#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x4a s SER 2 N 0.00 -0.39 -0.18 1.61 1.04 -1.26 -5.15 113.70 109.37 1x4a s SER 2 Ca 0.00 0.58 -0.01 0.00 0.48 0.00 0.00 55.95 57.00 1x4a s SER 2 Cb 0.00 1.32 0.00 0.00 0.10 0.00 0.00 66.02 67.45 1x4a s SER 2 CO 0.00 -0.09 -0.14 -0.55 0.98 0.00 0.00 173.24 173.44 1x4a s SER 3 N 1.81 3.62 0.52 7.02 0.15 -1.26 -5.03 113.70 120.52 1x4a s SER 3 Ca -0.05 -0.52 0.00 0.00 0.70 0.00 0.00 55.95 56.08 1x4a s SER 3 Cb -0.04 -1.58 0.00 0.00 -1.71 0.00 0.00 66.02 62.70 1x4a s SER 3 CO -0.15 0.02 0.00 0.61 1.20 0.00 0.00 173.24 174.92 1x4a n GLY 4 N 4.47 -2.77 3.52 9.45 0.00 -1.26 -4.72 105.19 113.88 1x4a n GLY 4 Ca -0.20 -0.99 -0.48 0.00 0.00 0.00 0.00 46.02 44.35 1x4a n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1x4a n SER 5 N -4.33 0.41 -4.90 1.61 2.88 -1.26 -4.94 113.62 103.10 1x4a n SER 5 Ca -0.06 1.15 -0.28 0.00 -1.33 0.00 0.00 58.87 58.35 1x4a n SER 5 Cb 0.67 -1.13 -0.01 0.00 -0.75 0.00 0.00 64.21 62.99 1x4a n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1x4a s SER 6 N -0.46 6.35 0.00 -3.46 0.15 -1.26 -4.88 113.70 110.15 1x4a s SER 6 Ca 0.68 0.90 0.00 0.00 0.70 0.00 0.00 55.95 58.23 1x4a s SER 6 Cb -0.88 -2.23 0.00 0.00 -1.71 0.00 0.00 66.02 61.20 1x4a s SER 6 CO 0.56 -0.45 0.00 0.61 1.20 0.00 0.00 173.24 175.15 1x4a n GLY 7 N -1.80 -2.37 1.08 9.45 0.00 -1.26 -5.08 105.19 105.21 1x4a n GLY 7 Ca 0.00 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.37 1x4a n GLY 7 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1x4a n MET 8 N 0.39 0.00 -2.41 1.61 2.00 -1.26 -5.06 117.12 112.39 1x4a n MET 8 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 57.70 57.67 1x4a n MET 8 Cb 0.00 -0.47 -0.02 0.00 0.00 0.00 0.00 33.22 32.72 1x4a n MET 8 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 175.97 176.40 1x4a n SER 9 N -3.28 -3.09 -3.59 7.83 7.64 -1.26 -5.07 113.62 112.80 1x4a n SER 9 Ca 0.00 1.11 -0.11 0.00 1.01 0.00 0.00 58.87 60.87 1x4a n SER 9 Cb 0.20 -4.44 -0.06 0.00 -1.01 0.00 0.00 64.21 58.89 1x4a n SER 9 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1x4a s GLY 10 N -0.84 -0.29 1.12 0.23 0.00 -1.26 -5.13 107.32 101.15 1x4a s GLY 10 Ca -0.14 2.15 -0.17 0.00 0.00 0.00 0.00 44.72 46.55 1x4a s GLY 10 CO 0.64 1.32 0.18 0.61 0.00 0.00 0.00 173.10 175.85 1x4a n GLY 11 N 1.34 -2.39 3.23 0.20 0.00 -1.26 -5.01 105.19 101.31 1x4a n GLY 11 Ca -0.12 -0.84 -0.10 0.00 0.00 0.00 0.00 46.02 44.95 1x4a n GLY 11 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1x4a s GLY 12 N -1.94 -0.30 -0.24 -0.02 0.00 -1.26 -5.01 107.32 98.55 1x4a s GLY 12 Ca 0.58 1.43 -0.08 0.00 0.00 0.00 0.00 44.72 46.65 1x4a s GLY 12 CO 0.66 1.85 0.18 -0.62 0.00 0.00 0.00 173.10 175.17 1x4a n VAL 13 N 4.63 -7.37 0.14 1.40 0.31 -1.26 -4.88 118.33 111.30 1x4a n VAL 13 Ca -0.19 1.01 -0.14 0.00 -0.01 0.00 0.00 64.34 65.01 1x4a n VAL 13 Cb 0.53 -5.18 -0.07 0.00 -0.91 0.00 0.00 33.84 28.20 1x4a n VAL 13 CO 0.00 0.00 0.00 -0.29 -1.32 0.00 0.00 176.83 175.22 1x4a h ILE 14 N 2.95 0.77 -4.17 2.52 2.10 -2.04 -3.45 117.51 116.20 1x4a h ILE 14 Ca -0.08 0.00 -0.14 0.00 1.08 0.00 0.00 64.86 65.72 1x4a h ILE 14 Cb 0.69 0.77 -0.16 0.00 -1.09 0.00 0.00 36.82 37.03 1x4a h ILE 14 CO 0.10 0.00 -0.69 -0.13 -1.08 0.00 0.00 178.15 176.35 1x4a s ARG 15 N -6.15 0.56 0.06 2.19 0.52 -1.26 -5.17 118.95 109.70 1x4a s ARG 15 Ca -0.15 -1.10 -0.08 0.00 -0.52 0.00 0.00 55.73 53.88 1x4a s ARG 15 Cb 0.05 0.17 -0.00 0.00 0.52 0.00 0.00 34.95 35.69 1x4a s ARG 15 CO 0.65 -0.09 0.17 