#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i1o h ARG 3 N 0.00 0.00 -7.12 -0.14 0.11 -2.14 -3.44 114.38 101.65 3i1o h ARG 3 Ca 0.00 0.00 -0.45 0.00 0.10 0.00 0.00 59.98 59.63 3i1o h ARG 3 Cb 0.00 0.00 0.07 0.00 1.11 0.00 0.00 29.97 31.15 3i1o h ARG 3 CO 0.00 0.00 0.12 0.50 0.10 0.00 0.00 179.97 180.69 3i1o s ARG 4 N -3.41 2.26 -0.43 0.08 6.06 -1.26 -5.07 118.95 117.18 3i1o s ARG 4 Ca 0.04 -0.53 0.07 0.00 -2.50 0.00 0.00 55.73 52.82 3i1o s ARG 4 Cb 0.09 -2.30 0.26 0.00 0.06 0.00 0.00 34.95 33.06 3i1o s ARG 4 CO 0.54 -1.08 0.72 1.33 -2.50 0.00 0.00 175.30 174.31 3i1o n VAL 5 N -2.71 -0.34 -1.84 7.11 0.24 -1.26 -5.15 118.33 114.38 3i1o n VAL 5 Ca 0.09 -2.96 -0.37 0.00 -2.04 0.00 0.00 64.34 59.06 3i1o n VAL 5 Cb 0.60 -0.27 0.05 0.00 -1.47 0.00 0.00 33.84 32.75 3i1o n VAL 5 CO 0.00 0.00 0.00 -0.51 -2.14 0.00 0.00 176.83 174.18 3i1o s ILE 6 N -0.50 2.22 -0.06 1.34 2.07 -1.26 -4.98 121.20 120.04 3i1o s ILE 6 Ca 0.33 0.15 -0.04 0.00 -1.41 0.00 0.00 60.65 59.69 3i1o s ILE 6 Cb 0.22 -3.07 -0.02 0.00 0.13 0.00 0.00 42.46 39.72 3i1o s ILE 6 CO -0.15 -0.02 0.20 1.23 -1.91 0.00 0.00 174.94 174.28 3i1o h GLY 7 N 1.01 -0.15 0.00 1.50 0.00 -2.08 -3.50 103.07 99.85 3i1o h GLY 7 Ca -0.51 0.05 0.00 0.00 0.00 0.00 0.00 47.33 46.88 3i1o h GLY 7 CO 0.55 -0.05 0.00 -0.18 0.00 0.00 0.00 176.54 176.86 3i1o n GLN 8 N -4.15 -2.23 0.00 4.80 0.00 -1.26 -5.17 117.38 109.36 3i1o n GLN 8 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 56.98 3i1o n GLN 8 Cb 0.06 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.30 3i1o n GLN 8 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.06 179.95 3i1o n ARG 9 N -0.01 3.29 -2.72 3.69 1.85 -1.26 -5.12 116.66 116.38 3i1o n ARG 9 Ca 0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 57.85 56.83 3i1o n ARG 9 Cb 0.00 0.00 0.02 0.00 -1.05 0.00 0.00 32.46 31.43 3i1o n ARG 9 CO 0.00 0.00 0.00 -1.59 -0.01 0.00 0.00 177.63 176.03 3i1o s LYS 10 N 2.79 0.32 0.51 2.89 0.00 -1.26 -5.16 119.74 119.83 3i1o s LYS 10 Ca 0.00 -0.27 -0.17 0.00 0.00 0.00 0.00 55.97 55.53 3i1o s LYS 10 Cb 0.00 -0.00 -0.08 0.00 0.00 0.00 0.00 37.83 37.75 3i1o s LYS 10 CO 0.00 -0.41 0.98 0.96 0.00 0.00 0.00 175.35 176.89 3i1o s ILE 11 N 1.22 4.51 0.42 3.79 -4.36 -1.26 -5.04 121.20 120.48 3i1o s ILE 11 Ca 0.22 1.23 -0.22 0.00 -0.26 0.00 0.00 60.65 61.61 3i1o s ILE 11 Cb 0.09 -3.71 -0.10 0.00 1.25 0.00 0.00 42.46 39.99 3i1o s ILE 11 CO -0.11 -0.66 1.00 -1.48 0.24 0.00 0.00 174.94 173.93 3i1o s LEU 12 N -4.02 4.03 0.00 0.37 -0.00 -1.26 -5.05 118.68 112.75 3i1o s LEU 12 Ca 0.59 1.88 0.00 0.00 -0.00 0.00 0.00 54.13 56.61 3i1o s LEU 12 Cb -0.10 -4.36 0.00 0.00 -0.00 0.00 0.00 46.19 41.73 3i1o s LEU 12 CO 0.30 -0.48 0.00 -0.81 -0.00 0.00 0.00 176.35 175.37 3i1o n PRO 13 N -0.38 -0.32 -2.93 1.48 -0.04 -1.26 -4.80 135.00 126.75 3i1o n PRO 13 Ca 0.06 0.00 -0.40 0.00 -0.04 0.00 0.00 63.50 63.13 3i1o n PRO 13 Cb 0.52 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.92 3i1o n PRO 13 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 3i1o s ASP 14 N -2.00 7.40 0.12 3.54 3.68 -1.24 -4.82 116.67 123.35 3i1o s ASP 14 Ca 0.00 1.66 -0.32 0.00 2.13 0.00 0.00 52.55 56.02 3i1o s ASP 14 Cb 0.00 -2.51 -0.10 0.00 -1.45 0.00 0.00 42.92 38.85 3i1o s ASP 14 CO 0.00 0.15 1.57 1.55 0.13 0.00 0.00 175.17 178.56 3i1o h PRO 15 N 4.65 -0.57 0.00 4.34 0.13 -1.96 -3.06 132.00 135.53 3i1o h PRO 15 Ca -0.46 0.04 -0.39 0.00 -0.87 0.00 0.00 66.00 64.32 3i1o h PRO 15 Cb 1.21 0.13 -0.07 0.00 0.13 0.00 0.00 31.00 32.40 3i1o h PRO 15 CO 0.68 -0.38 -2.47 1.63 -0.23 0.00 0.00 178.00 177.22 3i1o n LYS 16 N -5.45 0.65 -0.08 0.86 4.76 -1.26 -4.75 118.16 112.89 3i1o n LYS 16 Ca -0.06 0.14 -0.11 0.00 -2.87 0.00 0.00 58.31 55.42 3i1o n LYS 16 Cb 0.38 -1.52 -0.06 0.00 -1.84 0.00 0.00 35.03 31.99 3i1o n LYS 16 CO 0.00 0.00 0.00 0.35 -1.37 0.00 0.00 177.40 176.38 3i1o h PHE 17 N 0.00 0.00 -0.32 2.13 3.57 -2.00 -3.50 116.94 116.82 3i1o h PHE 17 Ca -0.58 0.00 0.00 0.00 3.53 0.00 0.00 57.97 60.92 3i1o h PHE 17 Cb 1.91 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.65 3i1o h PHE 17 CO 0.03 0.65 0.00 0.41 -2.23 0.00 0.00 178.31 177.17 3i1o n GLY 18 N 1.59 0.83 3.38 2.40 0.00 -1.16 -4.94 105.19 107.30 3i1o n GLY 18 Ca -0.14 -0.74 -0.33 0.00 0.00 0.00 0.00 46.02 44.81 3i1o n GLY 18 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3i1o s SER 19 N -2.07 4.16 0.01 1.61 0.15 -1.26 -4.68 113.70 111.62 3i1o s SER 19 Ca 0.00 -0.30 -0.25 0.00 0.70 0.00 0.00 55.95 56.09 3i1o s SER 19 Cb 0.00 -1.65 -0.15 0.00 -1.71 0.00 0.00 66.02 62.51 3i1o s SER 19 CO 0.00 0.15 1.12 -0.33 1.20 0.00 0.00 173.24 175.38 3i1o h GLU 20 N 6.82 -0.73 0.18 5.44 4.39 -1.96 -0.49 114.58 128.23 3i1o h GLU 20 Ca -0.28 0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.47 3i1o h GLU 20 Cb 1.20 0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 30.01 3i1o h GLU 20 CO 0.57 -0.43 -0.15 -0.07 -1.16 0.00 0.00 179.01 177.77 3i1o h LEU 21 N -1.08 -0.39 -2.15 1.33 4.07 -1.99 -2.29 115.31 112.80 3i1o h LEU 21 Ca -0.08 0.03 0.02 0.00 0.08 0.00 0.00 57.88 57.93 3i1o h LEU 21 Cb 0.64 0.13 -0.00 