179.97 181.06 3m8n h LEU 18 N 0.98 0.16 -0.91 3.04 5.85 -0.91 -1.30 115.31 122.21 3m8n h LEU 18 Ca 0.32 0.04 0.02 0.00 0.84 0.00 0.00 57.88 59.11 3m8n h LEU 18 Cb 0.03 0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.03 3m8n h LEU 18 CO -0.12 0.13 0.60 0.00 -0.34 0.00 0.00 178.44 178.71 3m8n h ALA 19 N 1.25 1.19 -0.29 1.25 0.00 -1.24 -0.40 119.26 121.01 3m8n h ALA 19 Ca 0.18 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.90 3m8n h ALA 19 Cb 0.15 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 3m8n h ALA 19 CO -0.17 0.50 -0.37 -0.07 0.00 0.00 0.00 179.25 179.13 3m8n h LEU 20 N 1.19 0.69 -0.57 0.00 3.38 -1.15 -1.27 115.31 117.57 3m8n h LEU 20 Ca 0.35 -0.29 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 3m8n h LEU 20 Cb -0.06 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.47 3m8n h LEU 20 CO -0.10 0.99 0.35 0.00 0.09 0.00 0.00 178.44 179.77 3m8n h ALA 21 N 1.05 0.73 0.00 1.53 0.00 -0.91 0.26 119.26 121.92 3m8n h ALA 21 Ca 0.05 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 3m8n h ALA 21 Cb 0.88 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 3m8n h ALA 21 CO 0.08 0.20 -0.38 -0.07 0.00 0.00 0.00 179.25 179.08 3m8n h LEU 22 N 0.77 0.00 -1.25 0.00 3.38 -0.60 -2.25 115.31 115.36 3m8n h LEU 22 Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 3m8n h LEU 22 Cb -0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.72 3m8n h LEU 22 CO -0.04 0.38 0.00 0.18 0.09 0.00 0.00 178.44 179.05 3m8n n LEU 23 N -3.76 1.92 -4.10 1.67 4.77 -0.52 -4.95 117.00 112.03 3m8n n LEU 23 Ca -0.01 -0.70 -0.33 0.00 -0.03 0.00 0.00 56.01 54.94 3m8n n LEU 23 Cb 0.46 -0.05 -0.01 0.00 -2.33 0.00 0.00 43.42 41.49 3m8n n LEU 23 CO 0.37 0.35 -0.02 -0.67 -1.33 0.00 0.00 177.39 176.09 3m8n n ASP 24 N 0.49 -3.25 -4.71 -1.43 2.03 -0.56 -4.96 116.55 104.15 3m8n n ASP 24 Ca 0.18 -0.95 -0.37 0.00 0.52 0.00 0.00 54.79 54.17 3m8n n ASP 24 Cb 0.40 -3.11 -0.07 0.00 -0.72 0.00 0.00 41.12 37.62 3m8n n ASP 24 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3m8n s ALA 25 N -3.39 3.59 0.50 -1.67 0.00 0.82 -5.00 121.76 116.60 3m8n s ALA 25 Ca 0.61 -0.51 -0.23 0.00 0.00 0.00 0.00 51.96 51.83 3m8n s ALA 25 Cb -0.32 -2.42 -0.06 0.00 0.00 0.00 0.00 23.12 20.31 3m8n s ALA 25 CO 0.90 -0.00 1.29 -2.14 0.00 0.00 0.00 175.76 175.81 3m8n s PRO 26 N 0.67 3.44 0.20 0.00 0.02 -1.26 -4.69 135.00 133.38 3m8n s PRO 26 Ca 0.16 2.09 -0.23 0.00 0.02 0.00 0.00 61.00 63.04 3m8n s PRO 26 Cb -0.13 -2.37 0.05 0.00 0.02 0.00 0.00 34.50 32.07 3m8n s PRO 26 CO 0.04 -0.90 0.78 1.52 -0.33 0.00 0.00 177.00 178.11 3m8n s TYR 27 N -1.37 -0.25 -0.23 6.54 -0.85 -1.26 -3.09 117.35 116.83 3m8n s TYR 27 Ca 0.67 -0.09 0.01 0.00 -0.52 0.00 0.00 57.07 57.15 3m8n s TYR 27 Cb -0.37 0.65 0.04 0.00 0.38 0.00 0.00 41.96 42.66 3m8n s TYR 27 CO 0.44 -0.99 -0.13 0.50 -1.52 0.00 0.00 175.55 173.85 3m8n s ARG 28 N -3.64 2.60 0.03 -3.49 3.00 0.38 -4.61 118.95 113.22 3m8n s ARG 28 Ca 0.09 -1.11 -0.24 0.00 -1.00 0.00 0.00 55.73 53.47 3m8n s ARG 28 Cb -0.03 -2.80 -0.05 0.00 0.00 0.00 0.00 34.95 32.06 3m8n s ARG 28 CO 0.01 -0.42 0.72 0.00 0.00 0.00 0.00 175.30 175.60 3m8n s ALA 29 N 1.21 3.40 -0.35 6.12 0.00 -1.26 -1.83 121.76 129.04 3m8n s ALA 29 Ca -0.03 0.21 -0.08 0.00 0.00 0.00 0.00 51.96 52.07 3m8n s ALA 29 Cb -0.17 -2.93 0.04 0.00 0.00 0.00 0.00 23.12 20.05 3m8n s ALA 29 CO -0.08 0.08 0.14 0.08 0.00 0.00 0.00 175.76 175.99 3m8n s VAL 30 N -0.05 4.08 0.19 0.00 1.01 0.60 -4.95 120.40 121.27 3m8n s VAL 30 Ca 0.37 -1.03 -0.30 0.00 0.00 0.00 0.00 61.98 61.01 3m8n s VAL 30 Cb -0.20 -3.30 -0.09 0.00 0.00 0.00 0.00 36.38 32.80 3m8n s VAL 30 CO 0.21 -0.20 1.33 -0.70 0.00 0.00 0.00 175.10 175.75 3m8n s GLU 31 N 1.46 4.37 -0.16 2.72 2.56 -1.25 -1.01 118.70 127.39 3m8n s GLU 31 Ca -0.00 2.08 -0.02 0.00 0.00 0.00 0.00 54.97 57.02 3m8n s GLU 31 Cb -0.19 -3.20 0.05 0.00 2.00 0.00 0.00 34.13 32.79 3m8n s GLU 31 CO 0.04 -0.30 0.01 0.08 -0.56 0.00 0.00 175.26 174.54 3m8n s VAL 32 N 0.26 0.56 -0.65 3.70 1.01 -0.06 -4.87 120.40 120.36 3m8n s VAL 32 Ca 0.58 -0.38 -0.19 0.00 0.00 0.00 0.00 61.98 61.98 3m8n s VAL 32 Cb -0.37 -0.93 0.11 0.00 0.00 0.00 0.00 36.38 35.19 3m8n s VAL 32 CO 0.37 -0.04 0.80 -0.62 0.00 0.00 0.00 175.10 175.61 3m8n s ASP 33 N 1.86 6.25 0.31 3.32 -1.08 -1.26 -4.82 116.67 121.24 3m8n s ASP 33 Ca 0.01 -1.48 0.03 0.00 -0.52 0.00 0.00 52.55 50.59 3m8n s ASP 33 Cb -0.16 -2.33 0.60 0.00 -1.46 0.00 0.00 42.92 39.58 3m8n s ASP 33 CO -0.07 -1.14 1.88 0.40 0.52 0.00 0.00 175.17 176.75 3m8n h ILE 34 N 5.87 0.96 -0.06 4.11 1.08 -1.95 -2.16 117.51 125.36 3m8n h ILE 34 Ca -0.23 -0.32 -0.05 0.00 -0.39 0.00 0.00 64.86 63.86 3m8n h ILE 34 Cb 1.08 -0.07 -0.01 0.00 -3.07 0.00 0.00 36.82 34.75 3m8n h ILE 34 CO 1.10 0.17 -0.21 -0.07 -0.69 0.00 0.00 178.15 178.45 3m8n h LEU 35 N 0.95 0.09 -2.40 1.44 3.38 -2.01 -1.66 115.31 115.10 3m8n h LEU 35 Ca 0.44 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.36 3m8n h LEU 35 Cb 0.41 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 3m8n h LEU 35 CO -0.20 0.31 0.04 0.54 0.09 0.00 0.00 178.44 179.23 3m8n n ARG 36 N -4.25 2.83 -1.04 1.13 1.74 -0.84 -4.91 116.66 111.32 3m8n n ARG 36 Ca -0.02 -1.60 -0.01 0.00 -0.77 0.00 0.00 57.85 55.45 3m8n n ARG 36 Cb 0.29 -1.86 -0.01 0.00 -1.02 0.00 0.00 32.46 29.87 3m8n n ARG 36 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3m8n n GLY 37 N 0.23 0.36 0.14 -0.13 0.00 -0.62 -4.90 105.19 100.27 3m8n n GLY 37 Ca 0.16 -0.07 0.12 0.00 0.00 0.00 0.00 46.02 46.24 3m8n n GLY 37 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3m8n h GLU 38 N 0.43 0.00 -0.29 1.61 5.08 -1.67 -1.40 114.58 118.34 3m8n h GLU 38 Ca -0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 3m8n h GLU 38 Cb 0.53 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.78 3m8n h GLU 38 CO 0.04 0.00 0.00 -1.13 -1.00 0.00 0.00 179.01 176.92 3m8n n SER 39 N -2.31 1.71 -0.14 1.42 3.41 -1.26 -4.07 113.62 112.38 3m8n n SER 39 Ca 0.02 -1.92 0.01 0.00 -0.26 0.00 0.00 58.87 56.72 3m8n n SER 39 Cb 0.24 -0.19 0.02 0.00 -0.26 0.00 0.00 64.21 64.02 3m8n n SER 39 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3m8n n ARG 40 N 0.41 0.86 -1.79 4.33 1.74 -0.53 -4.47 116.66 117.22 3m8n n ARG 40 Ca 0.12 -1.16 -0.35 0.00 -0.77 0.00 0.00 57.85 55.69 3m8n n ARG 40 Cb 0.29 -0.76 0.05 0.00 -1.02 0.00 0.00 32.46 31.02 3m8n n ARG 40 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 3m8n s THR 41 N -0.65 2.65 0.36 0.55 -4.23 -1.23 -4.90 115.64 108.20 3m8n s THR 41 Ca 0.05 0.36 0.10 0.00 -1.18 0.00 0.00 61.69 61.02 3m8n s THR 41 Cb 0.04 -3.01 0.11 0.00 1.34 0.00 0.00 72.50 70.98 3m8n s THR 41 CO 0.00 -0.13 1.84 -0.65 -0.54 0.00 0.00 174.62 175.14 3m8n h PRO 42 N 0.36 0.15 -0.30 3.99 0.11 -1.96 -0.60 132.00 133.74 3m8n h PRO 42 Ca -0.49 -0.05 0.04 0.00 0.11 0.00 0.00 66.00 65.61 3m8n h