0.20 0.02 0.00 0.00 175.30 176.24 1x4a s GLY 16 N -2.63 0.10 -0.23 -3.53 0.00 -1.26 -5.12 107.32 94.64 1x4a s GLY 16 Ca 0.03 -0.50 -0.29 0.00 0.00 0.00 0.00 44.72 43.95 1x4a s GLY 16 CO -0.08 -0.68 1.31 2.56 0.00 0.00 0.00 173.10 176.22 1x4a s PRO 17 N -3.19 4.05 0.31 2.90 0.04 -1.26 -5.01 135.00 132.84 1x4a s PRO 17 Ca -0.00 1.47 -0.17 0.00 0.04 0.00 0.00 61.00 62.34 1x4a s PRO 17 Cb 0.02 -3.84 -0.09 0.00 0.04 0.00 0.00 34.50 30.63 1x4a s PRO 17 CO -0.07 -0.95 0.76 0.00 0.04 0.00 0.00 177.00 176.78 1x4a s ALA 18 N 4.05 3.32 0.00 8.56 0.00 -1.26 -5.07 121.76 131.36 1x4a s ALA 18 Ca 0.57 0.12 0.00 0.00 0.00 0.00 0.00 51.96 52.65 1x4a s ALA 18 Cb -0.20 -2.83 0.00 0.00 0.00 0.00 0.00 23.12 20.10 1x4a s ALA 18 CO 0.20 0.31 0.00 0.41 0.00 0.00 0.00 175.76 176.68 1x4a n GLY 19 N -0.07 0.95 3.01 0.00 0.00 -1.26 -5.12 105.19 102.69 1x4a n GLY 19 Ca 0.02 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.79 1x4a n GLY 19 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1x4a s ASN 20 N -0.36 1.82 -0.15 1.61 3.84 -1.26 -4.95 114.94 115.50 1x4a s ASN 20 Ca 0.00 -0.30 -0.07 0.00 0.21 0.00 0.00 52.86 52.70 1x4a s ASN 20 Cb 0.00 -0.83 0.03 0.00 -0.55 0.00 0.00 41.25 39.90 1x4a s ASN 20 CO 0.00 0.01 0.14 -3.20 -2.79 0.00 0.00 177.10 171.26 1x4a n ASN 21 N 3.97 -2.09 -4.57 -4.21 2.85 -1.26 -4.76 115.26 105.20 1x4a n ASN 21 Ca -0.22 0.96 -0.28 0.00 -0.11 0.00 0.00 54.58 54.93 1x4a n ASN 21 Cb 0.51 -4.00 -0.05 0.00 1.24 0.00 0.00 39.78 37.48 1x4a n ASN 21 CO 0.00 0.00 0.00 -1.81 -2.11 0.00 0.00 177.26 173.34 1x4a s ASP 22 N -0.63 5.22 -0.41 1.20 1.01 -1.26 -4.69 116.67 117.11 1x4a s ASP 22 Ca -0.16 -0.99 0.05 0.00 0.71 0.00 0.00 52.55 52.16 1x4a s ASP 22 Cb 0.01 -2.57 0.58 0.00 1.01 0.00 0.00 42.92 41.96 1x4a s ASP 22 CO 0.56 -2.74 1.74 0.00 0.21 0.00 0.00 175.17 174.94 1x4a s ARG 24 N -3.34 2.82 -0.02 0.00 1.70 -1.26 0.46 118.95 119.30 1x4a s ARG 24 Ca 0.53 -0.58 0.02 0.00 -0.47 0.00 0.00 55.73 55.23 1x4a s ARG 24 Cb 0.45 -2.58 0.00 0.00 -0.57 0.00 0.00 34.95 32.26 1x4a s ARG 24 CO 0.05 0.59 -0.09 0.96 -1.08 0.00 0.00 175.30 175.74 1x4a s ILE 25 N -0.62 0.76 -0.14 4.99 -4.36 0.38 -4.61 121.20 117.59 1x4a s ILE 25 Ca 0.09 -0.35 -0.15 0.00 -0.26 0.00 0.00 60.65 59.98 1x4a s ILE 25 Cb -0.11 -0.67 -0.05 0.00 1.25 0.00 0.00 42.46 42.88 1x4a s ILE 25 CO 0.02 0.24 0.34 -0.47 0.24 0.00 0.00 174.94 175.31 1x4a s TYR 26 N 0.15 3.48 -0.19 1.37 5.04 0.16 -0.32 117.35 127.04 1x4a s TYR 26 Ca -0.02 0.68 -0.03 0.00 -2.44 0.00 0.00 57.07 55.26 1x4a s TYR 26 Cb -0.08 -2.39 -0.01 0.00 0.35 0.00 0.00 41.96 39.82 1x4a s TYR 26 CO 0.00 0.24 -0.06 0.08 -1.34 0.00 0.00 175.55 174.47 1x4a s VAL 27 N 0.44 3.46 0.48 3.14 1.01 -0.17 -1.09 120.40 127.67 1x4a s VAL 27 Ca 0.19 -0.49 0.02 0.00 0.00 0.00 0.00 61.98 61.71 1x4a s VAL 27 Cb -0.14 -2.54 -0.02 0.00 0.00 0.00 0.00 36.38 33.69 1x4a s VAL 27 CO 0.06 0.46 0.03 -0.83 0.00 0.00 0.00 175.10 174.82 1x4a s GLY 28 N 0.98 2.88 -0.99 4.51 0.00 0.59 -2.70 107.32 112.60 1x4a s GLY 28 Ca -0.00 -0.74 -0.08 0.00 0.00 0.00 0.00 44.72 43.89 1x4a s GLY 28 CO 0.00 -2.11 0.82 0.70 0.00 0.00 0.00 173.10 172.51 1x4a n ASN 29 N -1.24 -6.47 -4.65 1.64 3.02 -1.26 -0.56 115.26 105.74 1x4a n ASN 29 Ca -0.15 -0.66 -0.23 0.00 -0.03 0.00 0.00 54.58 53.51 1x4a n ASN 29 Cb 0.67 -4.54 -0.07 0.00 -0.61 0.00 0.00 39.78 35.23 1x4a n ASN 29 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1x4a s LEU 30 N -5.34 3.19 0.74 3.41 1.43 -1.25 -3.71 118.68 117.16 1x4a s LEU 30 Ca 0.33 -0.66 -0.11 