#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x4c n SER 2 N 0.00 -3.49 -4.36 1.61 2.88 -1.26 -5.02 113.62 103.98 1x4c n SER 2 Ca 0.00 -0.63 -0.32 0.00 -1.33 0.00 0.00 58.87 56.59 1x4c n SER 2 Cb 0.00 -0.99 -0.15 0.00 -0.75 0.00 0.00 64.21 62.32 1x4c n SER 2 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1x4c s SER 3 N -2.66 3.48 0.27 -3.46 1.04 -1.26 -5.02 113.70 106.09 1x4c s SER 3 Ca 0.60 -0.37 -0.01 0.00 0.48 0.00 0.00 55.95 56.65 1x4c s SER 3 Cb -0.13 -0.76 0.62 0.00 0.10 0.00 0.00 66.02 65.85 1x4c s SER 3 CO 0.53 0.29 1.65 1.23 0.98 0.00 0.00 173.24 177.93 1x4c h GLY 4 N 5.70 1.23 -1.22 7.32 0.00 -2.09 -3.41 103.07 110.60 1x4c h GLY 4 Ca -0.40 -0.02 -0.47 0.00 0.00 0.00 0.00 47.33 46.45 1x4c h GLY 4 CO 0.49 -0.32 0.25 -0.56 0.00 0.00 0.00 176.54 176.40 1x4c s SER 5 N -5.14 5.15 -0.12 0.19 0.01 -1.26 -5.08 113.70 107.45 1x4c s SER 5 Ca -0.12 0.67 -0.02 0.00 1.31 0.00 0.00 55.95 57.78 1x4c s SER 5 Cb 0.24 -1.45 -0.03 0.00 0.21 0.00 0.00 66.02 65.00 1x4c s SER 5 CO 0.77 -1.40 -0.03 -0.44 0.41 0.00 0.00 173.24 172.55 1x4c s SER 6 N -4.43 4.90 0.00 2.44 0.01 -1.26 -4.84 113.70 110.53 1x4c s SER 6 Ca 0.58 -0.03 0.00 0.00 1.31 0.00 0.00 55.95 57.80 1x4c s SER 6 Cb -0.11 -1.59 0.00 0.00 0.21 0.00 0.00 66.02 64.53 1x4c s SER 6 CO 0.46 0.26 0.00 0.61 0.41 0.00 0.00 173.24 174.98 1x4c n GLY 7 N 2.94 -1.03 0.00 3.44 0.00 -1.26 -5.16 105.19 104.12 1x4c n GLY 7 Ca -0.18 0.43 0.00 0.00 0.00 0.00 0.00 46.02 46.27 1x4c n GLY 7 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x4c n GLY 8 N 0.00 2.28 3.77 -0.02 0.00 -1.26 -5.04 105.19 104.92 1x4c n GLY 8 Ca 0.00 -1.82 -0.34 0.00 0.00 0.00 0.00 46.02 43.86 1x4c n GLY 8 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x4c s PRO 9 N -3.49 3.05 0.56 1.61 0.04 -1.26 -5.01 135.00 130.50 1x4c s PRO 9 Ca 0.00 1.49 -0.19 0.00 0.04 0.00 0.00 61.00 62.35 1x4c s PRO 9 Cb 0.00 -1.98 -0.05 0.00 0.04 0.00 0.00 34.50 32.51 1x4c s PRO 9 CO 0.00 -1.07 1.13 -1.25 0.04 0.00 0.00 177.00 175.85 1x4c s PRO 10 N -3.72 3.27 0.05 0.56 0.04 -1.26 -5.07 135.00 128.88 1x4c s PRO 10 Ca 0.70 1.57 -0.01 0.00 0.04 0.00 0.00 61.00 63.30 1x4c s PRO 10 Cb -0.22 -2.00 -0.04 0.00 0.04 0.00 0.00 34.50 32.28 1x4c s PRO 10 CO 0.35 -0.91 -0.02 -1.12 0.04 0.00 0.00 177.00 175.34 1x4c s SER 11 N -1.90 0.47 0.44 6.66 0.01 -1.26 -5.12 113.70 113.01 1x4c s SER 11 Ca 0.72 -0.98 0.00 0.00 1.31 0.00 0.00 55.95 57.00 1x4c s SER 11 Cb -0.23 0.20 0.00 0.00 0.21 0.00 0.00 66.02 66.20 1x4c s SER 11 CO 0.29 -0.59 0.00 0.54 0.41 0.00 0.00 173.24 173.89 1x4c n ARG 12 N 0.15 -2.08 -0.76 12.44 5.12 -1.26 -4.81 116.66 125.46 1x4c n ARG 12 Ca -0.14 1.37 0.00 0.00 -1.93 0.00 0.00 57.85 57.14 1x4c n ARG 12 Cb 0.61 -2.53 0.00 0.00 -1.16 0.00 0.00 32.46 29.38 1x4c n ARG 12 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 1x4c n ARG 13 N -3.50 -0.47 -4.25 5.56 3.00 -1.26 -4.95 116.66 110.80 1x4c n ARG 13 Ca 0.01 0.12 -0.28 0.00 -0.01 0.00 0.00 57.85 57.69 1x4c n ARG 13 Cb 0.47 -4.08 -0.09 0.00 0.00 0.00 0.00 32.46 28.76 1x4c n ARG 13 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 1x4c s SER 14 N -2.20 4.42 -0.15 0.55 1.04 -1.26 -5.02 113.70 111.09 1x4c s SER 14 Ca 0.00 -0.46 0.11 0.00 0.48 0.00 0.00 55.95 56.07 1x4c s SER 14 Cb 0.00 -0.83 0.57 0.00 0.10 0.00 0.00 66.02 65.86 1x4c s SER 14 CO 0.00 0.13 1.39 -0.62 0.98 0.00 0.00 173.24 175.12 1x4c n GLU 15 N 0.26 3.61 -2.98 4.02 1.02 -1.26 -4.88 120.64 120.42 1x4c n GLU 15 Ca -0.12 -2.20 -0.12 0.00 -0.02 0.00 0.00 57.16 54.70 1x4c n