#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 -0.02 -4.53 1.61 2.88 -1.26 -5.15 113.62 107.15 1x4c n SER 2 Ca 0.00 0.36 -0.34 0.00 -1.33 0.00 0.00 58.87 57.55 1x4c n SER 2 Cb 0.00 0.38 0.10 0.00 -0.75 0.00 0.00 64.21 63.94 1x4c n SER 2 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1x4c n SER 3 N -2.71 -0.65 0.00 -3.46 2.88 -1.26 -4.45 113.62 103.97 1x4c n SER 3 Ca 0.00 0.53 0.00 0.00 -1.33 0.00 0.00 58.87 58.07 1x4c n SER 3 Cb 0.00 -1.31 0.00 0.00 -0.75 0.00 0.00 64.21 62.15 1x4c n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x4c n GLY 4 N 1.24 1.60 0.86 0.46 0.00 -1.26 -5.12 105.19 102.96 1x4c n GLY 4 Ca 0.10 -0.57 0.11 0.00 0.00 0.00 0.00 46.02 45.66 1x4c n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1x4c n SER 5 N 0.00 -4.84 -4.97 1.61 3.41 -1.26 -4.88 113.62 102.69 1x4c n SER 5 Ca 0.00 0.37 -0.19 0.00 -0.26 0.00 0.00 58.87 58.79 1x4c n SER 5 Cb 0.00 -2.80 -0.01 0.00 -0.26 0.00 0.00 64.21 61.14 1x4c n SER 5 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1x4c s SER 6 N -4.63 5.74 0.00 4.04 1.04 -1.26 -4.98 113.70 113.65 1x4c s SER 6 Ca 0.00 -0.33 0.00 0.00 0.48 0.00 0.00 55.95 56.10 1x4c s SER 6 Cb 0.00 -1.01 0.00 0.00 0.10 0.00 0.00 66.02 65.11 1x4c s SER 6 CO 0.00 -0.52 0.00 0.61 0.98 0.00 0.00 173.24 174.31 1x4c n GLY 7 N -1.65 -2.13 3.21 7.32 0.00 -1.26 -5.15 105.19 105.53 1x4c n GLY 7 Ca 0.02 0.70 -0.35 0.00 0.00 0.00 0.00 46.02 46.39 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 -3.11 3.73 -0.02 0.00 -1.26 -4.94 105.19 99.60 1x4c n GLY 8 Ca 0.00 -0.71 -0.30 0.00 0.00 0.00 0.00 46.02 45.01 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 -2.87 1.58 0.77 1.61 0.04 -1.26 -5.03 135.00 129.85 1x4c s PRO 9 Ca 0.49 0.93 -0.11 0.00 0.04 0.00 0.00 61.00 62.35 1x4c s PRO 9 Cb -0.15 -1.84 0.06 0.00 0.04 0.00 0.00 34.50 32.61 1x4c s PRO 9 CO 0.73 -2.05 1.09 -1.25 0.04 0.00 0.00 177.00 175.56 1x4c s PRO 10 N -4.93 2.24 -0.02 0.56 0.04 -1.26 -5.05 135.00 126.58 1x4c s PRO 10 Ca 0.63 1.16 0.01 0.00 0.04 0.00 0.00 61.00 62.84 1x4c s PRO 10 Cb -0.18 -1.90 -0.03 0.00 0.04 0.00 0.00 34.50 32.43 1x4c s PRO 10 CO 0.57 -1.65 -0.02 0.45 0.04 0.00 0.00 177.00 176.38 1x4c s SER 11 N -3.40 5.01 0.69 6.66 0.15 -1.26 -5.11 113.70 116.44 1x4c s SER 11 Ca 0.61 -0.01 -0.12 0.00 0.70 0.00 0.00 55.95 57.12 1x4c s SER 11 Cb -0.17 -1.29 0.01 0.00 -1.71 0.00 0.00 66.02 62.85 1x4c s SER 11 CO 0.56 0.30 1.07 -0.13 1.20 0.00 0.00 173.24 176.24 1x4c s ARG 12 N -1.39 2.83 0.00 5.44 3.00 -1.26 -3.09 118.95 124.48 1x4c s ARG 12 Ca 0.18 1.12 0.00 0.00 0.00 0.00 0.00 55.73 57.03 1x4c s ARG 12 Cb -0.11 -1.97 0.00 0.00 0.00 0.00 0.00 34.95 32.87 1x4c s ARG 12 CO 0.08 -1.19 0.00 0.54 0.00 0.00 0.00 175.30 174.73 1x4c n ARG 13 N -2.89 -0.45 -1.32 3.54 3.00 -1.26 -4.70 116.66 112.58 1x4c n ARG 13 Ca 0.09 0.11 0.16 0.00 -0.01 0.00 0.00 57.85 58.20 1x4c n ARG 13 Cb 0.53 -4.10 -0.08 0.00 0.00 0.00 0.00 32.46 28.81 1x4c n ARG 13 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 1x4c n SER 14 N -0.23 -7.41 -0.89 0.55 7.64 -1.18 -4.70 113.62 107.40 1x4c n SER 14 Ca 0.00 1.23 0.01 0.00 1.01 0.00 0.00 58.87 61.11 1x4c n SER 14 Cb 0.11 -4.48 0.20 0.00 -1.01 0.00 0.00 64.21 59.04 1x4c n SER 14 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1x4c n GLU 15 N -4.15 1.76 -3.00 1.43 -0.58 -1.26 -4.94 120.64 109.90 1x4c n GLU 15 Ca -0.07 -3.19 -0.12 0.00 -0.42 0.00 0.00 57.16 53.36 1x4c n GLU 15 Cb 0.63 -1.73 0.05 0.00 -0.57 0.00 0.00 31.44 