#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x5n s SER 2 N 0.00 4.11 0.08 1.61 0.01 -1.26 -5.15 113.70 113.11 1x5n s SER 2 Ca 0.00 -1.08 -0.24 0.00 1.31 0.00 0.00 55.95 55.94 1x5n s SER 2 Cb 0.00 -0.48 0.06 0.00 0.21 0.00 0.00 66.02 65.81 1x5n s SER 2 CO 0.00 -0.30 0.59 -0.55 0.41 0.00 0.00 173.24 173.39 1x5n s SER 3 N -3.73 -0.54 0.14 2.44 0.15 -1.26 -5.18 113.70 105.72 1x5n s SER 3 Ca 0.35 0.19 -0.25 0.00 0.70 0.00 0.00 55.95 56.94 1x5n s SER 3 Cb 0.02 0.56 0.07 0.00 -1.71 0.00 0.00 66.02 64.96 1x5n s SER 3 CO 0.19 -0.82 1.02 -0.83 1.20 0.00 0.00 173.24 174.00 1x5n s GLY 4 N -2.22 -0.16 -0.30 9.45 0.00 -1.26 -5.16 107.32 107.67 1x5n s GLY 4 Ca -0.03 0.07 -0.18 0.00 0.00 0.00 0.00 44.72 44.58 1x5n s GLY 4 CO -0.05 0.67 1.23 -0.56 0.00 0.00 0.00 173.10 174.40 1x5n s SER 5 N -3.08 -0.12 -0.02 1.64 0.01 -1.26 -5.03 113.70 105.84 1x5n s SER 5 Ca 0.15 0.11 0.16 0.00 1.31 0.00 0.00 55.95 57.68 1x5n s SER 5 Cb -0.01 1.11 -0.24 0.00 0.21 0.00 0.00 66.02 67.10 1x5n s SER 5 CO 0.02 -0.02 0.36 -0.24 0.41 0.00 0.00 173.24 173.77 1x5n n SER 6 N 5.10 1.41 0.00 2.44 2.88 -1.26 -5.11 113.62 119.08 1x5n n SER 6 Ca -0.08 -0.04 0.00 0.00 -1.33 0.00 0.00 58.87 57.42 1x5n n SER 6 Cb 0.55 1.68 0.00 0.00 -0.75 0.00 0.00 64.21 65.69 1x5n n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x5n n GLY 7 N 1.60 0.48 2.90 0.46 0.00 -1.26 -5.03 105.19 104.35 1x5n n GLY 7 Ca -0.03 -2.12 -0.18 0.00 0.00 0.00 0.00 46.02 43.69 1x5n n GLY 7 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1x5n s SER 8 N 0.00 0.73 1.12 1.61 0.15 -1.26 -5.15 113.70 110.90 1x5n s SER 8 Ca 0.00 -0.10 -0.19 0.00 0.70 0.00 0.00 55.95 56.36 1x5n s SER 8 Cb 0.00 -0.30 0.27 0.00 -1.71 0.00 0.00 66.02 64.28 1x5n s SER 8 CO 0.00 -0.03 1.24 -2.16 1.20 0.00 0.00 173.24 173.49 1x5n s PRO 9 N 0.64 -0.64 -0.37 5.44 0.04 -1.26 -5.06 135.00 133.79 1x5n s PRO 9 Ca -0.08 -0.38 0.01 0.00 0.04 0.00 0.00 61.00 60.60 1x5n s PRO 9 Cb -0.11 -1.69 0.15 0.00 0.04 0.00 0.00 34.50 32.89 1x5n s PRO 9 CO -0.00 -3.27 0.26 0.20 0.04 0.00 0.00 177.00 174.22 1x5n s GLY 10 N -4.50 0.87 -0.24 0.56 0.00 -1.26 -5.10 107.32 97.65 1x5n s GLY 10 Ca 0.75 -1.96 -0.37 0.00 0.00 0.00 0.00 44.72 43.14 1x5n s GLY 10 CO 0.55 2.15 1.32 0.54 0.00 0.00 0.00 173.10 177.66 1x5n s ASN 11 N 0.82 -0.06 -0.76 1.64 4.22 -1.26 -5.09 114.94 114.45 1x5n s ASN 11 Ca 0.22 -0.00 0.03 0.00 -2.14 0.00 0.00 52.86 50.97 1x5n s