GLU 15 Cb 0.54 -1.98 0.04 0.00 -0.02 0.00 0.00 31.44 30.03 1x4c n GLU 15 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1x4c n ASN 16 N 0.52 -3.56 -4.68 1.62 4.13 -1.26 -4.67 115.26 107.35 1x4c n ASN 16 Ca 0.20 -0.30 -0.33 0.00 1.68 0.00 0.00 54.58 55.82 1x4c n ASN 16 Cb 0.87 -2.95 -0.09 0.00 -1.54 0.00 0.00 39.78 36.07 1x4c n ASN 16 CO 0.00 0.00 0.00 -0.60 0.28 0.00 0.00 177.26 176.94 1x4c s ARG 17 N -5.37 2.82 0.25 3.52 3.52 -1.26 -0.74 118.95 121.68 1x4c s ARG 17 Ca 0.21 -0.57 0.04 0.00 -0.13 0.00 0.00 55.73 55.28 1x4c s ARG 17 Cb -0.09 -2.69 -0.05 0.00 -1.56 0.00 0.00 34.95 30.55 1x4c s ARG 17 CO 0.39 0.64 -0.00 0.14 -0.81 0.00 0.00 175.30 175.66 1x4c s VAL 18 N -1.04 1.10 -0.00 7.11 -7.23 0.86 -0.83 120.40 120.37 1x4c s VAL 18 Ca 0.18 -2.04 0.02 0.00 -1.81 0.00 0.00 61.98 58.34 1x4c s VAL 18 Cb -0.11 -2.41 -0.03 0.00 0.56 0.00 0.00 36.38 34.38 1x4c s VAL 18 CO 0.08 -0.28 -0.04 -0.69 -0.31 0.00 0.00 175.10 173.87 1x4c s VAL 19 N -3.37 3.88 -0.07 1.32 1.01 -0.10 -2.41 120.40 120.66 1x4c s VAL 19 Ca 0.30 -0.69 0.03 0.00 0.00 0.00 0.00 61.98 61.62 1x4c s VAL 19 Cb 0.06 -2.71 0.01 0.00 0.00 0.00 0.00 36.38 33.74 1x4c s VAL 19 CO 0.10 0.39 -0.16 -0.69 0.00 0.00 0.00 175.10 174.73 1x4c s VAL 20 N -1.03 1.44 0.23 2.92 1.01 0.12 -2.73 120.40 122.36 1x4c s VAL 20 Ca 0.18 -0.67 0.03 0.00 0.00 0.00 0.00 61.98 61.52 1x4c s VAL 20 Cb -0.11 -1.27 -0.05 0.00 0.00 0.00 0.00 36.38 34.95 1x4c s VAL 20 CO 0.09 0.42 0.01 -0.94 0.00 0.00 0.00 175.10 174.68 1x4c s SER 21 N 0.41 1.71 -0.46 3.32 1.04 -0.99 0.58 113.70 119.31 1x4c s SER 21 Ca -0.13 -1.24 0.00 0.00 0.48 0.00 0.00 55.95 55.06 1x4c s SER 21 Cb -0.15 0.03 0.00 0.00 0.10 0.00 0.00 66.02 66.00 1x4c s SER 21 CO 0.05 -0.55 0.00 0.61 0.98 0.00 0.00 173.24 174.33 1x4c n GLY 22 N -0.42 0.61 3.76 7.32 0.00 -0.10 -1.74 105.19 114.63 1x4c n GLY 22 Ca -0.05 -0.83 -0.39 0.00 0.00 0.00 0.00 46.02 44.76 1x4c n GLY 22 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1x4c s LEU 23 N -1.09 4.45 0.95 0.99 1.43 0.99 -4.39 118.68 122.01 1x4c s LEU 23 Ca 0.00 2.11 -0.12 0.00 -1.03 0.00 0.00 54.13 55.09 1x4c s LEU 23 Cb 0.00 -3.79 0.16 0.00 0.03 0.00 0.00 46.19 42.59 1x4c s LEU 23 CO 0.00 -0.16 1.09 -2.16 0.23 0.00 0.00 176.35 175.35 1x4c s PRO 24 N -1.70 0.86 0.24 1.29 0.04 -1.26 -4.12 135.00 130.35 1x4c s PRO 24 Ca 0.47 0.67 0.01 0.00 0.04 0.00 0.00 61.00 62.20 1x4c s PRO 24 Cb -0.27 -1.77 0.28 0.00 0.04 0.00 0.00 34.50 32.77 1x4c s PRO 24 CO 0.35 -2.48 1.61 -1.00 0.04 0.00 0.00 177.00 175.52 1x4c h PRO 25 N -1.71 0.44 0.00 0.56 0.13 -1.97 -3.00 132.00 126.45 1x4c h PRO 25 Ca -0.52 -0.23 0.00 0.00 -0.87 0.00 0.00 66.00 64.38 1x4c h PRO 25 Cb 1.31 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.44 1x4c h PRO 25 CO 0.56 0.79 -0.58 0.77 -0.23 0.00 0.00 178.00 179.32 1x4c h SER 26 N 0.36 0.00 -3.65 1.44 0.02 -2.01 -3.47 113.55 106.24 1x4c h SER 26 Ca 0.03 -0.09 -0.55 0.00 -0.84 0.00 0.00 61.79 60.34 1x4c h SER 26 Cb 0.91 0.00 0.10 0.00 0.14 0.00 0.00 62.40 63.55 1x4c h SER 26 CO 0.08 0.04 0.74 0.61 -1.14 0.00 0.00 176.83 177.16 1x4c n GLY 27 N 1.25 1.09 3.34 -3.77 0.00 -1.13 -4.82 105.19 101.14 1x4c n GLY 27 Ca 0.03 0.34 -0.17 0.00 0.00 0.00 0.00 46.02 46.22 1x4c n GLY 27 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x4c s SER 28 N -0.04 1.68 0.11 1.61 0.01 -1.26 -4.89 113.70 110.92 1x4c s SER 28 Ca 0.56 -1.28 -0.21 0.00 1.31 0.00 0.00 55.95 56.33 1x4c s SER 28 Cb -0.50 0.05 -0.10 0.00 0.21 0.00 0.00 66.02 65.68 1x4c s SER 28 CO 0.61 -0.59 1.75 