PRO 42 Cb 1.29 -0.01 -0.04 0.00 0.11 0.00 0.00 31.00 32.34 3m8n h PRO 42 CO 0.53 0.43 0.06 0.22 -0.21 0.00 0.00 178.00 179.03 3m8n h ASP 43 N 0.14 0.01 -0.22 -2.05 3.58 -1.98 -0.04 116.42 115.87 3m8n h ASP 43 Ca 0.02 0.05 -0.14 0.00 0.42 0.00 0.00 57.03 57.38 3m8n h ASP 43 Cb 0.57 0.07 -0.01 0.00 1.72 0.00 0.00 39.33 41.68 3m8n h ASP 43 CO 0.04 0.04 -0.34 0.15 -2.88 0.00 0.00 179.24 176.25 3m8n h PHE 44 N 0.17 0.87 0.00 0.28 3.57 -1.77 -2.99 116.94 117.07 3m8n h PHE 44 Ca 0.14 -0.24 -0.04 0.00 3.53 0.00 0.00 57.97 61.37 3m8n h PHE 44 Cb 0.15 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 38.70 3m8n h PHE 44 CO -0.17 0.98 -0.18 -0.07 -2.23 0.00 0.00 178.31 176.64 3m8n h LEU 45 N 0.62 0.00 -0.67 0.59 3.38 -0.82 0.30 115.31 118.70 3m8n h LEU 45 Ca 0.06 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.06 3m8n h LEU 45 Cb 0.88 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.59 3m8n h LEU 45 CO 0.08 0.18 0.42 0.00 0.09 0.00 0.00 178.44 179.21 3m8n h ALA 46 N 1.82 0.88 0.02 1.53 0.00 -0.93 -2.09 119.26 120.48 3m8n h ALA 46 Ca -0.00 -0.02 -0.26 0.00 0.00 0.00 0.00 54.91 54.62 3m8n h ALA 46 Cb 0.86 -0.22 0.02 0.00 0.00 0.00 0.00 17.79 18.45 3m8n h ALA 46 CO 0.02 0.20 -1.04 0.87 0.00 0.00 0.00 179.25 179.30 3m8n h LYS 47 N 0.84 0.67 -3.18 0.00 1.57 -0.95 -3.43 116.57 112.10 3m8n h LYS 47 Ca 0.27 -0.75 -0.56 0.00 -1.87 0.00 0.00 60.65 57.74 3m8n h LYS 47 Cb 0.00 0.22 -0.40 0.00 0.08 0.00 0.00 32.23 32.13 3m8n h LYS 47 CO -0.10 1.32 -0.77 1.21 -0.57 0.00 0.00 179.45 180.55 3m8n s ASN 48 N -7.28 3.78 0.58 0.86 3.04 0.90 -4.86 114.94 111.96 3m8n s ASN 48 Ca -0.10 -1.53 0.29 0.00 0.04 0.00 0.00 52.86 51.56 3m8n s ASN 48 Cb 0.06 -0.63 1.46 0.00 -1.54 0.00 0.00 41.25 40.60 3m8n s ASN 48 CO 0.92 -0.42 1.87 -0.65 -3.04 0.00 0.00 177.10 175.78 3m8n h PRO 49 N 8.16 0.00 0.00 0.43 0.11 -1.64 0.49 132.00 139.56 3m8n h PRO 49 Ca -0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.96 3m8n h PRO 49 Cb 1.01 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.12 3m8n h PRO 49 CO 0.45 0.00 0.00 0.43 -0.21 0.00 0.00 178.00 178.67 3m8n n SER 50 N -3.78 0.41 -1.67 -2.05 7.64 -1.26 -4.98 113.62 107.93 3m8n n SER 50 Ca 0.10 0.54 -0.11 0.00 1.01 0.00 0.00 58.87 60.41 3m8n n SER 50 Cb 0.74 -0.65 0.02 0.00 -1.01 0.00 0.00 64.21 63.31 3m8n n SER 50 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3m8n n GLY 51 N 1.31 0.07 3.29 0.23 0.00 0.16 -5.03 105.19 105.22 3m8n n GLY 51 Ca 0.06 -0.31 -0.27 0.00 0.00 0.00 0.00 46.02 45.50 3m8n n GLY 51 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3m8n s GLN 52 N -5.14 1.48 0.16 1.61 -0.21 -1.26 -4.72 119.66 111.58 3m8n s GLN 52 Ca 0.16 -1.04 -0.02 0.00 0.02 0.00 0.00 55.36 54.48 3m8n s GLN 52 Cb -0.07 -1.65 -0.05 0.00 1.00 0.00 0.00 33.01 32.24 3m8n s GLN 52 CO 0.20 0.42 0.36 0.14 -2.12 0.00 0.00 175.29 174.29 3m8n s VAL 53 N -0.85 5.21 0.68 1.09 -7.23 -1.26 -4.52 120.40 113.52 3m8n s VAL 53 Ca 0.09 -0.19 -0.05 0.00 -1.81 0.00 0.00 61.98 60.02 3m8n s VAL 53 Cb -0.09 -3.67 0.06 0.00 0.56 0.00 0.00 36.38 33.24 3m8n s VAL 53 CO 0.02 -0.04 0.96 -2.16 -0.31 0.00 0.00 175.10 173.57 3m8n s PRO 54 N -2.94 2.19 -0.14 4.82 0.04 -1.26 -4.58 135.00 133.12 3m8n s PRO 54 Ca 0.39 -0.46 -0.07 0.00 0.04 0.00 0.00 61.00 60.91 3m8n s PRO 54 Cb -0.12 -2.25 0.06 0.00 0.04 0.00 0.00 34.50 32.23 3m8n s PRO 54 CO 0.27 -1.17 0.33 -1.17 0.04 0.00 0.00 177.00 175.30 3m8n s LEU 55 N -5.14 -0.00 -0.24 -3.56 2.96 -0.85 -4.30 118.68 107.55 3m8n s LEU 55 Ca 0.60 0.73 -0.09 0.00 -0.22 0.00 0.00 54.13 55.15 3m8n s LEU 55 Cb -0.10 1.03 -0.04 0.00 0.50 0.00 0.00 46.19 47.58 3m8n s LEU 55 CO 0.43 -0.19 0.13 -0.22 -1.32 0.00 0.00 176.35 175.18 3m8n s LEU 56 N 1.64 3.89 -0.10 -0.68 2.96 -0.46 -0.97 118.68 124.96 3m8n s LEU 56 Ca -0.07 0.01 -0.25 0.00 -0.22 0.00 0.00 54.13 53.60 3m8n s LEU 56 Cb -0.10 -2.04 -0.03 0.00 0.50 0.00 0.00 46.19 44.52 3m8n s LEU 56 CO -0.11 0.04 0.78 -0.70 -1.32 0.00 0.00 176.35 175.04 3m8n s GLU 57 N 1.20 4.39 -0.05 1.98 2.12 -0.85 0.51 118.70 128.01 3m8n s GLU 57 Ca 0.06 0.98 0.05 0.00 0.36 0.00 0.00 54.97 56.43 3m8n s GLU 57 Cb -0.14 -3.50 -0.07 0.00 0.26 0.00 0.00 34.13 30.67 3m8n s GLU 57 CO 0.05 -0.10 0.04 2.41 -0.54 0.00 0.00 175.26 177.12 3m8n n THR 58 N 4.17 0.32 -3.77 -1.70 -1.04 0.12 -4.39 114.28 108.00 3m8n n THR 58 Ca 0.02 -0.22 -0.04 0.00 -2.04 0.00 0.00 64.05 61.77 3m8n n THR 58 Cb 0.50 -0.64 -0.01 0.00 -1.82 0.00 0.00 70.33 68.36 3m8n n THR 58 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3m8n s ALA 59 N -2.19 -1.62 0.12 2.41 0.00 -1.20 -5.04 121.76 114.25 3m8n s ALA 59 Ca -0.03 0.03 -0.31 0.00 0.00 0.00 0.00 51.96 51.66 3m8n s ALA 59 Cb 0.02 0.66 -0.09 0.00 0.00 0.00 0.00 23.12 23.71 3m8n s ALA 59 CO 0.24 -1.05 1.50 -1.25 0.00 0.00 0.00 175.76 175.20 3m8n s PRO 60 N -3.12 4.26 -1.63 0.00 0.04 -1.26 -1.87 135.00 131.42 3m8n s PRO 60 Ca 0.14 2.22 0.00 0.00 0.04 0.00 0.00 61.00 63.39 3m8n s PRO 60 Cb -0.02 -3.27 0.00 0.00 0.04 0.00 0.00 34.50 31.25 3m8n s PRO 60 CO 0.03 -0.55 0.00 0.41 0.04 0.00 0.00 177.00 176.93 3m8n n GLY 61 N 3.67 1.22 2.88 0.56 0.00 -1.26 -4.97 105.19 107.29 3m8n n GLY 61 Ca 0.13 -0.25 -0.25 0.00 0.00 0.00 0.00 46.02 45.65 3m8n n GLY 61 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3m8n s ARG 62 N -3.65 1.19 -0.02 1.61 3.52 -0.78 -5.09 118.95 115.73 3m8n s ARG 62 Ca 0.00 -0.15 0.04 0.00 -0.13 0.00 0.00 55.73 55.50 3m8n s ARG 62 Cb 0.00 -1.30 -0.01 0.00 -1.56 0.00 0.00 34.95 32.09 3m8n s ARG 62 CO 0.00 -0.22 -0.15 0.71 -0.81 0.00 0.00 175.30 174.83 3m8n s TYR 63 N 1.58 1.40 -0.18 5.12 2.02 -1.26 0.14 117.35 126.17 3m8n s TYR 63 Ca 0.01 -0.32 -0.05 0.00 -0.37 0.00 0.00 57.07 56.34 3m8n s TYR 63 Cb -0.13 -0.93 -0.03 0.00 -0.40 0.00 0.00 41.96 40.47 3m8n s TYR 63 CO -0.05 -0.07 0.01 -1.17 -1.57 0.00 0.00 175.55 172.69 3m8n s LEU 64 N -0.16 3.41 0.55 -1.29 2.96 0.18 -4.94 118.68 119.39 3m8n s LEU 64 Ca 0.02 -0.10 0.05 0.00 -0.22 0.00 0.00 54.13 53.88 3m8n s LEU 64 Cb -0.08 -1.85 0.04 0.00 0.50 0.00 0.00 46.19 44.80 3m8n s LEU 64 CO 0.00 0.13 0.37 0.00 -1.32 0.00 0.00 176.35 175.53 3m8n s ALA 65 N 0.63 4.45 -0.02 5.97 0.00 -1.26 -1.35 121.76 130.18 3m8n s ALA 65 Ca -0.00 -1.09 -0.02 0.00 0.00 0.00 0.00 51.96 50.85 3m8n s ALA 65 Cb -0.14 -0.65 0.01 0.00 0.00 0.00 0.00 23.12 22.33 3m8n s ALA 65 CO 0.02 -0.42 0.03 0.39 0.00 0.00 0.00 175.76 175.78 3m8n n GLU 66 N -1.74 -1.31 -0.34 0.00 -0.58 -1.26 -4.40 120.64 111.00 3m8n n GLU 66 Ca -0.04 1.33 0.21 0.00 -0.42 0.00 0.00 57.16 58.24 3m8n n GLU 66 Cb 0.65 -1.85 0.44 0.00 -0.57 0.00 0.00 31.44 30.10 3m8n n GLU 66 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 3m8n h SER 67 N 1.11 0.59 0.42 1.62 4.64 -1.86 -0.90 113.55 119.16 3m8n h SER 67 Ca -0.08 0.15 -0.14 0.00 -0.47 0.00 0.00 61.79 61.25 3m8n h SER 67 Cb 0.17 