ASN 11 Cb -0.15 0.06 0.22 0.00 1.28 0.00 0.00 41.25 42.66 1x5n s ASN 11 CO -0.05 -0.11 0.72 0.54 -2.04 0.00 0.00 177.10 176.16 1x5n n ARG 12 N -0.06 2.45 -3.46 3.55 3.00 -1.26 -5.02 116.66 115.85 1x5n n ARG 12 Ca 0.03 -4.56 -0.12 0.00 -0.01 0.00 0.00 57.85 53.20 1x5n n ARG 12 Cb 0.57 -2.33 -0.03 0.00 0.00 0.00 0.00 32.46 30.68 1x5n n ARG 12 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.63 176.42 1x5n s GLU 13 N -1.87 1.09 -0.55 5.56 0.41 -1.26 -5.11 118.70 116.96 1x5n s GLU 13 Ca 0.31 -0.30 0.04 0.00 -0.41 0.00 0.00 54.97 54.61 1x5n s GLU 13 Cb 0.02 0.51 0.14 0.00 -1.78 0.00 0.00 34.13 33.01 1x5n s GLU 13 CO -0.09 -0.46 0.30 -0.80 -0.49 0.00 0.00 175.26 173.73 1x5n s ASN 14 N -2.39 4.41 0.40 -0.19 0.01 -1.26 -5.07 114.94 110.85 1x5n s ASN 14 Ca 0.00 -3.16 0.06 0.00 -0.71 0.00 0.00 52.86 49.05 1x5n s ASN 14 Cb -0.01 -1.64 -0.07 0.00 0.41 0.00 0.00 41.25 39.94 1x5n s ASN 14 CO -0.08 -0.21 0.02 -0.54 -1.51 0.00 0.00 177.10 174.79 1x5n s LYS 15 N -0.50 1.92 -0.08 -0.60 -0.14 -1.26 -4.82 119.74 114.25 1x5n s LYS 15 Ca 0.18 -2.10 -0.05 0.00 -1.36 0.00 0.00 55.97 52.64 1x5n s LYS 15 Cb -0.22 -1.44 0.01 0.00 -1.68 0.00 0.00 37.83 34.50 1x5n s LYS 15 CO -0.03 -0.12 0.09 0.39 -0.76 0.00 0.00 175.35 174.92 1x5n n GLU 16 N -0.94 -0.71 -4.48 1.68 1.02 -1.24 -4.93 120.64 111.04 1x5n n GLU 16 Ca -0.06 1.00 -0.34 0.00 -0.02 0.00 0.00 57.16 57.74 1x5n n GLU 16 Cb 0.67 -1.44 -0.10 0.00 -0.02 0.00 0.00 31.44 30.54 1x5n n GLU 16 CO 0.00 0.00 0.00 -1.59 1.18 0.00 0.00 177.13 176.72 1x5n s LYS 17 N -1.25 2.79 -0.39 3.49 -2.85 0.20 -4.96 119.74 116.77 1x5n s LYS 17 Ca 0.05 -0.54 -0.16 0.00 -1.00 0.00 0.00 55.97 54.32 1x5n s LYS 17 Cb -0.01 -2.64 0.01 0.00 -2.06 0.00 0.00 37.83 33.13 1x5n s LYS 17 CO 0.18 0.66 0.39 0.21 0.10 0.00 0.00 175.35 176.89 1x5n s LYS 18 N -1.03 3.28 -0.23 1.78 2.20 -1.26 -1.59 119.74 122.89 1x5n s LYS 18 Ca 0.14 -0.64 -0.02 0.00 -0.36 0.00 0.00 55.97 55.10 1x5n s LYS 18 Cb -0.11 -3.90 0.02 0.00 -1.51 0.00 0.00 37.83 32.33 1x5n s LYS 18 CO 0.04 -0.70 -0.08 0.14 -0.36 0.00 0.00 175.35 174.39 1x5n s VAL 19 N 2.04 2.86 -0.30 4.02 -7.23 0.20 -4.98 120.40 117.00 1x5n s VAL 19 Ca 0.11 -0.92 -0.17 0.00 -1.81 0.00 0.00 61.98 59.20 1x5n s VAL 19 Cb -0.17 -2.40 -0.02 0.00 0.56 0.00 0.00 36.38 34.35 1x5n s VAL 19 CO 0.12 0.28 0.45 0.12 -0.31 0.00 0.00 175.10 175.76 1x5n s PHE 20 N 1.35 3.22 -0.56 2.82 2.19 -1.26 0.08 117.98 125.82 