4.11 0.41 0.00 0.00 173.24 179.52 1x4c h TRP 29 N 2.42 0.07 -0.89 2.43 5.08 -1.93 0.23 115.95 123.36 1x4c h TRP 29 Ca -0.38 0.01 0.24 0.00 1.08 0.00 0.00 58.89 59.83 1x4c h TRP 29 Cb 1.23 -0.02 -0.04 0.00 -3.00 0.00 0.00 29.16 27.33 1x4c h TRP 29 CO 0.54 0.04 0.62 1.96 -1.28 0.00 0.00 178.44 180.33 1x4c h GLN 30 N 0.10 0.10 0.08 0.12 4.20 -1.97 0.17 115.11 117.91 1x4c h GLN 30 Ca 0.04 -0.01 -0.23 0.00 0.06 0.00 0.00 58.65 58.52 1x4c h GLN 30 Cb 0.02 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.77 1x4c h GLN 30 CO -0.04 0.06 -1.20 -0.44 -0.67 0.00 0.00 178.83 176.54 1x4c h ASP 31 N 0.10 0.25 0.03 1.46 5.19 -1.75 -3.25 116.42 118.45 1x4c h ASP 31 Ca 0.43 -0.80 0.02 0.00 -0.62 0.00 0.00 57.03 56.06 1x4c h ASP 31 Cb 1.56 -0.08 -0.03 0.00 0.18 0.00 0.00 39.33 40.96 1x4c h ASP 31 CO -0.05 1.51 -0.14 0.25 -3.12 0.00 0.00 179.24 177.69 1x4c h LEU 32 N -0.54 -0.39 -1.60 1.55 5.85 0.54 -1.75 115.31 118.97 1x4c h LEU 32 Ca -0.28 0.05 0.08 0.00 0.84 0.00 0.00 57.88 58.58 1x4c h LEU 32 Cb 1.57 0.16 -0.04 0.00 0.37 0.00 0.00 40.66 42.72 1x4c h LEU 32 CO -0.01 -0.20 0.39 0.50 -0.34 0.00 0.00 178.44 178.79 1x4c h LYS 33 N -0.24 0.46 0.00 1.25 3.64 -0.89 0.12 116.57 120.91 1x4c h LYS 33 Ca 0.04 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.37 1x4c h LYS 33 Cb 0.29 -0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 32.00 1x4c h LYS 33 CO -0.12 0.30 -0.11 -0.44 -2.27 0.00 0.00 179.45 176.81 1x4c h ASP 34 N 0.47 0.00 0.16 4.20 5.19 -1.36 -0.41 116.42 124.68 1x4c h ASP 34 Ca 0.27 0.00 -0.34 0.00 -0.62 0.00 0.00 57.03 56.34 1x4c h ASP 34 Cb 0.43 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.94 1x4c h ASP 34 CO -0.08 0.11 -1.70 -0.74 -3.12 0.00 0.00 179.24 173.72 1x4c h HIS 35 N 0.00 0.62 0.00 4.55 2.76 -0.46 -3.32 115.15 119.31 1x4c h HIS 35 Ca -0.00 -0.45 0.00 0.00 -2.20 0.00 0.00 60.37 57.71 1x4c h HIS 35 Cb 0.34 -0.02 0.00 0.00 1.55 0.00 0.00 27.41 29.27 1x4c h HIS 35 CO 0.00 1.67 0.00 -1.33 -1.30 0.00 0.00 177.93 176.97 1x4c n MET 36 N -3.67 0.02 0.19 5.26 2.81 -0.72 -3.15 117.12 117.86 1x4c n MET 36 Ca -0.26 0.13 0.06 0.00 -1.81 0.00 0.00 57.70 55.82 1x4c n MET 36 Cb 1.03 -1.54 0.53 0.00 -0.71 0.00 0.00 33.22 32.54 1x4c n MET 36 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1x4c h ARG 37 N 0.00 0.12 -0.94 0.03 3.08 -1.17 -2.48 114.38 113.01 1x4c h ARG 37 Ca 0.00 -0.01 0.21 0.00 0.07 0.00 0.00 59.98 60.24 1x4c h ARG 37 Cb 0.41 -0.02 -0.11 0.00 0.08 0.00 0.00 29.97 30.32 1x4c h ARG 37 CO 0.00 0.16 0.51 1.05 -1.07 0.00 0.00 179.97 180.62 1x4c h GLU 38 N 0.12 0.57 -0.88 0.04 4.11 -1.76 0.21 114.58 116.98 1x4c h GLU 38 Ca 0.03 -0.03 0.08 0.00 0.07 0.00 0.00 59.36 59.51 1x4c h GLU 38 Cb 0.13 -0.13 -0.06 0.00 0.50 0.00 0.00 28.75 29.19 1x4c h GLU 38 CO 0.00 0.38 0.57 0.00 0.07 0.00 0.00 179.01 180.03 1x4c h ALA 39 N 1.67 1.60 0.00 1.06 0.00 -1.70 -3.48 119.26 118.42 1x4c h ALA 39 Ca 0.57 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.47 1x4c h ALA 39 Cb 0.99 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1x4c h ALA 39 CO -0.45 0.23 0.00 0.41 0.00 0.00 0.00 179.25 179.45 1x4c n GLY 40 N -1.41 -1.41 2.97 0.00 0.00 0.75 -4.62 105.19 101.47 1x4c n GLY 40 Ca 0.14 0.62 -0.18 0.00 0.00 0.00 0.00 46.02 46.60 1x4c n GLY 40 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1x4c s ASP 41 N -4.00 0.88 0.05 1.61 1.01 -1.26 -4.80 116.67 110.16 1x4c s ASP 41 Ca 0.00 -0.13 -0.03 0.00 0.71 0.00 0.00 52.55 53.10 1x4c s ASP 41 Cb 0.00 -0.18 -0.05 0.00 1.01 0.00 0.00 42.92 