29.82 1x4c n GLU 15 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1x4c n ASN 16 N -1.11 -3.49 -4.52 1.62 5.03 -1.26 -4.72 115.26 106.80 1x4c n ASN 16 Ca 0.27 -0.33 -0.33 0.00 0.87 0.00 0.00 54.58 55.05 1x4c n ASN 16 Cb 0.88 -3.14 -0.12 0.00 -1.02 0.00 0.00 39.78 36.38 1x4c n ASN 16 CO 0.00 0.00 0.00 -0.60 -1.83 0.00 0.00 177.26 174.83 1x4c s ARG 17 N -5.35 2.73 0.14 3.52 3.52 -1.26 -0.38 118.95 121.87 1x4c s ARG 17 Ca 0.20 -0.62 0.06 0.00 -0.13 0.00 0.00 55.73 55.24 1x4c s ARG 17 Cb -0.09 -2.52 -0.04 0.00 -1.56 0.00 0.00 34.95 30.74 1x4c s ARG 17 CO 0.42 0.60 -0.14 0.14 -0.81 0.00 0.00 175.30 175.51 1x4c s VAL 18 N -0.65 1.42 0.04 7.11 -7.23 0.03 -1.22 120.40 119.91 1x4c s VAL 18 Ca 0.10 -1.87 0.02 0.00 -1.81 0.00 0.00 61.98 58.41 1x4c s VAL 18 Cb -0.11 -1.70 -0.04 0.00 0.56 0.00 0.00 36.38 35.09 1x4c s VAL 18 CO 0.01 -0.49 0.07 -0.69 -0.31 0.00 0.00 175.10 173.70 1x4c s VAL 19 N -2.44 4.55 0.14 1.32 1.01 -0.00 -1.92 120.40 123.06 1x4c s VAL 19 Ca 0.13 -0.64 0.08 0.00 0.00 0.00 0.00 61.98 61.55 1x4c s VAL 19 Cb -0.03 -3.14 -0.04 0.00 0.00 0.00 0.00 36.38 33.17 1x4c s VAL 19 CO 0.04 0.22 -0.18 -0.69 0.00 0.00 0.00 175.10 174.49 1x4c s VAL 20 N -1.29 1.68 0.18 2.92 1.01 0.31 -2.33 120.40 122.87 1x4c s VAL 20 Ca 0.26 -1.79 -0.12 0.00 0.00 0.00 0.00 61.98 60.33 1x4c s VAL 20 Cb -0.12 -1.71 0.00 0.00 0.00 0.00 0.00 36.38 34.56 1x4c s VAL 20 CO 0.18 -0.29 0.37 -0.94 0.00 0.00 0.00 175.10 174.43 1x4c s SER 21 N -2.46 -0.06 -0.24 3.32 1.04 -1.11 -2.23 113.70 111.97 1x4c s SER 21 Ca 0.12 -0.78 0.00 0.00 0.48 0.00 0.00 55.95 55.77 1x4c s SER 21 Cb -0.06 0.49 0.00 0.00 0.10 0.00 0.00 66.02 66.55 1x4c s SER 21 CO 0.05 -0.97 0.00 0.61 0.98 0.00 0.00 173.24 173.91 1x4c n GLY 22 N -0.27 0.41 3.78 7.32 0.00 -0.73 -2.42 105.19 113.29 1x4c n GLY 22 Ca -0.07 -0.87 -0.37 0.00 0.00 0.00 0.00 46.02 44.71 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 -0.66 4.40 0.98 0.99 1.43 -0.58 -4.45 118.68 120.79 1x4c s LEU 23 Ca 0.00 1.74 -0.12 0.00 -1.03 0.00 0.00 54.13 54.71 1x4c s LEU 23 Cb 0.00 -3.81 0.18 0.00 0.03 0.00 0.00 46.19 42.59 1x4c s LEU 23 CO 0.00 0.01 1.09 -2.16 0.23 0.00 0.00 176.35 175.52 1x4c s PRO 24 N -1.86 0.56 0.23 1.29 0.04 -1.26 -4.34 135.00 129.65 1x4c s PRO 24 Ca 0.46 0.58 -0.00 0.00 0.04 0.00 0.00 61.00 62.07 1x4c s PRO 24 Cb -0.19 -1.75 0.23 0.00 0.04 0.00 0.00 34.50 32.83 1x4c s PRO 24 CO 0.24 -2.66 1.59 -1.00 0.04 0.00 0.00 177.00 175.21 1x4c h PRO 25 N -1.84 0.51 0.00 0.56 0.13 -1.97 -3.03 132.00 126.36 1x4c h PRO 25 Ca -0.54 -0.27 0.00 0.00 -0.87 0.00 0.00 66.00 64.32 1x4c h PRO 25 Cb 1.32 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.46 1x4c h PRO 25 CO 0.57 0.85 -0.65 0.77 -0.23 0.00 0.00 178.00 179.31 1x4c h SER 26 N 0.41 0.00 -2.74 1.44 0.02 -2.01 -3.47 113.55 107.21 1x4c h SER 26 Ca 0.03 -0.12 -0.59 0.00 -0.84 0.00 0.00 61.79 60.27 1x4c h SER 26 Cb 0.93 0.00 0.10 0.00 0.14 0.00 0.00 62.40 63.57 1x4c h SER 26 CO 0.08 0.06 0.39 0.61 -1.14 0.00 0.00 176.83 176.83 1x4c n GLY 27 N 1.27 0.32 3.31 -3.77 0.00 -1.14 -4.85 105.19 100.32 1x4c n GLY 27 Ca 0.02 0.39 -0.17 0.00 0.00 0.00 0.00 46.02 46.27 1x4c n GLY 27 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1x4c s SER 28 N -0.20 1.93 0.14 1.61 0.15 -1.26 -4.91 113.70 111.16 1x4c s SER 28 Ca 0.62 -1.15 -0.18 0.00 0.70 0.00 0.00 55.95 55.94 1x4c s SER 28 Cb -0.66 -0.02 0.02 0.00 -1.71 0.00 0.00 66.02 63.65 1x4c s SER 28 CO 0.57 -0.43 1.72 4.11 1.20 0.00 0.00 173.24 