1x5n s PHE 20 Ca 0.02 0.32 -0.19 0.00 0.33 0.00 0.00 56.93 57.41 1x5n s PHE 20 Cb -0.16 -2.73 0.09 0.00 -1.31 0.00 0.00 43.02 38.91 1x5n s PHE 20 CO -0.05 -0.37 0.65 0.42 1.83 0.00 0.00 175.22 177.70 1x5n s ILE 21 N 2.22 4.87 -0.40 3.12 -1.09 0.21 -4.94 121.20 125.20 1x5n s ILE 21 Ca 0.17 -0.86 -0.22 0.00 -2.23 0.00 0.00 60.65 57.52 1x5n s ILE 21 Cb -0.16 -4.40 0.01 0.00 -1.58 0.00 0.00 42.46 36.33 1x5n s ILE 21 CO 0.11 -0.98 0.70 -0.44 -1.23 0.00 0.00 174.94 173.10 1x5n s SER 22 N 3.27 6.43 -1.25 3.58 0.01 -1.26 -1.49 113.70 122.98 1x5n s SER 22 Ca 0.12 0.02 -0.10 0.00 1.31 0.00 0.00 55.95 57.30 1x5n s SER 22 Cb -0.23 -2.35 0.17 0.00 0.21 0.00 0.00 66.02 63.82 1x5n s SER 22 CO 0.08 -0.74 1.73 0.18 0.41 0.00 0.00 173.24 174.90 1x5n n LEU 23 N 6.33 6.23 -3.83 2.44 4.32 -1.04 -4.89 117.00 126.56 1x5n n LEU 23 Ca 0.00 -4.62 -0.27 0.00 -0.02 0.00 0.00 56.01 51.10 1x5n n LEU 23 Cb 0.48 -1.51 -0.17 0.00 -1.62 0.00 0.00 43.42 40.61 1x5n n LEU 23 CO 0.53 1.21 -0.40 0.68 -1.22 0.00 0.00 177.39 178.19 1x5n s VAL 24 N 0.57 0.84 0.00 4.08 -7.23 -1.26 -4.71 120.40 112.69 1x5n s VAL 24 Ca 0.40 -0.54 0.00 0.00 -1.81 0.00 0.00 61.98 60.03 1x5n s VAL 24 Cb 0.06 -1.13 0.00 0.00 0.56 0.00 0.00 36.38 35.86 1x5n s VAL 24 CO 0.01 0.02 0.00 0.61 -0.31 0.00 0.00 175.10 175.43 1x5n n GLY 25 N 4.96 1.24 2.65 2.32 0.00 -1.26 -4.85 105.19 110.25 1x5n n GLY 25 Ca -0.10 -0.62 -0.11 0.00 0.00 0.00 0.00 46.02 45.19 1x5n n GLY 25 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1x5n n SER 26 N 0.00 -2.27 -3.63 1.61 3.41 -1.26 -5.11 113.62 106.36 1x5n n SER 26 Ca 0.00 -3.30 -0.04 0.00 -0.26 0.00 0.00 58.87 55.27 1x5n n SER 26 Cb 0.00 1.45 -0.06 0.00 -0.26 0.00 0.00 64.21 65.35 1x5n n SER 26 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1x5n s ARG 27 N 0.26 0.62 -0.50 4.33 0.52 -1.26 -5.07 118.95 117.86 1x5n s ARG 27 Ca 0.31 1.23 0.06 0.00 -0.52 0.00 0.00 55.73 56.80 1x5n s ARG 27 Cb 0.24 0.37 0.38 0.00 0.52 0.00 0.00 34.95 36.46 1x5n s ARG 27 CO -0.19 -0.16 1.01 0.41 0.02 0.00 0.00 175.30 176.40 1x5n n GLY 28 N 4.64 5.56 1.92 -3.53 0.00 -1.26 -4.66 105.19 107.85 1x5n n GLY 28 Ca -0.17 -2.68 0.00 0.00 0.00 0.00 0.00 46.02 43.17 1x5n n GLY 28 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1x5n n LEU 29 N -0.32 -5.39 -2.41 0.99 7.94 -1.26 -4.87 117.00 111.68 1x5n n LEU 29 Ca 0.33 2.25 -0.34 0.00 -1.11 0.00 0.00 56.01 57.15 1x5n n LEU 29 Cb 