43.70 1x4c s ASP 41 CO 0.00 0.06 0.26 -0.69 0.21 0.00 0.00 175.17 175.01 1x4c s VAL 42 N 0.08 5.32 -0.01 -1.27 1.01 -1.26 -2.85 120.40 121.42 1x4c s VAL 42 Ca -0.01 -0.11 0.04 0.00 0.00 0.00 0.00 61.98 61.90 1x4c s VAL 42 Cb -0.06 -3.60 -0.06 0.00 0.00 0.00 0.00 36.38 32.67 1x4c s VAL 42 CO -0.00 0.20 0.07 0.00 0.00 0.00 0.00 175.10 175.37 1x4c s TYR 44 N -2.23 -0.49 -0.03 0.00 5.04 -0.91 -4.95 117.35 113.79 1x4c s TYR 44 Ca -0.02 1.17 -0.03 0.00 -2.44 0.00 0.00 57.07 55.75 1x4c s TYR 44 Cb 0.02 0.17 0.01 0.00 0.35 0.00 0.00 41.96 42.51 1x4c s TYR 44 CO 0.16 -0.24 0.09 0.00 -1.34 0.00 0.00 175.55 174.22 1x4c s ALA 45 N 0.35 -0.21 -0.28 3.97 0.00 -1.26 -1.10 121.76 123.23 1x4c s ALA 45 Ca -0.01 0.20 -0.25 0.00 0.00 0.00 0.00 51.96 51.89 1x4c s ALA 45 Cb -0.04 -0.12 0.12 0.00 0.00 0.00 0.00 23.12 23.09 1x4c s ALA 45 CO -0.01 -0.05 1.05 -0.51 0.00 0.00 0.00 175.76 176.23 1x4c s ASP 46 N -0.08 -0.43 0.27 0.00 1.11 -0.82 -5.00 116.67 111.73 1x4c s ASP 46 Ca -0.01 0.83 0.07 0.00 0.18 0.00 0.00 52.55 53.62 1x4c s ASP 46 Cb -0.01 0.84 -0.06 0.00 1.07 0.00 0.00 42.92 44.76 1x4c s ASP 46 CO 0.00 -0.15 -0.08 0.68 1.18 0.00 0.00 175.17 176.80 1x4c s VAL 47 N 0.19 1.74 0.28 -1.27 -7.23 -1.26 -0.34 120.40 112.51 1x4c s VAL 47 Ca 0.03 -2.16 0.10 0.00 -1.81 0.00 0.00 61.98 58.15 1x4c s VAL 47 Cb -0.05 -2.41 -0.05 0.00 0.56 0.00 0.00 36.38 34.43 1x4c s VAL 47 CO -0.06 -0.34 -0.16 -0.31 -0.31 0.00 0.00 175.10 173.93 1x4c s TYR 48 N -2.95 2.16 -1.20 2.82 2.02 0.19 -4.93 117.35 115.46 1x4c s TYR 48 Ca 0.29 -0.45 0.02 0.00 -0.37 0.00 0.00 57.07 56.56 1x4c s TYR 48 Cb 0.03 -1.03 0.09 0.00 -0.40 0.00 0.00 41.96 40.64 1x4c s TYR 48 CO 0.12 0.58 0.75 0.54 -1.57 0.00 0.00 175.55 175.96 1x4c n ARG 49 N -0.60 1.37 -0.39 -0.62 1.74 -1.26 -3.33 116.66 113.57 1x4c n ARG 49 Ca -0.06 -0.33 0.07 0.00 -0.77 0.00 0.00 57.85 56.76 1x4c n ARG 49 Cb 0.61 -1.45 0.19 0.00 -1.02 0.00 0.00 32.46 30.79 1x4c n ARG 49 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1x4c n ASP 50 N -0.02 2.41 -1.38 0.55 8.00 -1.26 -4.94 116.55 119.91 1x4c n ASP 50 Ca 0.03 -3.42 -0.12 0.00 0.71 0.00 0.00 54.79 51.99 1x4c n ASP 50 Cb 0.28 -0.51 -0.01 0.00 -0.02 0.00 0.00 41.12 40.86 1x4c n ASP 50 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1x4c n GLY 51 N -1.16 -0.02 3.51 0.44 0.00 -1.21 -4.88 105.19 101.87 1x4c n GLY 51 Ca 0.20 -0.37 -0.24 0.00 0.00 0.00 0.00 46.02 45.61 1x4c n GLY 51 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1x4c s THR 52 N -2.61 1.05 0.09 2.61 -4.23 -1.25 -0.01 115.64 111.30 1x4c s THR 52 Ca 0.00 -2.00 -0.26 0.00 -1.18 0.00 0.00 61.69 58.25 1x4c s THR 52 Cb 0.00 -2.61 0.09 0.00 1.34 0.00 0.00 72.50 71.32 1x4c s THR 52 CO 0.00 0.00 1.13 -0.83 -0.54 0.00 0.00 174.62 174.38 1x4c s GLY 53 N -3.58 -0.15 -0.14 3.99 0.00 0.20 -0.63 107.32 107.01 1x4c s GLY 53 Ca 0.29 0.10 -0.12 0.00 0.00 0.00 0.00 44.72 45.00 1x4c s GLY 53 CO 0.14 1.87 0.37 -1.34 0.00 0.00 0.00 173.10 174.14 1x4c s VAL 54 N -2.46 -0.01 0.04 1.40 -7.23 0.54 0.16 120.40 112.85 1x4c s VAL 54 Ca 0.19 0.02 0.03 0.00 -1.81 0.00 0.00 61.98 60.41 1x4c s VAL 54 Cb 0.00 -0.52 -0.02 0.00 0.56 0.00 0.00 36.38 36.39 1x4c s VAL 54 CO 0.01 0.01 -0.10 -0.69 -0.31 0.00 0.00 175.10 174.02 1x4c s VAL 55 N 0.41 0.71 -0.26 1.32 1.01 -1.01 -1.94 120.40 120.64 1x4c s VAL 55 Ca -0.02 -1.02 0.00 0.00 0.00 0.00 0.00 61.98 60.94 1x4c s VAL 55 Cb -0.04 -0.72 0.07 0.00 0.00 0.00 0.00 36.38 35.69 1x4c s VAL 55 CO -0.02 -0.25 0.00 -0.70 0.00 0.00 0.00 175.10 174.14 1x4c s GLU 