180.42 1x4c h TRP 29 N 2.55 0.05 -1.21 3.44 5.08 -1.91 -0.81 115.95 123.14 1x4c h TRP 29 Ca -0.38 0.02 0.35 0.00 1.08 0.00 0.00 58.89 59.96 1x4c h TRP 29 Cb 1.21 0.02 -0.05 0.00 -3.00 0.00 0.00 29.16 27.35 1x4c h TRP 29 CO 0.61 -0.01 1.04 1.96 -1.28 0.00 0.00 178.44 180.77 1x4c h GLN 30 N 0.12 0.00 0.00 0.12 4.20 -1.97 -1.07 115.11 116.51 1x4c h GLN 30 Ca 0.13 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.82 1x4c h GLN 30 Cb 0.15 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.93 1x4c h GLN 30 CO -0.19 0.00 -0.50 -0.44 -0.67 0.00 0.00 178.83 177.03 1x4c h ASP 31 N 0.00 0.00 -0.99 1.46 3.32 -1.57 -3.33 116.42 115.30 1x4c h ASP 31 Ca 0.58 -0.06 0.20 0.00 0.02 0.00 0.00 57.03 57.76 1x4c h ASP 31 Cb 2.65 0.00 -0.19 0.00 0.22 0.00 0.00 39.33 42.01 1x4c h ASP 31 CO -0.01 0.79 -0.26 -0.11 -1.72 0.00 0.00 179.24 177.93 1x4c n LEU 32 N -4.62 -0.38 -0.27 1.55 7.94 -0.52 0.11 117.00 120.81 1x4c n LEU 32 Ca -0.08 1.71 0.03 0.00 -1.11 0.00 0.00 56.01 56.55 1x4c n LEU 32 Cb 0.27 -0.51 0.16 0.00 0.53 0.00 0.00 43.42 43.87 1x4c n LEU 32 CO 0.10 -1.63 1.11 0.50 -1.11 0.00 0.00 177.39 176.35 1x4c h LYS 33 N 0.00 0.68 -0.46 1.96 3.11 -1.45 0.30 116.57 120.71 1x4c h LYS 33 Ca 0.47 -0.04 0.07 0.00 -2.81 0.00 0.00 60.65 58.34 1x4c h LYS 33 Cb 0.72 -0.15 -0.06 0.00 -1.00 0.00 0.00 32.23 31.73 1x4c h LYS 33 CO -1.02 0.45 0.10 0.22 -2.81 0.00 0.00 179.45 176.39 1x4c h ASP 34 N 0.70 0.02 0.07 4.20 3.58 0.73 0.57 116.42 126.29 1x4c h ASP 34 Ca 0.38 0.08 -0.13 0.00 0.42 0.00 0.00 57.03 57.78 1x4c h ASP 34 Cb 0.39 0.10 -0.01 0.00 1.72 0.00 0.00 39.33 41.53 1x4c h ASP 34 CO -0.26 0.04 -0.43 -0.74 -2.88 0.00 0.00 179.24 174.97 1x4c h HIS 35 N 0.24 0.54 0.00 0.28 2.76 -0.87 -2.84 115.15 115.25 1x4c h HIS 35 Ca 0.23 -0.16 -0.07 0.00 -2.20 0.00 0.00 60.37 58.17 1x4c h HIS 35 Cb 0.28 -0.11 -0.01 0.00 1.55 0.00 0.00 27.41 29.12 1x4c h HIS 35 CO -0.21 0.81 -0.34 0.52 -1.30 0.00 0.00 177.93 177.40 1x4c h MET 36 N 0.37 0.00 -0.93 5.26 2.86 0.08 -3.18 114.93 119.39 1x4c h MET 36 Ca 0.03 0.00 0.14 0.00 -2.06 0.00 0.00 59.70 57.81 1x4c h MET 36 Cb 0.91 0.00 -0.09 0.00 0.06 0.00 0.00 31.60 32.48 1x4c h MET 36 CO 0.08 0.34 0.54 0.00 1.06 0.00 0.00 176.91 178.93 1x4c h ARG 37 N 0.00 0.78 -1.37 1.72 3.08 0.36 -0.72 114.38 118.24 1x4c h ARG 37 Ca -0.00 -0.05 0.40 0.00 0.07 0.00 0.00 59.98 60.40 1x4c h ARG 37 Cb 0.94 -0.18 -0.05 0.00 0.08 0.00 0.00 29.97 30.76 1x4c h ARG 37 CO 0.04 0.52 1.29 0.39 -1.07 0.00 0.00 179.97 181.15 1x4c n GLU 38 N -4.74 0.01 0.05 0.04 4.71 -1.20 0.21 120.64 119.72 1x4c n GLU 38 Ca 0.18 1.04 -0.20 0.00 -0.01 0.00 0.00 57.16 58.17 1x4c n GLU 38 Cb 0.41 -2.51 -0.12 0.00 -1.01 0.00 0.00 31.44 28.20 1x4c n GLU 38 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1x4c h ALA 39 N 0.69 0.02 0.00 0.62 0.00 -1.37 -3.50 119.26 115.71 1x4c h ALA 39 Ca 0.65 -0.68 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1x4c h ALA 39 Cb 3.23 0.08 0.00 0.00 0.00 0.00 0.00 17.79 21.10 1x4c h ALA 39 CO -0.01 0.52 0.00 0.41 0.00 0.00 0.00 179.25 180.18 1x4c n GLY 40 N 1.28 -0.59 3.46 0.00 0.00 0.57 -4.57 105.19 105.35 1x4c n GLY 40 Ca -0.12 0.43 -0.33 0.00 0.00 0.00 0.00 46.02 46.00 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 4.23 -0.02 1.61 1.01 -1.26 -4.68 116.67 113.56 1x4c s ASP 41 Ca 0.00 -0.20 -0.09 0.00 0.71 0.00 0.00 52.55 52.97 1x4c s ASP 41 Cb 0.00 -1.28 -0.05 0.00 1.01 0.00 0.00 42.92 42.60 1x4c s ASP 41 CO 0.00 0.27 0.28 -0.69 0.21 0.00 0.00 