0.00 -1.03 0.00 0.00 54.13 52.66 1x4a s LEU 30 Cb -0.07 -1.71 0.04 0.00 0.03 0.00 0.00 46.19 44.48 1x4a s LEU 30 CO 0.78 -0.02 1.08 -2.16 0.23 0.00 0.00 176.35 176.26 1x4a s PRO 31 N -3.68 2.55 0.32 1.29 0.04 -1.26 -4.33 135.00 129.92 1x4a s PRO 31 Ca 0.32 0.81 0.16 0.00 0.04 0.00 0.00 61.00 62.33 1x4a s PRO 31 Cb -0.06 -1.96 0.41 0.00 0.04 0.00 0.00 34.50 32.94 1x4a s PRO 31 CO 0.20 -1.34 1.61 -1.00 0.04 0.00 0.00 177.00 176.51 1x4a h PRO 32 N -0.89 0.00 -1.01 0.56 0.13 -2.00 -2.98 132.00 125.81 1x4a h PRO 32 Ca -0.45 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.15 1x4a h PRO 32 Cb 1.24 0.00 -0.29 0.00 0.13 0.00 0.00 31.00 32.07 1x4a h PRO 32 CO 0.58 0.48 0.68 -0.25 -0.23 0.00 0.00 178.00 179.26 1x4a n ASP 33 N -3.45 4.58 -4.88 1.44 9.92 -1.26 -4.96 116.55 117.94 1x4a n ASP 33 Ca 0.00 -3.58 -0.29 0.00 -0.53 0.00 0.00 54.79 50.39 1x4a n ASP 33 Cb 0.62 -0.86 -0.02 0.00 -0.64 0.00 0.00 41.12 40.21 1x4a n ASP 33 CO 0.00 0.00 0.00 -0.51 0.13 0.00 0.00 177.20 176.82 1x4a s ILE 34 N -3.48 4.83 0.17 0.53 1.10 -1.13 -5.10 121.20 118.13 1x4a s ILE 34 Ca 0.56 0.49 0.06 0.00 -0.51 0.00 0.00 60.65 61.25 1x4a s ILE 34 Cb 0.47 -3.78 -0.04 0.00 0.15 0.00 0.00 42.46 39.26 1x4a s ILE 34 CO 0.08 -0.63 -0.13 -0.13 -2.11 0.00 0.00 174.94 172.02 1x4a s ARG 35 N -4.14 1.20 0.22 3.50 0.52 -1.26 -5.04 118.95 113.95 1x4a s ARG 35 Ca 0.50 -1.50 0.02 0.00 -0.52 0.00 0.00 55.73 54.23 1x4a s ARG 35 Cb -0.10 -0.94 0.19 0.00 0.52 0.00 0.00 34.95 34.62 1x4a s ARG 35 CO 0.36 0.15 1.53 1.15 0.02 0.00 0.00 175.30 178.51 1x4a h THR 36 N 2.77 1.37 0.06 0.02 2.02 -1.99 -2.54 112.91 114.62 1x4a h THR 36 Ca -0.38 -1.98 -0.00 0.00 0.77 0.00 0.00 66.41 64.82 1x4a h THR 36 Cb 1.21 1.98 0.00 0.00 -1.74 0.00 0.00 68.15 69.60 1x4a h THR 36 CO 0.61 0.59 -0.03 0.50 0.37 0.00 0.00 175.52 177.56 1x4a h LYS 37 N 0.24 -0.08 -0.81 6.66 1.63 -1.98 -2.24 116.57 119.99 1x4a h LYS 37 Ca -0.01 0.01 0.19 0.00 -0.85 0.00 0.00 60.65 59.99 1x4a h LYS 37 Cb 1.14 0.02 -0.12 0.00 -0.60 0.00 0.00 32.23 32.67 1x4a h LYS 37 CO 0.10 0.51 0.23 -0.44 -3.45 0.00 0.00 179.45 176.41 1x4a h ASP 38 N -0.77 0.07 0.37 4.20 3.32 -1.98 1.66 116.42 123.28 1x4a h ASP 38 Ca -0.01 0.16 -0.07 0.00 0.02 0.00 0.00 57.03 57.14 1x4a h ASP 38 Cb 0.62 0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.37 1x4a h ASP 38 CO 0.01 -0.06 -0.31 0.40 -1.72 0.00 0.00 179.24 177.56 1x4a h ILE 39 N 0.28 1.14 0.05 0.35 2.04 -1.47 -1.78 117.51 118.11 1x4a h ILE 39 Ca 0.48 -1.09 -0.00 0.00 1.00 0.00 0.00 64.86 65.25 1x4a h ILE 39 Cb 0.89 1.60 0.00 0.00 -0.74 0.00 0.00 36.82 38.57 1x4a h ILE 39 CO -0.56 0.30 -0.02 -0.08 0.00 0.00 0.00 178.15 177.79 1x4a h GLU 40 N 0.00 -0.06 -0.01 2.37 4.81 0.27 -2.80 114.58 119.16 1x4a h GLU 40 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1x4a h GLU 40 Cb 0.58 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.97 1x4a h GLU 40 CO 0.04 0.52 0.04 0.22 -0.73 0.00 0.00 179.01 179.10 1x4a h ASP 41 N -0.71 0.00 0.20 1.04 3.58 0.46 0.95 116.42 121.94 1x4a h ASP 41 Ca -0.01 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.43 1x4a h ASP 41 Cb 0.61 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.66 1x4a h ASP 41 CO 0.01 0.00 -0.10 0.58 -2.88 0.00 0.00 179.24 176.85 1x4a h VAL 42 N 0.00 0.00 -0.08 2.25 2.07 -1.20 -3.24 116.25 116.05 1x4a h VAL 42 Ca 0.01 -0.20 -0.07 0.00 0.82 0.00 0.00 66.70 67.26 1x4a h VAL 42 Cb 0.08 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 29.84 1x4a h VAL 42 CO -0.00 0.00 -0.27 -0.26 0.02 0.00 