0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.31 3m8n h SER 67 CO 0.00 0.02 -0.58 0.78 -0.87 0.00 0.00 176.83 176.18 3m8n h ASN 68 N 0.46 0.19 0.46 4.97 2.35 -1.93 -1.25 115.58 120.84 3m8n h ASN 68 Ca 0.67 -0.10 -0.17 0.00 -0.55 0.00 0.00 56.30 56.15 3m8n h ASN 68 Cb 1.44 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 39.75 3m8n h ASN 68 CO -0.49 0.73 -0.74 0.00 -1.65 0.00 0.00 177.43 175.27 3m8n h ALA 69 N 1.28 0.67 -0.47 -0.83 0.00 -1.45 -2.52 119.26 115.93 3m8n h ALA 69 Ca -0.00 -0.63 -0.11 0.00 0.00 0.00 0.00 54.91 54.16 3m8n h ALA 69 Cb 1.06 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 3m8n h ALA 69 CO 0.09 0.82 -0.15 0.82 0.00 0.00 0.00 179.25 180.83 3m8n h ILE 70 N 0.15 1.27 -0.03 0.00 2.04 -1.09 -1.57 117.51 118.27 3m8n h ILE 70 Ca -0.03 -1.27 -0.00 0.00 1.00 0.00 0.00 64.86 64.56 3m8n h ILE 70 Cb 1.31 1.06 -0.00 0.00 -0.74 0.00 0.00 36.82 38.45 3m8n h ILE 70 CO 0.11 0.44 0.01 -0.07 0.00 0.00 0.00 178.15 178.65 3m8n h LEU 71 N 0.79 0.04 -0.63 1.44 3.38 -1.23 -1.61 115.31 117.51 3m8n h LEU 71 Ca 0.12 -0.16 0.09 0.00 0.09 0.00 0.00 57.88 58.02 3m8n h LEU 71 Cb 0.68 -0.01 -0.07 0.00 0.09 0.00 0.00 40.66 41.35 3m8n h LEU 71 CO 0.05 0.19 0.26 -0.25 0.09 0.00 0.00 178.44 178.79 3m8n h TRP 72 N -0.11 0.47 0.36 1.13 2.91 -1.35 0.46 115.95 119.81 3m8n h TRP 72 Ca 0.01 0.03 -0.02 0.00 1.13 0.00 0.00 58.89 60.04 3m8n h TRP 72 Cb 0.16 -0.11 0.00 0.00 -0.51 0.00 0.00 29.16 28.70 3m8n h TRP 72 CO -0.02 0.15 -0.17 -0.92 -1.03 0.00 0.00 178.44 176.44 3m8n h TYR 73 N 0.47 -0.44 -0.62 2.65 3.20 -1.13 -2.78 116.97 118.31 3m8n h TYR 73 Ca 0.31 -0.01 0.12 0.00 3.14 0.00 0.00 58.73 62.29 3m8n h TYR 73 Cb 0.35 0.15 -0.09 0.00 1.54 0.00 0.00 36.73 38.68 3m8n h TYR 73 CO -0.15 -0.26 0.11 -0.07 -1.64 0.00 0.00 178.16 176.15 3m8n h LEU 74 N -0.51 -0.05 -0.60 2.82 3.38 -1.18 -3.10 115.31 116.07 3m8n h LEU 74 Ca -0.05 0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.04 3m8n h LEU 74 Cb 0.38 0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.32 3m8n h LEU 74 CO 0.08 -0.02 0.00 0.00 0.09 0.00 0.00 178.44 178.59 3m8n h ALA 75 N 1.51 1.00 -2.26 1.53 0.00 -0.78 -3.46 119.26 116.80 3m8n h ALA 75 Ca 0.33 0.00 -0.57 0.00 0.00 0.00 0.00 54.91 54.67 3m8n h ALA 75 Cb 0.51 0.00 0.03 0.00 0.00 0.00 0.00 17.79 18.33 3m8n h ALA 75 CO -0.44 0.00 1.09 0.28 0.00 0.00 0.00 179.25 180.18 3m8n n VAL 76 N -2.32 0.48 -1.03 0.00 0.31 -1.06 -1.60 118.33 113.12 3m8n n VAL 76 Ca 0.03 -0.09 -0.01 0.00 -0.01 0.00 0.00 64.34 64.26 3m8n n VAL 76 Cb 0.28 -1.99 -0.00 0.00 -0.91 0.00 0.00 33.84 31.22 3m8n n VAL 76 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3m8n n GLY 77 N 4.25 0.47 3.66 2.92 0.00 -1.26 -5.02 105.19 110.21 3m8n n GLY 77 Ca 0.20 -0.81 -0.30 0.00 0.00 0.00 0.00 46.02 45.12 3m8n n GLY 77 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3m8n s THR 78 N -2.02 1.35 -1.06 2.61 -4.23 -0.63 -5.02 115.64 106.64 3m8n s THR 78 Ca 0.00 -2.00 0.12 0.00 -1.18 0.00 0.00 61.69 58.63 3m8n s THR 78 Cb 0.00 -2.49 0.12 0.00 1.34 0.00 0.00 72.50 71.46 3m8n s THR 78 CO 0.00 0.00 1.37 -1.54 -0.54 0.00 0.00 174.62 173.91 3m8n n SER 79 N -1.13 0.00 -0.30 3.99 3.41 -1.26 -2.32 113.62 116.00 3m8n n SER 79 Ca -0.12 0.44 0.14 0.00 -0.26 0.00 0.00 58.87 59.07 3m8n n SER 79 Cb 0.67 -0.47 0.48 0.00 -0.26 0.00 0.00 64.21 64.63 3m8n n SER 79 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3m8n n LEU 80 N -1.47 1.08 -4.69 1.04 4.77 -1.26 -4.74 117.00 111.73 3m8n n LEU 80 Ca 0.03 -0.30 -0.35 0.00 -0.03 0.00 0.00 56.01 55.36 3m8n n LEU 80 Cb 0.13 -0.08 -0.09 0.00 -2.33 0.00 0.00 43.42 41.06 3m8n n LEU 80 CO 0.11 0.19 -0.22 0.00 -1.33 0.00 0.00 177.39 176.14 3m8n s ALA 81 N -2.30 3.54 0.99 -1.18 0.00 -0.98 -1.97 121.76 119.85 3m8n s ALA 81 Ca 0.31 -0.72 -0.13 0.00 0.00 0.00 0.00 51.96 51.42 3m8n s ALA 81 Cb 0.20 -1.98 0.18 0.00 0.00 0.00 0.00 23.12 21.53 3m8n s ALA 81 CO 0.44 0.25 1.12 -1.25 0.00 0.00 0.00 175.76 176.32 3m8n s PRO 82 N 0.14 0.53 -0.10 0.00 0.04 -1.26 -4.80 135.00 129.55 3m8n s PRO 82 Ca 0.06 0.32 0.17 0.00 0.04 0.00 0.00 61.00 61.60 3m8n s PRO 82 Cb -0.12 -1.77 -0.24 0.00 0.04 0.00 0.00 34.50 32.42 3m8n s PRO 82 CO -0.00 -2.62 0.37 -0.25 0.04 0.00 0.00 177.00 174.55 3m8n n ASP 83 N -4.06 0.34 -4.95 6.66 8.00 -1.26 -4.69 116.55 116.59 3m8n n ASP 83 Ca 0.07 0.16 -0.21 0.00 0.71 0.00 0.00 54.79 55.52 3m8n n ASP 83 Cb 0.58 0.72 -0.02 0.00 -0.02 0.00 0.00 41.12 42.39 3m8n n ASP 83 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3m8n s THR 84 N -2.70 4.85 -0.52 -3.53 -4.23 -1.26 -5.00 115.64 103.25 3m8n s THR 84 Ca -0.07 -1.07 0.00 0.00 -1.18 0.00 0.00 61.69 59.36 3m8n s THR 84 Cb 0.08 -3.68 0.00 0.00 1.34 0.00 0.00 72.50 70.24 3m8n s THR 84 CO 0.83 -0.30 0.00 -1.14 -0.54 0.00 0.00 174.62 173.48 3m8n n ARG 85 N -1.41 0.00 0.00 3.99 0.63 -1.26 -1.78 116.66 116.83 3m8n n ARG 85 Ca -0.07 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.86 3m8n n ARG 85 Cb 0.57 -1.14 0.00 0.00 0.45 0.00 0.00 32.46 32.35 3m8n n ARG 85 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 3m8n n ASP 87 N 0.66 0.00 -0.29 6.15 8.00 -1.26 -2.06 116.55 127.74 3m8n n ASP 87 Ca 0.00 0.00 0.06 0.00 0.71 0.00 0.00 54.79 55.56 3m8n n ASP 87 Cb 0.00 0.00 0.20 0.00 -0.02 0.00 0.00 41.12 41.30 3m8n n ASP 87 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 3m8n h ARG 88 N 0.00 0.66 -0.34 -1.24 3.08 -1.63 0.12 114.38 115.04 3m8n h ARG 88 Ca 0.00 -0.04 -0.08 0.00 0.07 0.00 0.00 59.98 59.93 3m8n h ARG 88 Cb 0.00 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 29.89 3m8n h ARG 88 CO 0.00 0.43 -0.13 0.00 -1.07 0.00 0.00 179.97 179.21 3m8n h ALA 89 N 1.52 1.15 -0.49 0.04 0.00 -1.67 -1.92 119.26 117.90 3m8n h ALA 89 Ca 0.44 -0.29 -0.11 0.00 0.00 0.00 0.00 54.91 54.95 3m8n h ALA 89 Cb 0.55 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 3m8n h ALA 89 CO -0.32 0.54 -0.11 1.49 0.00 0.00 0.00 179.25 180.84 3m8n h GLU 90 N 0.54 0.95 -0.52 0.00 4.81 -1.71 -0.31 114.58 118.33 3m8n h GLU 90 Ca 0.10 -0.36 0.08 0.00 -0.13 0.00 0.00 59.36 59.04 3m8n h GLU 90 Cb 0.53 -0.06 -0.06 0.00 0.63 0.00 0.00 28.75 29.80 3m8n h GLU 90 CO 0.03 1.02 0.17 0.00 -0.73 0.00 0.00 179.01 179.51 3m8n h ALA 91 N 0.90 0.64 -0.41 2.92 0.00 -0.61 -2.96 119.26 119.75 3m8n h ALA 91 Ca 0.13 0.08 -0.10 0.00 0.00 0.00 0.00 54.91 55.01 3m8n h ALA 91 Cb 0.67 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 3m8n h ALA 91 CO 0.05 -0.23 -0.16 -0.07 0.00 0.00 0.00 179.25 178.84 3m8n h LEU 92 N 0.34 0.76 -0.62 0.00 3.38 -0.97 -2.97 115.31 115.24 3m8n h LEU 92 Ca 0.26 -0.25 0.10 0.00 0.09 0.00 0.00 57.88 58.08 3m8n h LEU 92 Cb 0.30 -0.21 -0.08 0.00 0.09 0.00 0.00 40.66 40.76 3m8n h LEU 92 CO -0.27 0.93 0.20 -0.61 0.09 0.00 0.00 178.44 178.77 3m8n h GLN 93 N 0.68 0.35 -1.70 1.13 4.15 -0.92 -1.32 115.11 117.48 3m8n h GLN 93 Ca 0.11 