0.54 -2.68 0.06 0.00 0.53 0.00 0.00 43.42 41.86 1x5n n LEU 29 CO 0.33 -1.95 1.22 0.61 -1.11 0.00 0.00 177.39 176.48 1x5n n GLY 30 N 1.40 5.90 2.98 -3.96 0.00 -1.26 -4.93 105.19 105.32 1x5n n GLY 30 Ca 0.00 -2.42 -0.14 0.00 0.00 0.00 0.00 46.02 43.46 1x5n n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x5n s SER 32 N -0.66 7.03 0.02 0.00 0.15 0.15 -4.95 113.70 115.44 1x5n s SER 32 Ca -0.03 1.22 0.08 0.00 0.70 0.00 0.00 55.95 57.92 1x5n s SER 32 Cb -0.05 -2.35 -0.03 0.00 -1.71 0.00 0.00 66.02 61.88 1x5n s SER 32 CO -0.00 0.24 -0.24 0.27 1.20 0.00 0.00 173.24 174.70 1x5n s ILE 33 N -0.88 2.28 0.22 6.45 -4.36 -1.26 0.46 121.20 124.11 1x5n s ILE 33 Ca 0.29 -1.24 0.01 0.00 -0.26 0.00 0.00 60.65 59.44 1x5n s ILE 33 Cb -0.19 -1.87 -0.05 0.00 1.25 0.00 0.00 42.46 41.60 1x5n s ILE 33 CO 0.18 0.43 0.09 -0.55 0.24 0.00 0.00 174.94 175.34 1x5n s SER 34 N -1.07 0.86 0.10 4.36 0.15 0.33 -4.88 113.70 113.55 1x5n s SER 34 Ca 0.12 -1.35 0.01 0.00 0.70 0.00 0.00 55.95 55.43 1x5n s SER 34 Cb -0.10 0.22 -0.04 0.00 -1.71 0.00 0.00 66.02 64.39 1x5n s SER 34 CO 0.02 -0.74 0.23 -0.55 1.20 0.00 0.00 173.24 173.40 1x5n s SER 35 N -3.24 6.28 0.64 5.45 0.15 -1.26 -1.14 113.70 120.57 1x5n s SER 35 Ca 0.35 0.20 0.02 0.00 0.70 0.00 0.00 55.95 57.23 1x5n s SER 35 Cb 0.07 -1.90 0.09 0.00 -1.71 0.00 0.00 66.02 62.58 1x5n s SER 35 CO 0.11 0.12 0.88 -0.83 1.20 0.00 0.00 173.24 174.72 1x5n s GLY 36 N -2.81 1.78 0.22 9.45 0.00 -1.00 -4.91 107.32 110.06 1x5n s GLY 36 Ca 0.34 -1.70 -0.04 0.00 0.00 0.00 0.00 44.72 43.32 1x5n s GLY 36 CO 0.28 -1.25 0.25 -1.55 0.00 0.00 0.00 173.10 170.83 1x5n n PRO 37 N -2.55 -0.85 0.13 2.90 -0.04 -1.12 -4.49 135.00 128.98 1x5n n PRO 37 Ca 0.13 -0.39 -0.02 0.00 -0.04 0.00 0.00 63.50 63.18 1x5n n PRO 37 Cb 0.60 -0.31 0.15 0.00 -0.04 0.00 0.00 33.50 33.90 1x5n n PRO 37 CO 0.00 0.00 0.00 0.97 -0.04 0.00 0.00 175.50 176.43 1x5n h ILE 38 N -1.45 1.46 0.01 0.52 6.09 -1.99 0.53 117.51 122.67 1x5n h ILE 38 Ca -0.09 -2.21 -0.19 0.00 -1.37 0.00 0.00 64.86 61.00 1x5n h ILE 38 Cb 0.25 2.19 -0.02 0.00 0.47 0.00 0.00 36.82 39.71 1x5n h ILE 38 CO 0.06 0.63 -0.91 0.06 -3.07 0.00 0.00 178.15 174.93 1x5n h GLN 39 N 0.01 0.05 -2.05 2.19 3.07 -2.06 -3.35 115.11 112.97 1x5n h GLN 39 Ca -0.01 -0.06 -0.51 0.00 0.09 0.00 0.00 58.65 58.16 1x5n h GLN 39 Cb 1.15 0.02 -0.40 0.00 0.08 0.00 0.00 27.48 28.32 1x5n h GLN 39 CO 0.08 0.92 -1.09 1.17 0.09 0.00 0.00 