0.00 177.57 177.06 1x4a h PHE 43 N -0.47 0.16 -0.52 1.57 0.04 -1.21 -2.50 116.94 114.00 1x4a h PHE 43 Ca -0.03 -0.03 0.15 0.00 2.80 0.00 0.00 57.97 60.87 1x4a h PHE 43 Cb 0.21 -0.04 -0.02 0.00 2.20 0.00 0.00 35.95 38.30 1x4a h PHE 43 CO 0.07 0.41 0.58 -0.92 -0.60 0.00 0.00 178.31 177.85 1x4a h TYR 44 N 0.13 0.00 0.00 -0.55 5.03 0.84 0.70 116.97 123.12 1x4a h TYR 44 Ca 0.02 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.33 1x4a h TYR 44 Cb 0.55 0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.83 1x4a h TYR 44 CO 0.01 0.00 0.14 1.57 -1.32 0.00 0.00 178.16 178.55 1x4a h LYS 45 N 0.00 0.00 0.00 1.82 5.09 -1.47 -2.83 116.57 119.18 1x4a h LYS 45 Ca 0.25 0.00 -0.10 0.00 0.09 0.00 0.00 60.65 60.89 1x4a h LYS 45 Cb 1.41 0.00 -0.01 0.00 0.10 0.00 0.00 32.23 33.72 1x4a h LYS 45 CO -0.00 0.00 -1.29 0.66 -2.09 0.00 0.00 179.45 176.73 1x4a n TYR 46 N -2.73 0.07 0.00 0.07 4.02 0.24 -5.10 117.16 113.73 1x4a n TYR 46 Ca -0.02 0.03 0.00 0.00 -0.01 0.00 0.00 57.90 57.90 1x4a n TYR 46 Cb 0.18 -0.63 0.00 0.00 -0.02 0.00 0.00 39.34 38.88 1x4a n TYR 46 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1x4a n GLY 47 N 1.43 5.08 3.28 2.72 0.00 -1.07 -5.13 105.19 111.50 1x4a n GLY 47 Ca -0.22 -0.67 -0.23 0.00 0.00 0.00 0.00 46.02 44.90 1x4a n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x4a s ALA 48 N -1.73 1.77 0.03 4.61 0.00 -1.26 -4.24 121.76 120.93 1x4a s ALA 48 Ca 0.00 -1.27 -0.02 0.00 0.00 0.00 0.00 51.96 50.68 1x4a s ALA 48 Cb 0.00 -0.22 -0.04 0.00 0.00 0.00 0.00 23.12 22.86 1x4a s ALA 48 CO 0.00 0.31 0.20 0.42 0.00 0.00 0.00 175.76 176.70 1x4a s ILE 49 N -1.35 5.40 -0.11 0.00 1.01 -1.26 -3.39 121.20 121.50 1x4a s ILE 49 Ca 0.07 -0.26 0.15 0.00 0.00 0.00 0.00 60.65 60.62 1x4a s ILE 49 Cb -0.09 -3.59 -0.24 0.00 0.01 0.00 0.00 42.46 38.56 1x4a s ILE 49 CO 0.04 0.23 0.44 -1.14 0.00 0.00 0.00 174.94 174.51 1x4a n ARG 50 N 0.61 0.65 0.00 2.79 0.63 0.49 -4.91 116.66 116.93 1x4a n ARG 50 Ca -0.08 0.17 0.00 0.00 -0.92 0.00 0.00 57.85 57.02 1x4a n ARG 50 Cb 0.52 -1.69 0.00 0.00 0.45 0.00 0.00 32.46 31.74 1x4a n ARG 50 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 1x4a n ASP 51 N -2.92 0.00 -4.10 6.15 -0.08 -1.20 -4.99 116.55 109.41 1x4a n ASP 51 Ca -0.23 0.00 -0.30 0.00 -1.51 0.00 0.00 54.79 52.75 1x4a n ASP 51 Cb 1.08 0.00 -0.17 0.00 2.34 0.00 0.00 41.12 44.37 1x4a n ASP 51 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 1x4a s ILE 52 N -1.49 1.76 -0.32 5.18 1.01 -1.26 -1.03 121.20 125.05 1x4a s ILE 52 Ca 0.00 -0.80 -0.06 0.00 0.00 0.00 0.00 60.65 59.79 1x4a s ILE 52 Cb 0.00 -1.59 0.03 0.00 0.01 0.00 0.00 42.46 40.91 1x4a s ILE 52 CO 0.00 0.49 0.09 -1.81 0.00 0.00 0.00 174.94 173.71 1x4a s ASP 53 N 0.97 5.21 -0.19 3.58 1.01 0.16 -4.94 116.67 122.46 1x4a s ASP 53 Ca -0.05 -1.00 -0.04 0.00 0.71 0.00 0.00 52.55 52.17 1x4a s ASP 53 Cb -0.15 -1.86 -0.02 0.00 1.01 0.00 0.00 42.92 41.90 1x4a s ASP 53 CO -0.03 -0.28 -0.04 -0.22 0.21 0.00 0.00 175.17 174.81 1x4a s LEU 54 N 1.43 3.01 -0.03 1.23 2.96 -1.26 0.33 118.68 126.35 1x4a s LEU 54 Ca -0.00 -0.30 -0.02 0.00 -0.22 0.00 0.00 54.13 53.59 1x4a s LEU 54 Cb -0.19 -1.75 -0.01 0.00 0.50 0.00 0.00 46.19 44.75 1x4a s LEU 54 CO 0.02 0.05 -0.04 0.11 -1.32 0.00 0.00 176.35 175.18 1x4a h LYS 55 N 7.57 0.00 -5.81 1.98 1.57 -1.63 -3.49 116.57 116.76 1x4a h LYS 55 Ca -0.36 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.39 1x4a h LYS 55 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.49 1x4a h LYS 55 CO 0.60 0.00 -0.98 -1.71 -0.57 0.00 0.00 179.45 176.79 1x4a n ASN 56 N -2.84 -7.19 0.00 0.86 5.15 -1.23 -4.87 115.26 105.14 1x4a n ASN 56 Ca -0.02 0.80 0.00 0.00 -0.60 0.00 0.00 54.58 54.76 1x4a n ASN 56 Cb 0.06 -3.39 0.00 0.00 -0.53 0.00 0.00 39.78 35.92 1x4a n ASN 56 CO 0.00 0.00 0.00 -1.14 1.40 0.00 0.00 177.26 177.52 1x4a n ARG 57 N 0.84 0.00 -1.59 1.20 0.63 -1.26 -5.03 116.66 111.45 1x4a n ARG 57 Ca 0.00 0.00 -0.41 0.00 -0.92 0.00 0.00 57.85 56.52 1x4a n ARG 57 Cb 0.31 0.00 0.01 0.00 0.45 0.00 0.00 32.46 33.23 1x4a n ARG 57 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 1x4a n ARG 58 N 0.00 1.21 -1.48 -0.14 1.74 -1.26 -4.76 116.66 111.98 1x4a n ARG 58 Ca 0.00 0.44 -0.57 0.00 -0.77 0.00 0.00 57.85 56.94 1x4a n ARG 58 Cb 0.00 -1.98 -0.07 0.00 -1.02 0.00 0.00 32.46 29.39 1x4a n ARG 58 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1x4a n GLY 59 N 1.27 -0.40 0.00 -0.13 0.00 -1.26 -4.62 105.19 100.06 1x4a n GLY 59 Ca 0.10 0.72 0.00 0.00 0.00 0.00 0.00 46.02 46.84 1x4a n GLY 59 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x4a n GLY 60 N 1.53 -0.40 3.79 -0.02 0.00 -1.26 -4.81 105.19 104.01 1x4a n GLY 60 Ca 0.20 -2.21 -0.29 0.00 0.00 0.00 0.00 46.02 43.71 1x4a n GLY 60 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x4a s PRO 61 N 0.00 1.12 -0.01 1.61 0.04 -1.26 -4.87 135.00 131.63 1x4a s PRO 61 Ca 0.00 0.28 -0.30 0.00 0.04 0.00 0.00 61.00 61.02 1x4a s PRO 61 Cb 0.00 -1.84 -0.04 0.00 0.04 0.00 0.00 34.50 32.66 1x4a s PRO 61 CO 0.00 -2.21 1.20 -1.25 0.04 0.00 0.00 177.00 174.78 1x4a s PRO 62 N -5.29 4.38 0.18 0.56 0.04 -1.26 -4.80 135.00 128.81 1x4a s PRO 62 Ca 0.64 1.71 0.11 0.00 0.04 0.00 0.00 61.00 63.49 1x4a s PRO 62 Cb -0.15 -3.49 -0.04 0.00 0.04 0.00 0.00 34.50 30.87 1x4a s PRO 62 CO 0.53 -0.37 -0.23 -0.59 0.04 0.00 0.00 177.00 176.38 1x4a s PHE 63 N 1.80 2.16 0.10 0.56 -0.71 -1.26 -3.87 117.98 116.75 1x4a s PHE 63 Ca 0.57 -0.39 -0.24 0.00 -1.04 0.00 0.00 56.93 55.83 1x4a s PHE 63 Cb -0.26 -1.08 0.06 0.00 -1.21 0.00 0.00 43.02 40.53 1x4a s PHE 63 CO 0.25 0.44 0.59 0.00 -1.34 0.00 0.00 175.22 175.16 1x4a s ALA 64 N -1.72 -1.54 -0.06 1.99 0.00 -1.10 -1.39 121.76 117.94 1x4a s ALA 64 Ca 0.19 0.63 0.03 0.00 0.00 0.00 0.00 51.96 52.81 1x4a s ALA 64 Cb -0.08 0.62 -0.02 0.00 0.00 0.00 0.00 23.12 23.64 1x4a s ALA 64 CO 0.09 -0.64 -0.15 -0.06 0.00 0.00 0.00 175.76 175.00 1x4a s PHE 65 N -3.05 2.70 -0.14 0.00 0.40 0.15 -1.00 117.98 117.05 1x4a s PHE 65 Ca -0.02 -0.26 -0.02 0.00 -0.60 0.00 0.00 56.93 56.03 1x4a s PHE 65 Cb -0.01 -1.66 -0.02 0.00 0.51 0.00 0.00 43.02 41.84 1x4a s PHE 65 CO -0.07 0.10 -0.07 0.08 0.70 0.00 0.00 175.22 175.97 1x4a s VAL 66 N -0.54 3.59 -0.44 -0.44 1.01 0.56 -0.66 120.40 123.48 1x4a s VAL 66 Ca 0.07 -0.47 -0.09 0.00 0.00 0.00 0.00 61.98 61.49 1x4a s VAL 66 Cb -0.12 -2.54 0.10 0.00 0.00 0.00 0.00 36.38 33.82 1x4a s VAL 66 CO 0.01 0.52 0.29 -0.70 0.00 0.00 0.00 175.10 175.22 1x4a s GLU 67 N 0.22 2.52 0.76 2.72 2.12 -0.20 -0.47 118.70 126.37 1x4a s GLU 67 Ca -0.05 -1.59 -0.11 0.00 0.36 0.00 0.00 54.97 53.57 1x4a s GLU 67 Cb -0.14 -3.82 0.05 0.00 0.26 0.00 0.00 34.13 30.47 1x4a s GLU 67 CO 0.04 -1.05 1.10 -0.06 -0.54 0.00 0.00 175.26 174.74 1x4a s PHE 68 N 1.39 3.03 -0.00 5.30 0.08 0.17 0.19 117.98 128.13 1x4a s PHE 68 Ca 0.04 1.12 -0.19 0.00 0.12 0.00 0.00 56.93 58.03 1x4a s PHE 68 Cb -0.24 -3.09 -0.31 0.00 -0.57 0.00 0.00 43.02 38.80 1x4a s PHE 68 CO 0.01 -1.53 0.99 0.93 -0.10 0.00 0.00 175.22 175.52 1x4a h GLU 69 N -0.91 0.44 -6.51 0.44 4.39 -1.84 -3.43 