#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 -8.22 -3.96 1.61 7.64 -1.26 -4.74 113.62 104.69 1x4c n SER 2 Ca 0.00 0.78 -0.30 0.00 1.01 0.00 0.00 58.87 60.36 1x4c n SER 2 Cb 0.00 -4.31 -0.15 0.00 -1.01 0.00 0.00 64.21 58.74 1x4c n SER 2 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1x4c s SER 3 N -7.02 4.49 1.19 6.43 0.01 -1.26 -5.11 113.70 112.43 1x4c s SER 3 Ca 0.00 -2.42 -0.16 0.00 1.31 0.00 0.00 55.95 54.68 1x4c s SER 3 Cb 0.00 -1.53 0.28 0.00 0.21 0.00 0.00 66.02 64.98 1x4c s SER 3 CO 0.00 -0.33 1.04 -0.83 0.41 0.00 0.00 173.24 173.53 1x4c s GLY 4 N 0.54 1.52 0.00 3.44 0.00 -1.26 -5.06 107.32 106.50 1x4c s GLY 4 Ca 0.13 -0.51 0.00 0.00 0.00 0.00 0.00 44.72 44.34 1x4c s GLY 4 CO -0.06 0.28 0.00 -1.26 0.00 0.00 0.00 173.10 172.06 1x4c n SER 5 N -4.88 0.00 -4.72 1.64 2.88 -1.26 -5.15 113.62 102.13 1x4c n SER 5 Ca 0.07 0.00 -0.36 0.00 -1.33 0.00 0.00 58.87 57.25 1x4c n SER 5 Cb 0.57 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.96 1x4c n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1x4c s SER 6 N 0.00 6.32 -0.43 -3.46 0.15 -1.26 -4.59 113.70 110.43 1x4c s SER 6 Ca 0.00 0.36 -0.01 0.00 0.70 0.00 0.00 55.95 57.01 1x4c s SER 6 Cb 0.00 -2.14 0.00 0.00 -1.71 0.00 0.00 66.02 62.17 1x4c s SER 6 CO 0.00 0.11 0.41 0.61 1.20 0.00 0.00 173.24 175.58 1x4c n GLY 7 N 3.57 -0.87 3.39 9.45 0.00 -1.26 -4.92 105.19 114.55 1x4c n GLY 7 Ca -0.13 0.23 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 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 -1.40 -1.98 3.72 -0.02 0.00 -1.26 -4.93 105.19 99.33 1x4c n GLY 8 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.40 1.34 0.61 1.61 0.04 -1.26 -5.02 135.00 130.91 1x4c s PRO 9 Ca 0.62 0.84 -0.17 0.00 0.04 0.00 0.00 61.00 62.33 1x4c s PRO 9 Cb -0.60 -1.82 -0.03 0.00 0.04 0.00 0.00 34.50 32.10 1x4c s PRO 9 CO 0.60 -2.19 1.12 -1.25 0.04 0.00 0.00 177.00 175.31 1x4c s PRO 10 N -4.93 3.05 0.22 0.56 0.04 -1.26 -4.85 135.00 127.83 1x4c s PRO 10 Ca 0.63 1.49 0.00 0.00 0.04 0.00 0.00 61.00 63.17 1x4c s PRO 10 Cb -0.18 -1.98 0.00 0.00 0.04 0.00 0.00 34.50 32.39 1x4c s PRO 10 CO 0.57 -1.07 0.00 0.45 0.04 0.00 0.00 177.00 176.99 1x4c n SER 11 N -1.91 -3.46 -4.50 6.66 2.88 -1.26 -4.86 113.62 107.17 1x4c n SER 11 Ca 0.11 0.49 -0.39 0.00 -1.33 0.00 0.00 58.87 57.75 1x4c n SER 11 Cb 0.51 -1.98 0.03 0.00 -0.75 0.00 0.00 64.21 62.02 1x4c n SER 11 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1x4c n ARG 12 N -3.15 0.69 -0.04 -1.46 1.74 -1.26 -4.86 116.66 108.32 1x4c n ARG 12 Ca -0.02 0.26 0.11 0.00 -0.77 0.00 0.00 57.85 57.42 1x4c n ARG 12 Cb 0.28 -1.75 0.49 0.00 -1.02 0.00 0.00 32.46 30.45 1x4c n ARG 12 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 1x4c n ARG 13 N 0.02 1.43 0.00 5.56 0.00 -1.26 -4.85 116.66 117.57 1x4c n ARG 13 Ca 0.11 -0.65 0.00 0.00 -0.00 0.00 0.00 57.85 57.32 1x4c n ARG 13 Cb 0.44 -1.38 0.00 0.00 0.00 0.00 0.00 32.46 31.53 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 -0.15 0.00 0.00 6.15 7.64 -1.26 -5.00 113.62 121.00 1x4c n SER 14 Ca 0.16 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.04 1x4c n SER 14 Cb 0.23 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.43 1x4c n SER 14 CO 0.00 0.00 0.00 -1.84 -3.01 0.00 0.00 175.04 170.19 1x4c n GLU 15 N 0.00 0.00 -2.65 1.43 0.28 -1.26 -5.01 120.64 113.43 1x4c n GLU 15 Ca 0.00 0.00 -0.41 0.00 -0.16 0.00 0.00 57.16 56.59 1x4c n GLU 15 Cb 0.00 0.00 0.02 0.00 1.43 0.00 0.00 31.44 32.89 1x4c n GLU 