175.17 175.24 1x4c s VAL 42 N -0.25 5.27 -0.07 -1.27 1.01 -1.26 -3.00 120.40 120.83 1x4c s VAL 42 Ca 0.02 0.37 0.04 0.00 0.00 0.00 0.00 61.98 62.41 1x4c s VAL 42 Cb -0.13 -3.57 -0.07 0.00 0.00 0.00 0.00 36.38 32.62 1x4c s VAL 42 CO 0.03 0.47 -0.01 0.00 0.00 0.00 0.00 175.10 175.59 1x4c s TYR 44 N -2.15 -0.01 -0.12 0.00 5.04 -1.07 -4.95 117.35 114.08 1x4c s TYR 44 Ca -0.05 0.14 -0.06 0.00 -2.44 0.00 0.00 57.07 54.65 1x4c s TYR 44 Cb 0.02 -0.12 0.05 0.00 0.35 0.00 0.00 41.96 42.26 1x4c s TYR 44 CO 0.23 -0.06 0.28 0.00 -1.34 0.00 0.00 175.55 174.65 1x4c s ALA 45 N 0.63 -0.65 -0.28 3.97 0.00 -1.26 -1.81 121.76 122.35 1x4c s ALA 45 Ca -0.05 1.10 -0.22 0.00 0.00 0.00 0.00 51.96 52.79 1x4c s ALA 45 Cb -0.07 -0.72 0.13 0.00 0.00 0.00 0.00 23.12 22.45 1x4c s ALA 45 CO -0.02 -0.25 1.00 0.34 0.00 0.00 0.00 175.76 176.83 1x4c s ASP 46 N 1.38 -0.49 0.34 0.00 2.15 -1.21 -4.93 116.67 113.90 1x4c s ASP 46 Ca -0.09 0.89 0.07 0.00 0.43 0.00 0.00 52.55 53.85 1x4c s ASP 46 Cb -0.10 1.01 -0.02 0.00 -0.30 0.00 0.00 42.92 43.50 1x4c s ASP 46 CO -0.09 -0.15 0.36 0.68 -0.17 0.00 0.00 175.17 175.79 1x4c s VAL 47 N 0.63 3.67 0.26 1.11 -7.23 -1.26 -2.48 120.40 115.10 1x4c s VAL 47 Ca -0.01 -1.24 0.10 0.00 -1.81 0.00 0.00 61.98 59.02 1x4c s VAL 47 Cb -0.05 -3.25 -0.05 0.00 0.56 0.00 0.00 36.38 33.60 1x4c s VAL 47 CO -0.09 -0.16 -0.18 -0.31 -0.31 0.00 0.00 175.10 174.05 1x4c s TYR 48 N -2.27 2.08 -1.31 2.82 2.02 0.17 -4.97 117.35 115.89 1x4c s TYR 48 Ca 0.43 -0.43 -0.18 0.00 -0.37 0.00 0.00 57.07 56.52 1x4c s TYR 48 Cb -0.07 -0.93 0.07 0.00 -0.40 0.00 0.00 41.96 40.63 1x4c s TYR 48 CO 0.28 0.58 1.76 0.54 -1.57 0.00 0.00 175.55 177.14 1x4c n ARG 49 N -0.54 3.19 0.00 -0.62 1.74 -1.26 -3.25 116.66 115.92 1x4c n ARG 49 Ca -0.06 -3.26 0.00 0.00 -0.77 0.00 0.00 57.85 53.76 1x4c n ARG 49 Cb 0.60 -3.48 0.00 0.00 -1.02 0.00 0.00 32.46 28.56 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 8.21 0.00 0.00 0.55 9.92 -1.26 -5.00 116.55 128.97 1x4c n ASP 50 Ca 0.49 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.75 1x4c n ASP 50 Cb 0.46 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.94 1x4c n ASP 50 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1x4c n GLY 51 N 0.00 1.94 2.97 0.44 0.00 -1.20 -4.89 105.19 104.45 1x4c n GLY 51 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.00 0.38 0.09 2.61 -4.23 -1.26 -1.53 115.64 109.70 1x4c s THR 52 Ca 0.00 -0.41 -0.04 0.00 -1.18 0.00 0.00 61.69 60.06 1x4c s THR 52 Cb 0.00 -0.36 -0.02 0.00 1.34 0.00 0.00 72.50 73.45 1x4c s THR 52 CO 0.00 -0.03 0.09 -0.83 -0.54 0.00 0.00 174.62 173.32 1x4c s GLY 53 N -0.47 0.45 -0.06 3.99 0.00 -0.94 -0.66 107.32 109.62 1x4c s GLY 53 Ca -0.01 -1.04 0.02 0.00 0.00 0.00 0.00 44.72 43.69 1x4c s GLY 53 CO -0.00 -1.11 -0.11 -1.34 0.00 0.00 0.00 173.10 170.54 1x4c s VAL 54 N -3.93 1.05 -0.04 1.40 -7.23 -1.03 0.11 120.40 110.73 1x4c s VAL 54 Ca 0.11 -0.42 0.04 0.00 -1.81 0.00 0.00 61.98 59.89 1x4c s VAL 54 Cb 0.06 -0.97 -0.00 0.00 0.56 0.00 0.00 36.38 36.03 1x4c s VAL 54 CO -0.07 0.34 -0.15 -0.69 -0.31 0.00 0.00 175.10 174.21 1x4c s VAL 55 N 0.73 1.29 -0.24 1.32 1.01 -0.81 -3.35 120.40 120.35 1x4c s VAL 55 Ca -0.13 -0.64 -0.02 0.00 0.00 0.00 0.00 61.98 61.18 1x4c s VAL 55 Cb -0.15 -1.11 0.02 0.00 0.00 0.00 0.00 36.38 35.13 1x4c s VAL 55 CO 0.03 0.38 -0.06 -0.70 0.00 0.00 0.00 175.10 174.74 1x4c s GLU 56 N 0.04 2.94 -0.26 2.72 2.12 -0.75 -0.79 118.70 124.72 1x4c s GLU 56 Ca -0.03 -0.91 -0.24 0.00 