0.00 1.08 0.00 0.00 40.66 42.51 3i1o h LEU 21 CO 0.13 -0.23 0.04 0.25 -1.08 0.00 0.00 178.44 177.55 3i1o h LEU 22 N -0.35 0.00 -1.46 1.67 6.46 -1.95 1.55 115.31 121.24 3i1o h LEU 22 Ca -0.01 0.00 0.09 0.00 -0.12 0.00 0.00 57.88 57.85 3i1o h LEU 22 Cb 0.32 0.00 -0.05 0.00 -0.73 0.00 0.00 40.66 40.20 3i1o h LEU 22 CO -0.02 0.00 0.47 0.00 -0.62 0.00 0.00 178.44 178.27 3i1o h ALA 23 N 1.96 1.84 0.00 1.25 0.00 -0.48 0.15 119.26 123.99 3i1o h ALA 23 Ca 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3i1o h ALA 23 Cb 0.11 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.76 3i1o h ALA 23 CO -0.00 0.02 -1.09 1.17 0.00 0.00 0.00 179.25 179.34 3i1o n LYS 24 N -4.49 1.04 0.06 0.00 4.81 0.60 -4.33 118.16 115.85 3i1o n LYS 24 Ca 0.12 -0.04 -0.12 0.00 -0.87 0.00 0.00 58.31 57.39 3i1o n LYS 24 Cb 0.32 -1.35 -0.01 0.00 0.02 0.00 0.00 35.03 34.01 3i1o n LYS 24 CO 0.00 0.00 0.00 0.35 1.17 0.00 0.00 177.40 178.92 3i1o h PHE 25 N 0.00 0.59 -0.15 5.64 3.57 0.31 0.99 116.94 127.89 3i1o h PHE 25 Ca 0.00 -0.29 -0.12 0.00 3.53 0.00 0.00 57.97 61.09 3i1o h PHE 25 Cb 0.52 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.17 3i1o h PHE 25 CO 0.00 1.08 -0.44 -0.39 -2.23 0.00 0.00 178.31 176.33 3i1o h VAL 26 N 0.26 1.32 -0.11 1.41 -1.51 -0.96 -2.87 116.25 113.78 3i1o h VAL 26 Ca -0.06 -1.61 -0.21 0.00 -1.23 0.00 0.00 66.70 63.60 3i1o h VAL 26 Cb 1.45 1.69 0.00 0.00 -2.13 0.00 0.00 31.29 32.30 3i1o h VAL 26 CO 0.15 0.49 -0.77 0.78 -1.23 0.00 0.00 177.57 176.99 3i1o h ASN 27 N 0.29 0.72 -0.45 4.19 4.21 -1.73 -3.16 115.58 119.66 3i1o h ASN 27 Ca 0.02 -0.48 0.09 0.00 1.21 0.00 0.00 56.30 57.14 3i1o h ASN 27 Cb 0.90 -0.21 -0.08 0.00 -1.12 0.00 0.00 38.32 37.80 3i1o h ASN 27 CO 0.07 1.25 -0.07 0.40 -1.29 0.00 0.00 177.43 177.79 3i1o h ILE 28 N 0.41 0.58 0.00 2.81 1.08 -0.63 -3.28 117.51 118.48 3i1o h ILE 28 Ca -0.05 -0.01 0.00 0.00 -0.39 0.00 0.00 64.86 64.41 3i1o h ILE 28 Cb 1.38 0.54 0.00 0.00 -3.07 0.00 0.00 36.82 35.67 3i1o h ILE 28 CO 0.15 0.01 0.00 -0.11 -0.69 0.00 0.00 178.15 177.50 3i1o n LEU 29 N -5.30 0.00 0.00 1.44 7.94 -1.10 -4.94 117.00 115.05 3i1o n LEU 29 Ca 0.04 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.94 3i1o n LEU 29 Cb 0.24 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.19 3i1o n LEU 29 CO 0.14 0.00 0.00 0.23 -1.11 0.00 0.00 177.39 176.65 3i1o n MET 30 N 0.00 0.00 0.00 1.96 2.81 -1.19 -5.06 117.12 115.63 3i1o n MET 30 Ca 0.00 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 3i1o n MET 30 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.51 3i1o n MET 30 CO 0.00 0.00 0.00 1.55 1.51 0.00 0.00 175.97 179.03 3i1o n VAL 31 N -0.40 0.00 -2.92 2.03 3.14 -1.26 -5.00 118.33 113.92 3i1o n VAL 31 Ca 0.00 0.00 -0.14 0.00 -2.96 0.00 0.00 64.34 61.24 3i1o n VAL 31 Cb 0.00 0.00 -0.01 0.00 -1.06 0.00 0.00 33.84 32.77 3i1o n VAL 31 CO 0.00 0.00 0.00 0.47 -6.46 0.00 0.00 176.83 170.84 3i1o n ASP 32 N 0.00 -2.69 -4.31 6.55 9.92 -1.26 -0.94 116.55 123.82 3i1o n ASP 32 Ca 0.00 -0.01 -0.38 0.00 -0.53 0.00 0.00 54.79 53.87 3i1o n ASP 32 Cb 0.00 -2.32 -0.06 0.00 -0.64 0.00 0.00 41.12 38.10 3i1o n ASP 32 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3i1o n GLY 33 N -0.83 -0.42 2.93 0.44 0.00 -1.26 -4.87 105.19 101.18 3i1o n GLY 33 Ca -0.03 0.08 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 3i1o n GLY 33 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3i1o n LYS 34 N -4.01 2.58 -2.51 1.61 5.02 -0.11 -5.02 118.16 115.72 3i1o n LYS 34 Ca 0.10 -4.53 -0.40 0.00 -2.02 0.00 0.00 58.31 51.47 3i1o n LYS 34 Cb 0.46 -2.36 -0.03 0.00 -0.02 0.00 0.00 35.03 33.08 3i1o n LYS 34 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 3i1o s LYS 35 N -1.72 3.42 0.01 1.97 2.20 -1.26 -3.68 119.74 120.67 3i1o s LYS 35 Ca 0.29 -0.87 0.00 0.00 -0.36 0.00 0.00 55.97 55.04 3i1o s LYS 35 Cb -0.02 -5.12 0.00 0.00 -1.51 0.00 0.00 37.83 31.19 3i1o s LYS 35 CO -0.10 -2.31 0.00 0.45 -0.36 0.00 0.00 175.35 173.03 3i1o n SER 36 N 9.47 -0.07 0.00 1.43 2.88 -1.26 -4.86 113.62 121.21 3i1o n SER 36 Ca 0.28 0.34 0.08 0.00 -1.33 0.00 0.00 58.87 58.24 3i1o n SER 36 Cb 0.50 0.39 0.38 0.00 -0.75 0.00 0.00 64.21 64.74 3i1o n SER 36 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 3i1o n THR 37 N -2.67 0.72 0.09 2.46 -1.04 -1.24 0.31 114.28 112.91 3i1o n THR 37 Ca 0.00 0.18 -0.17 0.00 -2.04 0.00 0.00 64.05 62.02 3i1o n THR 37 Cb 0.00 -0.90 -0.14 0.00 -1.82 0.00 0.00 70.33 67.47 3i1o n THR 37 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3i1o h ALA 38 N 2.66 0.15 -0.01 2.41 0.00 -1.90 -3.20 119.26 119.38 3i1o h ALA 38 Ca 0.00 -0.97 0.00 0.00 0.00 0.00 0.00 54.91 53.94 3i1o h ALA 38 Cb 0.24 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.14 3i1o h ALA 38 CO 0.00 1.02 -0.19 0.39 0.00 0.00 0.00 179.25 180.47 3i1o n GLU 39 N -3.51 0.96 0.18 0.00 1.02 -0.32 -3.19 120.64 115.78 3i1o n GLU 39 Ca -0.12 -0.53 0.12 0.00 -0.02 0.00 0.00 57.16 56.61 3i1o n GLU 39 Cb 1.04 -1.49 0.19 0.00 -0.02 0.00 0.00 31.44 31.15 3i1o n GLU 39 CO 0.00 0.00 0.00 0.77 1.18 0.00 0.00 177.13 179.08 3i1o h SER 40 N 1.29 0.00 -0.44 1.62 0.02 -0.14 -3.06 113.55 112.84 3i1o h SER 40 Ca 0.00 -0.01 -0.10 0.00 -0.84 0.00 0.00 61.79 60.84 3i1o h SER 40 Cb 0.48 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 62.96 3i1o h SER 40 CO 0.00 0.00 0.07 -0.38 -1.14 0.00 0.00 176.83 175.38 3i1o n ILE 41 N -2.89 2.57 -4.38 3.27 5.41 -1.19 -4.57 119.36 117.57 3i1o n ILE 41 Ca 0.04 -1.97 -0.21 0.00 1.00 0.00 0.00 62.75 61.60 3i1o n ILE 41 Cb 0.51 -0.30 -0.13 0.00 -0.71 0.00 0.00 39.64 39.01 3i1o n ILE 41 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 3i1o s VAL 42 N -2.97 1.26 0.00 1.39 1.01 -1.16 -3.95 120.40 115.98 3i1o s VAL 42 Ca 0.47 -1.11 0.00 0.00 0.00 0.00 0.00 61.98 61.35 3i1o s VAL 42 Cb 0.39 -1.13 0.00 0.00 0.00 0.00 0.00 36.38 35.63 3i1o s VAL 42 CO 0.09 0.01 0.00 -1.22 0.00 0.00 0.00 175.10 173.98 3i1o n TYR 43 N 1.77 0.00 0.00 5.22 0.53 -1.26 -4.54 117.16 118.88 3i1o n TYR 43 Ca -0.18 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.70 3i1o n TYR 43 Cb 0.54 -0.51 0.00 0.00 -1.03 0.00 0.00 39.34 38.34 3i1o n TYR 43 CO 0.00 0.00 0.00 0.45 -1.02 0.00 0.00 176.86 176.29 3i1o n SER 44 N 0.00 2.38 -0.86 7.72 2.88 -1.26 -4.54 113.62 119.93 3i1o n SER 44 Ca 0.00 0.00 0.10 0.00 -1.33 0.00 0.00 58.87 57.64 3i1o n SER 44 Cb 0.00 0.15 0.27 0.00 -0.75 0.00 0.00 64.21 63.88 3i1o n SER 44 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3i1o n ALA 45 N -1.61 2.45 0.14 -1.46 0.00 -1.25 -3.77 120.51 115.01 3i1o n ALA 45 Ca 0.00 -0.79 0.08 0.00 0.00 0.00 0.00 53.44 52.73 3i1o n ALA 45 Cb 0.26 -0.98 -0.12 0.00 0.00 0.00 0.00 19.45 18.61 3i1o n ALA 45 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 3i1o n LEU 46 N 0.89 0.15 -0.40 0.00 7.94 -1.26 -4.34 117.00 119.98 3i1o n LEU 46 Ca 0.17 -0.10 0.05 0.00 -1.11 0.00 0.00 56.01 55.02 3i1o n LEU 46 Cb 0.44 0.00 0.15 0.00 0.53 0.00 0.00 43.42 44.54 3i1o n LEU 46 CO 0.13 0.04 0.62 -0.62 -1.11 0.00 0.00 177.39 176.44 3i1o n GLU 47 N -1.94 1.51 -0.83 1.96 -0.58 -1.25 -3.57 120.64 115.93 3i1o n GLU 47 Ca -0.02 -0.79 0.05 0.00 -0.42 0.00 0.00 57.16 55.99 3i1o n GLU 47 Cb 0.40 -1.20 0.12 0.00 -0.57 0.00 0.00 31.44 30.19 3i1o n GLU 47 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 3i1o n THR 48 N 0.12 1.23 -0.66 2.62 -1.04 -1.26 -4.63 114.28 110.66 3i1o n THR 48 Ca 0.09 -2.09 0.00 0.00 -2.04 0.00 0.00 64.05 60.01 3i1o n THR 48 Cb 0.19 0.24 0.00 0.00 -1.82 0.00 0.00 70.33 68.95 3i1o n THR 48 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 3i1o n LEU 49 N -0.51 0.00 0.10 -4.42 -0.00 -1.23 -4.53 117.00 106.41 3i1o n LEU 49 Ca 0.13 0.00 -0.23 0.00 -0.00 0.00 0.00 56.01 55.91 3i1o n LEU 49 Cb 0.84 0.00 -0.14 0.00 -0.00 0.00 0.00 43.42 44.13 3i1o n LEU 49 CO -0.03 0.03 -0.09 0.00 -0.00 0.00 0.00 177.39 177.30 3i1o h ALA 50 N 0.00 -0.04 0.00 1.96 0.00 -1.82 -2.48 119.26 116.88 3i1o h ALA 50 Ca 0.00 -0.78 -0.19 0.00 0.00 0.00 0.00 54.91 53.94 3i1o h ALA 50 Cb 0.17 0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 3i1o h ALA 50 CO 0.00 0.67 -2.16 0.00 0.00 0.00 0.00 179.25 177.76 3i1o n GLN 51 N -3.80 0.67 0.00 0.00 10.64 -1.26 -3.14 117.38 120.49 3i1o n GLN 51 Ca -0.14 -0.09 0.00 0.00 -1.83 0.00 0.00 57.00 54.94 3i1o n GLN 51 Cb 0.99 -1.54 0.00 0.00 -0.86 0.00 0.00 30.24 28.84 3i1o n GLN 51 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.06 175.77 3i1o n ARG 52 N -2.53 0.00 -0.04 2.61 1.74 -1.26 -4.55 116.66 112.63 3i1o n ARG 52 Ca -0.18 0.00 0.08 0.00 -0.77 0.00 0.00 57.85 56.98 3i1o n ARG 52 Cb 0.87 0.00 0.40 0.00 -1.02 0.00 0.00 32.46 32.71 3i1o n ARG 52 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 3i1o n SER 53 N 0.00 0.69 -4.88 0.55 2.88 -1.26 -4.84 113.62 106.76 3i1o n SER 53 Ca 0.00 -1.62 -0.28 0.00 -1.33 0.00 0.00 58.87 55.63 3i1o n SER 53 Cb 0.00 -0.05 -0.04 0.00 -0.75 0.00 0.00 64.21 63.36 3i1o n SER 53 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 3i1o s GLY 54 N -1.47 1.92 -0.79 0.46 0.00 -0.93 -4.94 107.32 101.57 3i1o s GLY 54 Ca 0.26 -1.00 0.02 0.00 0.00 0.00 0.00 44.72 44.00 3i1o s GLY 54 CO 0.20 -0.99 0.71 0.28 0.00 0.00 0.00 173.10 173.30 3i1o n LYS 55 N -0.06 2.42 -0.48 2.90 4.01 -1.25 -4.25 118.16 121.44 3i1o n LYS 55 Ca -0.07 -4.53 0.07 0.00 -0.51 0.00 0.00 58.31 53.27 3i1o n LYS 55 Cb 0.53 -2.34 -0.02 0.00 -0.51 0.00 0.00 35.03 32.69 3i1o n LYS 55 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 3i1o n SER 56 N 1.84 -4.34 -0.90 4.39 2.88 -1.19 -4.56 113.62 111.74 3i1o n SER 56 Ca 0.23 0.52 0.08 0.00 -1.33 0.00 0.00 58.87 58.37 3i1o n SER 56 Cb 0.37 -1.45 0.26 0.00 -0.75 0.00 0.00 64.21 62.63 3i1o n SER 56 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 3i1o n GLU 57 N -2.15 2.89 0.00 -1.46 4.71 -1.26 -4.18 120.64 119.20 3i1o n GLU 57 Ca 0.00 -2.86 0.06 0.00 -0.01 0.00 0.00 57.16 54.36 3i1o n GLU 57 Cb 0.22 -1.85 0.39 0.00 -1.01 0.00 0.00 31.44 29.19 3i1o n GLU 57 CO 0.00 0.00 0.00 1.47 0.09 0.00 0.00 177.13 178.69 3i1o n LEU 58 N -0.53 0.00 0.00 -4.62 -0.00 -1.26 -4.13 117.00 106.46 3i1o n LEU 58 Ca 0.22 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.23 3i1o n LEU 58 Cb 0.90 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 44.32 