56 N -1.40 1.29 -0.10 2.72 2.12 -0.26 -0.10 118.70 122.97 1x4c s GLU 56 Ca -0.06 -1.03 -0.30 0.00 0.36 0.00 0.00 54.97 53.95 1x4c s GLU 56 Cb -0.09 -2.48 -0.02 0.00 0.26 0.00 0.00 34.13 31.80 1x4c s GLU 56 CO 0.01 -0.72 1.14 -0.06 -0.54 0.00 0.00 175.26 175.09 1x4c s PHE 57 N 1.45 3.24 0.45 5.30 0.08 0.08 0.37 117.98 128.95 1x4c s PHE 57 Ca -0.00 1.31 0.25 0.00 0.12 0.00 0.00 56.93 58.60 1x4c s PHE 57 Cb -0.18 -3.36 1.26 0.00 -0.57 0.00 0.00 43.02 40.17 1x4c s PHE 57 CO -0.10 -1.01 1.80 -0.24 -0.10 0.00 0.00 175.22 175.57 1x4c h VAL 58 N 5.14 0.51 -3.65 -0.44 3.04 -1.79 -3.34 116.25 115.71 1x4c h VAL 58 Ca -0.31 -0.08 -0.64 0.00 -1.01 0.00 0.00 66.70 64.66 1x4c h VAL 58 Cb 1.14 0.24 -0.37 0.00 -2.01 0.00 0.00 31.29 30.29 1x4c h VAL 58 CO 0.90 0.04 -0.80 -0.13 -1.01 0.00 0.00 177.57 176.57 1x4c s ARG 59 N -5.28 2.07 0.31 4.17 0.52 -1.26 -5.00 118.95 114.48 1x4c s ARG 59 Ca -0.07 -1.10 0.14 0.00 -0.52 0.00 0.00 55.73 54.17 1x4c s ARG 59 Cb 0.24 -2.68 1.05 0.00 0.52 0.00 0.00 34.95 34.08 1x4c s ARG 59 CO 0.80 -0.52 1.39 1.17 0.02 0.00 0.00 175.30 178.15 1x4c n LYS 60 N 4.57 -0.06 -0.35 3.54 4.81 -1.26 0.10 118.16 129.51 1x4c n LYS 60 Ca -0.14 1.25 0.03 0.00 -0.87 0.00 0.00 58.31 58.58 1x4c n LYS 60 Cb 0.44 -2.17 0.10 0.00 0.02 0.00 0.00 35.03 33.42 1x4c n LYS 60 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 1x4c n GLU 61 N -5.08 -0.14 -0.02 1.64 0.00 -1.26 0.16 120.64 115.95 1x4c n GLU 61 Ca 0.30 1.49 -0.03 0.00 0.00 0.00 0.00 57.16 58.92 1x4c n GLU 61 Cb 1.01 -2.22 0.21 0.00 0.00 0.00 0.00 31.44 30.44 1x4c n GLU 61 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.13 176.69 1x4c h ASP 62 N 0.00 0.57 0.06 4.31 3.32 -0.60 -2.44 116.42 121.64 1x4c h ASP 62 Ca 0.41 -0.16 -0.00 0.00 0.02 0.00 0.00 57.03 57.30 1x4c h ASP 62 Cb 0.65 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.05 1x4c h ASP 62 CO -0.98 0.73 -0.03 -0.03 -1.72 0.00 0.00 179.24 177.21 1x4c h MET 63 N 0.53 -0.08 0.00 3.56 4.05 0.16 0.23 114.93 123.38 1x4c h MET 63 Ca 0.09 0.01 -0.01 0.00 -0.28 0.00 0.00 59.70 59.51 1x4c h MET 63 Cb 0.54 0.02 -0.00 0.00 -0.80 0.00 0.00 31.60 31.36 1x4c h MET 63 CO 0.03 0.08 -0.06 1.15 0.23 0.00 0.00 176.91 178.35 1x4c h THR 64 N -0.22 0.32 0.19 -0.77 2.02 -0.64 -2.17 112.91 111.64 1x4c h THR 64 Ca -0.01 -0.34 -0.33 0.00 0.77 0.00 0.00 66.41 66.50 1x4c h THR 64 Cb 0.19 1.25 0.01 0.00 -1.74 0.00 0.00 68.15 67.86 1x4c h THR 64 CO 0.01 0.05 -1.64 0.22 0.37 0.00 0.00 175.52 174.54 1x4c h TYR 65 N 0.00 0.71 -0.59 3.16 3.20 -0.96 -3.24 116.97 119.25 1x4c h TYR 65 Ca -0.00 -0.52 -0.02 0.00 3.14 0.00 0.00 58.73 61.33 1x4c h TYR 65 Cb 0.24 -0.03 -0.03 0.00 1.54 0.00 0.00 36.73 38.46 1x4c h TYR 65 CO 0.00 1.64 0.30 0.00 -1.64 0.00 0.00 178.16 178.46 1x4c h ALA 66 N 0.09 0.75 0.00 1.82 0.00 -0.18 0.20 119.26 121.94 1x4c h ALA 66 Ca -0.32 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1x4c h ALA 66 Cb 2.05 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 19.60 1x4c h ALA 66 CO 0.17 0.29 0.00 -0.39 0.00 0.00 0.00 179.25 179.33 1x4c h VAL 67 N 0.79 0.00 0.02 0.00 -1.51 -1.55 1.88 116.25 115.88 1x4c h VAL 67 Ca 0.20 -0.35 -0.25 0.00 -1.23 0.00 0.00 66.70 65.07 1x4c h VAL 67 Cb 0.08 1.32 -0.03 0.00 -2.13 0.00 0.00 31.29 30.53 1x4c h VAL 67 CO -0.03 0.00 -1.37 0.03 -1.23 0.00 0.00 177.57 174.98 1x4c h ARG 68 N 0.00 0.04 0.01 5.19 3.08 -1.35 -3.39 114.38 117.96 1x4c h ARG 68 Ca 0.00 -0.06 -0.37 0.00 0.07 0.00 0.00 59.98 59.61 1x4c h ARG 68 Cb 0.36 0.02 -0.05 0.00 0.08 0.00 0.00 29.97 30.38 