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.51 3m8n h GLN 93 Cb 0.65 -0.08 0.00 0.00 0.21 0.00 0.00 27.48 28.26 3m8n h GLN 93 CO 0.05 0.23 0.00 0.91 -1.93 0.00 0.00 178.83 178.09 3m8n n TRP 94 N -5.04 0.00 0.00 3.99 7.02 -1.12 -1.63 117.44 120.66 3m8n n TRP 94 Ca 0.09 -0.30 0.00 0.00 -1.02 0.00 0.00 57.50 56.27 3m8n n TRP 94 Cb 0.30 -0.23 0.00 0.00 -2.42 0.00 0.00 31.31 28.96 3m8n n TRP 94 CO 0.00 0.00 0.00 1.19 -2.02 0.00 0.00 177.69 176.86 3m8n n PHE 96 N 1.10 0.00 -0.31 -5.99 3.72 -0.50 -0.84 117.46 114.64 3m8n n PHE 96 Ca 0.00 0.00 -0.04 0.00 -0.05 0.00 0.00 57.45 57.36 3m8n n PHE 96 Cb 0.22 0.00 0.08 0.00 -0.94 0.00 0.00 39.48 38.84 3m8n n PHE 96 CO 0.00 0.00 0.00 0.35 -0.05 0.00 0.00 176.76 177.06 3m8n h PHE 97 N 0.00 1.15 -0.68 1.38 3.57 -1.56 -2.61 116.94 118.19 3m8n h PHE 97 Ca 0.00 -0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.50 3m8n h PHE 97 Cb 0.00 -0.37 -0.04 0.00 2.79 0.00 0.00 35.95 38.33 3m8n h PHE 97 CO 0.00 0.78 0.44 1.49 -2.23 0.00 0.00 178.31 178.79 3m8n h GLU 98 N 1.18 0.84 -0.46 1.11 4.22 -1.27 0.67 114.58 120.87 3m8n h GLU 98 Ca 0.30 -0.05 -0.06 0.00 0.08 0.00 0.00 59.36 59.63 3m8n h GLU 98 Cb -0.00 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.04 3m8n h GLU 98 CO -0.05 0.56 0.03 0.37 -2.18 0.00 0.00 179.01 177.74 3m8n h GLN 99 N 0.87 0.74 0.00 1.92 5.75 -1.76 0.11 115.11 122.73 3m8n h GLN 99 Ca 0.27 -0.18 -0.28 0.00 -0.15 0.00 0.00 58.65 58.31 3m8n h GLN 99 Cb -0.03 -0.10 -0.05 0.00 1.07 0.00 0.00 27.48 28.37 3m8n h GLN 99 CO -0.09 0.73 -2.11 -2.39 -2.65 0.00 0.00 178.83 172.32 3m8n n HIS 100 N -4.24 0.00 -0.11 3.99 1.44 -1.01 -4.34 115.22 110.96 3m8n n HIS 100 Ca 0.03 0.00 -0.13 0.00 -2.01 0.00 0.00 57.72 55.61 3m8n n HIS 100 Cb 0.27 -0.79 -0.13 0.00 0.12 0.00 0.00 29.99 29.46 3m8n n HIS 100 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3m8n n ALA 101 N -2.58 1.51 -0.06 1.59 0.00 0.21 -4.61 120.51 116.57 3m8n n ALA 101 Ca -0.25 -1.15 -0.05 0.00 0.00 0.00 0.00 53.44 51.99 3m8n n ALA 101 Cb 1.00 -0.11 -0.02 0.00 0.00 0.00 0.00 19.45 20.32 3m8n n ALA 101 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 3m8n n LEU 102 N -2.94 1.47 0.26 0.00 7.94 -0.71 -4.41 117.00 118.62 3m8n n LEU 102 Ca -0.36 0.48 0.15 0.00 -1.11 0.00 0.00 56.01 55.17 3m8n n LEU 102 Cb 1.04 -0.77 0.60 0.00 0.53 0.00 0.00 43.42 44.82 3m8n n LEU 102 CO 0.33 -0.44 0.93 1.05 -1.11 0.00 0.00 177.39 178.15 3m8n h GLU 103 N -0.80 0.00 0.00 1.96 -0.00 -1.03 -1.93 114.58 112.78 3m8n h GLU 103 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 59.36 59.33 3m8n h GLU 103 Cb 0.51 0.00 -0.00 0.00 -0.00 0.00 0.00 28.75 29.25 3m8n h GLU 103 CO 0.00 0.07 -0.15 -1.35 -0.00 0.00 0.00 179.01 177.58 3m8n h PRO 104 N 0.00 0.00 0.00 1.06 0.11 -1.81 -2.81 132.00 128.55 3m8n h PRO 104 Ca -0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 3m8n h PRO 104 Cb 0.60 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.71 3m8n h PRO 104 CO 0.01 0.15 -0.69 0.09 -0.21 0.00 0.00 178.00 177.35 3m8n n ASN 105 N -3.23 1.66 -0.14 -2.05 4.13 -0.83 -3.52 115.26 111.28 3m8n n ASN 105 Ca 0.01 0.27 -0.08 0.00 1.68 0.00 0.00 54.58 56.46 3m8n n ASN 105 Cb 0.45 -0.62 0.07 0.00 -1.54 0.00 0.00 39.78 38.15 3m8n n ASN 105 CO 0.00 0.00 0.00 0.40 0.28 0.00 0.00 177.26 177.94 3m8n h ILE 106 N -0.69 1.26 -0.97 2.41 2.04 -1.60 -0.72 117.51 119.23 3m8n h ILE 106 Ca 0.00 -1.23 0.10 0.00 1.00 0.00 0.00 64.86 64.73 3m8n h ILE 106 Cb 0.69 1.01 -0.07 0.00 -0.74 0.00 0.00 36.82 37.70 3m8n h ILE 106 CO 0.00 0.43 0.62 1.23 0.00 0.00 0.00 178.15 180.43 3m8n h GLY 107 N 0.96 1.50 0.69 5.37 0.00 -1.53 0.12 103.07 110.19 3m8n h GLY 107 Ca 0.13 -0.42 -0.12 0.00 0.00 0.00 0.00 47.33 46.91 3m8n h GLY 107 CO 0.04 0.22 -0.47 1.76 0.00 0.00 0.00 176.54 178.10 3m8n h SER 108 N 1.02 0.44 -0.35 0.19 0.02 -1.51 -2.06 113.55 111.29 3m8n h SER 108 Ca 0.46 -0.74 0.08 0.00 -0.84 0.00 0.00 61.79 60.74 3m8n h SER 108 Cb 0.38 -0.13 -0.08 0.00 0.14 0.00 0.00 62.40 62.70 3m8n h SER 108 CO -0.21 1.13 -0.21 0.00 -1.14 0.00 0.00 176.83 176.39 3m8n h ALA 109 N 0.33 0.02 -0.54 3.77 0.00 -1.01 -1.35 119.26 120.48 3m8n h ALA 109 Ca -0.05 0.12 0.06 0.00 0.00 0.00 0.00 54.91 55.04 3m8n h ALA 109 Cb 1.18 0.49 -0.06 0.00 0.00 0.00 0.00 17.79 19.41 3m8n h ALA 109 CO 0.09 -0.60 0.23 -0.92 0.00 0.00 0.00 179.25 178.05 3m8n h TYR 110 N -0.17 0.41 0.36 0.00 3.20 -0.76 0.26 116.97 120.27 3m8n h TYR 110 Ca 0.18 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.06 3m8n h TYR 110 Cb 0.44 -0.11 -0.00 0.00 1.54 0.00 0.00 36.73 38.60 3m8n h TYR 110 CO -0.42 0.16 -0.21 0.35 -1.64 0.00 0.00 178.16 176.40 3m8n h PHE 111 N 0.44 -0.55 -0.06 -3.82 3.57 -0.53 0.13 116.94 116.11 3m8n h PHE 111 Ca 0.25 -0.01 -0.14 0.00 3.53 0.00 0.00 57.97 61.60 3m8n h PHE 111 Cb 0.23 0.20 0.01 0.00 2.79 0.00 0.00 35.95 39.18 3m8n h PHE 111 CO -0.13 -0.33 -0.51 -1.49 -2.23 0.00 0.00 178.31 173.61 3m8n h TRP 112 N -0.54 0.64 0.00 0.41 4.06 -1.21 -0.70 115.95 118.61 3m8n h TRP 112 Ca -0.04 -0.30 -0.17 0.00 2.06 0.00 0.00 58.89 60.44 3m8n h TRP 112 Cb 0.44 -0.09 -0.02 0.00 -1.00 0.00 0.00 29.16 28.49 3m8n h TRP 112 CO -0.09 1.09 -0.79 -0.07 -3.56 0.00 0.00 178.44 175.02 3m8n h LEU 113 N 0.01 0.00 0.00 -4.49 3.38 -0.50 -3.35 115.31 110.36 3m8n h LEU 113 Ca -0.05 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 3m8n h LEU 113 Cb 1.18 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.92 3m8n h LEU 113 CO 0.10 0.79 -1.31 0.00 0.09 0.00 0.00 178.44 178.12 3m8n n LEU 115 N -1.85 2.30 -4.63 0.00 4.32 -0.30 -4.94 117.00 111.90 3m8n n LEU 115 Ca -0.03 0.23 -0.41 0.00 -0.02 0.00 0.00 56.01 55.77 3m8n n LEU 115 Cb 0.30 -0.93 -0.05 0.00 -1.62 0.00 0.00 43.42 41.12 3m8n n LEU 115 CO 0.13 0.64 0.54 -0.69 -1.22 0.00 0.00 177.39 176.79 3m8n s VAL 116 N -2.48 4.87 -0.27 4.08 1.01 -0.99 -5.01 120.40 121.61 3m8n s VAL 116 Ca -0.33 1.28 -0.40 0.00 0.00 0.00 0.00 61.98 62.53 3m8n s VAL 116 Cb 0.10 -4.06 -0.16 0.00 0.00 0.00 0.00 36.38 32.26 3m8n s VAL 116 CO 0.59 -0.10 1.71 0.29 0.00 0.00 0.00 175.10 177.60 3m8n n LYS 117 N 5.97 1.09 -4.20 2.72 4.01 -1.26 -1.85 118.16 124.64 3m8n n LYS 117 Ca 0.03 0.40 -0.35 0.00 -0.51 0.00 0.00 58.31 57.88 3m8n n LYS 117 Cb 0.48 -2.07 -0.03 0.00 -0.51 0.00 0.00 35.03 32.90 3m8n n LYS 117 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 3m8n n GLY 118 N 4.08 -0.40 0.08 0.72 0.00 -1.26 -4.83 105.19 103.58 3m8n n GLY 118 Ca 0.26 0.14 0.15 0.00 0.00 0.00 0.00 46.02 46.56 3m8n n GLY 118 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3m8n n GLY 119 N -1.51 -0.83 0.19 -0.02 0.00 -0.77 -4.11 105.19 98.14 3m8n n GLY 119 Ca 0.01 -0.23 -0.11 0.00 0.00 0.00 0.00 46.02 45.69 3m8n n GLY 119 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3m8n h ARG 120 N 0.37 0.59 0.03 1.61 2.43 -1.83 -2.99 114.38 114.59 3m8n h ARG 120 Ca 0.00 -0.20 -0.24 0.00 -0.81 0.00 0.00 59.98 58.73 3m8n h ARG 120 Cb 0.08 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.56 3m8n h ARG 120 CO 0.00 0.74 -1.17 -0.44 -1.51 0.00 0.00 179.97 177.59 3m8n h ASP 121 N 0.38 0.09 0.00 -3.80 3.32 -1.96 -2.82 116.42 111.63 3m8n h ASP 121 Ca 0.09 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.03 3m8n h ASP 121 Cb 0.49 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.01 3m8n h ASP 121 CO 0.02 1.09 0.21 -0.07 -1.72 0.00 0.00 179.24 178.77 3m8n h LEU 122 N 0.02 0.00 -0.86 1.55 3.38 -1.75 -3.34 115.31 114.31 3m8n h LEU 122 Ca -0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.89 3m8n h LEU 122 Cb 1.85 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.60 3m8n h LEU 122 CO 0.14 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.67 3m8n n GLN 123 N -2.56 -0.11 -0.06 1.13 1.13 -1.08 -4.95 117.38 110.88 3m8n n GLN 123 Ca -0.02 -0.43 0.23 0.00 -1.94 0.00 0.00 57.00 54.84 3m8n n GLN 123 Cb 0.25 -0.78 0.51 0.00 0.11 0.00 0.00 30.24 30.33 3m8n n GLN 123 CO 0.00 0.00 0.00 1.15 -1.44 0.00 0.00 177.06 176.77 3m8n h THR 124 N 0.62 0.10 0.26 5.09 2.02 -1.64 0.26 112.91 119.62 3m8n h THR 124 Ca 0.00 0.00 -0.34 0.00 0.77 0.00 0.00 66.41 66.84 3m8n h THR 124 Cb 0.32 0.21 0.04 0.00 -1.74 0.00 0.00 68.15 66.98 3m8n h THR 124 CO 0.00 0.00 -1.50 1.12 0.37 0.00 0.00 175.52 175.51 3m8n h HIS 125 N 0.00 0.99 0.00 3.16 -0.00 -1.92 -3.32 115.15 114.06 3m8n h HIS 125 Ca 0.35 -0.72 -0.09 0.00 -0.00 0.00 0.00 60.37 59.91 3m8n h HIS 125 Cb 2.25 -0.04 -0.01 0.00 -0.00 0.00 0.00 27.41 29.60 3m8n h HIS 125 CO 0.00 1.57 -0.42 0.00 -0.00 0.00 0.00 177.93 179.09 3m8n h ALA 126 N 0.15 1.28 0.08 6.11 0.00 -0.87 -3.11 119.26 122.90 3m8n h ALA 126 Ca -0.26 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.27 3m8n h ALA 126 Cb 2.17 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.89 3m8n h ALA 126 CO 0.28 0.52 -0.09 -0.07 0.00 0.00 0.00 179.25 179.89 3m8n h LEU 127 N 0.00 -0.23 -0.83 0.00 3.38 -1.62 -0.30 115.31 115.72 3m8n h LEU 127 Ca -0.00 0.02 0.29 0.00 0.09 0.00 0.00 57.88 58.27 3m8n h LEU 127 Cb 0.75 0.08 -0.15 0.00 0.09 0.00 0.00 40.66 41.43 3m8n h LEU 127 CO 0.05 -0.13 0.22 1.21 0.09 0.00 0.00 178.44 179.89 3m8n n GLU 128 N -5.20 -0.06 -0.06 1.13 4.07 -1.18 -0.49 120.64 118.85 3m8n n GLU 128 Ca -0.07 1.19 -0.12 0.00 -0.06 0.00 0.00 57.16 58.10 3m8n n GLU 128 Cb 0.13 -2.01 -0.11 0.00 -0.06 0.00 0.00 31.44 29.39 3m8n n GLU 128 CO 0.00 0.00 0.00 -0.44 -0.06 0.00 0.00 177.13 176.63 3m8n h ASP 129 N 0.00 -0.00 -0.69 4.31 3.32 -1.50 -2.81 116.42 119.04 3m8n h ASP 129 Ca 0.60 -0.84 0.15 0.00 0.02 0.00 0.00 57.03 56.95 3m8n h ASP 129 Cb 1.43 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 40.86 3m8n h ASP 129 CO -0.71 0.91 0.00 -0.50 -1.72 0.00 0.00 179.24 177.22 3m8n h TRP 130 N -0.98 -0.05 -0.04 4.55 6.55 -0.29 -1.11 115.95 124.58 3m8n h TRP 130 Ca -0.00 0.05 -0.00 0.00 0.95 0.00 0.00 58.89 59.89 3m8n h TRP 130 Cb 0.85 0.13 -0.00 0.00 -0.86 0.00 0.00 29.16 29.27 3m8n h TRP 130 CO 0.24 -0.20 0.02 -0.07 -1.05 0.00 0.00 178.44 177.37 3m8n h LEU 131 N 0.11 0.06 -0.52 -4.49 3.38 -0.88 0.18 115.31 113.15 3m8n h LEU 131 Ca 0.37 -0.13 -0.07 0.00 0.09 0.00 0.00 57.88 58.14 3m8n h LEU 131 Cb 0.62 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.34 3m8n h LEU 131 CO -0.60 0.17 0.03 -0.33 0.09 0.00 0.00 178.44 177.80 3m8n h GLU 132 N -0.06 0.90 -0.08 1.13 5.08 -1.19 0.12 114.58 120.48 3m8n h GLU 132 Ca 0.01 -0.27 -0.20 0.00 -1.00 0.00 0.00 59.36 57.91 3m8n h GLU 132 Cb 0.13 -0.09 0.01 0.00 0.50 0.00 0.00 28.75 29.30 3m8n h GLU 132 CO -0.00 0.90 -0.71 0.00 -1.00 0.00 0.00 179.01 178.20 3m8n h ARG 133 N 0.77 0.63 -0.94 2.33 3.08 -1.21 -2.05 114.38 116.99 3m8n h ARG 133 Ca 0.15 -0.57 0.03 0.00 0.07 0.00 0.00 59.98 59.67 3m8n h ARG 133 Cb 0.48 0.13 -0.05 0.00 0.08 0.00 0.00 29.97 30.61 3m8n h ARG 133 CO 0.02 1.18 0.61 0.78 -1.07 0.00 0.00 179.97 181.49 3m8n h GLY 134 N 0.28 1.36 1.38 0.04 0.00 -0.46 -1.65 103.07 104.02 3m8n h GLY 134 Ca -0.07 -0.47 -0.14 0.00 0.00 0.00 0.00 47.33 46.66 3m8n h GLY 134 CO 0.14 0.40 -0.37 -0.97 0.00 0.00 0.00 176.54 175.75 3m8n h TYR 135 N 1.18 0.82 -0.62 5.60 0.05 -0.68 0.15 116.97 123.47 3m8n h TYR 135 Ca 0.37 -0.23 -0.05 0.00 0.05 0.00 0.00 58.73 58.87 3m8n h TYR 135 Cb -0.00 -0.18 -0.03 0.00 1.01 0.00 0.00 36.73 37.53 3m8n h TYR 135 CO -0.01 0.96 0.18 0.00 -1.05 0.00 0.00 178.16 178.24 3m8n h ALA 136 N 1.02 1.14 -0.05 3.88 0.00 -1.12 -1.27 119.26 122.86 3m8n h ALA 136 Ca 0.05 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 3m8n h ALA 136 Cb 0.89 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 3m8n h ALA 136 CO 0.08 0.59 0.01 0.00 0.00 0.00 0.00 179.25 179.92 3m8n h ALA 137 N 1.27 0.07 -0.02 0.00 0.00 -0.91 -2.32 119.26 117.35 3m8n h ALA 137 Ca 0.20 -0.15 0.01 0.00 0.00 0.00 0.00 54.91 54.97 3m8n h ALA 137 Cb 0.29 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 3m8n h ALA 137 CO -0.01 -0.28 0.02 -0.07 0.00 0.00 0.00 179.25 178.91 3m8n h LEU 138 N -0.17 0.00 0.11 0.00 3.38 -0.85 -2.38 115.31 115.40 3m8n h LEU 138 Ca 0.02 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.69 3m8n h LEU 138 Cb 0.29 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.07 3m8n h LEU 138 CO 0.00 0.00 -1.22 -0.61 0.09 0.00 0.00 178.44 176.70 3m8n h GLN 139 N 0.00 0.63 -1.07 1.13 5.75 -1.05 -1.97 115.11 118.53 3m8n h GLN 139 Ca 0.01 -0.83 0.00 0.00 -0.15 0.00 0.00 58.65 57.68 3m8n h GLN 139 Cb 0.05 0.27 0.00 0.00 1.07 0.00 0.00 27.48 28.87 3m8n h GLN 139 CO -0.00 1.38 0.00 0.28 -2.65 0.00 0.00 178.83 177.84 3m8n n VAL 140 N -3.81 0.00 0.00 2.39 0.31 -0.89 -1.56 118.33 114.77 3m8n n VAL 140 Ca -0.14 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.19 3m8n n VAL 140 Cb 0.97 -0.25 0.00 0.00 -0.91 0.00 0.00 33.84 33.65 3m8n n VAL 140 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 3m8n n GLU 142 N 0.72 0.00 -0.19 5.55 4.07 -0.74 -2.47 120.64 127.58 3m8n n GLU 142 Ca 0.00 0.00 -0.04 0.00 -0.06 0.00 0.00 57.16 57.06 3m8n n GLU 142 Cb 0.00 0.00 0.15 0.00 -0.06 0.00 0.00 31.44 31.53 3m8n n GLU 142 CO 0.00 0.00 0.00 -0.91 -0.06 0.00 0.00 177.13 176.16 3m8n h ASN 143 N 0.00 0.90 -0.19 4.31 2.35 -1.57 -0.70 115.58 120.68 3m8n h ASN 143 Ca 0.00 -0.15 -0.16 0.00 -0.55 0.00 0.00 56.30 55.44 3m8n h ASN 143 Cb 0.00 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.13 3m8n h ASN 143 CO 0.00 0.84 -0.45 -0.74 -1.65 0.00 0.00 177.43 175.43 3m8n h HIS 144 N 0.94 0.91 0.00 1.19 2.76 -1.76 -3.16 115.15 116.03 3m8n h HIS 144 Ca 0.21 -0.29 0.00 0.00 -2.20 0.00 0.00 60.37 58.09 3m8n h HIS 144 Cb 0.26 -0.19 0.00 0.00 1.55 0.00 0.00 27.41 29.03 3m8n h HIS 144 CO 0.02 1.06 0.00 1.28 -1.30 0.00 0.00 177.93 178.99 3m8n n LEU 145 N -4.02 0.36 -0.25 0.26 4.77 -0.97 -3.00 117.00 114.15 3m8n n LEU 145 Ca -0.03 0.54 