0.36 0.00 0.00 54.97 54.14 1x4c s GLU 56 Cb -0.11 -2.98 -0.00 0.00 0.26 0.00 0.00 34.13 31.31 1x4c s GLU 56 CO 0.02 -0.36 0.83 -0.06 -0.54 0.00 0.00 175.26 175.15 1x4c s PHE 57 N 1.35 3.28 0.52 5.30 0.08 0.49 -0.56 117.98 128.45 1x4c s PHE 57 Ca 0.01 1.06 0.33 0.00 0.12 0.00 0.00 56.93 58.45 1x4c s PHE 57 Cb -0.16 -3.11 1.47 0.00 -0.57 0.00 0.00 43.02 40.65 1x4c s PHE 57 CO -0.05 -0.45 1.83 -0.24 -0.10 0.00 0.00 175.22 176.22 1x4c h VAL 58 N 5.48 0.48 -3.77 -0.44 3.04 -1.83 -3.33 116.25 115.88 1x4c h VAL 58 Ca -0.23 -0.02 -0.68 0.00 -1.01 0.00 0.00 66.70 64.76 1x4c h VAL 58 Cb 1.09 0.42 -0.34 0.00 -2.01 0.00 0.00 31.29 30.45 1x4c h VAL 58 CO 0.88 0.01 -0.71 -0.13 -1.01 0.00 0.00 177.57 176.61 1x4c s ARG 59 N -5.03 2.30 0.28 4.17 0.52 -1.26 -4.99 118.95 114.94 1x4c s ARG 59 Ca -0.05 -1.36 -0.06 0.00 -0.52 0.00 0.00 55.73 53.73 1x4c s ARG 59 Cb 0.23 -3.14 0.52 0.00 0.52 0.00 0.00 34.95 33.07 1x4c s ARG 59 CO 0.79 -0.66 1.56 -0.22 0.02 0.00 0.00 175.30 176.80 1x4c h LYS 60 N 7.92 0.00 -0.99 3.54 3.64 -1.94 0.51 116.57 129.26 1x4c h LYS 60 Ca -0.19 -0.00 0.31 0.00 -1.27 0.00 0.00 60.65 59.50 1x4c h LYS 60 Cb 1.05 -0.00 -0.18 0.00 -0.41 0.00 0.00 32.23 32.69 1x4c h LYS 60 CO 0.53 0.00 0.17 -1.91 -2.27 0.00 0.00 179.45 175.96 1x4c n GLU 61 N -5.60 -0.07 -0.04 1.90 2.13 -1.26 0.19 120.64 117.88 1x4c n GLU 61 Ca 0.17 1.45 -0.08 0.00 0.66 0.00 0.00 57.16 59.37 1x4c n GLU 61 Cb 0.55 -2.39 0.09 0.00 0.27 0.00 0.00 31.44 29.96 1x4c n GLU 61 CO 0.00 0.00 0.00 -0.44 -0.41 0.00 0.00 177.13 176.28 1x4c h ASP 62 N 0.00 0.70 0.36 4.31 3.32 -0.22 -2.43 116.42 122.46 1x4c h ASP 62 Ca 0.67 -0.29 -0.02 0.00 0.02 0.00 0.00 57.03 57.41 1x4c h ASP 62 Cb 1.52 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 40.88 1x4c h ASP 62 CO -0.88 0.98 -0.17 -0.03 -1.72 0.00 0.00 179.24 177.41 1x4c h MET 63 N 0.56 -0.47 -0.42 3.56 4.05 0.23 0.13 114.93 122.57 1x4c h MET 63 Ca 0.06 0.03 0.02 0.00 -0.28 0.00 0.00 59.70 59.53 1x4c h MET 63 Cb 0.85 0.11 -0.02 0.00 -0.80 0.00 0.00 31.60 31.74 1x4c h MET 63 CO 0.07 -0.26 0.28 1.15 0.23 0.00 0.00 176.91 178.38 1x4c h THR 64 N -0.57 1.07 -0.01 -0.77 2.02 -1.11 -1.36 112.91 112.19 1x4c h THR 64 Ca -0.05 -0.18 -0.17 0.00 0.77 0.00 0.00 66.41 66.78 1x4c h THR 64 Cb 0.43 0.51 -0.02 0.00 -1.74 0.00 0.00 68.15 67.33 1x4c h THR 64 CO 0.08 0.09 -0.77 0.22 0.37 0.00 0.00 175.52 175.51 1x4c h TYR 65 N 0.52 0.14 -0.31 3.16 5.03 -1.17 -3.02 116.97 121.33 1x4c h TYR 65 Ca 0.16 -0.07 -0.06 0.00 2.58 0.00 0.00 58.73 61.34 1x4c h TYR 65 Cb 0.02 -0.02 -0.01 0.00 1.55 0.00 0.00 36.73 38.27 1x4c h TYR 65 CO -0.00 0.83 -0.02 0.00 -1.32 0.00 0.00 178.16 177.64 1x4c h ALA 66 N 1.15 0.42 0.00 1.82 0.00 0.36 0.13 119.26 123.13 1x4c h ALA 66 Ca -0.02 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1x4c h ALA 66 Cb 1.36 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1x4c h ALA 66 CO 0.11 0.20 0.00 -0.39 0.00 0.00 0.00 179.25 179.16 1x4c h VAL 67 N 0.35 0.00 0.00 0.00 -1.51 -1.45 1.29 116.25 114.93 1x4c h VAL 67 Ca 0.08 -0.36 -0.18 0.00 -1.23 0.00 0.00 66.70 65.01 1x4c h VAL 67 Cb 0.48 1.26 -0.03 0.00 -2.13 0.00 0.00 31.29 30.87 1x4c h VAL 67 CO 0.02 0.00 -1.08 0.03 -1.23 0.00 0.00 177.57 175.31 1x4c h ARG 68 N 0.00 0.00 0.01 5.19 3.08 -1.33 -3.39 114.38 117.94 1x4c h ARG 68 Ca 0.00 0.00 -0.34 0.00 0.07 0.00 0.00 59.98 59.71 1x4c h ARG 68 Cb 0.41 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.41 1x4c h ARG 68 CO 0.00 0.80 -1.85 1.63 -1.07 