15 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 177.13 177.24 1x4c n ASN 16 N 0.00 7.33 -4.09 -1.84 0.23 -1.26 -4.92 115.26 110.70 1x4c n ASN 16 Ca 0.00 -3.69 -0.29 0.00 -0.53 0.00 0.00 54.58 50.07 1x4c n ASN 16 Cb 0.00 -1.17 -0.17 0.00 -2.08 0.00 0.00 39.78 36.37 1x4c n ASN 16 CO 0.00 0.00 0.00 -0.60 -0.93 0.00 0.00 177.26 175.73 1x4c s ARG 17 N -4.31 2.42 0.19 -3.83 3.52 -1.26 -1.37 118.95 114.30 1x4c s ARG 17 Ca 0.39 -0.64 0.10 0.00 -0.13 0.00 0.00 55.73 55.45 1x4c s ARG 17 Cb 0.19 -2.00 -0.04 0.00 -1.56 0.00 0.00 34.95 31.54 1x4c s ARG 17 CO -0.13 -0.02 -0.16 0.14 -0.81 0.00 0.00 175.30 174.33 1x4c s VAL 18 N 0.86 2.83 -0.06 7.11 -7.23 0.65 0.10 120.40 124.65 1x4c s VAL 18 Ca -0.09 -1.82 -0.02 0.00 -1.81 0.00 0.00 61.98 58.24 1x4c s VAL 18 Cb -0.15 -2.38 -0.04 0.00 0.56 0.00 0.00 36.38 34.37 1x4c s VAL 18 CO -0.00 -0.11 0.04 -0.69 -0.31 0.00 0.00 175.10 174.03 1x4c s VAL 19 N -1.69 4.56 -0.01 1.32 1.01 -0.21 -1.62 120.40 123.76 1x4c s VAL 19 Ca 0.23 -0.27 0.07 0.00 0.00 0.00 0.00 61.98 62.01 1x4c s VAL 19 Cb -0.08 -2.99 -0.02 0.00 0.00 0.00 0.00 36.38 33.29 1x4c s VAL 19 CO 0.13 0.51 -0.22 -0.69 0.00 0.00 0.00 175.10 174.84 1x4c s VAL 20 N -1.01 2.46 0.00 2.92 1.01 0.34 -2.65 120.40 123.48 1x4c s VAL 20 Ca 0.17 -1.06 -0.08 0.00 0.00 0.00 0.00 61.98 61.01 1x4c s VAL 20 Cb -0.12 -1.93 0.00 0.00 0.00 0.00 0.00 36.38 34.33 1x4c s VAL 20 CO 0.06 0.51 0.15 -0.94 0.00 0.00 0.00 175.10 174.89 1x4c s SER 21 N -0.87 0.00 0.00 3.32 1.04 -0.86 -1.45 113.70 114.88 1x4c s SER 21 Ca 0.11 -0.17 0.00 0.00 0.48 0.00 0.00 55.95 56.37 1x4c s SER 21 Cb -0.10 0.22 0.00 0.00 0.10 0.00 0.00 66.02 66.23 1x4c s SER 21 CO 0.01 -0.37 0.00 0.61 0.98 0.00 0.00 173.24 174.47 1x4c n GLY 22 N 1.46 1.08 3.80 7.32 0.00 0.08 -0.74 105.19 118.18 1x4c n GLY 22 Ca -0.22 -0.46 -0.34 0.00 0.00 0.00 0.00 46.02 44.99 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 0.00 3.97 0.99 0.99 1.43 0.13 -4.29 118.68 121.91 1x4c s LEU 23 Ca 0.00 1.86 -0.12 0.00 -1.03 0.00 0.00 54.13 54.84 1x4c s LEU 23 Cb 0.00 -4.44 0.18 0.00 0.03 0.00 0.00 46.19 41.97 1x4c s LEU 23 CO 0.00 -0.53 1.09 -2.16 0.23 0.00 0.00 176.35 174.99 1x4c s PRO 24 N -2.97 0.51 0.52 1.29 0.04 -1.26 -4.47 135.00 128.65 1x4c s PRO 24 Ca 0.62 0.55 0.30 0.00 0.04 0.00 0.00 61.00 62.52 1x4c s PRO 24 Cb -0.15 -1.74 1.27 0.00 0.04 0.00 0.00 34.50 33.92 1x4c s PRO 24 CO 0.19 -2.69 1.96 -1.00 0.04 0.00 0.00 177.00 175.50 1x4c h PRO 25 N -1.86 0.00 -0.25 0.56 0.13 -1.98 -2.83 132.00 125.77 1x4c h PRO 25 Ca -0.54 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.52 1x4c h PRO 25 Cb 1.32 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.41 1x4c h PRO 25 CO 0.57 0.08 -0.05 0.43 -0.23 0.00 0.00 178.00 178.80 1x4c n SER 26 N -3.24 3.00 -4.58 1.44 7.64 -1.26 -4.98 113.62 111.63 1x4c n SER 26 Ca 0.00 -3.37 -0.40 0.00 1.01 0.00 0.00 58.87 56.11 1x4c n SER 26 Cb 0.33 -0.56 -0.08 0.00 -1.01 0.00 0.00 64.21 62.88 1x4c n SER 26 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1x4c s GLY 27 N -2.37 1.86 0.30 0.23 0.00 -1.07 -4.54 107.32 101.73 1x4c s GLY 27 Ca 0.42 -0.90 0.09 0.00 0.00 0.00 0.00 44.72 44.33 1x4c s GLY 27 CO 0.04 1.12 0.08 -0.45 0.00 0.00 0.00 173.10 173.89 1x4c s SER 28 N 1.67 4.67 0.25 1.64 0.15 -1.26 -4.87 113.70 115.95 1x4c s SER 28 Ca 0.17 -0.69 -0.04 0.00 0.70 0.00 0.00 55.95 56.09 1x4c s SER 28 Cb -0.16 -0.82 0.43 0.00 -1.71 0.00 0.00 66.02 63.76 1x4c s SER 28 CO 0.11 -0.15 1.78 4.11 1.20 0.00 