1x4c h ARG 68 CO 0.00 1.03 -2.07 1.63 -1.07 0.00 0.00 179.97 179.49 1x4c n LYS 69 N -4.30 0.60 -1.63 0.04 4.76 0.63 -4.51 118.16 113.74 1x4c n LYS 69 Ca -0.32 0.36 -0.36 0.00 -2.87 0.00 0.00 58.31 55.12 1x4c n LYS 69 Cb 0.73 -1.60 -0.03 0.00 -1.84 0.00 0.00 35.03 32.29 1x4c n LYS 69 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 1x4c n LEU 70 N -4.17 7.87 -3.80 -0.35 4.77 0.64 -4.84 117.00 117.12 1x4c n LEU 70 Ca -0.45 -4.49 -0.23 0.00 -0.03 0.00 0.00 56.01 50.82 1x4c n LEU 70 Cb 0.84 -1.41 -0.17 0.00 -2.33 0.00 0.00 43.42 40.34 1x4c n LEU 70 CO 0.13 2.00 -0.39 -0.62 -1.33 0.00 0.00 177.39 177.18 1x4c s ASP 71 N 1.08 1.55 -1.02 -1.43 2.15 -1.12 -4.27 116.67 113.60 1x4c s ASP 71 Ca 0.61 -0.11 -0.05 0.00 0.43 0.00 0.00 52.55 53.43 1x4c s ASP 71 Cb 0.22 -0.47 0.01 0.00 -0.30 0.00 0.00 42.92 42.37 1x4c s ASP 71 CO -0.09 -0.17 0.88 -3.20 -0.17 0.00 0.00 175.17 172.42 1x4c n ASN 72 N 5.00 -4.50 -4.69 -0.34 4.05 -0.09 -4.88 115.26 109.80 1x4c n ASN 72 Ca -0.10 -0.43 -0.23 0.00 0.45 0.00 0.00 54.58 54.27 1x4c n ASN 72 Cb 0.50 -4.02 -0.07 0.00 1.23 0.00 0.00 39.78 37.42 1x4c n ASN 72 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 177.26 174.63 1x4c s THR 73 N -3.26 3.34 -0.46 -0.44 -4.23 -0.78 -4.80 115.64 105.01 1x4c s THR 73 Ca 0.33 -1.80 -0.29 0.00 -1.18 0.00 0.00 61.69 58.75 1x4c s THR 73 Cb -0.15 -2.93 0.03 0.00 1.34 0.00 0.00 72.50 70.79 1x4c s THR 73 CO 0.56 -0.30 1.18 -0.75 -0.54 0.00 0.00 174.62 174.77 1x4c s LYS 74 N -3.75 3.72 0.07 3.99 2.47 -1.26 -0.64 119.74 124.34 1x4c s LYS 74 Ca 0.34 0.64 -0.10 0.00 -1.56 0.00 0.00 55.97 55.30 1x4c s LYS 74 Cb -0.05 -3.92 -0.06 0.00 -1.46 0.00 0.00 37.83 32.35 1x4c s LYS 74 CO 0.21 -1.39 0.38 0.12 0.16 0.00 0.00 175.35 174.83 1x4c s PHE 75 N 4.57 3.59 -0.05 4.03 2.19 0.79 -4.84 117.98 128.25 1x4c s PHE 75 Ca 0.50 0.77 0.04 0.00 0.33 0.00 0.00 56.93 58.56 1x4c s PHE 75 Cb -0.08 -2.14 -0.02 0.00 -1.31 0.00 0.00 43.02 39.46 1x4c s PHE 75 CO 0.31 0.54 -0.15 0.50 1.83 0.00 0.00 175.22 178.25 1x4c s ARG 76 N -1.85 2.55 0.43 10.12 3.52 -1.26 -0.52 118.95 131.94 1x4c s ARG 76 Ca 0.32 -0.72 0.07 0.00 -0.13 0.00 0.00 55.73 55.26 1x4c s ARG 76 Cb -0.14 -2.37 0.01 0.00 -1.56 0.00 0.00 34.95 30.90 1x4c s ARG 76 CO 0.18 0.58 0.59 -1.54 -0.81 0.00 0.00 175.30 174.29 1x4c s SER 77 N -0.61 5.66 0.21 -2.12 1.04 -0.11 -4.90 113.70 112.87 1x4c s SER 77 Ca 0.09 -0.30 0.16 0.00 0.48 0.00 0.00 55.95 56.38 1x4c s SER 77 Cb -0.11 -0.81 0.82 0.00 0.10 0.00 0.00 66.02 66.01 1x4c s SER 77 CO 0.01 -0.76 1.49 0.00 0.98 0.00 0.00 173.24 174.96 1x4c n HIS 78 N -1.89 0.51 1.35 5.02 1.44 -1.26 -0.40 115.22 119.99 1x4c n HIS 78 Ca 0.06 0.25 0.13 0.00 -2.01 0.00 0.00 57.72 56.16 1x4c n HIS 78 Cb 0.59 -0.91 0.43 0.00 0.12 0.00 0.00 29.99 30.22 1x4c n HIS 78 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 1x4c n GLU 79 N -2.02 1.27 -0.47 -1.40 -0.58 -1.26 -4.91 120.64 111.27 1x4c n GLU 79 Ca -0.00 -0.76 0.00 0.00 -0.42 0.00 0.00 57.16 55.98 1x4c n GLU 79 Cb 0.06 -1.48 0.00 0.00 -0.57 0.00 0.00 31.44 29.45 1x4c n GLU 79 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1x4c n GLY 80 N 1.27 1.06 3.78 0.62 0.00 0.47 -5.03 105.19 107.34 1x4c n GLY 80 Ca 0.15 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.80 1x4c n GLY 80 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1x4c s GLU 81 N -0.39 4.12 -0.06 1.61 2.12 -1.26 -4.76 118.70 120.08 1x4c s GLU 81 Ca 0.00 1.65 0.05 0.00 0.36 0.00 0.00 54.97 57.03 1x4c s GLU 81 Cb 0.00 -2.61 -0.02 0.00 0.26 0.00 