0.00 0.00 179.97 179.48 1x4c n LYS 69 N -4.47 0.60 -1.77 0.04 4.76 0.41 -4.48 118.16 113.24 1x4c n LYS 69 Ca -0.27 0.41 -0.38 0.00 -2.87 0.00 0.00 58.31 55.21 1x4c n LYS 69 Cb 0.59 -1.64 -0.02 0.00 -1.84 0.00 0.00 35.03 32.12 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 -4.18 7.96 -3.66 -0.35 4.77 0.44 -4.82 117.00 117.16 1x4c n LEU 70 Ca -0.41 -4.65 -0.27 0.00 -0.03 0.00 0.00 56.01 50.66 1x4c n LEU 70 Cb 0.81 -1.39 -0.17 0.00 -2.33 0.00 0.00 43.42 40.35 1x4c n LEU 70 CO 0.17 2.02 -0.34 -0.62 -1.33 0.00 0.00 177.39 177.29 1x4c s ASP 71 N 0.80 2.70 -0.03 -1.43 -1.08 -1.09 -4.19 116.67 112.36 1x4c s ASP 71 Ca 0.58 -0.77 -0.00 0.00 -0.52 0.00 0.00 52.55 51.84 1x4c s ASP 71 Cb 0.21 -0.41 0.00 0.00 -1.46 0.00 0.00 42.92 41.25 1x4c s ASP 71 CO -0.10 -0.34 0.03 -3.20 0.52 0.00 0.00 175.17 172.08 1x4c n ASN 72 N 5.17 -2.07 -4.69 -0.34 5.15 0.66 -4.84 115.26 114.30 1x4c n ASN 72 Ca -0.08 -0.01 -0.25 0.00 -0.60 0.00 0.00 54.58 53.64 1x4c n ASN 72 Cb 0.48 -0.60 -0.07 0.00 -0.53 0.00 0.00 39.78 39.06 1x4c n ASN 72 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 1x4c s THR 73 N -3.01 3.84 -0.26 -0.44 -4.23 -0.82 -4.78 115.64 105.94 1x4c s THR 73 Ca 0.01 -1.49 -0.29 0.00 -1.18 0.00 0.00 61.69 58.74 1x4c s THR 73 Cb -0.00 -2.98 -0.02 0.00 1.34 0.00 0.00 72.50 70.84 1x4c s THR 73 CO 0.02 -0.20 1.55 -0.75 -0.54 0.00 0.00 174.62 174.70 1x4c s LYS 74 N -3.24 3.77 -0.15 3.99 2.20 -1.26 -1.07 119.74 123.98 1x4c s LYS 74 Ca 0.29 1.51 -0.05 0.00 -0.36 0.00 0.00 55.97 57.36 1x4c s LYS 74 Cb -0.09 -4.01 -0.04 0.00 -1.51 0.00 0.00 37.83 32.18 1x4c s LYS 74 CO 0.20 -1.32 0.03 0.12 -0.36 0.00 0.00 175.35 174.02 1x4c s PHE 75 N 5.16 3.20 -0.03 4.03 2.19 0.47 -4.87 117.98 128.12 1x4c s PHE 75 Ca 0.68 0.02 0.04 0.00 0.33 0.00 0.00 56.93 58.01 1x4c s PHE 75 Cb -0.22 -1.99 -0.03 0.00 -1.31 0.00 0.00 43.02 39.47 1x4c s PHE 75 CO 0.28 0.19 -0.14 0.50 1.83 0.00 0.00 175.22 177.89 1x4c s ARG 76 N 0.07 2.44 0.52 10.12 3.52 -1.26 -0.29 118.95 134.07 1x4c s ARG 76 Ca 0.04 -0.74 0.09 0.00 -0.13 0.00 0.00 55.73 54.99 1x4c s ARG 76 Cb -0.13 -2.36 0.06 0.00 -1.56 0.00 0.00 34.95 30.97 1x4c s ARG 76 CO 0.01 0.61 0.71 -1.54 -0.81 0.00 0.00 175.30 174.28 1x4c s SER 77 N -0.89 5.27 0.42 -2.12 1.04 -0.19 -4.94 113.70 112.29 1x4c s SER 77 Ca 0.12 -0.72 0.29 0.00 0.48 0.00 0.00 55.95 56.12 1x4c s SER 77 Cb -0.11 -0.01 1.45 0.00 0.10 0.00 0.00 66.02 67.46 1x4c s SER 77 CO 0.02 -1.15 1.88 1.12 0.98 0.00 0.00 173.24 176.09 1x4c h HIS 78 N 0.34 0.00 -0.04 5.02 2.07 -1.89 -0.10 115.15 120.55 1x4c h HIS 78 Ca -0.33 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.19 1x4c h HIS 78 Cb 1.29 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.27 1x4c h HIS 78 CO 0.43 0.00 0.00 0.39 -3.07 0.00 0.00 177.93 175.68 1x4c n GLU 79 N -2.55 1.42 0.00 5.12 -0.58 -1.26 -4.90 120.64 117.89 1x4c n GLU 79 Ca -0.01 -0.61 0.00 0.00 -0.42 0.00 0.00 57.16 56.12 1x4c n GLU 79 Cb 0.12 -1.45 0.00 0.00 -0.57 0.00 0.00 31.44 29.54 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 1.08 3.15 3.72 0.62 0.00 -0.05 -5.01 105.19 108.69 1x4c n GLY 80 Ca 0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 1x4c n GLY 80 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1x4c n GLU 81 N -1.97 1.19 -4.33 1.61 2.13 -1.26 -4.66 120.64 113.36 1x4c n GLU 81 Ca 0.00 0.46 -0.20 0.00 0.66 0.00 0.00 57.16 58.08 1x4c n GLU 81 Cb 0.00 -2.49 -0.11 0.00 0.27 0.00 0.00 31.44 29.11 1x4c n GLU 81 CO 0.00 0.00 0.00 0.95 -0.41 0.00 0.00 177.13 177.67 1x4c s THR 82 N -1.38 1.75 -0.29 6.31 -4.23 -1.26 -1.02 115.64 115.52 1x4c s THR 82 Ca 0.80 -1.99 -0.18 0.00 -1.18 0.00 0.00 61.69 59.14 1x4c s THR 82 Cb -0.39 -1.87 0.17 0.00 1.34 0.00 0.00 72.50 71.74 1x4c s THR 82 CO 0.43 -0.41 1.11 0.00 -0.54 0.00 0.00 174.62 175.21 1x4c s ALA 83 N -2.33 -2.35 -0.19 3.99 0.00 0.60 -4.95 121.76 116.53 1x4c s ALA 83 Ca 0.17 2.06 -0.29 0.00 0.00 0.00 0.00 51.96 53.90 1x4c s ALA 83 Cb -0.04 -1.77 -0.02 0.00 0.00 0.00 0.00 23.12 21.29 1x4c s ALA 83 CO 0.06 -0.30 1.44 0.71 0.00 0.00 0.00 175.76 177.67 1x4c s TYR 84 N 1.02 2.46 0.03 0.00 2.02 -1.26 -0.40 117.35 121.22 1x4c s TYR 84 Ca -0.06 0.71 0.02 0.00 -0.37 0.00 0.00 57.07 57.36 1x4c s TYR 84 Cb -0.03 -3.79 -0.04 0.00 -0.40 0.00 0.00 41.96 37.69 1x4c s TYR 84 CO -0.12 -2.42 0.04 0.96 -1.57 0.00 0.00 175.55 172.43 1x4c s ILE 85 N 4.24 4.38 -0.08 2.71 -4.36 -0.23 -4.62 121.20 123.24 1x4c s ILE 85 Ca 0.63 -0.65 0.00 0.00 -0.26 0.00 0.00 60.65 60.37 1x4c s ILE 85 Cb -0.24 -3.03 -0.03 0.00 1.25 0.00 0.00 42.46 40.42 1x4c s ILE 85 CO 0.23 0.27 -0.07 -0.13 0.24 0.00 0.00 174.94 175.48 1x4c s ARG 86 N -1.92 2.86 -0.07 0.37 1.81 -1.01 -0.24 118.95 120.74 1x4c s ARG 86 Ca 0.24 -0.56 0.05 0.00 -1.72 0.00 0.00 55.73 53.74 1x4c s ARG 86 Cb -0.12 -2.62 -0.01 0.00 -0.45 0.00 0.00 34.95 31.76 1x4c s ARG 86 CO 0.15 0.60 -0.24 0.08 -0.68 0.00 0.00 175.30 175.20 1x4c s VAL 87 N -0.63 2.04 -0.00 3.52 1.01 -1.26 -2.74 120.40 122.34 1x4c s VAL 87 Ca 0.09 -1.04 -0.09 0.00 0.00 0.00 0.00 61.98 60.94 1x4c s VAL 87 Cb -0.12 -1.74 0.01 0.00 0.00 0.00 0.00 36.38 34.53 1x4c s VAL 87 CO 0.02 0.56 0.17 -1.59 0.00 0.00 0.00 175.10 174.26 1x4c s LYS 88 N 0.01 0.52 0.02 2.72 -2.85 -0.99 -4.64 119.74 114.53 1x4c s LYS 88 Ca -0.09 -0.35 -0.30 0.00 -1.00 0.00 0.00 55.97 54.23 1x4c s LYS 88 Cb -0.15 0.22 -0.07 0.00 -2.06 0.00 0.00 37.83 35.77 1x4c s LYS 88 CO 0.05 -0.13 1.55 0.54 0.10 0.00 0.00 175.35 177.47 1x4c s VAL 89 N -1.35 3.40 -0.80 1.79 0.11 -1.26 -0.82 120.40 121.48 1x4c s VAL 89 Ca -0.14 0.77 -0.28 0.00 -2.93 0.00 0.00 61.98 59.40 1x4c s VAL 89 Cb -0.07 -3.49 -0.17 0.00 -1.53 0.00 0.00 36.38 31.12 1x4c s VAL 89 CO 0.02 -0.02 2.55 -0.67 -3.33 0.00 0.00 175.10 173.66 1x4c n ASP 90 N 5.80 1.03 -0.92 3.54 -0.08 -0.35 -4.38 116.55 121.19 1x4c n ASP 90 Ca 0.15 -0.20 0.00 0.00 -1.51 0.00 0.00 54.79 53.23 1x4c n ASP 90 Cb 0.42 -1.19 0.00 0.00 2.34 0.00 0.00 41.12 42.70 1x4c n ASP 90 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1x4c n GLY 91 N 6.27 -3.70 2.79 0.27 0.00 -1.26 -4.99 105.19 104.57 1x4c n GLY 91 Ca 0.54 -0.98 -0.24 0.00 0.00 0.00 0.00 46.02 45.34 1x4c n GLY 91 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1x4c n PRO 92 N -1.67 -2.72 0.00 1.61 -0.04 -1.26 -4.98 135.00 125.94 1x4c n PRO 92 Ca 0.00 -1.39 0.00 0.00 -0.04 0.00 0.00 63.50 62.07 1x4c n PRO 92 Cb 0.17 -1.31 0.00 0.00 -0.04 0.00 0.00 33.50 32.33 1x4c n PRO 92 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 1x4c n ARG 93 N -4.17 0.00 -2.75 0.54 0.63 -1.26 -5.06 116.66 104.59 1x4c n ARG 93 Ca 0.12 0.00 -0.04 0.00 -0.92 0.00 0.00 57.85 57.01 1x4c n ARG 93 Cb 0.47 0.00 0.01 0.00 0.45 0.00 0.00 32.46 33.39 1x4c n ARG 93 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 1x4c n SER 94 N -2.07 -3.33 -4.71 6.15 7.64 -1.26 -5.14 113.62 110.90 1x4c n SER 94 Ca 0.00 -2.80 -0.42 0.00 1.01 0.00 0.00 58.87 56.66 1x4c n SER 94 Cb 0.00 1.69 -0.03 0.00 -1.01 0.00 0.00 64.21 64.86 