178.83 180.00 1x5n n LYS 40 N -3.52 1.29 -2.53 0.06 4.81 -1.12 -5.11 118.16 112.05 1x5n n LYS 40 Ca -0.01 -3.60 -0.37 0.00 -0.87 0.00 0.00 58.31 53.46 1x5n n LYS 40 Cb 0.85 -1.72 -0.04 0.00 0.02 0.00 0.00 35.03 34.14 1x5n n LYS 40 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 1x5n s PRO 41 N -2.38 4.15 0.00 1.64 0.04 0.18 -2.79 135.00 135.85 1x5n s PRO 41 Ca 0.40 1.52 0.00 0.00 0.04 0.00 0.00 61.00 62.97 1x5n s PRO 41 Cb 0.31 -2.54 0.00 0.00 0.04 0.00 0.00 34.50 32.31 1x5n s PRO 41 CO -0.09 -0.15 0.00 0.41 0.04 0.00 0.00 177.00 177.21 1x5n n GLY 42 N 0.34 0.05 3.07 0.56 0.00 -1.26 -4.71 105.19 103.24 1x5n n GLY 42 Ca 0.05 -1.34 -0.32 0.00 0.00 0.00 0.00 46.02 44.41 1x5n n GLY 42 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1x5n s ILE 43 N -3.21 1.88 -0.00 -0.61 -1.09 -1.26 -2.38 121.20 114.54 1x5n s ILE 43 Ca 0.00 -0.96 0.05 0.00 -2.23 0.00 0.00 60.65 57.51 1x5n s ILE 43 Cb 0.00 -1.79 -0.01 0.00 -1.58 0.00 0.00 42.46 39.07 1x5n s ILE 43 CO 0.00 0.38 -0.16 -0.36 -1.23 0.00 0.00 174.94 173.57 1x5n s PHE 44 N 1.33 1.42 0.64 3.97 0.40 -0.29 0.16 117.98 125.61 1x5n s PHE 44 Ca 0.02 -0.28 -0.17 0.00 -0.60 0.00 0.00 56.93 55.90 1x5n s PHE 44 Cb -0.14 -0.90 -0.01 0.00 0.51 0.00 0.00 43.02 42.47 1x5n s PHE 44 CO -0.11 -0.01 1.16 0.42 0.70 0.00 0.00 175.22 177.38 1x5n s ILE 45 N -0.44 2.86 -0.03 0.64 1.01 -1.18 -0.51 121.20 123.55 1x5n s ILE 45 Ca 0.06 0.46 0.01 0.00 0.00 0.00 0.00 60.65 61.17 1x5n s ILE 45 Cb -0.06 -3.07 -0.02 0.00 0.01 0.00 0.00 42.46 39.32 1x5n s ILE 45 CO -0.00 -0.18 -0.02 -1.54 0.00 0.00 0.00 174.94 173.19 1x5n n SER 46 N -2.05 3.84 -3.70 3.58 3.41 0.17 -3.70 113.62 115.18 1x5n n SER 46 Ca 0.12 -0.01 -0.10 0.00 -0.26 0.00 0.00 58.87 58.62 1x5n n SER 46 Cb 0.51 0.03 -0.05 0.00 -0.26 0.00 0.00 64.21 64.44 1x5n n SER 46 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 1x5n s HIS 47 N -2.06 -0.10 -0.03 7.33 5.65 -1.22 -4.88 115.29 119.98 1x5n s HIS 47 Ca -0.04 -0.24 -0.01 0.00 0.25 0.00 0.00 55.06 55.02 1x5n s HIS 47 Cb 0.01 0.16 0.03 0.00 -1.18 0.00 0.00 32.58 31.60 1x5n s HIS 47 CO 0.08 -0.65 0.06 0.08 -0.65 0.00 0.00 174.74 173.66 1x5n s VAL 48 N -3.78 -0.05 0.60 0.89 1.01 -1.26 -0.68 120.40 117.13 1x5n s VAL 48 Ca 0.03 0.19 -0.15 0.00 0.00 0.00 0.00 61.98 62.05 1x5n s VAL 48 Cb 0.03 -0.12 -0.04 0.00 0.00 0.00 0.00 36.38 36.25 1x5n s VAL 48 CO -0.11 0.08 1.04 -0.54 0.00 0.00 0.00 175.10 175.56 