114.58 107.17 1x4a h GLU 69 Ca -0.46 -0.68 -0.63 0.00 0.34 0.00 0.00 59.36 57.93 1x4a h GLU 69 Cb 1.26 0.24 -0.19 0.00 -0.10 0.00 0.00 28.75 29.96 1x4a h GLU 69 CO 0.61 1.31 -0.82 0.34 -1.16 0.00 0.00 179.01 179.28 1x4a s ASP 70 N -7.20 3.26 -0.02 1.42 2.15 -1.26 -5.02 116.67 110.00 1x4a s ASP 70 Ca -0.12 -0.85 -0.22 0.00 0.43 0.00 0.00 52.55 51.80 1x4a s ASP 70 Cb 0.03 -0.23 -0.22 0.00 -0.30 0.00 0.00 42.92 42.20 1x4a s ASP 70 CO 0.88 0.10 1.10 1.55 -0.17 0.00 0.00 175.17 178.63 1x4a h PRO 71 N 3.32 0.30 -0.88 4.34 0.13 -1.90 -1.10 132.00 136.20 1x4a h PRO 71 Ca -0.46 -0.30 0.24 0.00 -0.87 0.00 0.00 66.00 64.61 1x4a h PRO 71 Cb 1.20 0.08 -0.15 0.00 0.13 0.00 0.00 31.00 32.26 1x4a h PRO 71 CO 0.47 0.98 0.18 0.00 -0.23 0.00 0.00 178.00 179.40 1x4a h ARG 72 N -0.26 0.15 0.03 0.86 3.08 -1.98 0.75 114.38 117.01 1x4a h ARG 72 Ca -0.04 -0.01 -0.08 0.00 0.07 0.00 0.00 59.98 59.91 1x4a h ARG 72 Cb 1.10 -0.03 0.01 0.00 0.08 0.00 0.00 29.97 31.12 1x4a h ARG 72 CO 0.08 0.10 -0.35 0.22 -1.07 0.00 0.00 179.97 178.95 1x4a h ASP 73 N 0.16 0.25 -0.72 7.04 1.82 -1.98 -0.44 116.42 122.56 1x4a h ASP 73 Ca 0.55 -0.86 0.21 0.00 -0.39 0.00 0.00 57.03 56.53 1x4a h ASP 73 Cb 1.11 -0.08 -0.03 0.00 0.68 0.00 0.00 39.33 41.02 1x4a h ASP 73 CO -0.70 1.09 0.65 0.00 -1.61 0.00 0.00 179.24 178.67 1x4a h ALA 74 N 0.17 2.54 0.02 -0.78 0.00 0.46 0.52 119.26 122.19 1x4a h ALA 74 Ca -0.05 -0.03 -0.25 0.00 0.00 0.00 0.00 54.91 54.59 1x4a h ALA 74 Cb 1.17 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.98 1x4a h ALA 74 CO 0.07 -1.02 -1.34 0.93 0.00 0.00 0.00 179.25 177.88 1x4a h GLU 75 N 0.00 0.04 -0.66 0.00 5.08 0.42 -3.19 114.58 116.28 1x4a h GLU 75 Ca 0.34 -0.08 0.17 0.00 -1.00 0.00 0.00 59.36 58.79 1x4a h GLU 75 Cb 1.64 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 30.88 1x4a h GLU 75 CO -0.00 1.04 0.46 -0.44 -1.00 0.00 0.00 179.01 179.06 1x4a h ASP 76 N -0.83 0.11 0.33 1.42 3.32 0.75 1.47 116.42 122.99 1x4a h ASP 76 Ca -0.35 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 56.69 1x4a h ASP 76 Cb 1.41 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.95 1x4a h ASP 76 CO -0.16 0.06 -0.16 0.00 -1.72 0.00 0.00 179.24 177.26 1x4a h ALA 77 N 1.68 -0.63 -0.50 3.45 0.00 -0.20 -3.11 119.26 119.96 1x4a h ALA 77 Ca 0.32 -0.10 0.08 0.00 0.00 0.00 0.00 54.91 55.21 1x4a h ALA 77 Cb 1.09 0.17 -0.03 0.00 0.00 0.00 0.00 17.79 19.02 1x4a h ALA 77 CO -0.04 -0.59 0.34 -0.24 0.00 0.00 0.00 179.25 178.72 1x4a h VAL 78 N -0.76 0.91 0.00 0.00 3.04 -1.38 0.48 116.25 118.55 1x4a h VAL 78 Ca -0.05 -0.11 0.00 0.00 -1.01 0.00 0.00 66.70 65.53 1x4a h VAL 78 Cb 0.34 0.55 0.00 0.00 -2.01 0.00 0.00 31.29 30.17 1x4a h VAL 78 CO 0.07 0.06 0.00 -1.22 -1.01 0.00 0.00 177.57 175.48 1x4a n TYR 79 N -4.47 0.60 0.01 3.17 4.02 0.50 -1.92 117.16 119.07 1x4a n TYR 79 Ca 0.07 0.31 0.00 0.00 -0.01 0.00 0.00 57.90 58.28 1x4a n TYR 79 Cb 0.33 -1.00 0.00 0.00 -0.02 0.00 0.00 39.34 38.65 1x4a n TYR 79 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1x4a n GLY 80 N -1.33 0.06 0.35 2.72 0.00 0.11 -4.77 105.19 102.33 1x4a n GLY 80 Ca -0.01 0.00 0.33 0.00 0.00 0.00 0.00 46.02 46.33 1x4a n GLY 80 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x4a n ARG 81 N -2.61 -0.05 -1.54 1.61 5.12 0.13 -3.92 116.66 115.40 1x4a n ARG 81 Ca 0.00 1.25 -0.17 0.00 -1.93 0.00 0.00 57.85 57.00 1x4a n ARG 81 Cb 0.00 -2.32 -0.11 0.00 -1.16 0.00 0.00 32.46 28.86 1x4a n ARG 81 CO 0.00 0.00 0.00 -3.47 -1.93 0.00 0.00 177.63 172.23 1x4a n ASP 82 N -4.94 0.91 