3i1o n LEU 58 CO 0.16 0.00 0.00 -1.84 -0.00 0.00 0.00 177.39 175.71 3i1o n GLU 59 N -0.85 0.00 0.00 1.47 0.28 -1.26 -5.01 120.64 115.27 3i1o n GLU 59 Ca 0.10 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.10 3i1o n GLU 59 Cb 0.04 -0.01 0.00 0.00 1.43 0.00 0.00 31.44 32.91 3i1o n GLU 59 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3i1o n ALA 60 N -2.46 0.00 0.00 -1.84 0.00 -1.26 -4.18 120.51 110.78 3i1o n ALA 60 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3i1o n ALA 60 Cb 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 19.45 19.37 3i1o n ALA 60 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3i1o n PHE 61 N -1.43 0.00 0.17 0.00 0.99 -1.26 -4.89 117.46 111.03 3i1o n PHE 61 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 3i1o n PHE 61 Cb 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 38.48 3i1o n PHE 61 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.76 177.15 3i1o n GLU 62 N -1.44 0.14 0.01 -1.08 4.71 -1.26 -1.89 120.64 119.82 3i1o n GLU 62 Ca 0.00 0.00 -0.21 0.00 -0.01 0.00 0.00 57.16 56.94 3i1o n GLU 62 Cb 0.12 -1.05 -0.14 0.00 -1.01 0.00 0.00 31.44 29.36 3i1o n GLU 62 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 3i1o n VAL 63 N 0.21 1.79 0.01 2.62 0.31 -1.26 -4.01 118.33 118.00 3i1o n VAL 63 Ca 0.00 -0.66 0.10 0.00 -0.01 0.00 0.00 64.34 63.77 3i1o n VAL 63 Cb 0.03 -1.74 0.28 0.00 -0.91 0.00 0.00 33.84 31.49 3i1o n VAL 63 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3i1o n ALA 64 N -2.99 2.44 -0.13 3.52 0.00 -0.79 -3.09 120.51 119.47 3i1o n ALA 64 Ca -0.32 -1.10 -0.19 0.00 0.00 0.00 0.00 53.44 51.83 3i1o n ALA 64 Cb 1.05 -0.96 -0.12 0.00 0.00 0.00 0.00 19.45 19.42 3i1o n ALA 64 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 3i1o n LEU 65 N 1.29 2.93 -0.00 0.00 0.00 -1.24 -2.07 117.00 117.90 3i1o n LEU 65 Ca 0.21 -0.11 0.14 0.00 0.00 0.00 0.00 56.01 56.25 3i1o n LEU 65 Cb 0.54 -0.91 0.67 0.00 0.00 0.00 0.00 43.42 43.71 3i1o n LEU 65 CO 0.15 0.92 0.98 -0.62 0.00 0.00 0.00 177.39 178.82 3i1o n GLU 66 N -3.30 0.17 -0.02 1.96 4.71 -1.26 -3.42 120.64 119.47 3i1o n GLU 66 Ca -0.46 -0.00 -0.03 0.00 -0.01 0.00 0.00 57.16 56.65 3i1o n GLU 66 Cb 0.99 -1.50 -0.01 0.00 -1.01 0.00 0.00 31.44 29.91 3i1o n GLU 66 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 3i1o n ASN 67 N -1.41 0.98 -2.42 1.62 5.03 -1.18 -4.63 115.26 113.24 3i1o n ASN 67 Ca 0.10 0.16 -0.17 0.00 0.87 0.00 0.00 54.58 55.53 3i1o n ASN 67 Cb 0.30 -0.49 -0.11 0.00 -1.02 0.00 0.00 39.78 38.46 3i1o n ASN 67 CO 0.00 0.00 0.00 0.52 -1.83 0.00 0.00 177.26 175.95 3i1o n VAL 68 N -3.46 2.88 -2.78 2.41 0.31 -0.88 -4.89 118.33 111.92 3i1o n VAL 68 Ca -0.05 -1.54 -0.43 0.00 -0.01 0.00 0.00 64.34 62.30 3i1o n VAL 68 Cb 0.20 -2.08 -0.04 0.00 -0.91 0.00 0.00 33.84 31.01 3i1o n VAL 68 CO 0.00 0.00 0.00 -0.60 -1.32 0.00 0.00 176.83 174.91 3i1o s ARG 69 N 1.68 3.51 -1.09 5.55 6.06 -1.22 -4.72 118.95 128.72 3i1o s ARG 69 Ca 0.58 0.13 -0.23 0.00 -2.50 0.00 0.00 55.73 53.71 3i1o s ARG 69 Cb 0.24 -3.96 -0.03 0.00 0.06 0.00 0.00 34.95 31.26 3i1o s ARG 69 CO -0.01 -1.33 1.84 -2.14 -2.50 0.00 0.00 175.30 171.16 3i1o s PRO 70 N 3.97 2.89 -0.13 5.12 0.02 -1.26 -4.55 135.00 141.06 3i1o s PRO 70 Ca 0.37 -1.00 0.08 0.00 0.02 0.00 0.00 61.00 60.48 3i1o s PRO 70 Cb -0.10 -5.25 -0.14 0.00 0.02 0.00 0.00 34.50 29.04 3i1o s PRO 70 CO 0.26 -3.28 -0.01 -2.37 -0.33 0.00 0.00 177.00 171.27 3i1o n THR 71 N 7.49 0.86 -4.03 0.99 5.66 -1.26 -4.15 114.28 119.84 3i1o n THR 71 Ca 0.42 -0.47 -0.31 0.00 -3.05 0.00 0.00 64.05 60.65 3i1o n THR 71 Cb 0.47 -0.79 -0.16 0.00 -1.55 0.00 0.00 70.33 68.30 3i1o n THR 71 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 3i1o s VAL 72 N -2.30 1.67 -0.12 1.08 1.01 -1.26 -4.01 120.40 116.46 3i1o s VAL 72 Ca -0.10 -0.80 -0.05 0.00 0.00 0.00 0.00 61.98 61.03 3i1o s VAL 72 Cb 0.04 -1.61 -0.04 0.00 0.00 0.00 0.00 36.38 34.77 3i1o s VAL 72 CO 0.46 0.38 0.05 -0.70 0.00 0.00 0.00 175.10 175.29 3i1o s GLU 73 N 1.43 3.42 0.77 2.72 2.12 -0.88 -4.71 118.70 123.57 3i1o s GLU 73 Ca 0.03 -0.32 -0.11 0.00 0.36 0.00 0.00 54.97 54.93 3i1o s GLU 73 Cb -0.14 -3.02 0.06 0.00 0.26 0.00 0.00 34.13 31.28 3i1o s GLU 73 CO -0.10 0.59 1.08 0.14 -0.54 0.00 0.00 175.26 176.43 3i1o s VAL 74 N -0.52 3.39 0.11 3.70 -7.23 -1.26 -2.03 120.40 116.55 3i1o s VAL 74 Ca 0.10 0.45 -0.19 0.00 -1.81 0.00 0.00 61.98 60.54 3i1o s VAL 74 Cb -0.12 -3.05 0.04 0.00 0.56 0.00 0.00 36.38 33.82 3i1o s VAL 74 CO 0.02 -0.59 0.46 -0.75 -0.31 0.00 0.00 175.10 173.93 3i1o s LYS 75 N -4.99 1.09 -0.19 4.82 2.47 -1.26 -4.70 119.74 116.98 3i1o s LYS 75 Ca 0.61 -0.55 -0.03 0.00 -1.56 0.00 0.00 55.97 54.44 3i1o s LYS 75 Cb -0.16 0.49 0.06 0.00 -1.46 0.00 0.00 37.83 36.76 3i1o s LYS 75 CO 0.56 -0.43 0.04 -1.54 0.16 0.00 0.00 175.35 174.14 3i1o s SER 76 N -2.57 2.82 -0.20 1.43 1.04 -1.26 -2.66 113.70 112.30 3i1o s SER 76 Ca 0.00 -0.78 -0.04 0.00 0.48 0.00 0.00 55.95 55.61 3i1o s SER 76 Cb 0.01 -0.56 0.09 0.00 0.10 0.00 0.00 66.02 65.66 3i1o s SER 76 CO -0.09 -0.31 0.23 -0.13 0.98 0.00 0.00 173.24 173.92 3i1o s ARG 77 N 1.89 0.19 0.01 