0.12 0.00 -0.03 0.00 0.00 56.01 56.61 3m8n n LEU 145 Cb 0.56 -0.42 0.40 0.00 -2.33 0.00 0.00 43.42 41.63 3m8n n LEU 145 CO 0.48 -0.09 1.22 0.11 -1.33 0.00 0.00 177.39 177.77 3m8n h LYS 146 N 0.00 0.63 0.00 3.23 1.79 -1.10 -3.10 116.57 118.01 3m8n h LYS 146 Ca 0.00 -0.04 -0.01 0.00 -2.18 0.00 0.00 60.65 58.42 3m8n h LYS 146 Cb 0.60 -0.14 -0.03 0.00 -1.58 0.00 0.00 32.23 31.07 3m8n h LYS 146 CO 0.00 0.42 -0.28 0.25 -1.08 0.00 0.00 179.45 178.75 3m8n n THR 147 N -4.55 1.37 -3.76 -0.16 -2.24 -1.20 -5.02 114.28 98.73 3m8n n THR 147 Ca 0.17 -1.83 -0.13 0.00 -2.27 0.00 0.00 64.05 59.99 3m8n n THR 147 Cb 0.48 0.02 -0.11 0.00 -2.10 0.00 0.00 70.33 68.63 3m8n n THR 147 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 3m8n s ASN 148 N -2.45 -0.35 0.08 3.42 0.01 -1.16 -5.04 114.94 109.44 3m8n s ASN 148 Ca 0.26 0.68 0.17 0.00 -0.71 0.00 0.00 52.86 53.26 3m8n s ASN 148 Cb 0.24 0.69 -0.12 0.00 0.41 0.00 0.00 41.25 42.48 3m8n s ASN 148 CO -0.01 -0.12 0.88 0.44 -1.51 0.00 0.00 177.10 176.78 3m8n h ASP 149 N 5.62 0.00 -4.42 -1.22 5.19 -1.89 -3.39 116.42 116.31 3m8n h ASP 149 Ca -0.26 0.00 -0.29 0.00 -0.62 0.00 0.00 57.03 55.86 3m8n h ASP 149 Cb 1.19 0.00 -0.17 0.00 0.18 0.00 0.00 39.33 40.53 3m8n h ASP 149 CO 0.29 0.55 -0.72 -0.31 -3.12 0.00 0.00 179.24 175.94 3m8n s TYR 150 N -2.94 1.01 0.13 4.55 2.02 -1.26 -4.86 117.35 116.00 3m8n s TYR 150 Ca -0.02 -0.73 -0.14 0.00 -0.37 0.00 0.00 57.07 55.81 3m8n s TYR 150 Cb 0.09 -0.56 -0.00 0.00 -0.40 0.00 0.00 41.96 41.09 3m8n s TYR 150 CO 0.81 -0.04 1.59 0.74 -1.57 0.00 0.00 175.55 177.08 3m8n h PHE 151 N 3.36 0.83 -3.61 2.71 0.04 -1.91 -3.43 116.94 114.93 3m8n h PHE 151 Ca -0.36 -0.14 -0.50 0.00 2.80 0.00 0.00 57.97 59.77 3m8n h PHE 151 Cb 1.18 -0.22 -0.19 0.00 2.20 0.00 0.00 35.95 38.92 3m8n h PHE 151 CO 0.62 0.81 -0.79 0.00 -0.60 0.00 0.00 178.31 178.35 3m8n s ALA 152 N -5.05 1.75 0.00 2.45 0.00 -1.26 -4.85 121.76 114.81 3m8n s ALA 152 Ca -0.13 -1.33 0.00 0.00 0.00 0.00 0.00 51.96 50.51 3m8n s ALA 152 Cb 0.11 -0.17 0.00 0.00 0.00 0.00 0.00 23.12 23.06 3m8n s ALA 152 CO 0.80 0.24 0.00 0.00 0.00 0.00 0.00 175.76 176.80 3m8n n ALA 153 N 0.67 0.00 -2.05 0.00 0.00 -1.26 -2.97 120.51 114.90 3m8n n ALA 153 Ca -0.16 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.10 3m8n n ALA 153 Cb 0.56 -1.28 -0.03 0.00 0.00 0.00 0.00 19.45 18.69 3m8n n ALA 153 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3m8n n GLY 154 N -0.21 0.37 3.59 0.00 0.00 -1.26 -4.98 105.19 102.70 3m8n n GLY 154 Ca 0.00 -0.15 -0.09 0.00 0.00 0.00 0.00 46.02 45.78 3m8n n GLY 154 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3m8n s GLN 155 N -4.40 1.52 0.15 1.61 -2.07 -1.16 -4.90 119.66 110.41 3m8n s GLN 155 Ca 0.00 -1.16 -0.31 0.00 -1.82 0.00 0.00 55.36 52.07 3m8n s GLN 155 Cb 0.00 0.49 -0.08 0.00 -1.09 0.00 0.00 33.01 32.32 3m8n s GLN 155 CO 0.00 -0.64 1.39 -1.17 -1.32 0.00 0.00 175.29 173.56 3m8n s LEU 156 N -2.98 4.38 0.37 2.60 2.96 -1.26 -4.58 118.68 120.17 3m8n s LEU 156 Ca 0.19 2.40 0.06 0.00 -0.22 0.00 0.00 54.13 56.56 3m8n s LEU 156 Cb -0.01 -3.59 -0.03 0.00 0.50 0.00 0.00 46.19 43.06 3m8n s LEU 156 CO 0.06 -0.65 0.23 0.42 -1.32 0.00 0.00 176.35 175.10 3m8n s THR 157 N 0.81 0.19 0.60 3.68 -4.23 -1.26 -4.76 115.64 110.68 3m8n s THR 157 Ca 0.63 -2.00 0.31 0.00 -1.18 0.00 0.00 61.69 59.45 3m8n s THR 157 Cb -0.38 -2.42 0.37 0.00 1.34 0.00 0.00 72.50 71.41 3m8n s THR 157 CO 0.33 0.00 2.22 0.16 -0.54 0.00 0.00 174.62 176.79 3m8n h ILE 158 N 1.98 0.43 -0.95 2.99 3.07 -1.78 -1.29 117.51 121.96 3m8n h ILE 158 Ca -0.28 0.00 0.04 0.00 1.55 0.00 0.00 64.86 66.17 3m8n h ILE 158 Cb 1.25 0.94 -0.06 0.00 -0.27 0.00 0.00 36.82 38.68 3m8n h ILE 158 CO 0.43 0.00 0.62 0.00 -1.05 0.00 0.00 178.15 178.15 3m8n h ALA 159 N 1.91 1.40 -0.21 0.16 0.00 -1.87 -0.50 119.26 120.15 3m8n h ALA 159 Ca 0.02 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.75 3m8n h ALA 159 Cb 0.16 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.62 3m8n h ALA 159 CO -0.00 0.50 -0.41 -0.44 0.00 0.00 0.00 179.25 178.90 3m8n h ASP 160 N 1.18 0.72 -0.69 0.00 3.32 -1.62 -2.47 116.42 116.85 3m8n h ASP 160 Ca 0.38 -0.55 0.10 0.00 0.02 0.00 0.00 57.03 56.98 3m8n h ASP 160 Cb 0.04 -0.21 -0.07 0.00 0.22 0.00 0.00 39.33 39.31 3m8n h ASP 160 CO -0.12 1.13 0.32 0.40 -1.72 0.00 0.00 179.24 179.25 3m8n h ILE 161 N 0.33 0.82 -0.64 0.35 5.03 -1.41 0.19 117.51 122.18 3m8n h ILE 161 Ca 0.01 -0.19 -0.09 0.00 -0.12 0.00 0.00 64.86 64.47 3m8n h ILE 161 Cb 1.01 0.22 -0.02 0.00 -3.03 0.00 0.00 36.82 35.00 3m8n h ILE 161 CO 0.09 0.10 0.06 0.00 -0.68 0.00 0.00 178.15 177.72 3m8n h ALA 162 N 1.44 0.90 0.00 1.87 0.00 -0.96 -2.77 119.26 119.74 3m8n h ALA 162 Ca 0.35 -0.29 -0.20 0.00 0.00 0.00 0.00 54.91 54.76 3m8n h ALA 162 Cb 0.39 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 3m8n h ALA 162 CO -0.29 0.67 -0.97 -0.07 0.00 0.00 0.00 179.25 178.59 3m8n h LEU 163 N 1.00 0.02 -1.08 0.00 3.38 -1.13 -3.10 115.31 114.40 3m8n h LEU 163 Ca 0.19 -0.02 0.10 0.00 0.09 0.00 0.00 57.88 58.24 3m8n h LEU 163 Cb 0.49 -0.01 -0.07 0.00 0.09 0.00 0.00 40.66 41.16 3m8n h LEU 163 CO 0.02 0.98 0.62 0.22 0.09 0.00 0.00 178.44 180.36 3m8n h TYR 164 N 0.00 1.09 -0.92 1.13 3.20 -0.44 -2.84 116.97 118.20 3m8n h TYR 164 Ca -0.01 0.03 0.12 0.00 3.14 0.00 0.00 58.73 62.01 3m8n h TYR 164 Cb 1.71 -0.35 -0.14 0.00 1.54 0.00 0.00 36.73 39.49 3m8n h TYR 164 CO 0.00 0.49 -0.46 0.78 -1.64 0.00 0.00 178.16 177.33 3m8n h GLY 165 N 1.00 -0.31 0.02 1.82 0.00 -1.41 -1.48 103.07 102.70 3m8n h GLY 165 Ca 0.45 0.62 -0.38 0.00 0.00 0.00 0.00 47.33 48.02 3m8n h GLY 165 CO -0.21 -0.12 -2.41 -1.72 0.00 0.00 0.00 176.54 172.08 3m8n n TYR 166 N -5.39 0.02 -0.31 5.60 4.01 -1.24 -4.41 117.16 115.44 3m8n n TYR 166 Ca 0.06 0.01 0.11 0.00 -0.16 0.00 0.00 57.90 57.92 3m8n n TYR 166 Cb 0.35 -1.00 0.33 0.00 -0.31 0.00 0.00 39.34 38.71 3m8n n TYR 166 CO 0.00 0.00 0.00 1.15 -0.46 0.00 0.00 176.86 177.55 3m8n h THR 167 N 0.00 0.83 0.00 -0.72 2.02 -1.32 -0.32 112.91 113.40 3m8n h THR 167 Ca -0.56 -0.27 0.00 0.00 0.77 0.00 0.00 66.41 66.35 3m8n h THR 167 Cb 2.13 -0.03 0.00 0.00 -1.74 0.00 0.00 68.15 68.51 3m8n h THR 167 CO -0.01 0.14 0.00 0.00 0.37 0.00 0.00 175.52 176.02 3m8n n HIS 168 N -4.61 0.56 0.81 3.16 1.44 -0.57 -2.41 115.22 113.59 3m8n n HIS 168 Ca 0.19 0.22 0.10 0.00 -2.01 0.00 0.00 57.72 56.22 3m8n n HIS 168 Cb 0.47 -0.85 0.05 0.00 0.12 0.00 0.00 29.99 29.78 3m8n n HIS 168 CO 0.00 0.00 0.00 1.33 -2.81 0.00 0.00 176.34 174.86 3m8n n VAL 169 N -2.01 0.00 -0.19 0.61 0.24 -0.15 -4.69 118.33 112.15 3m8n n VAL 169 Ca 0.02 -0.43 -0.07 0.00 -2.04 0.00 0.00 64.34 61.83 3m8n n VAL 169 Cb 0.21 1.34 0.03 0.00 -1.47 0.00 0.00 33.84 33.94 3m8n n VAL 169 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3m8n h ALA 170 N 3.60 0.70 -0.49 2.33 0.00 -1.29 -1.55 119.26 