0.00 173.24 180.29 1x4c h TRP 29 N 1.70 0.73 -0.98 3.44 5.08 -1.91 0.11 115.95 124.12 1x4c h TRP 29 Ca -0.44 0.03 0.19 0.00 1.08 0.00 0.00 58.89 59.75 1x4c h TRP 29 Cb 1.25 -0.21 -0.09 0.00 -3.00 0.00 0.00 29.16 27.11 1x4c h TRP 29 CO 0.65 0.23 0.61 1.96 -1.28 0.00 0.00 178.44 180.61 1x4c h GLN 30 N 0.64 0.66 0.13 0.12 4.20 -1.95 -0.00 115.11 118.91 1x4c h GLN 30 Ca 0.41 -0.04 -0.21 0.00 0.06 0.00 0.00 58.65 58.87 1x4c h GLN 30 Cb 0.49 -0.15 0.01 0.00 0.30 0.00 0.00 27.48 28.13 1x4c h GLN 30 CO -0.31 0.44 -0.98 -0.44 -0.67 0.00 0.00 178.83 176.87 1x4c h ASP 31 N 0.68 0.42 0.21 1.46 3.32 -1.48 -3.18 116.42 117.85 1x4c h ASP 31 Ca 0.54 -0.92 0.00 0.00 0.02 0.00 0.00 57.03 56.68 1x4c h ASP 31 Cb 0.95 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 40.34 1x4c h ASP 31 CO -0.32 1.45 -0.40 0.25 -1.72 0.00 0.00 179.24 178.51 1x4c h LEU 32 N -0.38 -1.17 -0.94 1.55 5.85 -0.07 -2.03 115.31 118.11 1x4c h LEU 32 Ca -0.19 0.11 0.17 0.00 0.84 0.00 0.00 57.88 58.82 1x4c h LEU 32 Cb 1.65 0.41 -0.10 0.00 0.37 0.00 0.00 40.66 42.99 1x4c h LEU 32 CO 0.11 -0.46 0.53 0.50 -0.34 0.00 0.00 178.44 178.78 1x4c h LYS 33 N -0.66 0.67 -0.27 1.25 3.11 -1.20 0.40 116.57 119.87 1x4c h LYS 33 Ca -0.02 -0.04 0.08 0.00 -2.81 0.00 0.00 60.65 57.86 1x4c h LYS 33 Cb 0.62 -0.15 -0.01 0.00 -1.00 0.00 0.00 32.23 31.69 1x4c h LYS 33 CO -0.15 0.44 0.31 0.22 -2.81 0.00 0.00 179.45 177.46 1x4c h ASP 34 N 0.69 0.00 0.09 4.20 1.82 -1.35 -1.26 116.42 120.60 1x4c h ASP 34 Ca 0.53 0.00 -0.33 0.00 -0.39 0.00 0.00 57.03 56.84 1x4c h ASP 34 Cb 0.81 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 40.80 1x4c h ASP 34 CO -0.38 0.00 -1.81 1.57 -1.61 0.00 0.00 179.24 177.00 1x4c n HIS 35 N -3.73 1.18 0.21 0.28 -0.00 0.13 -3.95 115.22 109.35 1x4c n HIS 35 Ca 0.04 0.31 0.03 0.00 0.46 0.00 0.00 57.72 58.55 1x4c n HIS 35 Cb 0.45 -1.14 0.13 0.00 -0.12 0.00 0.00 29.99 29.30 1x4c n HIS 35 CO 0.00 0.00 0.00 -1.33 0.46 0.00 0.00 176.34 175.47 1x4c n MET 36 N -3.75 0.01 -0.24 1.57 2.81 -0.60 -2.39 117.12 114.55 1x4c n MET 36 Ca -0.32 0.37 0.01 0.00 -1.81 0.00 0.00 57.70 55.95 1x4c n MET 36 Cb 0.95 -1.50 0.23 0.00 -0.71 0.00 0.00 33.22 32.19 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 1.02 -1.48 0.03 3.08 -1.39 -2.25 114.38 113.38 1x4c h ARG 37 Ca 0.00 -0.06 0.47 0.00 0.07 0.00 0.00 59.98 60.46 1x4c h ARG 37 Cb 0.09 -0.23 -0.11 0.00 0.08 0.00 0.00 29.97 29.80 1x4c h ARG 37 CO 0.00 0.68 1.00 1.49 -1.07 0.00 0.00 179.97 182.06 1x4c h GLU 38 N 1.05 0.05 -0.30 0.04 4.22 -1.73 1.09 114.58 119.00 1x4c h GLU 38 Ca 0.29 -0.00 -0.12 0.00 0.08 0.00 0.00 59.36 59.61 1x4c h GLU 38 Cb -0.10 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 1x4c h GLU 38 CO -0.07 0.03 -0.27 0.00 -2.18 0.00 0.00 179.01 176.52 1x4c h ALA 39 N 1.44 0.43 0.00 2.92 0.00 -1.66 -3.50 119.26 118.90 1x4c h ALA 39 Ca 0.84 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 55.36 1x4c h ALA 39 Cb 2.88 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 20.58 1x4c h ALA 39 CO -0.30 0.44 0.00 0.41 0.00 0.00 0.00 179.25 179.80 1x4c n GLY 40 N 0.13 -1.01 3.26 0.00 0.00 0.38 -4.50 105.19 103.45 1x4c n GLY 40 Ca -0.04 0.53 -0.28 0.00 0.00 0.00 0.00 46.02 46.23 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 2.66 -0.15 1.61 1.11 -1.26 -4.71 116.67 111.93 1x4c s ASP 41 Ca 0.00 -0.47 -0.06 0.00 0.18 0.00 0.00 52.55 52.20 1x4c s ASP 41 Cb 0.00 -0.27 -0.04 0.00 1.07 0.00 0.00 42.92 43.68 1x4c s ASP 41 CO 0.00 0.24 0.07 -0.69 