0.00 34.13 31.77 1x4c s GLU 81 CO 0.00 -0.21 -0.20 0.95 -0.54 0.00 0.00 175.26 175.25 1x4c s THR 82 N -1.54 2.48 -0.20 -1.70 -4.23 -1.26 -0.93 115.64 108.25 1x4c s THR 82 Ca 0.57 -0.92 -0.14 0.00 -1.18 0.00 0.00 61.69 60.03 1x4c s THR 82 Cb -0.26 -1.94 0.06 0.00 1.34 0.00 0.00 72.50 71.70 1x4c s THR 82 CO 0.32 0.57 0.50 0.00 -0.54 0.00 0.00 174.62 175.47 1x4c s ALA 83 N -0.26 -1.27 0.03 3.99 0.00 0.33 -4.96 121.76 119.62 1x4c s ALA 83 Ca 0.00 1.63 -0.30 0.00 0.00 0.00 0.00 51.96 53.28 1x4c s ALA 83 Cb -0.13 -0.96 -0.06 0.00 0.00 0.00 0.00 23.12 21.97 1x4c s ALA 83 CO 0.03 -0.27 1.31 0.71 0.00 0.00 0.00 175.76 177.54 1x4c s TYR 84 N 0.93 3.12 0.18 0.00 2.02 -1.26 -0.15 117.35 122.19 1x4c s TYR 84 Ca -0.05 1.03 0.11 0.00 -0.37 0.00 0.00 57.07 57.79 1x4c s TYR 84 Cb -0.06 -3.57 -0.04 0.00 -0.40 0.00 0.00 41.96 37.90 1x4c s TYR 84 CO -0.08 -1.95 -0.24 0.96 -1.57 0.00 0.00 175.55 172.67 1x4c s ILE 85 N 1.81 2.38 -0.04 2.71 -4.36 0.19 -4.51 121.20 119.38 1x4c s ILE 85 Ca 0.61 -1.94 0.05 0.00 -0.26 0.00 0.00 60.65 59.11 1x4c s ILE 85 Cb -0.31 -2.12 -0.02 0.00 1.25 0.00 0.00 42.46 41.26 1x4c s ILE 85 CO 0.27 -0.06 -0.17 -0.60 0.24 0.00 0.00 174.94 174.62 1x4c s ARG 86 N -2.53 2.41 -0.03 0.37 3.52 -0.71 -0.91 118.95 121.07 1x4c s ARG 86 Ca 0.19 -0.75 0.05 0.00 -0.13 0.00 0.00 55.73 55.09 1x4c s ARG 86 Cb -0.08 -2.30 -0.01 0.00 -1.56 0.00 0.00 34.95 30.99 1x4c s ARG 86 CO 0.09 0.61 -0.18 0.08 -0.81 0.00 0.00 175.30 175.09 1x4c s VAL 87 N -0.72 1.47 -0.07 7.11 1.01 -1.26 -2.35 120.40 125.59 1x4c s VAL 87 Ca 0.11 -0.77 -0.20 0.00 0.00 0.00 0.00 61.98 61.12 1x4c s VAL 87 Cb -0.10 -1.24 0.04 0.00 0.00 0.00 0.00 36.38 35.08 1x4c s VAL 87 CO 0.00 0.42 0.47 -1.59 0.00 0.00 0.00 175.10 174.40 1x4c s LYS 88 N -0.26 0.76 -0.06 2.72 -2.85 -1.10 -4.77 119.74 114.18 1x4c s LYS 88 Ca 0.03 0.18 -0.30 0.00 -1.00 0.00 0.00 55.97 54.89 1x4c s LYS 88 Cb -0.09 0.35 -0.06 0.00 -2.06 0.00 0.00 37.83 35.97 1x4c s LYS 88 CO 0.00 -0.19 1.73 0.54 0.10 0.00 0.00 175.35 177.53 1x4c s VAL 89 N -0.85 3.46 0.06 1.79 0.11 -1.26 -0.92 120.40 122.79 1x4c s VAL 89 Ca -0.09 0.55 -0.36 0.00 -2.93 0.00 0.00 61.98 59.15 1x4c s VAL 89 Cb -0.03 -3.38 -0.16 0.00 -1.53 0.00 0.00 36.38 31.28 1x4c s VAL 89 CO 0.05 -0.08 1.46 -0.67 -3.33 0.00 0.00 175.10 172.54 1x4c n ASP 90 N 7.57 2.15 -4.84 3.54 -0.08 -0.01 -4.87 116.55 120.00 1x4c n ASP 90 Ca 0.18 1.10 -0.22 0.00 -1.51 0.00 0.00 54.79 54.35 1x4c n ASP 90 Cb 0.43 -1.25 0.07 0.00 2.34 0.00 0.00 41.12 42.71 1x4c n ASP 90 CO 0.00 0.00 0.00 -0.83 0.12 0.00 0.00 177.20 176.49 1x4c s GLY 91 N 1.06 1.79 0.37 0.27 0.00 -1.26 -4.94 107.32 104.61 1x4c s GLY 91 Ca 0.85 -1.68 -0.26 0.00 0.00 0.00 0.00 44.72 43.62 1x4c s GLY 91 CO 0.47 -1.24 1.20 2.56 0.00 0.00 0.00 173.10 176.09 1x4c s PRO 92 N -4.90 4.17 -0.23 2.90 0.04 -1.26 -4.98 135.00 130.73 1x4c s PRO 92 Ca 0.62 1.94 -0.14 0.00 0.04 0.00 0.00 61.00 63.46 1x4c s PRO 92 Cb -0.07 -2.82 -0.17 0.00 0.04 0.00 0.00 34.50 31.48 1x4c s PRO 92 CO 0.41 -0.25 -0.04 0.54 0.04 0.00 0.00 177.00 177.70 1x4c n ARG 93 N 0.35 0.61 -1.67 4.56 5.12 -1.26 -4.96 116.66 119.41 1x4c n ARG 93 Ca 0.03 0.37 -0.40 0.00 -1.93 0.00 0.00 57.85 55.91 1x4c n ARG 93 Cb 0.45 -1.62 0.02 0.00 -1.16 0.00 0.00 32.46 30.15 1x4c n ARG 93 CO 0.00 0.00 0.00 0.43 -1.93 0.00 0.00 177.63 176.13 1x4c n SER 94 N -4.11 1.96 -4.65 0.55 7.64 -1.26 -4.89 113.62 108.85 1x4c n SER 94 Ca -0.43 1.03 -0.43 0.00 1.01 0.00 0.00 58.87 60.06 1x4c n SER 94 Cb 0.84 -1.45 -0.03 0.00 -1.01 0.00 0.00 64.21 62.57 