1x5n s LYS 49 N 0.99 3.40 -0.38 2.72 1.02 0.74 -4.97 119.74 123.27 1x5n s LYS 49 Ca -0.08 1.09 -0.29 0.00 0.02 0.00 0.00 55.97 56.71 1x5n s LYS 49 Cb -0.11 -2.05 0.01 0.00 -0.52 0.00 0.00 37.83 35.15 1x5n s LYS 49 CO -0.03 -0.74 1.39 -1.25 -0.92 0.00 0.00 175.35 173.80 1x5n s PRO 50 N -4.29 3.67 -0.37 -1.68 0.04 -1.26 -3.13 135.00 127.98 1x5n s PRO 50 Ca 0.61 1.05 -0.01 0.00 0.04 0.00 0.00 61.00 62.69 1x5n s PRO 50 Cb -0.14 -3.99 0.00 0.00 0.04 0.00 0.00 34.50 30.41 1x5n s PRO 50 CO 0.40 -1.44 0.32 0.41 0.04 0.00 0.00 177.00 176.72 1x5n n GLY 51 N 4.86 0.36 0.00 0.56 0.00 -1.26 -5.06 105.19 104.65 1x5n n GLY 51 Ca 0.16 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.82 1x5n n GLY 51 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1x5n n SER 52 N -0.72 0.00 0.08 1.61 3.41 -1.18 -4.84 113.62 111.98 1x5n n SER 52 Ca -0.04 -0.65 0.13 0.00 -0.26 0.00 0.00 58.87 58.05 1x5n n SER 52 Cb 0.53 0.00 0.45 0.00 -0.26 0.00 0.00 64.21 64.94 1x5n n SER 52 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 1x5n n LEU 53 N 0.00 0.63 -0.08 1.04 7.94 -1.26 -1.88 117.00 123.38 1x5n n LEU 53 Ca 0.00 0.56 -0.21 0.00 -1.11 0.00 0.00 56.01 55.25 1x5n n LEU 53 Cb 0.00 -0.37 -0.12 0.00 0.53 0.00 0.00 43.42 43.46 1x5n n LEU 53 CO 0.00 -0.16 -1.10 -1.54 -1.11 0.00 0.00 177.39 173.47 1x5n n SER 54 N -2.09 2.02 -0.16 1.96 3.41 -1.26 -4.25 113.62 113.24 1x5n n SER 54 Ca 0.06 0.09 -0.09 0.00 -0.26 0.00 0.00 58.87 58.66 1x5n n SER 54 Cb 0.40 -0.67 0.00 0.00 -0.26 0.00 0.00 64.21 63.68 1x5n n SER 54 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1x5n h ALA 55 N -0.14 0.63 -1.15 7.33 0.00 -1.74 0.55 119.26 124.73 1x5n h ALA 55 Ca -0.52 -0.23 0.33 0.00 0.00 0.00 0.00 54.91 54.48 1x5n h ALA 55 Cb 1.86 -0.18 -0.10 0.00 0.00 0.00 0.00 17.79 19.37 1x5n h ALA 55 CO -0.08 0.36 0.76 1.05 0.00 0.00 0.00 179.25 181.33 1x5n h GLU 56 N 0.65 0.24 0.00 0.00 4.11 -1.57 1.32 114.58 119.32 1x5n h GLU 56 Ca 0.14 -0.01 -0.17 0.00 0.07 0.00 0.00 59.36 59.39 1x5n h GLU 56 Cb 0.39 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.56 1x5n h GLU 56 CO 0.01 0.16 -1.29 -0.39 0.07 0.00 0.00 179.01 177.57 1x5n h VAL 57 N 0.25 0.61 0.00 -1.06 -1.51 -1.61 -3.48 116.25 109.44 1x5n h VAL 57 Ca 0.66 -2.12 0.00 0.00 -1.23 0.00 0.00 66.70 64.01 1x5n h VAL 57 Cb 1.94 2.14 0.00 0.00 -2.13 0.00 0.00 31.29 33.24 1x5n h VAL 57 CO -0.29 0.35 0.00 0.61 -1.23 0.00 0.00 177.57 