1.18 0.00 0.00 175.17 175.97 1x4c s VAL 42 N -0.65 4.86 -0.12 -1.27 1.01 -1.26 -3.15 120.40 119.83 1x4c s VAL 42 Ca 0.09 -0.02 0.17 0.00 0.00 0.00 0.00 61.98 62.21 1x4c s VAL 42 Cb -0.09 -3.15 -0.24 0.00 0.00 0.00 0.00 36.38 32.90 1x4c s VAL 42 CO 0.00 0.52 0.19 0.00 0.00 0.00 0.00 175.10 175.81 1x4c s TYR 44 N -2.74 -0.39 -0.11 0.00 5.04 -1.14 -4.97 117.35 113.03 1x4c s TYR 44 Ca -0.08 0.89 -0.11 0.00 -2.44 0.00 0.00 57.07 55.33 1x4c s TYR 44 Cb 0.08 0.15 0.03 0.00 0.35 0.00 0.00 41.96 42.56 1x4c s TYR 44 CO 0.73 -0.26 0.31 0.00 -1.34 0.00 0.00 175.55 174.99 1x4c s ALA 45 N -0.17 -0.78 -0.24 3.97 0.00 -1.26 -1.76 121.76 121.52 1x4c s ALA 45 Ca -0.03 0.87 -0.26 0.00 0.00 0.00 0.00 51.96 52.53 1x4c s ALA 45 Cb -0.03 -0.50 0.12 0.00 0.00 0.00 0.00 23.12 22.71 1x4c s ALA 45 CO 0.02 -0.15 0.99 -0.51 0.00 0.00 0.00 175.76 176.11 1x4c s ASP 46 N 0.12 -0.46 0.01 0.00 1.01 -0.96 -4.98 116.67 111.41 1x4c s ASP 46 Ca -0.00 0.79 0.06 0.00 0.71 0.00 0.00 52.55 54.11 1x4c s ASP 46 Cb -0.02 0.77 -0.02 0.00 1.01 0.00 0.00 42.92 44.66 1x4c s ASP 46 CO 0.01 -0.22 -0.18 0.68 0.21 0.00 0.00 175.17 175.67 1x4c s VAL 47 N -0.12 1.43 0.24 -1.27 -7.23 -1.26 -0.77 120.40 111.42 1x4c s VAL 47 Ca 0.01 -0.94 0.06 0.00 -1.81 0.00 0.00 61.98 59.30 1x4c s VAL 47 Cb -0.04 -1.22 -0.03 0.00 0.56 0.00 0.00 36.38 35.65 1x4c s VAL 47 CO -0.03 0.26 0.31 -0.31 -0.31 0.00 0.00 175.10 175.02 1x4c s TYR 48 N -0.61 3.35 -0.29 2.82 1.51 0.29 -4.93 117.35 119.50 1x4c s TYR 48 Ca 0.06 -0.05 -0.06 0.00 -1.01 0.00 0.00 57.07 56.01 1x4c s TYR 48 Cb -0.08 -1.52 -0.21 0.00 -0.11 0.00 0.00 41.96 40.04 1x4c s TYR 48 CO 0.00 0.46 3.21 0.54 -1.11 0.00 0.00 175.55 178.66 1x4c n ARG 49 N -1.34 2.10 -0.80 -0.62 5.12 -1.26 -3.33 116.66 116.52 1x4c n ARG 49 Ca -0.09 -1.12 -0.01 0.00 -1.93 0.00 0.00 57.85 54.70 1x4c n ARG 49 Cb 0.57 -2.10 -0.02 0.00 -1.16 0.00 0.00 32.46 29.76 1x4c n ARG 49 CO 0.00 0.00 0.00 -3.47 -1.93 0.00 0.00 177.63 172.23 1x4c n ASP 50 N 2.78 -0.14 -1.48 0.55 2.03 -1.26 -4.99 116.55 114.04 1x4c n ASP 50 Ca 0.45 -1.63 -0.13 0.00 0.52 0.00 0.00 54.79 54.00 1x4c n ASP 50 Cb 0.71 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 41.10 1x4c n ASP 50 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1x4c n GLY 51 N 0.07 -0.14 3.34 0.27 0.00 -1.21 -4.84 105.19 102.68 1x4c n GLY 51 Ca -0.07 -0.34 -0.17 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.65 1.15 -0.23 2.61 -4.23 -1.25 -0.69 115.64 110.35 1x4c s THR 52 Ca 0.00 -2.05 -0.28 0.00 -1.18 0.00 0.00 61.69 58.18 1x4c s THR 52 Cb 0.00 -2.31 0.14 0.00 1.34 0.00 0.00 72.50 71.67 1x4c s THR 52 CO 0.00 -0.37 1.10 -0.83 -0.54 0.00 0.00 174.62 173.99 1x4c s GLY 53 N -3.31 -0.11 0.00 3.99 0.00 -0.53 -0.55 107.32 106.81 1x4c s GLY 53 Ca 0.27 2.52 0.03 0.00 0.00 0.00 0.00 44.72 47.54 1x4c s GLY 53 CO 0.08 1.43 -0.05 -1.34 0.00 0.00 0.00 173.10 173.22 1x4c s VAL 54 N -0.50 3.79 0.01 1.40 -7.23 0.06 0.13 120.40 118.05 1x4c s VAL 54 Ca 0.02 -0.72 0.01 0.00 -1.81 0.00 0.00 61.98 59.48 1x4c s VAL 54 Cb -0.03 -2.66 -0.01 0.00 0.56 0.00 0.00 36.38 34.24 1x4c s VAL 54 CO -0.04 0.39 -0.03 -0.69 -0.31 0.00 0.00 175.10 174.42 1x4c s VAL 55 N -1.02 0.20 -0.19 1.32 1.01 -0.64 -2.28 120.40 118.81 1x4c s VAL 55 Ca 0.18 -0.37 0.01 0.00 0.00 0.00 0.00 61.98 61.80 1x4c s VAL 55 Cb -0.11 -0.23 0.04 0.00 0.00 0.00 0.00 36.38 36.08 1x4c s VAL 55 CO 0.08 -0.11 -0.12 -0.70 0.00 0.00 0.00 175.10 174.25 1x4c s GLU 56 N -0.50 2.19 -0.39 2.72 2.12 -0.72 -0.26 118.70 123.85 1x4c s GLU 56 Ca -0.04 -0.80 -0.24 0.00 0.36 0.00 0.00 54.97 54.25 1x4c s GLU 56 Cb -0.04 -2.38 0.02 0.00 0.26 0.00 0.00 34.13 31.99 1x4c s GLU 56 CO -0.00 -0.37 0.84 -0.06 -0.54 0.00 0.00 175.26 175.12 1x4c s PHE 57 N 1.39 3.06 0.52 5.30 0.08 -0.47 -0.45 117.98 127.41 1x4c s PHE 57 Ca 0.00 0.52 0.42 0.00 0.12 0.00 0.00 56.93 57.99 1x4c s PHE 57 Cb -0.15 -3.59 1.61 0.00 -0.57 0.00 0.00 43.02 40.32 1x4c s PHE 57 CO -0.09 -0.85 1.63 -0.24 -0.10 0.00 0.00 175.22 175.57 1x4c h VAL 58 N 5.85 0.11 -3.78 -0.44 3.04 -1.85 -3.28 116.25 115.90 1x4c h VAL 58 Ca -0.24 -0.01 -0.65 0.00 -1.01 0.00 0.00 66.70 64.79 1x4c h VAL 58 Cb 1.09 0.08 -0.37 0.00 -2.01 0.00 0.00 31.29 30.07 1x4c h VAL 58 CO 0.95 0.00 -0.80 -0.13 -1.01 0.00 0.00 177.57 176.59 1x4c s ARG 59 N -5.02 2.07 0.28 4.17 1.81 -1.26 -4.99 118.95 116.00 1x4c s ARG 59 Ca -0.06 -1.23 0.09 0.00 -1.72 0.00 0.00 55.73 52.81 1x4c s ARG 59 Cb 0.27 -2.79 0.87 0.00 -0.45 0.00 0.00 34.95 32.85 1x4c s ARG 59 CO 0.86 -0.57 1.31 1.17 -0.68 0.00 0.00 175.30 177.39 1x4c n LYS 60 N 4.51 -0.06 -0.37 3.54 3.00 -1.24 -0.25 118.16 127.29 1x4c n LYS 60 Ca -0.14 1.20 -0.11 0.00 -0.00 0.00 0.00 58.31 59.26 1x4c n LYS 60 Cb 0.43 -2.02 -0.09 0.00 0.00 0.00 0.00 35.03 33.34 1x4c n LYS 60 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.40 178.33 1x4c h GLU 61 N 0.00 -0.06 -0.35 1.64 3.07 -1.94 1.13 114.58 118.07 1x4c h GLU 61 Ca 0.60 0.00 0.09 0.00 -0.50 0.00 0.00 59.36 59.55 1x4c h GLU 61 Cb 1.44 0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 29.35 1x4c h GLU 61 CO -0.71 -0.04 0.25 -0.44 -1.40 0.00 0.00 179.01 176.66 1x4c h ASP 62 N -0.06 0.06 0.56 1.42 3.32 -0.85 -1.77 116.42 119.10 1x4c h ASP 62 Ca 0.15 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.18 1x4c h ASP 62 Cb 0.45 -0.01 0.01 0.00 0.22 0.00 0.00 39.33 39.99 1x4c h ASP 62 CO -0.89 0.04 -0.27 -0.03 -1.72 0.00 0.00 179.24 176.37 1x4c h MET 63 N 0.07 -0.73 -0.19 3.56 4.05 0.13 0.64 114.93 122.45 1x4c h MET 63 Ca 0.16 0.05 0.06 0.00 -0.28 0.00 0.00 59.70 59.69 1x4c h MET 63 Cb 0.57 0.17 -0.01 0.00 -0.80 0.00 0.00 31.60 31.52 1x4c h MET 63 CO -0.01 -0.43 0.19 1.15 0.23 0.00 0.00 176.91 178.04 1x4c h THR 64 N -1.10 0.56 0.12 -0.77 2.02 -0.56 -1.78 112.91 111.41 1x4c h THR 64 Ca -0.08 0.00 -0.17 0.00 0.77 0.00 0.00 66.41 66.93 1x4c h THR 64 Cb 0.63 0.85 0.02 0.00 -1.74 0.00 0.00 68.15 67.92 1x4c h THR 64 CO 0.13 0.00 -0.74 0.22 0.37 0.00 0.00 175.52 175.50 1x4c h TYR 65 N 0.00 0.51 -0.70 3.16 3.20 -1.22 -3.20 116.97 118.71 1x4c h TYR 65 Ca 0.09 -0.36 0.08 0.00 3.14 0.00 0.00 58.73 61.68 1x4c h TYR 65 Cb 0.47 -0.02 -0.07 0.00 1.54 0.00 0.00 36.73 38.65 1x4c h TYR 65 CO 0.00 1.28 0.36 0.00 -1.64 0.00 0.00 178.16 178.16 1x4c h ALA 66 N 0.09 0.96 0.00 1.82 0.00 -0.02 0.21 119.26 122.33 1x4c h ALA 66 Ca -0.13 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1x4c h ALA 66 Cb 1.57 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.29 1x4c h ALA 66 CO 0.14 -0.02 0.00 -0.39 0.00 0.00 0.00 179.25 178.98 1x4c h VAL 67 N 0.63 0.00 0.00 0.00 -1.51 -1.53 1.57 116.25 115.40 1x4c h VAL 67 Ca 0.34 -0.32 -0.07 0.00 -1.23 0.00 0.00 66.70 65.42 1x4c h VAL 67 Cb 0.32 1.25 -0.01 0.00 -2.13 0.00 0.00 31.29 30.72 1x4c h VAL 67 CO -0.25 0.00 -0.67 0.03 -1.23 0.00 0.00 177.57 175.46 1x4c h ARG 68 N 0.00 0.00 0.07 5.19 3.08 -0.76 -3.38 114.38 118.58 1x4c h ARG 68 Ca 0.00 0.00 -0.30 0.00 0.07 0.00 0.00 59.98 59.75 1x4c h ARG 68 Cb 0.34 