4.02 1.81 -0.85 -4.85 118.95 121.17 3i1o s ARG 77 Ca -0.01 0.23 -0.03 0.00 -1.72 0.00 0.00 55.73 54.20 3i1o s ARG 77 Cb -0.17 -1.15 -0.04 0.00 -0.45 0.00 0.00 34.95 33.14 3i1o s ARG 77 CO -0.08 -0.64 0.21 0.50 -0.68 0.00 0.00 175.30 174.61 3i1o s ARG 78 N 2.34 3.48 -0.42 3.54 3.00 -1.25 -4.47 118.95 125.17 3i1o s ARG 78 Ca 0.07 -0.27 0.02 0.00 -1.00 0.00 0.00 55.73 54.55 3i1o s ARG 78 Cb -0.16 -3.08 0.15 0.00 0.00 0.00 0.00 34.95 31.87 3i1o s ARG 78 CO -0.12 0.65 0.26 0.14 0.00 0.00 0.00 175.30 176.24 3i1o s VAL 79 N -1.35 0.80 0.00 7.11 -7.23 -1.26 -4.90 120.40 113.57 3i1o s VAL 79 Ca 0.29 -2.35 0.00 0.00 -1.81 0.00 0.00 61.98 58.10 3i1o s VAL 79 Cb -0.13 -1.56 0.00 0.00 0.56 0.00 0.00 36.38 35.25 3i1o s VAL 79 CO 0.19 -1.01 0.00 0.61 -0.31 0.00 0.00 175.10 174.59 3i1o n GLY 80 N 3.50 0.85 3.02 2.32 0.00 -1.26 -4.63 105.19 109.00 3i1o n GLY 80 Ca 0.15 -0.80 -0.22 0.00 0.00 0.00 0.00 46.02 45.14 3i1o n GLY 80 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i1o n GLY 81 N 0.00 -0.52 3.96 -0.02 0.00 -1.26 -4.99 105.19 102.37 3i1o n GLY 81 Ca 0.00 0.13 -0.22 0.00 0.00 0.00 0.00 46.02 45.93 3i1o n GLY 81 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3i1o s SER 82 N -2.69 6.32 -0.58 1.61 0.01 -1.26 -5.01 113.70 112.11 3i1o s SER 82 Ca 0.30 0.09 0.00 0.00 1.31 0.00 0.00 55.95 57.66 3i1o s SER 82 Cb -0.13 -1.87 0.54 0.00 0.21 0.00 0.00 66.02 64.76 3i1o s SER 82 CO 0.37 -0.04 1.99 0.35 0.41 0.00 0.00 173.24 176.32 3i1o n THR 83 N -1.23 3.45 -2.08 1.44 -2.24 -1.26 -4.74 114.28 107.62 3i1o n THR 83 Ca -0.09 -2.50 -0.41 0.00 -2.27 0.00 0.00 64.05 58.78 3i1o n THR 83 Cb 0.56 -0.88 -0.03 0.00 -2.10 0.00 0.00 70.33 67.89 3i1o n THR 83 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 3i1o s TYR 84 N -3.59 3.11 -0.56 4.78 4.12 -1.26 -4.98 117.35 118.96 3i1o s TYR 84 Ca 0.61 1.05 0.05 0.00 0.02 0.00 0.00 57.07 58.81 3i1o s TYR 84 Cb 0.49 -3.76 0.20 0.00 -1.52 0.00 0.00 41.96 37.38 3i1o s TYR 84 CO 0.04 -2.48 0.50 1.04 0.02 0.00 0.00 175.55 174.68 3i1o n GLN 85 N 2.64 1.31 -3.22 -0.62 1.13 -1.26 -2.01 117.38 115.35 3i1o n GLN 85 Ca 0.07 -3.94 -0.41 0.00 -1.94 0.00 0.00 57.00 50.78 3i1o n GLN 85 Cb 0.41 -1.94 -0.08 0.00 0.11 0.00 0.00 30.24 28.75 3i1o n GLN 85 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 3i1o s VAL 86 N -1.17 4.99 0.64 5.09 1.01 -1.09 -4.75 120.40 125.13 3i1o s VAL 86 Ca 0.32 0.42 -0.18 0.00 0.00 0.00 0.00 61.98 62.53 3i1o s VAL 86 Cb 0.05 -3.98 -0.02 0.00 0.00 0.00 0.00 36.38 32.44 3i1o s VAL 86 CO -0.14 -0.22 1.26 -0.81 0.00 0.00 0.00 175.10 175.19 3i1o n PRO 87 N 5.79 1.12 -0.80 2.72 -0.04 -1.26 -4.33 135.00 138.20 3i1o n PRO 87 Ca -0.04 0.44 0.00 0.00 -0.04 0.00 0.00 63.50 63.86 3i1o n PRO 87 Cb 0.49 -2.50 0.00 0.00 -0.04 0.00 0.00 33.50 31.45 3i1o n PRO 87 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 3i1o n VAL 88 N -1.85 0.00 -2.05 0.52 3.14 -0.86 -4.91 118.33 112.32 3i1o n VAL 88 Ca 0.15 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.53 3i1o n VAL 88 Cb 0.48 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.26 3i1o n VAL 88 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 3i1o n GLU 89 N 0.00 2.24 -3.93 1.45 4.71 -1.26 -2.07 120.64 121.79 3i1o n GLU 89 Ca 0.00 0.00 -0.10 0.00 -0.01 0.00 0.00 57.16 57.05 3i1o n GLU 89 Cb 0.00 0.00 -0.02 0.00 -1.01 0.00 0.00 31.44 30.41 3i1o n GLU 89 CO 0.00 0.00 0.00 0.14 0.09 0.00 0.00 177.13 177.36 3i1o s VAL 90 N 1.49 0.00 0.34 2.62 -7.23 -1.26 -4.23 120.40 112.12 3i1o s VAL 90 Ca 0.00 -1.23 0.09 0.00 -1.81 0.00 0.00 61.98 59.03 3i1o s VAL 90 Cb 0.00 -2.47 -0.05 0.00 0.56 0.00 0.00 36.38 34.42 3i1o s VAL 90 CO 0.00 0.00 0.02 -0.60 -0.31 0.00 0.00 175.10 174.21 3i1o s ARG 91 N -3.26 2.10 0.30 4.82 3.52 -1.26 -4.93 118.95 120.24 3i1o s ARG 91 Ca 0.20 -1.72 0.19 0.00 -0.13 0.00 0.00 55.73 54.27 3i1o s ARG 91 Cb -0.03 -1.96 1.04 0.00 -1.56 0.00 0.00 34.95 32.45 3i1o s ARG 91 CO 0.12 0.15 1.16 -2.30 -0.81 0.00 0.00 175.30 173.62 3i1o n PRO 92 N -0.96 -0.04 0.00 5.12 -0.02 -1.26 -0.97 135.00 136.87 3i1o n PRO 92 Ca -0.04 0.98 0.00 0.00 -2.02 0.00 0.00 63.50 62.42 3i1o n PRO 92 Cb 0.62 -1.83 0.00 0.00 -0.02 0.00 0.00 33.50 32.27 3i1o n PRO 92 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3i1o n VAL 93 N -4.46 0.00 0.11 -1.45 0.31 -1.26 -1.59 118.33 109.99 3i1o n VAL 93 Ca 0.29 1.49 -0.04 0.00 -0.01 0.00 0.00 64.34 66.07 3i1o n VAL 93 Cb 1.04 -2.08 0.13 0.00 -0.91 0.00 0.00 33.84 32.02 3i1o n VAL 93 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 3i1o h ARG 94 N 0.00 0.12 -0.35 5.55 3.08 -1.68 -0.25 114.38 120.85 3i1o h ARG 94 Ca 0.00 -0.09 0.10 0.00 0.07 0.00 0.00 59.98 60.06 3i1o h ARG 94 Cb 0.00 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 3i1o h ARG 94 CO 0.00 0.72 0.61 0.00 -1.07 0.00 0.00 179.97 180.22 3i1o h ARG 95 N 0.09 0.00 0.00 0.04 2.47 -0.57 -1.83 114.38 114.57 3i1o h ARG 95 Ca -0.01 0.00 -0.05 0.00 -1.26 0.00 0.00 59.98 58.67 3i1o h ARG 95 Cb 1.14 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.46 3i1o h ARG 95 CO 0.09 0.00 -0.72 0.09 0.56 0.00 0.00 179.97 179.99 3i1o n ASN 96 N -3.25 0.91 0.00 7.04 3.02 -0.62 -4.22 115.26 118.14 3i1o n ASN 96 Ca 0.06 0.13 0.06 0.00 -0.03 0.00 0.00 54.58 54.81 3i1o n ASN 96 Cb 0.75 -0.32 0.31 0.00 -0.61 0.00 0.00 39.78 39.91 3i1o n ASN 96 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3i1o n ALA 97 N -3.51 1.72 -0.02 5.41 0.00 -0.12 -2.59 120.51 121.40 3i1o n ALA 97 Ca -0.07 -0.06 -0.16 0.00 0.00 0.00 0.00 53.44 53.15 3i1o n ALA 97 Cb 0.32 -1.20 -0.12 0.00 0.00 0.00 0.00 19.45 18.45 3i1o n ALA 97 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3i1o h LEU 98 N 0.00 0.28 0.00 0.00 3.38 -1.55 -3.37 115.31 114.05 3i1o h LEU 98 Ca 0.00 -0.80 0.00 0.00 0.09 0.00 0.00 57.88 57.17 3i1o h LEU 98 Cb 0.13 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.80 3i1o h LEU 98 CO 0.00 1.04 0.00 0.00 0.09 0.00 0.00 178.44 179.57 3i1o n ALA 99 N -2.56 0.00 0.19 1.53 0.00 -1.07 -0.80 120.51 117.81 3i1o n ALA 99 Ca -0.10 0.00 0.18 0.00 0.00 0.00 0.00 53.44 53.52 3i1o n ALA 99 Cb 0.55 0.34 0.80 0.00 0.00 0.00 0.00 19.45 21.14 3i1o n ALA 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3i1o h MET 100 N 0.00 0.00 0.00 0.00 -0.00 -1.78 -1.50 114.93 111.64 3i1o h MET 100 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 3i1o h MET 100 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.60 3i1o h MET 100 CO 0.00 0.00 0.00 -2.13 -0.00 0.00 0.00 176.91 174.78 3i1o n ARG 101 N -3.49 0.13 0.00 -0.10 3.00 0.02 -1.72 116.66 114.51 3i1o n ARG 101 Ca 0.03 0.61 0.00 0.00 -0.00 0.00 0.00 57.85 58.49 3i1o n ARG 101 Cb 0.47 -1.92 0.00 0.00 0.00 0.00 0.00 32.46 31.01 3i1o n ARG 101 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.63 178.54 3i1o n TRP 102 N -2.20 0.00 0.35 -0.14 8.01 -0.58 -4.68 117.44 118.20 3i1o n TRP 102 Ca -0.01 0.00 0.08 0.00 -1.31 0.00 0.00 57.50 56.26 3i1o n TRP 102 Cb 0.05 0.00 0.35 0.00 -2.01 0.00 0.00 31.31 29.70 3i1o n TRP 102 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.69 175.79 3i1o n ILE 103 N -0.19 1.10 1.20 -0.99 5.41 -0.70 -0.75 119.36 124.45 3i1o n ILE 103 Ca 0.00 0.34 0.13 0.00 1.00 0.00 0.00 62.75 64.21 3i1o n ILE 103 Cb 0.08 -1.21 0.26 0.00 -0.71 0.00 0.00 39.64 38.05 3i1o n ILE 103 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 176.55 177.88 3i1o n VAL 104 N -1.82 0.00 -0.13 1.39 0.24 -1.24 -3.81 118.33 112.96 3i1o n VAL 104 Ca 0.02 -0.31 -0.12 0.00 -2.04 0.00 0.00 64.34 61.88 3i1o n VAL 104 Cb 0.15 0.95 -0.02 0.00 -1.47 0.00 0.00 33.84 33.46 3i1o n VAL 104 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 3i1o h GLU 105 N 2.95 0.91 -0.27 7.34 4.57 -1.25 -3.14 114.58 125.69 3i1o h GLU 105 Ca 0.00 -0.42 -0.08 0.00 -1.18 0.00 0.00 59.36 57.68 3i1o h GLU 105 Cb 0.71 -0.01 -0.05 0.00 -0.16 0.00 0.00 28.75 29.25 3i1o h GLU 105 CO 0.00 1.08 -0.04 0.00 -1.18 0.00 0.00 179.01 178.87 3i1o n ALA 106 N -2.51 3.49 -1.15 2.92 0.00 -1.26 -4.33 120.51 117.66 3i1o n ALA 106 Ca -0.01 -2.71 0.00 0.00 0.00 0.00 0.00 53.44 50.72 3i1o n ALA 106 Cb 0.47 -0.69 0.00 0.00 0.00 0.00 0.00 19.45 19.23 3i1o n ALA 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3i1o n ALA 107 N -0.88 0.00 0.28 0.00 0.00 -1.19 -4.46 120.51 114.27 3i1o n ALA 107 Ca 0.26 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.83 3i1o n ALA 107 Cb 0.93 0.00 0.62 0.00 0.00 0.00 0.00 19.45 21.00 3i1o n ALA 107 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3i1o h ARG 108 N 0.00 0.00 -2.98 0.00 3.08 -1.83 -3.31 114.38 109.35 3i1o h ARG 108 Ca 0.00 0.00 -0.77 0.00 0.07 0.00 0.00 59.98 59.28 3i1o h ARG 108 Cb 0.00 0.00 -0.19 0.00 0.08 0.00 0.00 29.97 29.86 3i1o h ARG 108 CO 0.00 0.00 1.72 1.63 -1.07 0.00 0.00 179.97 182.25 3i1o n LYS 109 N -2.40 4.30 -0.64 0.04 5.02 -1.26 -4.88 118.16 118.34 3i1o n LYS 109 Ca -0.00 -3.89 0.00 0.00 -2.02 0.00 0.00 58.31 52.40 3i1o n LYS 109 Cb 0.13 -2.70 0.00 0.00 -0.02 0.00 0.00 35.03 32.45 3i1o n LYS 109 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 3i1o n ARG 110 N 2.23 0.00 -0.01 1.97 3.00 -1.24 -4.68 116.66 117.93 3i1o n ARG 110 Ca 0.43 0.00 0.10 0.00 -0.00 0.00 0.00 57.85 58.38 3i1o n ARG 110 Cb 0.31 0.00 -0.14 0.00 0.00 0.00 0.00 32.46 32.63 3i1o n ARG 110 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3i1o n GLY 111 N 0.00 -0.87 3.47 5.14 0.00 -1.26 -5.02 105.19 106.66 3i1o n GLY 111 Ca 0.00 -0.46 -0.39 0.00 0.00 0.00 0.00 46.02 45.16 3i1o n GLY 111 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3i1o n ASP 112 N -2.09 -0.85 0.00 1.61 9.92 -1.26 -4.97 116.55 118.91 3i1o n ASP 112 Ca -0.03 0.80 0.00 0.00 -0.53 0.00 0.00 54.79 55.03 3i1o n ASP 112 Cb 0.48 -1.17 0.00 0.00 -0.64 0.00 0.00 41.12 39.79 3i1o n ASP 112 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 3i1o n LYS 113 N 0.13 0.00 -1.97 -1.24 5.02 -1.26 -4.70 118.16 114.14 3i1o n LYS 113 Ca 0.11 0.00 -0.29 0.00 -2.02 0.00 0.00 58.31 56.11 3i1o n LYS 113 Cb 0.45 -0.43 0.14 0.00 -0.02 0.00 0.00 35.03 35.17 3i1o n LYS 113 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 3i1o s SER 114 N -1.65 3.78 0.00 4.39 0.01 -1.26 -4.84 113.70 114.13 3i1o s SER 114 Ca 0.00 0.43 0.26 0.00 1.31 0.00 0.00 55.95 57.95 3i1o s SER 114 Cb 0.00 -0.69 1.27 0.00 0.21 0.00 0.00 66.02 66.81 3i1o s SER 114 CO 0.00 -2.33 1.86 0.80 0.41 0.00 0.00 173.24 173.98 3i1o n MET 115 N -3.51 0.33 -0.04 12.44 1.56 -1.26 -1.32 117.12 125.32 3i1o n MET 115 Ca 0.12 0.05 0.11 0.00 -0.27 0.00 0.00 57.70 57.71 3i1o n MET 115 Cb 0.60 -1.50 0.49 0.00 2.15 0.00 0.00 33.22 34.96 3i1o n MET 115 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 3i1o n ALA 116 N -1.31 2.57 0.00 -5.12 0.00 -1.26 -3.20 120.51 112.18 3i1o n ALA 116 Ca 0.11 -0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.19 3i1o n ALA 116 Cb 0.21 -1.19 0.00 0.00 0.00 0.00 0.00 19.45 18.47 3i1o n ALA 116 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3i1o n LEU 117 N -0.13 0.44 -0.06 0.00 4.32 -0.44 -2.25 117.00 118.90 3i1o n LEU 117 Ca 0.16 0.00 -0.12 0.00 -0.02 0.00 0.00 56.01 56.04 3i1o n LEU 117 Cb 0.24 0.00 -0.06 0.00 -1.62 0.00 0.00 43.42 41.98 3i1o n LEU 117 CO 0.13 0.07 0.75 0.03 -1.22 0.00 0.00 177.39 177.16 3i1o h ARG 118 N 0.00 0.31 0.00 3.23 3.08 -1.37 -3.29 114.38 116.34 3i1o h ARG 118 Ca 0.00 -0.10 -0.06 0.00 0.07 0.00 0.00 59.98 59.89 3i1o h ARG 118 Cb 0.77 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.78 3i1o h ARG 118 CO 0.00 0.52 -1.22 -0.11 -1.07 0.00 0.00 179.97 178.09 3i1o n LEU 119 N -4.72 1.89 0.43 3.04 0.00 -1.21 -4.28 117.00 112.15 3i1o n LEU 119 Ca -0.05 0.01 -0.20 0.00 0.00 0.00 0.00 56.01 55.77 3i1o n LEU 119 Cb 0.22 -0.13 -0.10 0.00 0.00 0.00 0.00 43.42 43.41 3i1o n LEU 119 CO 0.36 0.37 0.55 0.00 0.00 0.00 0.00 177.39 178.67 3i1o h ALA 120 N -0.06 -1.23 0.00 1.96 0.00 -1.73 0.87 119.26 119.08 3i1o h ALA 120 Ca -0.09 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.57 3i1o h ALA 120 Cb 1.12 0.58 0.00 0.00 0.00 0.00 0.00 17.79 19.49 3i1o h ALA 120 CO -0.03 -1.21 0.00 0.09 0.00 0.00 0.00 179.25 178.10 3i1o n ASN 121 N -5.62 0.23 -0.00 0.00 3.02 -0.95 -2.09 115.26 109.85 3i1o n ASN 121 Ca -0.15 -1.62 0.01 0.00 -0.03 0.00 0.00 54.58 52.79 3i1o n ASN 121 Cb 0.49 -0.12 -0.01 0.00 -0.61 0.00 0.00 39.78 39.53 3i1o n ASN 121 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 3i1o n GLU 122 N -0.33 3.76 0.00 3.52 0.00 -0.56 -4.55 120.64 122.48 3i1o n GLU 122 Ca 0.00 -0.01 0.03 0.00 0.00 0.00 0.00 57.16 57.19 3i1o n GLU 122 Cb 0.06 -0.78 0.18 0.00 0.00 0.00 0.00 31.44 30.90 3i1o n GLU 122 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 3i1o n LEU 123 N -1.26 0.00 0.11 4.31 7.99 0.29 -0.76 117.00 127.68 3i1o n LEU 123 Ca 0.00 0.20 -0.03 0.00 -0.01 0.00 0.00 56.01 56.17 3i1o n LEU 123 Cb 0.04 -0.20 0.16 0.00 -0.11 0.00 0.00 43.42 43.31 3i1o n LEU 123 CO 0.04 -0.16 0.52 0.77 -1.51 0.00 0.00 177.39 177.05 3i1o h SER 124 N 0.00 0.16 0.01 -1.43 4.64 -1.80 -2.58 113.55 112.55 3i1o h SER 124 Ca 0.00 -0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.23 3i1o h SER 124 Cb 0.04 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3i1o h SER 124 CO 0.00 0.70 0.00 0.47 -0.87 0.00 0.00 176.83 177.13 3i1o n ASP 125 N -3.88 0.00 -0.00 4.97 10.43 0.06 -0.85 116.55 127.28 3i1o n ASP 125 Ca -0.02 -0.08 -0.11 0.00 2.57 0.00 0.00 54.79 57.16 3i1o n ASP 125 Cb 0.59 -0.03 -0.09 0.00 1.84 0.00 0.00 41.12 43.43 3i1o n ASP 125 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3i1o h ALA 126 N 2.23 -0.10 0.18 2.24 0.00 -1.63 -2.54 119.26 119.63 3i1o h ALA 126 Ca 0.00 -0.28 -0.32 0.00 0.00 0.00 0.00 54.91 54.31 3i1o h ALA 126 Cb 0.00 0.04 0.01 0.00 0.00 0.00 0.00 17.79 17.85 3i1o h ALA 126 CO 0.00 -0.17 -1.53 0.00 0.00 0.00 0.00 179.25 177.55 3i1o h ALA 127 N -0.20 0.07 0.08 0.00 0.00 -1.37 -3.39 119.26 114.46 3i1o h ALA 127 Ca -0.01 -1.03 -0.27 0.00 0.00 0.00 0.00 54.91 53.60 3i1o h ALA 127 Cb 0.60 0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 3i1o h ALA 127 CO 0.02 0.85 -1.33 1.05 0.00 0.00 0.00 179.25 179.84 3i1o h GLU 128 N -0.03 0.18 0.00 0.00 4.11 -1.19 -3.47 114.58 114.17 3i1o h GLU 128 Ca -0.30 -0.31 0.00 0.00 0.07 0.00 0.00 59.36 58.82 3i1o h GLU 128 Cb 1.99 0.11 0.00 0.00 0.50 0.00 0.00 28.75 31.35 3i1o h GLU 128 CO 0.17 1.07 0.00 0.09 0.07 0.00 0.00 179.01 180.41 3i1o n ASN 129 N -3.42 -0.50 -4.56 3.06 3.02 -0.96 -4.90 115.26 107.00 3i1o n ASN 129 Ca -0.10 0.00 -0.21 0.00 -0.03 0.00 0.00 54.58 54.24 3i1o n ASN 129 Cb 1.01 -1.67 -0.06 0.00 -0.61 0.00 0.00 39.78 38.46 3i1o n ASN 129 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3i1o s LYS 130 N -0.70 1.98 0.00 3.52 -0.14 -1.26 -4.65 119.74 118.49 3i1o s LYS 130 Ca 0.00 0.33 0.00 0.00 -1.36 0.00 0.00 55.97 54.94 3i1o s LYS 130 Cb 0.00 -4.83 0.00 0.00 -1.68 0.00 0.00 37.83 31.32 3i1o s LYS 130 CO 0.00 -3.95 0.00 0.41 -0.76 0.00 0.00 175.35 171.05 3i1o n GLY 131 N 6.71 -0.70 3.60 -3.33 0.00 -1.26 -4.83 105.19 105.37 3i1o n GLY 131 Ca 0.43 -2.24 -0.43 0.00 0.00 0.00 0.00 46.02 43.77 3i1o n GLY 131 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3i1o s THR 132 N -0.55 3.94 0.00 2.61 2.01 -1.26 -4.38 115.64 118.01 3i1o s THR 132 Ca 0.00 0.95 0.00 0.00 0.31 0.00 0.00 61.69 62.95 3i1o s THR 132 Cb 0.00 -4.25 0.00 0.00 0.01 0.00 0.00 72.50 68.26 3i1o s THR 132 CO 0.00 -0.79 0.00 0.00 -0.69 0.00 0.00 