177.01 1x5n n GLY 58 N 1.38 1.14 3.78 5.19 0.00 0.45 -5.07 105.19 112.06 1x5n n GLY 58 Ca -0.08 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.55 1x5n n GLY 58 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1x5n s LEU 59 N 0.00 4.48 0.28 0.99 1.43 0.18 -4.95 118.68 121.09 1x5n s LEU 59 Ca 0.00 1.30 0.02 0.00 -1.03 0.00 0.00 54.13 54.42 1x5n s LEU 59 Cb 0.00 -3.00 -0.04 0.00 0.03 0.00 0.00 46.19 43.18 1x5n s LEU 59 CO 0.00 0.17 0.15 -1.83 0.23 0.00 0.00 176.35 175.07 1x5n s GLU 60 N -0.62 1.49 0.27 1.70 -1.05 -1.26 -4.28 118.70 114.95 1x5n s GLU 60 Ca 0.32 -1.84 -0.30 0.00 -0.15 0.00 0.00 54.97 53.00 1x5n s GLU 60 Cb -0.20 -0.00 -0.11 0.00 -0.44 0.00 0.00 34.13 33.38 1x5n s GLU 60 CO 0.20 -0.43 1.54 0.42 0.95 0.00 0.00 175.26 177.93 1x5n s ILE 61 N -3.74 2.30 0.00 1.83 1.01 -1.26 -2.37 121.20 118.97 1x5n s ILE 61 Ca 0.37 0.25 0.00 0.00 0.00 0.00 0.00 60.65 61.27 1x5n s ILE 61 Cb 0.06 -3.16 0.00 0.00 0.01 0.00 0.00 42.46 39.36 1x5n s ILE 61 CO 0.17 0.04 0.00 0.61 0.00 0.00 0.00 174.94 175.76 1x5n n GLY 62 N 2.24 2.40 3.53 6.18 0.00 -1.24 -4.72 105.19 113.57 1x5n n GLY 62 Ca 0.08 -0.49 -0.31 0.00 0.00 0.00 0.00 46.02 45.29 1x5n n GLY 62 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1x5n n ASP 63 N 0.25 1.03 -4.71 1.61 9.92 -1.00 -1.90 116.55 121.75 1x5n n ASP 63 Ca 0.00 -0.48 -0.41 0.00 -0.53 0.00 0.00 54.79 53.37 1x5n n ASP 63 Cb 0.00 -1.24 -0.04 0.00 -0.64 0.00 0.00 41.12 39.20 1x5n n ASP 63 CO 0.00 0.00 0.00 -1.58 0.13 0.00 0.00 177.20 175.75 1x5n s GLN 64 N 8.43 4.51 -0.52 -1.24 0.74 -1.26 -3.08 119.66 127.24 1x5n s GLN 64 Ca 1.14 1.17 -0.27 0.00 0.05 0.00 0.00 55.36 57.45 1x5n s GLN 64 Cb -0.60 -3.45 0.03 0.00 1.10 0.00 0.00 33.01 30.09 1x5n s GLN 64 CO 0.35 0.02 1.07 0.42 -0.55 0.00 0.00 175.29 176.59 1x5n s ILE 65 N 0.86 4.24 -0.10 -2.34 1.01 0.43 -3.65 121.20 121.65 1x5n s ILE 65 Ca 0.45 0.86 0.21 0.00 0.00 0.00 0.00 60.65 62.17 1x5n s ILE 65 Cb -0.20 -4.59 -0.24 0.00 0.01 0.00 0.00 42.46 37.44 1x5n s ILE 65 CO 0.24 -1.09 0.56 1.33 0.00 0.00 0.00 174.94 175.98 1x5n n VAL 66 N 6.59 0.42 -3.65 2.92 0.24 -0.95 -4.02 118.33 119.88 1x5n n VAL 66 Ca 0.08 -0.58 -0.14 0.00 -2.04 0.00 0.00 64.34 61.66 1x5n n VAL 66 Cb 0.49 -0.20 -0.07 0.00 -1.47 0.00 0.00 33.84 32.59 1x5n n VAL 66 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 1x5n s GLU 67 N -3.29 0.89 -0.15 7.34 2.12 -1.19 -1.99 118.70 122.43 1x5n s