0.00 0.55 2.03 -0.81 0.10 116.55 114.39 1x4a n ASP 82 Ca 0.36 -1.16 0.00 0.00 0.52 0.00 0.00 54.79 54.51 1x4a n ASP 82 Cb 1.30 -1.34 0.00 0.00 -0.72 0.00 0.00 41.12 40.36 1x4a n ASP 82 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1x4a n GLY 83 N 6.42 1.88 3.93 0.27 0.00 -1.22 -4.85 105.19 111.61 1x4a n GLY 83 Ca 0.53 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.29 1x4a n GLY 83 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1x4a s TYR 84 N -2.00 3.30 -0.24 1.61 5.04 0.28 -4.89 117.35 120.46 1x4a s TYR 84 Ca 0.00 0.51 0.00 0.00 -2.44 0.00 0.00 57.07 55.14 1x4a s TYR 84 Cb 0.00 -2.48 0.07 0.00 0.35 0.00 0.00 41.96 39.90 1x4a s TYR 84 CO 0.00 -0.53 -0.02 0.34 -1.34 0.00 0.00 175.55 174.00 1x4a s ASP 85 N -4.23 3.74 -0.10 4.32 2.15 -1.26 -0.53 116.67 120.77 1x4a s ASP 85 Ca 0.50 -1.20 0.01 0.00 0.43 0.00 0.00 52.55 52.29 1x4a s ASP 85 Cb -0.10 -1.07 -0.02 0.00 -0.30 0.00 0.00 42.92 41.43 1x4a s ASP 85 CO 0.42 -0.27 -0.12 -0.47 -0.17 0.00 0.00 175.17 174.56 1x4a s TYR 86 N 1.47 2.80 -2.08 -5.34 5.04 0.13 -4.48 117.35 114.90 1x4a s TYR 86 Ca -0.03 -0.38 0.00 0.00 -2.44 0.00 0.00 57.07 54.22 1x4a s TYR 86 Cb -0.18 -1.77 0.00 0.00 0.35 0.00 0.00 41.96 40.36 1x4a s TYR 86 CO -0.08 -0.01 0.00 -3.47 -1.34 0.00 0.00 175.55 170.65 1x4a n ASP 87 N 2.98 -5.30 0.00 4.32 -0.08 -1.26 0.20 116.55 117.41 1x4a n ASP 87 Ca -0.18 0.45 0.00 0.00 -1.51 0.00 0.00 54.79 53.55 1x4a n ASP 87 Cb 0.53 -4.67 0.00 0.00 2.34 0.00 0.00 41.12 39.31 1x4a n ASP 87 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1x4a n GLY 88 N -0.43 2.80 3.76 0.27 0.00 -1.26 -5.02 105.19 105.31 1x4a n GLY 88 Ca -0.20 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.43 1x4a n GLY 88 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1x4a s TYR 89 N -2.14 3.67 0.32 1.61 2.02 0.13 -5.01 117.35 117.94 1x4a s TYR 89 Ca 0.00 1.15 -0.26 0.00 -0.37 0.00 0.00 57.07 57.59 1x4a s TYR 89 Cb 0.00 -2.58 -0.10 0.00 -0.40 0.00 0.00 41.96 38.88 1x4a s TYR 89 CO 0.00 0.35 0.95 -0.98 -1.57 0.00 0.00 175.55 174.30 1x4a s ARG 90 N -0.14 4.60 0.26 -0.62 1.70 -1.26 0.23 118.95 123.71 1x4a s ARG 90 Ca 0.30 1.36 0.11 0.00 -0.47 0.00 0.00 55.73 57.03 1x4a s ARG 90 Cb -0.18 -2.85 -0.05 0.00 -0.57 0.00 0.00 34.95 31.31 1x4a s ARG 90 CO 0.16 0.29 -0.15 -0.51 -1.08 0.00 0.00 175.30 174.01 1x4a s LEU 91 N -1.97 2.74 -0.30 -1.89 1.43 0.31 -4.55 118.68 114.46 1x4a s LEU 91 Ca 0.49 -0.89 0.01 0.00 -1.03 0.00 0.00 54.13 52.71 1x4a s LEU 91 Cb -0.20 -1.29 0.09 0.00 0.03 0.00 0.00 46.19 44.82 1x4a s LEU 91 CO 0.25 0.05 0.05 -0.60 0.23 0.00 0.00 176.35 176.33 1x4a s ARG 92 N -3.40 1.12 -0.24 1.70 3.52 0.27 -3.41 118.95 118.51 1x4a s ARG 92 Ca 0.29 -1.30 -0.13 0.00 -0.13 0.00 0.00 55.73 54.46 1x4a s ARG 92 Cb -0.06 -2.49 -0.04 0.00 -1.56 0.00 0.00 34.95 30.79 1x4a s ARG 92 CO 0.16 -0.89 0.27 0.08 -0.81 0.00 0.00 175.30 174.11 1x4a s VAL 93 N 1.35 5.28 0.06 7.11 1.01 -1.26 -0.30 120.40 133.65 1x4a s VAL 93 Ca 0.07 0.41 -0.27 0.00 0.00 0.00 0.00 61.98 62.19 1x4a s VAL 93 Cb -0.18 -3.61 0.07 0.00 0.00 0.00 0.00 36.38 32.66 1x4a s VAL 93 CO -0.16 0.28 0.64 -1.83 0.00 0.00 0.00 175.10 174.03 1x4a s GLU 94 N 1.37 1.17 0.43 2.72 -1.05 -0.25 -4.45 118.70 118.63 1x4a s GLU 94 Ca 0.12 -0.12 -0.22 0.00 -0.15 0.00 0.00 54.97 54.60 1x4a s GLU 94 Cb -0.14 0.55 -0.10 0.00 -0.44 0.00 0.00 34.13 33.99 1x4a s GLU 94 CO 0.07 -0.45 1.00 -0.06 0.95 0.00 0.00 175.26 176.77 1x4a s PHE 95 N -2.52 3.25 -1.12 4.83 0.08 -1.26 -0.67 117.98 120.58 1x4a s PHE 95 