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.36 1x4c h ARG 68 CO 0.00 0.37 -1.66 0.87 -1.07 0.00 0.00 179.97 178.48 1x4c h LYS 69 N -1.00 0.15 -2.61 0.04 1.79 -0.72 -3.39 116.57 110.83 1x4c h LYS 69 Ca -0.11 -0.25 -0.75 0.00 -2.18 0.00 0.00 60.65 57.35 1x4c h LYS 69 Cb 0.73 0.09 -0.15 0.00 -1.58 0.00 0.00 32.23 31.33 1x4c h LYS 69 CO -0.07 1.12 2.19 1.28 -1.08 0.00 0.00 179.45 182.90 1x4c n LEU 70 N -3.93 7.88 -3.57 2.94 4.77 0.53 -4.81 117.00 120.81 1x4c n LEU 70 Ca -0.32 -4.95 -0.28 0.00 -0.03 0.00 0.00 56.01 50.43 1x4c n LEU 70 Cb 0.88 -1.34 -0.16 0.00 -2.33 0.00 0.00 43.42 40.47 1x4c n LEU 70 CO 0.32 2.03 -0.33 -0.62 -1.33 0.00 0.00 177.39 177.46 1x4c s ASP 71 N 0.13 3.06 0.00 -1.43 2.15 -1.10 -4.23 116.67 115.26 1x4c s ASP 71 Ca 0.51 -1.02 0.00 0.00 0.43 0.00 0.00 52.55 52.47 1x4c s ASP 71 Cb 0.18 -0.32 0.00 0.00 -0.30 0.00 0.00 42.92 42.48 1x4c s ASP 71 CO -0.09 -0.40 0.00 -3.20 -0.17 0.00 0.00 175.17 171.31 1x4c n ASN 72 N 5.25 -1.55 -4.82 -0.34 5.15 0.55 -4.85 115.26 114.65 1x4c n ASN 72 Ca -0.06 0.00 -0.22 0.00 -0.60 0.00 0.00 54.58 53.70 1x4c n ASN 72 Cb 0.45 -0.45 -0.04 0.00 -0.53 0.00 0.00 39.78 39.20 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 -2.65 3.67 -0.30 -0.44 -4.23 -0.98 -4.77 115.64 105.95 1x4c s THR 73 Ca 0.00 -1.46 -0.29 0.00 -1.18 0.00 0.00 61.69 58.76 1x4c s THR 73 Cb 0.00 -3.19 0.00 0.00 1.34 0.00 0.00 72.50 70.65 1x4c s THR 73 CO 0.00 -0.23 1.31 -0.75 -0.54 0.00 0.00 174.62 174.41 1x4c s LYS 74 N -3.92 3.90 -0.17 3.99 2.20 -1.26 -1.14 119.74 123.35 1x4c s LYS 74 Ca 0.38 1.25 -0.07 0.00 -0.36 0.00 0.00 55.97 57.17 1x4c s LYS 74 Cb -0.06 -3.89 -0.04 0.00 -1.51 0.00 0.00 37.83 32.34 1x4c s LYS 74 CO 0.25 -1.14 0.05 0.12 -0.36 0.00 0.00 175.35 174.28 1x4c s PHE 75 N 4.42 3.24 -0.14 4.03 2.19 0.41 -4.86 117.98 127.27 1x4c s PHE 75 Ca 0.57 0.07 -0.03 0.00 0.33 0.00 0.00 56.93 57.86 1x4c s PHE 75 Cb -0.17 -2.04 -0.03 0.00 -1.31 0.00 0.00 43.02 39.47 1x4c s PHE 75 CO 0.23 0.19 -0.03 0.50 1.83 0.00 0.00 175.22 177.94 1x4c s ARG 76 N 0.22 3.56 0.69 10.12 3.52 -1.26 -0.31 118.95 135.50 1x4c s ARG 76 Ca 0.04 -0.49 -0.03 0.00 -0.13 0.00 0.00 55.73 55.11 1x4c s ARG 76 Cb -0.12 -2.90 0.09 0.00 -1.56 0.00 0.00 34.95 30.45 1x4c s ARG 76 CO 0.01 0.33 0.97 -1.54 -0.81 0.00 0.00 175.30 174.25 1x4c s SER 77 N 0.14 4.61 0.41 -2.12 1.04 0.20 -4.94 113.70 113.04 1x4c s SER 77 Ca -0.01 -0.01 0.08 0.00 0.48 0.00 0.00 55.95 56.50 1x4c s SER 77 Cb -0.13 -0.55 0.87 0.00 0.10 0.00 0.00 66.02 66.31 1x4c s SER 77 CO 0.03 -1.68 2.03 1.12 0.98 0.00 0.00 173.24 175.71 1x4c h HIS 78 N -0.48 0.55 0.00 5.02 2.07 -1.89 0.13 115.15 120.55 1x4c h HIS 78 Ca -0.41 0.01 -0.01 0.00 -2.85 0.00 0.00 60.37 57.12 1x4c h HIS 78 Cb 1.28 -0.18 -0.00 0.00 2.57 0.00 0.00 27.41 31.08 1x4c h HIS 78 CO 0.01 0.32 -0.03 0.93 -3.07 0.00 0.00 177.93 176.09 1x4c h GLU 79 N 0.57 0.00 0.00 5.12 4.39 -1.94 -3.45 114.58 119.27 1x4c h GLU 79 Ca 0.21 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.91 1x4c h GLU 79 Cb 0.11 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.76 1x4c h GLU 79 CO -0.05 0.03 0.00 0.41 -1.16 0.00 0.00 179.01 178.23 1x4c n GLY 80 N -0.60 1.18 3.77 -3.84 0.00 0.03 -5.08 105.19 100.64 1x4c n GLY 80 Ca -0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.64 3.26 0.12 1.61 2.56 -1.26 -4.70 118.70 119.66 1x4c s GLU 81 Ca 0.00 1.66 0.11 0.00 0.00 0.00 0.00 54.97 56.74 1x4c s GLU 81 Cb 0.00 -1.99 -0.04 0.00 2.00 0.00 0.00 34.13 34.10 1x4c s GLU 