122.56 3m8n h ALA 170 Ca 0.00 -0.05 0.11 0.00 0.00 0.00 0.00 54.91 54.97 3m8n h ALA 170 Cb 0.75 -0.22 -0.09 0.00 0.00 0.00 0.00 17.79 18.22 3m8n h ALA 170 CO 0.00 0.16 -0.07 -3.47 0.00 0.00 0.00 179.25 175.86 3m8n n ASP 171 N -4.68 -0.13 -0.03 0.00 2.03 -1.25 -1.30 116.55 111.18 3m8n n ASP 171 Ca 0.03 0.84 0.11 0.00 0.52 0.00 0.00 54.79 56.29 3m8n n ASP 171 Cb 0.03 -0.27 0.05 0.00 -0.72 0.00 0.00 41.12 40.21 3m8n n ASP 171 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3m8n n GLN 172 N -4.71 0.09 -1.88 -0.67 6.02 -0.59 -4.15 117.38 111.50 3m8n n GLN 172 Ca 0.09 -0.07 -0.17 0.00 -0.01 0.00 0.00 57.00 56.84 3m8n n GLN 172 Cb 0.30 -1.50 0.05 0.00 1.02 0.00 0.00 30.24 30.11 3m8n n GLN 172 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3m8n n ASP 174 N -0.74 -0.98 -4.84 0.00 9.92 -1.22 -4.77 116.55 113.91 3m8n n ASP 174 Ca 0.37 0.00 -0.37 0.00 -0.53 0.00 0.00 54.79 54.26 3m8n n ASP 174 Cb 0.92 -0.16 -0.07 0.00 -0.64 0.00 0.00 41.12 41.17 3m8n n ASP 174 CO 0.00 0.00 0.00 -0.36 0.13 0.00 0.00 177.20 176.97 3m8n s PHE 175 N -2.00 3.52 -0.30 1.24 0.08 -0.42 -5.04 117.98 115.06 3m8n s PHE 175 Ca 0.00 0.47 -0.06 0.00 0.12 0.00 0.00 56.93 57.46 3m8n s PHE 175 Cb 0.00 -1.91 0.02 0.00 -0.57 0.00 0.00 43.02 40.56 3m8n s PHE 175 CO 0.00 0.69 0.06 0.34 -0.10 0.00 0.00 175.22 176.21 3m8n s ASP 176 N -1.01 5.05 -0.03 1.36 2.15 -1.26 -3.92 116.67 119.00 3m8n s ASP 176 Ca 0.15 -0.85 0.16 0.00 0.43 0.00 0.00 52.55 52.44 3m8n s ASP 176 Cb -0.12 -1.84 0.51 0.00 -0.30 0.00 0.00 42.92 41.17 3m8n s ASP 176 CO 0.04 -0.22 1.41 0.18 -0.17 0.00 0.00 175.17 176.41 3m8n n LEU 177 N 4.82 3.22 -0.19 -1.34 4.32 -1.26 -4.40 117.00 122.16 3m8n n LEU 177 Ca -0.14 -1.62 0.03 0.00 -0.02 0.00 0.00 56.01 54.26 3m8n n LEU 177 Cb 0.47 -0.42 0.29 0.00 -1.62 0.00 0.00 43.42 42.14 3m8n n LEU 177 CO 0.31 0.70 1.23 0.77 -1.22 0.00 0.00 177.39 179.17 3m8n h SER 178 N 3.16 0.78 0.00 -1.43 4.64 -2.03 -0.51 113.55 118.17 3m8n h SER 178 Ca 0.00 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 3m8n h SER 178 Cb 0.89 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 62.79 3m8n h SER 178 CO 0.07 0.55 0.00 1.07 -0.87 0.00 0.00 176.83 177.64 3m8n n THR 179 N -4.45 0.00 -3.29 2.95 5.66 -1.26 -4.19 114.28 109.70 3m8n n THR 179 Ca 0.09 0.00 -0.26 0.00 -3.05 0.00 0.00 64.05 60.83 3m8n n THR 179 Cb 0.09 -0.52 -0.07 0.00 -1.55 0.00 0.00 70.33 68.28 3m8n n THR 179 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 175.07 172.51 3m8n n PHE 180 N -1.00 2.49 0.14 1.09 3.72 -0.20 -4.94 117.46 118.76 3m8n n PHE 180 Ca 0.23 -3.97 -0.01 0.00 -0.05 0.00 0.00 57.45 53.66 3m8n n PHE 180 Cb 0.11 -0.49 0.23 0.00 -0.94 0.00 0.00 39.48 38.39 3m8n n PHE 180 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 3m8n h PRO 181 N 3.92 0.06 -0.17 -1.08 0.13 -1.75 -2.52 132.00 130.61 3m8n h PRO 181 Ca 0.15 -0.04 -0.11 0.00 -0.87 0.00 0.00 66.00 65.14 3m8n h PRO 181 Cb 0.71 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.83 3m8n h PRO 181 CO 0.72 0.56 -0.37 0.00 -0.23 0.00 0.00 178.00 178.68 3m8n h ALA 182 N 1.44 1.07 -0.46 -0.56 0.00 -1.92 -0.92 119.26 117.91 3m8n h ALA 182 Ca -0.00 -0.40 -0.03 0.00 0.00 0.00 0.00 54.91 54.49 3m8n h ALA 182 Cb 0.91 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 3m8n h ALA 182 CO 0.07 0.59 0.18 0.28 0.00 0.00 0.00 179.25 180.37 3m8n h VAL 183 N 0.30 1.21 -0.51 0.00 2.07 -1.84 -2.44 116.25 115.03 3m8n h VAL 183 Ca 0.03 -0.64 -0.11 0.00 0.82 0.00 0.00 66.70 66.81 3m8n h VAL 183 Cb 0.79 0.77 -0.02 0.00 -1.52 0.00 0.00 31.29 31.31 3m8n h VAL 183 CO 0.06 0.24 -0.12 0.78 0.02 0.00 0.00 177.57 178.55 3m8n h ASN 184 N 0.60 0.96 -0.80 0.57 -0.26 -1.18 -0.72 115.58 114.75 3m8n h ASN 184 Ca 0.15 -0.31 0.00 0.00 -0.56 0.00 0.00 56.30 55.58 3m8n h ASN 184 Cb 0.19 -0.26 -0.04 0.00 -1.06 0.00 0.00 38.32 37.15 3m8n h ASN 184 CO -0.01 1.08 0.52 0.00 -1.06 0.00 0.00 177.43 177.96 3m8n h ALA 185 N 1.00 1.40 -0.32 -0.83 0.00 -1.11 -2.80 119.26 116.60 3m8n h ALA 185 Ca 0.13 -0.07 -0.14 0.00 0.00 0.00 0.00 54.91 54.84 3m8n h ALA 185 Cb 0.66 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 3m8n h ALA 185 CO 0.05 0.55 -0.35 2.35 0.00 0.00 0.00 179.25 181.84 3m8n h TRP 186 N 1.10 0.97 -0.94 0.00 7.01 -0.92 -2.37 115.95 120.80 3m8n h TRP 186 Ca 0.29 -0.30 0.19 0.00 2.11 0.00 0.00 58.89 61.18 3m8n h TRP 186 Cb -0.11 -0.20 -0.11 0.00 -2.10 0.00 0.00 29.16 26.65 3m8n h TRP 186 CO 0.00 1.09 0.52 -0.07 -2.79 0.00 0.00 178.44 177.19 3m8n h LEU 187 N 0.58 0.62 -0.41 0.65 3.38 -0.91 -0.92 115.31 118.30 3m8n h LEU 187 Ca 0.05 0.11 -0.18 0.00 0.09 0.00 0.00 57.88 57.95 3m8n h LEU 187 Cb 0.94 0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.69 3m8n h LEU 187 CO 0.09 0.20 -0.60 0.03 0.09 0.00 0.00 178.44 178.25 3m8n h ARG 188 N 0.64 0.64 -0.42 1.13 -0.00 -1.29 -1.79 114.38 113.30 3m8n h ARG 188 Ca 0.55 -0.43 0.03 0.00 -0.50 0.00 0.00 59.98 59.63 3m8n h ARG 188 Cb 0.88 0.06 -0.04 0.00 0.00 0.00 0.00 29.97 30.88 3m8n h ARG 188 CO -0.41 1.05 0.21 0.00 0.00 0.00 0.00 179.97 180.81 3m8n h ARG 189 N 0.48 0.40 -0.04 0.04 3.08 -0.83 0.58 114.38 118.09 3m8n h ARG 189 Ca -0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.03 3m8n h ARG 189 Cb 1.17 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 31.12 3m8n h ARG 189 CO 0.12 0.27 0.02 0.28 -1.07 0.00 0.00 179.97 179.58 3m8n h VAL 190 N 0.42 1.00 0.00 2.04 2.07 -0.98 -3.04 116.25 117.75 3m8n h VAL 190 Ca 0.18 -0.01 -0.01 0.00 0.82 0.00 0.00 66.70 67.68 3m8n h VAL 190 Cb 0.09 0.95 -0.00 0.00 -1.52 0.00 0.00 31.29 30.82 3m8n h VAL 190 CO -0.13 0.01 -0.04 -0.33 0.02 0.00 0.00 177.57 177.09 3m8n h GLU 191 N 0.04 0.00 -0.09 1.57 5.08 -1.02 -1.85 114.58 118.31 3m8n h GLU 191 Ca 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 3m8n h GLU 191 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 3m8n h GLU 191 CO -0.01 0.04 0.00 1.04 -1.00 0.00 0.00 179.01 179.08 3m8n n GLN 192 N -4.05 1.59 -2.10 2.33 6.02 0.17 -4.76 117.38 116.58 3m8n n GLN 192 Ca -0.03 -0.88 -0.41 0.00 -0.01 0.00 0.00 57.00 55.67 3m8n n GLN 192 Cb 0.13 -1.42 -0.03 0.00 1.02 0.00 0.00 30.24 29.94 3m8n n GLN 192 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 3m8n s THR 193 N -1.90 2.94 0.26 5.09 2.01 -0.70 -4.96 115.64 118.39 3m8n s THR 193 Ca 0.35 0.76 -0.30 0.00 0.31 0.00 0.00 61.69 62.82 3m8n s THR 193 Cb 0.19 -3.49 -0.14 0.00 0.01 0.00 0.00 72.50 69.07 3m8n s THR 193 CO 0.29 0.11 1.14 -2.65 -0.69 0.00 0.00 174.62 172.82 3m8n n PRO 194 N 2.79 1.51 -0.78 4.92 -0.02 -1.26 -1.59 135.00 140.56 3m8n n PRO 194 Ca 0.08 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 62.09 3m8n n PRO 194 Cb 0.41 -2.00 0.00 0.00 -0.02 0.00 0.00 33.50 31.89 3m8n n PRO 194 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3m8n n GLY 195 N 1.50 0.98 3.76 -1.23 0.00 -1.26 -4.82 105.19 104.13 