Ca -0.05 1.63 -0.19 0.00 0.12 0.00 0.00 56.93 58.45 1x4a s PHE 95 Cb -0.01 -2.99 -0.06 0.00 -0.57 0.00 0.00 43.02 39.40 1x4a s PHE 95 CO -0.02 -0.41 2.03 -0.35 -0.10 0.00 0.00 175.22 176.37 1x4a n PRO 96 N -0.45 2.18 -1.32 0.24 -0.04 -1.26 -4.83 135.00 129.51 1x4a n PRO 96 Ca 0.07 -2.31 0.17 0.00 -0.04 0.00 0.00 63.50 61.39 1x4a n PRO 96 Cb 0.52 -3.18 -0.06 0.00 -0.04 0.00 0.00 33.50 30.74 1x4a n PRO 96 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1x4a n ARG 97 N 6.86 -2.86 -3.46 0.54 1.74 -1.26 -4.94 116.66 113.28 1x4a n ARG 97 Ca 0.50 2.12 -0.11 0.00 -0.77 0.00 0.00 57.85 59.59 1x4a n ARG 97 Cb 0.41 -3.41 -0.10 0.00 -1.02 0.00 0.00 32.46 28.34 1x4a n ARG 97 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1x4a s SER 98 N -7.03 0.42 0.37 0.55 0.01 -1.26 -5.14 113.70 101.62 1x4a s SER 98 Ca 0.00 0.29 -0.21 0.00 1.31 0.00 0.00 55.95 57.34 1x4a s SER 98 Cb 0.00 0.94 -0.15 0.00 0.21 0.00 0.00 66.02 67.02 1x4a s SER 98 CO 0.00 -0.29 0.11 0.61 0.41 0.00 0.00 173.24 174.09 1x4a n GLY 99 N 5.36 -2.52 3.80 3.44 0.00 -1.26 -4.89 105.19 109.12 1x4a n GLY 99 Ca -0.05 0.01 -0.37 0.00 0.00 0.00 0.00 46.02 45.61 1x4a n GLY 99 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1x4a s ARG 100 N -0.95 4.40 -0.37 1.61 0.52 -1.26 -4.99 118.95 117.91 1x4a s ARG 100 Ca 0.56 1.03 0.02 0.00 -0.52 0.00 0.00 55.73 56.82 1x4a s ARG 100 Cb -0.63 -2.97 0.28 0.00 0.52 0.00 0.00 34.95 32.16 1x4a s ARG 100 CO 0.59 0.42 1.19 0.41 0.02 0.00 0.00 175.30 177.94 1x4a n GLY 101 N 0.94 -1.12 3.00 -3.53 0.00 -1.26 -5.14 105.19 98.08 1x4a n GLY 101 Ca -0.03 0.71 -0.23 0.00 0.00 0.00 0.00 46.02 46.47 1x4a n GLY 101 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1x4a s THR 102 N 0.23 0.97 0.00 2.61 -1.32 -1.26 -5.00 115.64 111.86 1x4a s THR 102 Ca 0.26 -0.41 0.00 0.00 -1.21 0.00 0.00 61.69 60.33 1x4a s THR 102 Cb 0.24 -0.89 0.00 0.00 -1.51 0.00 0.00 72.50 70.34 1x4a s THR 102 CO -0.14 0.31 0.00 0.61 -2.21 0.00 0.00 174.62 173.19 1x4a n GLY 103 N 3.68 -2.04 3.48 6.08 0.00 -1.26 -5.15 105.19 109.98 1x4a n GLY 103 Ca -0.22 0.76 -0.30 0.00 0.00 0.00 0.00 46.02 46.26 1x4a n GLY 103 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1x4a n SER 104 N 0.00 -1.42 -1.21 1.61 2.88 -1.26 -5.05 113.62 109.18 1x4a n SER 104 Ca 0.00 -0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1x4a n SER 104 Cb 0.00 -1.26 0.00 0.00 -0.75 0.00 0.00 64.21 62.20 1x4a n SER 104 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x4a n GLY 105 N 1.04 1.41 3.56 0.46 0.00 -1.26 -4.93 105.19 105.47 1x4a n GLY 105 Ca 0.05 -1.66 -0.35 0.00 0.00 0.00 0.00 46.02 44.06 1x4a n GLY 105 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x4a s PRO 106 N 2.09 3.07 0.47 1.61 0.04 -1.26 -4.96 135.00 136.06 1x4a s PRO 106 Ca 0.00 -0.62 -0.22 0.00 0.04 0.00 0.00 61.00 60.20 1x4a s PRO 106 Cb 0.00 -5.11 -0.10 0.00 0.04 0.00 0.00 34.50 29.32 1x4a s PRO 106 CO 0.00 -2.74 0.77 0.45 0.04 0.00 0.00 177.00 175.52 1x4a n SER 107 N 11.33 0.12 -4.89 6.66 2.88 -1.26 -4.96 113.62 123.50 1x4a n SER 107 Ca 0.34 0.92 -0.32 0.00 -1.33 0.00 0.00 58.87 58.47 1x4a n SER 107 Cb 0.49 -1.25 -0.05 0.00 -0.75 0.00 0.00 64.21 62.65 1x4a n SER 107 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1x4a s SER 108 N -0.94 6.51 0.00 -3.46 0.15 -1.26 -5.29 113.70 109.41 1x4a s SER 108 Ca 0.66 0.61 0.03 0.00 0.70 0.00 0.00 55.95 57.94 1x4a s SER 108 Cb -0.54 -2.10 0.17 0.00 -1.71 0.00 0.00 66.02 61.85 1x4a s SER 108 CO 0.56 0.11 0.66 0.61 1.20 0.00 0.00 173.24 176.37