81 CO 0.00 -0.93 -0.27 0.95 -0.56 0.00 0.00 175.26 174.45 1x4c s THR 82 N -1.73 2.22 -0.28 -1.70 -4.23 -1.26 -0.63 115.64 108.03 1x4c s THR 82 Ca 0.74 -1.70 -0.20 0.00 -1.18 0.00 0.00 61.69 59.35 1x4c s THR 82 Cb -0.25 -1.96 0.09 0.00 1.34 0.00 0.00 72.50 71.72 1x4c s THR 82 CO 0.28 0.12 0.79 0.00 -0.54 0.00 0.00 174.62 175.28 1x4c s ALA 83 N -1.03 -1.92 -0.14 3.99 0.00 0.58 -4.94 121.76 118.30 1x4c s ALA 83 Ca 0.13 2.19 -0.29 0.00 0.00 0.00 0.00 51.96 53.99 1x4c s ALA 83 Cb -0.10 -1.39 -0.03 0.00 0.00 0.00 0.00 23.12 21.59 1x4c s ALA 83 CO 0.05 -0.34 1.50 0.71 0.00 0.00 0.00 175.76 177.68 1x4c s TYR 84 N 0.98 2.33 0.08 0.00 2.02 -1.26 -0.45 117.35 121.04 1x4c s TYR 84 Ca -0.05 0.58 0.04 0.00 -0.37 0.00 0.00 57.07 57.27 1x4c s TYR 84 Cb -0.05 -3.80 -0.04 0.00 -0.40 0.00 0.00 41.96 37.67 1x4c s TYR 84 CO -0.10 -2.82 0.00 0.96 -1.57 0.00 0.00 175.55 172.01 1x4c s ILE 85 N 4.16 4.05 -0.08 2.71 -4.36 -0.29 -4.61 121.20 122.78 1x4c s ILE 85 Ca 0.66 -0.92 0.02 0.00 -0.26 0.00 0.00 60.65 60.15 1x4c s ILE 85 Cb -0.27 -2.91 -0.02 0.00 1.25 0.00 0.00 42.46 40.51 1x4c s ILE 85 CO 0.24 0.16 -0.12 -0.60 0.24 0.00 0.00 174.94 174.86 1x4c s ARG 86 N -2.19 2.86 0.00 0.37 6.06 0.08 -0.33 118.95 125.80 1x4c s ARG 86 Ca 0.25 -0.65 0.06 0.00 -2.50 0.00 0.00 55.73 52.89 1x4c s ARG 86 Cb -0.12 -2.52 -0.02 0.00 0.06 0.00 0.00 34.95 32.36 1x4c s ARG 86 CO 0.17 0.50 -0.20 0.08 -2.50 0.00 0.00 175.30 173.35 1x4c s VAL 87 N -0.38 1.57 -0.06 7.11 1.01 -1.26 -2.02 120.40 126.36 1x4c s VAL 87 Ca 0.05 -0.95 -0.22 0.00 0.00 0.00 0.00 61.98 60.86 1x4c s VAL 87 Cb -0.12 -1.33 0.05 0.00 0.00 0.00 0.00 36.38 34.98 1x4c s VAL 87 CO 0.02 0.36 0.51 -1.59 0.00 0.00 0.00 175.10 174.40 1x4c s LYS 88 N -0.68 0.82 -0.19 2.72 0.00 -1.08 -4.77 119.74 116.56 1x4c s LYS 88 Ca 0.07 0.17 -0.29 0.00 0.00 0.00 0.00 55.97 55.93 1x4c s LYS 88 Cb -0.08 0.38 -0.04 0.00 0.00 0.00 0.00 37.83 38.09 1x4c s LYS 88 CO 0.00 -0.22 1.80 0.54 0.00 0.00 0.00 175.35 177.46 1x4c s VAL 89 N -0.97 3.45 -0.45 1.79 0.11 -1.26 -1.04 120.40 122.03 1x4c s VAL 89 Ca -0.10 0.50 -0.43 0.00 -2.93 0.00 0.00 61.98 59.01 1x4c s VAL 89 Cb -0.03 -3.47 -0.18 0.00 -1.53 0.00 0.00 36.38 31.18 1x4c s VAL 89 CO 0.06 -0.21 1.90 -0.67 -3.33 0.00 0.00 175.10 172.85 1x4c n ASP 90 N 9.07 1.35 0.00 3.54 2.03 0.11 -4.65 116.55 128.00 1x4c n ASP 90 Ca 0.21 0.88 0.00 0.00 0.52 0.00 0.00 54.79 56.41 1x4c n ASP 90 Cb 0.45 -0.98 0.00 0.00 -0.72 0.00 0.00 41.12 39.87 1x4c n ASP 90 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1x4c n GLY 91 N 5.67 0.61 3.68 0.27 0.00 -1.26 -4.93 105.19 109.23 1x4c n GLY 91 Ca 0.41 -1.78 -0.42 0.00 0.00 0.00 0.00 46.02 44.22 1x4c n GLY 91 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x4c s PRO 92 N -2.00 4.24 0.09 1.61 0.04 -1.26 -4.98 135.00 132.74 1x4c s PRO 92 Ca 0.00 2.02 -0.31 0.00 0.04 0.00 0.00 61.00 62.75 1x4c s PRO 92 Cb 0.00 -3.72 -0.07 0.00 0.04 0.00 0.00 34.50 30.75 1x4c s PRO 92 CO 0.00 -0.69 1.27 0.50 0.04 0.00 0.00 177.00 178.12 1x4c s ARG 93 N 3.06 4.40 0.52 4.56 3.52 -1.26 -4.99 118.95 128.76 1x4c s ARG 93 Ca 0.66 1.89 -0.21 0.00 -0.13 0.00 0.00 55.73 57.94 1x4c s ARG 93 Cb -0.31 -3.30 -0.06 0.00 -1.56 0.00 0.00 34.95 29.72 1x4c s ARG 93 CO 0.26 -0.30 1.23 -1.12 -0.81 0.00 0.00 175.30 174.56 1x4c s SER 94 N 0.98 5.63 0.67 -2.12 0.01 -1.26 -4.99 113.70 112.61 1x4c s SER 94 Ca 0.60 2.46 -0.15 0.00 1.31 0.00 0.00 55.95 60.18 1x4c s SER 94 Cb -0.32 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.30 