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 0.87 4.32 -0.14 1.43 0.04 -1.26 -4.40 135.00 135.87 1x4c s PRO 95 Ca 0.30 2.04 -0.05 0.00 0.04 0.00 0.00 61.00 63.33 1x4c s PRO 95 Cb 0.01 -3.32 0.02 0.00 0.04 0.00 0.00 34.50 31.25 1x4c s PRO 95 CO -0.06 -0.45 0.09 0.45 0.04 0.00 0.00 177.00 177.07 1x4c n SER 96 N 4.22 -2.71 -0.13 6.66 2.88 -1.26 -5.03 113.62 118.25 1x4c n SER 96 Ca 0.12 0.81 -0.27 0.00 -1.33 0.00 0.00 58.87 58.20 1x4c n SER 96 Cb 0.43 -3.51 -0.10 0.00 -0.75 0.00 0.00 64.21 60.29 1x4c n SER 96 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1x4c n TYR 97 N 0.77 0.00 -3.69 0.66 4.19 -1.26 -5.11 117.16 112.72 1x4c n TYR 97 Ca -0.16 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.05 1x4c n TYR 97 Cb 0.24 -0.93 0.00 0.00 0.49 0.00 0.00 39.34 39.14 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 1.49 0.88 3.35 2.98 0.00 -1.26 -5.11 105.19 107.53 1x4c n GLY 98 Ca -0.50 -0.91 -0.45 0.00 0.00 0.00 0.00 46.02 44.16 1x4c n GLY 98 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1x4c s ARG 99 N -2.00 3.00 -0.22 1.61 6.06 -1.26 -5.02 118.95 121.12 1x4c s ARG 99 Ca 0.04 -1.50 -0.18 0.00 -2.50 0.00 0.00 55.73 51.59 1x4c s ARG 99 Cb -0.00 -4.22 0.06 0.00 0.06 0.00 0.00 34.95 30.84 1x4c s ARG 99 CO 0.00 -1.22 0.57 -1.54 -2.50 0.00 0.00 175.30 170.61 1x4c s SER 100 N 3.16 -0.63 0.01 -2.12 1.04 -1.26 -5.07 113.70 108.84 1x4c s SER 100 Ca 0.05 1.17 -0.00 0.00 0.48 0.00 0.00 55.95 57.64 1x4c s SER 100 Cb -0.27 1.15 -0.00 0.00 0.10 0.00 0.00 66.02 67.00 1x4c s SER 100 CO 0.05 -0.20 -0.01 0.54 0.98 0.00 0.00 173.24 174.60 1x4c n ARG 101 N 3.11 0.02 -3.09 4.02 1.74 -1.26 -5.10 116.66 116.10 1x4c n ARG 101 Ca -0.15 0.01 -0.04 0.00 -0.77 0.00 0.00 57.85 56.90 1x4c n ARG 101 Cb 0.56 -0.53 0.00 0.00 -1.02 0.00 0.00 32.46 31.47 1x4c n ARG 101 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1x4c n SER 102 N -3.14 -6.88 -4.28 0.55 7.64 -1.26 -5.02 113.62 101.23 1x4c n SER 102 Ca -0.02 0.61 -0.15 0.00 1.01 0.00 0.00 58.87 60.32 1x4c n SER 102 Cb 0.42 -2.62 -0.10 0.00 -1.01 0.00 0.00 64.21 60.89 1x4c n SER 102 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1x4c s SER 103 N -1.25 1.62 -0.18 6.43 1.04 -1.26 -5.12 113.70 114.98 1x4c s SER 103 Ca 0.04 -1.16 -0.29 0.00 0.48 0.00 0.00 55.95 55.02 1x4c s SER 103 Cb -0.01 0.04 0.13 0.00 0.10 0.00 0.00 66.02 66.28 1x4c s SER 103 CO 0.30 -0.49 1.01 -0.83 0.98 0.00 0.00 173.24 174.20 1x4c s GLY 104 N -3.23 -0.24 1.22 7.32 0.00 -1.26 -5.18 107.32 105.95 1x4c s GLY 104 Ca 0.24 2.15 -0.21 0.00 0.00 0.00 0.00 44.72 46.90 1x4c s GLY 104 CO 0.05 1.15 1.08 -1.55 0.00 0.00 0.00 173.10 173.84 1x4c n PRO 105 N 0.95 -3.15 -3.62 2.90 -0.04 -1.26 -5.09 135.00 125.68 1x4c n PRO 105 Ca -0.10 -1.73 -0.01 0.00 -0.04 0.00 0.00 63.50 61.61 1x4c n PRO 105 Cb 0.58 -1.63 -0.01 0.00 -0.04 0.00 0.00 33.50 32.39 1x4c n PRO 105 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1x4c s SER 106 N -4.42 -0.01 0.23 3.54 0.01 -1.26 -5.19 113.70 106.60 1x4c s SER 106 Ca 0.70 -0.00 -0.22 0.00 1.31 0.00 0.00 55.95 57.74 1x4c s SER 106 Cb -0.07 0.01 0.04 0.00 0.21 0.00 0.00 66.02 66.21 1x4c s SER 106 CO 0.54 -0.02 0.84 -0.55 0.41 0.00 0.00 173.24 174.46 1x4c s SER 107 N -2.27 -0.19 0.00 2.44 0.15 -1.26 -5.29 113.70 107.28 1x4c s SER 107 Ca 0.13 -0.58 0.00 0.00 0.70 0.00 0.00 55.95 56.20 1x4c s SER 107 Cb 0.01 0.63 0.00 0.00 -1.71 0.00 0.00 66.02 64.96 1x4c s SER 107 CO -0.03 -1.19 0.00 0.61 1.20 0.00 0.00 173.24 173.83