3m8n n GLY 195 Ca 0.11 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 3m8n n GLY 195 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3m8n s PHE 196 N -3.61 2.48 0.07 1.61 5.36 -0.62 -4.20 117.98 119.07 3m8n s PHE 196 Ca 0.00 1.33 0.07 0.00 -0.96 0.00 0.00 56.93 57.37 3m8n s PHE 196 Cb 0.00 -3.83 -0.03 0.00 -0.34 0.00 0.00 43.02 38.82 3m8n s PHE 196 CO 0.00 -2.75 -0.20 0.96 -1.46 0.00 0.00 175.22 171.78 3m8n s ILE 197 N -1.25 1.60 0.00 3.12 -4.36 -1.26 -5.06 121.20 113.98 3m8n s ILE 197 Ca 0.64 -1.36 0.00 0.00 -0.26 0.00 0.00 60.65 59.67 3m8n s ILE 197 Cb -0.41 -1.43 0.00 0.00 1.25 0.00 0.00 42.46 41.86 3m8n s ILE 197 CO 0.52 0.02 0.00 0.35 0.24 0.00 0.00 174.94 176.07 3m8n n THR 198 N 1.43 0.00 0.00 8.37 -2.24 -1.26 -4.90 114.28 115.68 3m8n n THR 198 Ca -0.19 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 3m8n n THR 198 Cb 0.54 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.77 3m8n n THR 198 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3m8n n ASP 200 N 0.00 0.00 -4.77 3.42 5.75 -1.26 -4.88 116.55 114.81 3m8n n ASP 200 Ca 0.00 0.00 -0.40 0.00 -0.01 0.00 0.00 54.79 54.38 3m8n n ASP 200 Cb 0.00 0.00 0.01 0.00 -1.03 0.00 0.00 41.12 40.10 3m8n n ASP 200 CO 0.00 0.00 0.00 0.86 -0.11 0.00 0.00 177.20 177.95 3m8n s TRP 201 N 0.00 2.48 -0.00 2.11 -0.00 -1.26 -5.04 118.94 117.24 3m8n s TRP 201 Ca 0.00 1.21 0.01 0.00 -0.00 0.00 0.00 56.10 57.32 3m8n s TRP 201 Cb 0.00 -3.99 -0.00 0.00 -0.00 0.00 0.00 33.47 29.48 3m8n s TRP 201 CO 0.00 -3.03 -0.04 0.95 -0.00 0.00 0.00 176.95 174.83 3m8n s THR 202 N -1.16 0.34 0.00 5.86 -4.23 -1.26 -5.11 115.64 110.07 3m8n s THR 202 Ca 0.58 -0.23 0.00 0.00 -1.18 0.00 0.00 61.69 60.86 3m8n s THR 202 Cb -0.45 -0.30 0.00 0.00 1.34 0.00 0.00 72.50 73.09 3m8n s THR 202 CO 0.60 0.06 0.00 -2.65 -0.54 0.00 0.00 174.62 172.09 3m8n n PRO 203 N 2.89 0.00 -3.82 3.99 -0.02 -1.26 -5.22 135.00 131.56 3m8n n PRO 203 Ca -0.13 0.00 -0.36 0.00 -2.02 0.00 0.00 63.50 60.99 3m8n n PRO 203 Cb 0.58 0.00 -0.12 0.00 -0.02 0.00 0.00 33.50 33.94 3m8n n PRO 203 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3m8n s ILE 206 N 0.00 3.29 0.08 4.25 1.01 -1.26 -5.26 121.20 123.31 3m8n s ILE 206 Ca 0.00 -1.62 -0.30 0.00 0.00 0.00 0.00 60.65 58.73 3m8n s ILE 206 Cb 0.00 -3.04 -0.06 0.00 0.01 0.00 0.00 42.46 39.37 3m8n s ILE 206 CO 0.00 -0.37 1.12 0.00 0.00 0.00 0.00 174.94 175.69 3m8n s ALA 207 N 1.24 3.34 0.13 9.38 0.00 -1.26 -5.04 121.76 129.54 3m8n s ALA 207 Ca 0.01 0.77 -0.14 0.00 0.00 0.00 0.00 51.96 52.60 3m8n s ALA 207 Cb -0.21 -3.39 -0.07 0.00 0.00 0.00 0.00 23.12 19.45 3m8n s ALA 207 CO -0.02 -0.32 0.53 0.00 0.00 0.00 0.00 175.76 175.96 3m8n s ALA 208 N 0.65 3.60 -0.41 0.00 0.00 -1.26 -4.72 121.76 119.61 3m8n s ALA 208 Ca 0.54 -0.14 -0.13 0.00 0.00 0.00 0.00 51.96 52.23 3m8n s ALA 208 Cb -0.28 -2.50 0.04 0.00 0.00 0.00 0.00 23.12 20.38 3m8n s ALA 208 CO 0.31 0.46 0.29 0.34 0.00 0.00 0.00 175.76 177.15 3m8n s ASP 209 N -1.64 5.93 0.40 0.00 2.15 -1.26 -4.70 116.67 117.56 3m8n s ASP 209 Ca 0.36 -1.12 0.17 0.00 0.43 0.00 0.00 52.55 52.39 3m8n s ASP 209 Cb -0.15 -2.10 0.85 0.00 -0.30 0.00 0.00 42.92 41.22 3m8n s ASP 209 CO 0.19 -0.49 1.85 1.55 -0.17 0.00 0.00 175.17 178.09 3m8n h PRO 210 N 8.57 0.00 0.00 4.34 0.13 -1.98 -3.02 132.00 140.04 3m8n h PRO 210 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 3m8n h PRO 210 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 3m8n h PRO 210 CO 0.75 0.33 0.00 0.25 -0.23 0.00 0.00 178.00 179.10 3m8n n THR 211 N -3.83 1.06 1.89 1.56 -2.24 -1.26 -3.70 114.28 107.75 3m8n n THR 211 Ca -0.01 0.27 0.06 0.00 -2.27 0.00 0.00 64.05 62.09 3m8n n THR 211 Cb 0.41 -1.06 0.33 0.00 -2.10 0.00 0.00 70.33 67.91 3m8n n THR 211 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3m8n n SER 212 N -1.45 0.00 -0.77 3.42 3.41 -1.14 -2.74 113.62 114.35 3m8n n SER 212 Ca 0.04 -1.54 0.08 0.00 -0.26 0.00 0.00 58.87 57.19 3m8n n SER 212 Cb 0.13 0.00 0.25 0.00 -0.26 0.00 0.00 64.21 64.33 3m8n n SER 212 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 3m8n n PHE 213 N -0.68 0.47 -0.18 7.33 3.72 -1.24 -4.45 117.46 122.41 3m8n n PHE 213 Ca 0.08 -0.23 -0.09 0.00 -0.05 0.00 0.00 57.45 57.16 3m8n n PHE 213 Cb 0.04 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 38.59 3m8n n PHE 213 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3m8n h ALA 214 N 3.94 0.68 -2.70 4.37 0.00 -1.85 -3.45 119.26 120.26 3m8n h ALA 214 Ca 0.00 -0.22 -0.55 0.00 0.00 0.00 0.00 54.91 54.14 3m8n h ALA 214 Cb 0.59 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.14 3m8n h ALA 214 CO 0.00 0.39 0.09 0.00 0.00 0.00 0.00 179.25 179.73 3m8n s ALA 215 N -5.28 3.41 0.72 0.00 0.00 -1.26 -5.07 121.76 114.28 3m8n s ALA 215 Ca -0.13 0.18 -0.12 0.00 0.00 0.00 0.00 51.96 51.89 3m8n s ALA 215 Cb 0.12 -2.90 0.03 0.00 0.00 0.00 0.00 23.12 20.37 3m8n s ALA 215 CO 0.80 0.10 1.09 -1.83 0.00 0.00 0.00 175.76 175.92 3m8n s GLU 216 N -0.07 2.53 2.39 0.00 -1.05 -1.26 -4.79 118.70 116.44 3m8n s GLU 216 Ca 0.36 1.22 0.00 0.00 -0.15 0.00 0.00 54.97 56.40 3m8n s GLU 216 Cb -0.19 -1.93 0.00 0.00 -0.44 0.00 0.00 34.13 31.57 3m8n s GLU 216 CO 0.20 -1.44 0.00 0.41 0.95 0.00 0.00 175.26 175.39 3m8n n GLY 217 N -1.05 -0.34 1.66 -3.83 0.00 -1.26 -4.99 105.19 95.38 3m8n n GLY 217 Ca 0.09 -1.06 -0.14 0.00 0.00 0.00 0.00 46.02 44.91 3m8n n GLY 217 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3m8n n HIS 218 N -0.22 0.34 -1.99 1.61 8.25 -1.26 -4.87 115.22 117.08 3m8n n HIS 218 Ca 0.00 -1.12 -0.07 0.00 -0.26 0.00 0.00 57.72 56.27 3m8n n HIS 218 Cb 0.00 -0.16 -0.01 0.00 1.12 0.00 0.00 29.99 30.94 3m8n n HIS 218 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 3m8n n HIS 219 N -0.63 -0.27 1.06 4.41 8.25 -1.26 -4.93 115.22 121.84 3m8n n HIS 219 Ca -0.09 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.49 3m8n n HIS 219 Cb 0.29 -1.88 0.11 0.00 1.12 0.00 0.00 29.99 29.63 3m8n n HIS 219 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 3m8n n HIS 220 N -3.83 0.00 -1.85 4.41 -0.00 -1.26 -4.62 115.22 108.07 3m8n n HIS 220 Ca -0.08 0.00 -0.16 0.00 -0.00 0.00 0.00 57.72 57.48 3m8n n HIS 220 Cb 0.51 -0.09 0.08 0.00 -0.00 0.00 0.00 29.99 30.49 3m8n n HIS 220 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 3m8n n HIS 221 N -0.96 2.02 -2.51 4.41 8.25 -1.26 -5.01 115.22 120.16 3m8n n HIS 221 Ca 0.07 -2.05 -0.43 0.00 -0.26 0.00 0.00 57.72 55.05 3m8n n HIS 221 Cb 0.37 -0.38 -0.02 0.00 1.12 0.00 0.00 29.99 31.07 3m8n n HIS 221 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 3m8n s HIS 222 N -3.51 2.76 0.00 4.41 3.76 -1.26 -5.24 115.29 116.21 3m8n s HIS 222 Ca 0.48 0.85 0.00 0.00 -0.15 0.00 0.00 55.06 56.24 3m8n s HIS 222 Cb 0.41 -4.11 0.00 0.00 1.11 0.00 0.00 32.58 29.98 3m8n s HIS 222 CO 0.01 -1.44 0.00 1.58 -0.85 0.00 0.00 174.74 174.04