174.62 173.14 3i1o n ALA 133 N 8.72 0.05 -1.32 7.40 0.00 -1.26 -4.65 120.51 129.45 3i1o n ALA 133 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.60 3i1o n ALA 133 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.93 3i1o n ALA 133 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 3i1o n VAL 134 N 0.00 0.00 0.35 0.00 0.24 -1.26 -4.93 118.33 112.73 3i1o n VAL 134 Ca 0.00 0.00 -0.17 0.00 -2.04 0.00 0.00 64.34 62.13 3i1o n VAL 134 Cb 0.14 0.98 -0.09 0.00 -1.47 0.00 0.00 33.84 33.40 3i1o n VAL 134 CO 0.00 0.00 0.00 0.50 -2.14 0.00 0.00 176.83 175.19 3i1o h LYS 135 N 0.00 -0.83 -0.62 7.34 3.64 -1.92 -1.77 116.57 122.40 3i1o h LYS 135 Ca 0.00 0.06 0.01 0.00 -1.27 0.00 0.00 60.65 59.45 3i1o h LYS 135 Cb 0.78 0.19 -0.03 0.00 -0.41 0.00 0.00 32.23 32.75 3i1o h LYS 135 CO 0.00 -0.54 0.41 -0.22 -2.27 0.00 0.00 179.45 176.83 3i1o h LYS 136 N -0.92 0.80 -0.22 1.90 1.63 -1.94 0.30 116.57 118.12 3i1o h LYS 136 Ca -0.09 -0.05 -0.01 0.00 -0.85 0.00 0.00 60.65 59.66 3i1o h LYS 136 Cb 0.68 -0.18 -0.01 0.00 -0.60 0.00 0.00 32.23 32.12 3i1o h LYS 136 CO 0.14 0.53 0.12 -0.09 -3.45 0.00 0.00 179.45 176.70 3i1o h ARG 137 N 0.82 0.31 0.00 1.90 1.12 -1.92 -2.26 114.38 114.34 3i1o h ARG 137 Ca 0.24 -0.04 0.00 0.00 -1.11 0.00 0.00 59.98 59.07 3i1o h ARG 137 Cb -0.06 -0.06 0.00 0.00 -0.01 0.00 0.00 29.97 29.84 3i1o h ARG 137 CO -0.07 0.29 0.00 0.93 -3.11 0.00 0.00 179.97 178.02 3i1o h GLU 138 N 0.24 0.00 -0.42 0.20 4.39 -1.12 -2.60 114.58 115.28 3i1o h GLU 138 Ca 0.08 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.78 3i1o h GLU 138 Cb 0.08 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.73 3i1o h GLU 138 CO -0.01 0.00 0.00 -3.47 -1.16 0.00 0.00 179.01 174.37 3i1o n ASP 139 N -2.49 1.38 -0.05 1.42 -0.08 0.10 -2.99 116.55 113.85 3i1o n ASP 139 Ca 0.03 -2.08 -0.02 0.00 -1.51 0.00 0.00 54.79 51.21 3i1o n ASP 139 Cb 0.36 -0.26 -0.10 0.00 2.34 0.00 0.00 41.12 43.45 3i1o n ASP 139 CO 0.00 0.00 0.00 0.52 0.12 0.00 0.00 177.20 177.84 3i1o n VAL 140 N 0.08 0.63 1.33 5.18 0.31 -0.98 -4.09 118.33 120.78 3i1o n VAL 140 Ca 0.06 -0.48 0.00 0.00 -0.01 0.00 0.00 64.34 63.91 3i1o n VAL 140 Cb 0.26 -0.41 0.00 0.00 -0.91 0.00 0.00 33.84 32.78 3i1o n VAL 140 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 3i1o n HIS 141 N -2.33 0.00 -0.05 3.52 8.25 -1.16 -1.81 115.22 121.64 3i1o n HIS 141 Ca -0.16 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.20 3i1o n HIS 141 Cb 0.76 -0.02 -0.03 0.00 1.12 0.00 0.00 29.99 31.82 3i1o n HIS 141 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 3i1o n ARG 142 N -0.35 0.28 0.00 -0.41 5.12 -1.26 -4.20 116.66 115.85 3i1o n ARG 142 Ca 0.00 0.12 0.13 0.00 -1.93 0.00 0.00 57.85 56.17 3i1o n ARG 142 Cb 0.05 -0.98 0.69 0.00 -1.16 0.00 0.00 32.46 31.06 3i1o n ARG 142 CO 0.00 0.00 0.00 -1.33 -1.93 0.00 0.00 177.63 174.37 3i1o n MET 143 N -3.78 0.40 0.00 5.56 2.81 -1.22 -1.69 117.12 119.20 3i1o n MET 143 Ca -0.18 0.03 0.00 0.00 -1.81 0.00 0.00 57.70 55.74 3i1o n MET 143 Cb 0.49 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.50 3i1o n MET 143 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3i1o n ALA 144 N -1.28 0.00 0.05 3.04 0.00 -0.75 -4.26 120.51 117.31 3i1o n ALA 144 Ca 0.13 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.52 3i1o n ALA 144 Cb 0.21 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.64 3i1o n ALA 144 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 3i1o h GLU 145 N 0.00 -0.23 -1.04 0.00 4.57 -1.75 -3.04 114.58 113.09 3i1o h GLU 145 Ca 0.00 0.02 0.27 0.00 -1.18 0.00 0.00 59.36 58.47 3i1o h GLU 145 Cb 0.00 0.05 -0.08 0.00 -0.16 0.00 0.00 28.75 28.56 3i1o h GLU 145 CO 0.00 -0.15 0.69 0.00 -1.18 0.00 0.00 179.01 178.37 3i1o h ALA 146 N -1.36 2.43 -2.74 2.92 0.00 -1.66 -3.24 119.26 115.61 3i1o h ALA 146 Ca -0.01 0.03 -0.77 0.00 0.00 0.00 0.00 54.91 54.17 3i1o h ALA 146 Cb 0.22 0.04 -0.27 0.00 0.00 0.00 0.00 17.79 17.78 3i1o h ALA 146 CO -0.06 -0.80 -0.06 1.21 0.00 0.00 0.00 179.25 179.54 3i1o s ASN 147 N -5.31 6.35 -0.38 0.00 2.47 -0.68 -4.87 114.94 112.52 3i1o s ASN 147 Ca -0.08 -2.51 0.13 0.00 0.42 0.00 0.00 52.86 50.82 3i1o s ASN 147 Cb 0.24 -2.14 0.39 0.00 -1.45 0.00 0.00 41.25 38.29 3i1o s ASN 147 CO 0.80 -0.60 0.84 2.29 -3.72 0.00 0.00 177.10 176.71 3i1o n LYS 148 N 4.17 1.41 -2.69 0.43 -0.00 -1.22 -4.58 118.16 115.68 3i1o n LYS 148 Ca 0.07 -3.57 -0.37 0.00 -0.00 0.00 0.00 58.31 54.44 3i1o n LYS 148 Cb 0.44 -1.66 0.01 0.00 -0.00 0.00 0.00 35.03 33.82 3i1o n LYS 148 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3i1o n ALA 149 N 0.08 5.73 0.07 0.58 0.00 -1.26 -4.62 120.51 121.09 3i1o n ALA 149 Ca 0.22 -4.61 0.00 0.00 0.00 0.00 0.00 53.44 49.04 3i1o n ALA 149 Cb 0.68 -1.79 0.00 0.00 0.00 0.00 0.00 19.45 18.34 3i1o n ALA 149 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3i1o n PHE 150 N -0.13 -1.40 0.14 0.00 3.01 -1.26 -5.06 117.46 112.75 3i1o n PHE 150 Ca 0.43 0.26 0.02 0.00 1.01 0.00 0.00 57.45 59.17 3i1o n PHE 150 Cb 0.30 0.68 0.01 0.00 -0.01 0.00 0.00 39.48 40.46 3i1o n PHE 150 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77