1x4c n SER 94 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1x4c s PRO 95 N -2.29 4.12 -0.15 1.43 0.04 -1.26 -4.99 135.00 131.90 1x4c s PRO 95 Ca 0.65 1.94 -0.04 0.00 0.04 0.00 0.00 61.00 63.59 1x4c s PRO 95 Cb -0.50 -3.93 0.07 0.00 0.04 0.00 0.00 34.50 30.18 1x4c s PRO 95 CO 0.55 -0.89 0.22 -1.12 0.04 0.00 0.00 177.00 175.80 1x4c s SER 96 N 3.12 0.90 0.13 6.66 0.01 -1.26 -5.00 113.70 118.25 1x4c s SER 96 Ca 0.68 0.17 0.00 0.00 1.31 0.00 0.00 55.95 58.11 1x4c s SER 96 Cb -0.28 0.45 0.00 0.00 0.21 0.00 0.00 66.02 66.40 1x4c s SER 96 CO 0.25 -0.28 0.00 0.00 0.41 0.00 0.00 173.24 173.62 1x4c n TYR 97 N 5.33 -1.37 -4.76 2.43 4.19 -1.26 -5.15 117.16 116.57 1x4c n TYR 97 Ca -0.05 0.25 0.00 0.00 3.31 0.00 0.00 57.90 61.41 1x4c n TYR 97 Cb 0.50 0.74 0.00 0.00 0.49 0.00 0.00 39.34 41.07 1x4c n TYR 97 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 1x4c n GLY 98 N 1.06 0.55 0.42 2.98 0.00 -1.26 -4.68 105.19 104.26 1x4c n GLY 98 Ca 0.00 -0.82 -0.04 0.00 0.00 0.00 0.00 46.02 45.16 1x4c n GLY 98 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x4c n ARG 99 N 0.00 0.24 -2.02 1.61 1.74 -1.26 -5.12 116.66 111.85 1x4c n ARG 99 Ca 0.00 0.09 -0.03 0.00 -0.77 0.00 0.00 57.85 57.15 1x4c n ARG 99 Cb 0.00 -0.87 -0.02 0.00 -1.02 0.00 0.00 32.46 30.55 1x4c n ARG 99 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1x4c n SER 100 N -3.65 -1.16 -3.69 0.55 7.64 -1.26 -5.10 113.62 106.95 1x4c n SER 100 Ca -0.06 0.65 -0.15 0.00 1.01 0.00 0.00 58.87 60.32 1x4c n SER 100 Cb 0.23 -3.06 -0.08 0.00 -1.01 0.00 0.00 64.21 60.30 1x4c n SER 100 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1x4c s ARG 101 N -0.84 0.79 0.00 1.43 3.00 -1.26 -5.14 118.95 116.93 1x4c s ARG 101 Ca -0.14 -0.06 0.00 0.00 0.00 0.00 0.00 55.73 55.52 1x4c s ARG 101 Cb 0.01 0.36 0.00 0.00 0.00 0.00 0.00 34.95 35.32 1x4c s ARG 101 CO 0.39 -0.23 0.00 -1.13 0.00 0.00 0.00 175.30 174.32 1x4c n SER 102 N 1.14 0.00 -3.64 0.23 3.41 -1.26 -5.17 113.62 108.33 1x4c n SER 102 Ca -0.21 0.00 -0.07 0.00 -0.26 0.00 0.00 58.87 58.33 1x4c n SER 102 Cb 0.56 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.44 1x4c n SER 102 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1x4c s SER 103 N 0.00 -0.43 -0.07 4.04 1.04 -1.26 -5.18 113.70 111.83 1x4c s SER 103 Ca 0.00 0.80 -0.16 0.00 0.48 0.00 0.00 55.95 57.07 1x4c s SER 103 Cb 0.00 0.90 0.03 0.00 0.10 0.00 0.00 66.02 67.05 1x4c s SER 103 CO 0.00 -0.14 0.39 -0.83 0.98 0.00 0.00 173.24 173.64 1x4c s GLY 104 N 0.48 -0.26 -0.02 7.32 0.00 -1.26 -5.13 107.32 108.44 1x4c s GLY 104 Ca 0.01 0.76 -0.30 0.00 0.00 0.00 0.00 44.72 45.18 1x4c s GLY 104 CO -0.09 0.55 1.46 2.56 0.00 0.00 0.00 173.10 177.59 1x4c s PRO 105 N -0.70 4.25 -0.13 2.90 0.04 -1.26 -5.01 135.00 135.10 1x4c s PRO 105 Ca -0.08 2.02 -0.05 0.00 0.04 0.00 0.00 61.00 62.93 1x4c s PRO 105 Cb -0.04 -3.68 0.06 0.00 0.04 0.00 0.00 34.50 30.89 1x4c s PRO 105 CO 0.03 -0.66 0.28 -1.12 0.04 0.00 0.00 177.00 175.58 1x4c s SER 106 N 2.23 0.01 -0.03 6.66 0.01 -1.26 -5.15 113.70 116.18 1x4c s SER 106 Ca 0.66 0.63 0.02 0.00 1.31 0.00 0.00 55.95 58.56 1x4c s SER 106 Cb -0.32 0.65 0.01 0.00 0.21 0.00 0.00 66.02 66.57 1x4c s SER 106 CO 0.26 -0.21 -0.08 -0.55 0.41 0.00 0.00 173.24 173.08 1x4c s SER 107 N 1.93 1.09 0.00 2.44 0.15 -1.26 -5.34 113.70 112.72 1x4c s SER 107 Ca -0.04 -0.17 0.00 0.00 0.70 0.00 0.00 55.95 56.45 1x4c s SER 107 Cb -0.11 -0.34 0.00 0.00 -1.71 0.00 0.00 66.02 63.86 1x4c s SER 107 CO -0.09 0.04 0.00 0.61 1.20 0.00 0.00 173.24 174.99