1x4c s SER 94 CO 0.30 -1.30 1.11 -2.16 0.41 0.00 0.00 173.24 171.60 1x4c s PRO 95 N -2.94 2.77 0.03 12.44 0.04 -1.26 -5.00 135.00 141.08 1x4c s PRO 95 Ca 0.70 1.38 -0.26 0.00 0.04 0.00 0.00 61.00 62.86 1x4c s PRO 95 Cb -0.32 -1.95 -0.14 0.00 0.04 0.00 0.00 34.50 32.12 1x4c s PRO 95 CO 0.38 -1.27 1.20 1.03 0.04 0.00 0.00 177.00 178.38 1x4c h SER 96 N -0.04 -0.79 -1.43 6.66 0.87 -2.02 -3.44 113.55 113.36 1x4c h SER 96 Ca -0.47 0.03 -0.71 0.00 -1.23 0.00 0.00 61.79 59.41 1x4c h SER 96 Cb 1.25 0.20 0.07 0.00 -0.44 0.00 0.00 62.40 63.48 1x4c h SER 96 CO 0.54 -0.49 0.15 0.00 -0.53 0.00 0.00 176.83 176.50 1x4c n TYR 97 N -4.95 0.91 0.00 2.24 4.19 -1.26 -3.38 117.16 114.91 1x4c n TYR 97 Ca -0.12 0.84 0.00 0.00 3.31 0.00 0.00 57.90 61.93 1x4c n TYR 97 Cb 0.37 -2.19 0.00 0.00 0.49 0.00 0.00 39.34 38.01 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 1.95 3.30 3.72 2.98 0.00 -1.26 -5.10 105.19 110.78 1x4c n GLY 98 Ca 0.18 -0.68 -0.42 0.00 0.00 0.00 0.00 46.02 45.10 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 0.00 4.27 0.14 1.61 3.52 -1.22 -5.02 118.95 122.26 1x4c s ARG 99 Ca 0.00 2.21 0.07 0.00 -0.13 0.00 0.00 55.73 57.89 1x4c s ARG 99 Cb 0.00 -3.20 -0.04 0.00 -1.56 0.00 0.00 34.95 30.15 1x4c s ARG 99 CO 0.00 -0.51 -0.05 0.45 -0.81 0.00 0.00 175.30 174.38 1x4c s SER 100 N 1.05 4.57 -0.47 -2.12 0.15 -1.26 -5.08 113.70 110.54 1x4c s SER 100 Ca 0.66 -0.40 -0.27 0.00 0.70 0.00 0.00 55.95 56.64 1x4c s SER 100 Cb -0.40 -0.92 0.03 0.00 -1.71 0.00 0.00 66.02 63.02 1x4c s SER 100 CO 0.32 0.13 1.03 -0.13 1.20 0.00 0.00 173.24 175.79 1x4c s ARG 101 N -2.61 3.62 0.02 5.44 1.81 -1.26 -4.96 118.95 121.02 1x4c s ARG 101 Ca 0.25 0.35 -0.29 0.00 -1.72 0.00 0.00 55.73 54.32 1x4c s ARG 101 Cb -0.10 -3.92 0.10 0.00 -0.45 0.00 0.00 34.95 30.58 1x4c s ARG 101 CO 0.16 -1.32 1.16 0.45 -0.68 0.00 0.00 175.30 175.07 1x4c s SER 102 N 2.38 -0.12 0.25 0.23 0.15 -1.26 -5.16 113.70 110.17 1x4c s SER 102 Ca 0.42 -0.20 0.00 0.00 0.70 0.00 0.00 55.95 56.87 1x4c s SER 102 Cb -0.09 0.27 0.00 0.00 -1.71 0.00 0.00 66.02 64.50 1x4c s SER 102 CO 0.29 -0.50 0.00 -0.24 1.20 0.00 0.00 173.24 173.99 1x4c n SER 103 N -0.43 -5.88 0.00 5.45 2.88 -1.26 -5.04 113.62 109.33 1x4c n SER 103 Ca -0.07 0.44 0.00 0.00 -1.33 0.00 0.00 58.87 57.91 1x4c n SER 103 Cb 0.62 -3.02 0.00 0.00 -0.75 0.00 0.00 64.21 61.06 1x4c n SER 103 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x4c n GLY 104 N -3.30 0.85 3.77 0.46 0.00 -1.26 -5.10 105.19 100.61 1x4c n GLY 104 Ca 0.00 -0.80 -0.33 0.00 0.00 0.00 0.00 46.02 44.89 1x4c n GLY 104 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x4c s PRO 105 N -1.87 2.89 0.06 1.61 0.04 -1.26 -5.07 135.00 131.40 1x4c s PRO 105 Ca 0.00 1.43 0.01 0.00 0.04 0.00 0.00 61.00 62.48 1x4c s PRO 105 Cb 0.00 -1.96 -0.03 0.00 0.04 0.00 0.00 34.50 32.55 1x4c s PRO 105 CO 0.00 -1.19 -0.05 -1.12 0.04 0.00 0.00 177.00 174.68 1x4c s SER 106 N -2.44 0.76 0.10 6.66 0.01 -1.26 -5.14 113.70 112.38 1x4c s SER 106 Ca 0.68 -0.84 -0.26 0.00 1.31 0.00 0.00 55.95 56.84 1x4c s SER 106 Cb -0.21 0.11 -0.06 0.00 0.21 0.00 0.00 66.02 66.07 1x4c s SER 106 CO 0.39 -0.43 0.81 -0.94 0.41 0.00 0.00 173.24 173.49 1x4c s SER 107 N -2.48 7.33 0.00 2.44 1.04 -1.26 -5.35 113.70 115.43 1x4c s SER 107 Ca 0.02 1.58 0.07 0.00 0.48 0.00 0.00 55.95 58.11 1x4c s SER 107 Cb 0.01 -2.50 0.43 0.00 0.10 0.00 0.00 66.02 64.06 1x4c s SER 107 CO -0.05 0.06 0.89 0.61 0.98 0.00 0.00 173.24 175.73