GLU 67 Ca -0.06 -0.18 -0.06 0.00 0.36 0.00 0.00 54.97 55.03 1x5n s GLU 67 Cb 0.12 0.41 0.07 0.00 0.26 0.00 0.00 34.13 34.98 1x5n s GLU 67 CO 0.87 -0.29 0.32 0.08 -0.54 0.00 0.00 175.26 175.70 1x5n s VAL 68 N -1.90 -0.46 -0.89 3.70 1.01 -0.97 -0.36 120.40 120.54 1x5n s VAL 68 Ca -0.09 0.23 0.00 0.00 0.00 0.00 0.00 61.98 62.12 1x5n s VAL 68 Cb -0.02 -0.52 0.00 0.00 0.00 0.00 0.00 36.38 35.84 1x5n s VAL 68 CO 0.02 0.10 0.00 -3.20 0.00 0.00 0.00 175.10 172.02 1x5n n ASN 69 N 5.26 -3.09 0.00 3.32 5.15 0.39 0.19 115.26 126.48 1x5n n ASN 69 Ca -0.09 0.25 0.00 0.00 -0.60 0.00 0.00 54.58 54.15 1x5n n ASN 69 Cb 0.50 -2.75 0.00 0.00 -0.53 0.00 0.00 39.78 37.00 1x5n n ASN 69 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1x5n n GLY 70 N -0.59 0.70 3.87 8.20 0.00 -1.26 -4.86 105.19 111.26 1x5n n GLY 70 Ca -0.11 -0.72 -0.27 0.00 0.00 0.00 0.00 46.02 44.93 1x5n n GLY 70 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1x5n s VAL 71 N -2.00 4.93 -0.98 1.61 1.01 0.52 -5.04 120.40 120.46 1x5n s VAL 71 Ca 0.00 -0.83 -0.20 0.00 0.00 0.00 0.00 61.98 60.95 1x5n s VAL 71 Cb 0.00 -3.51 0.10 0.00 0.00 0.00 0.00 36.38 32.97 1x5n s VAL 71 CO 0.00 -0.07 1.26 -0.62 0.00 0.00 0.00 175.10 175.68 1x5n s ASP 72 N -3.07 6.60 -0.28 3.32 2.15 -1.26 -2.28 116.67 121.85 1x5n s ASP 72 Ca 0.33 -1.87 0.09 0.00 0.43 0.00 0.00 52.55 51.53 1x5n s ASP 72 Cb -0.11 -2.46 0.68 0.00 -0.30 0.00 0.00 42.92 40.73 1x5n s ASP 72 CO 0.26 -1.21 1.69 0.49 -0.17 0.00 0.00 175.17 176.22 1x5n n PHE 73 N 7.39 2.18 0.13 -5.34 3.01 -0.84 -4.23 117.46 119.76 1x5n n PHE 73 Ca 0.28 -1.04 0.01 0.00 1.01 0.00 0.00 57.45 57.71 1x5n n PHE 73 Cb 0.50 -0.62 0.10 0.00 -0.01 0.00 0.00 39.48 39.44 1x5n n PHE 73 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 1x5n h SER 74 N 2.54 0.00 -0.61 4.37 0.87 -1.72 -3.36 113.55 115.65 1x5n h SER 74 Ca 0.21 0.00 -0.30 0.00 -1.23 0.00 0.00 61.79 60.47 1x5n h SER 74 Cb 2.14 0.00 -0.31 0.00 -0.44 0.00 0.00 62.40 63.79 1x5n h SER 74 CO 0.64 0.60 -0.88 0.59 -0.53 0.00 0.00 176.83 177.26 1x5n n ASN 75 N -3.41 0.19 -1.93 6.23 3.02 -1.26 -4.00 115.26 114.09 1x5n n ASN 75 Ca 0.00 -2.59 0.00 0.00 -0.03 0.00 0.00 54.58 51.96 1x5n n ASN 75 Cb 0.71 0.05 0.00 0.00 -0.61 0.00 0.00 39.78 39.93 1x5n n ASN 75 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1x5n n LEU 76 N -0.29 0.00 -4.35 3.41 4.77 -1.26 -4.97 117.00 114.30 1x5n n LEU 76 Ca 0.04 0.00 -0.18 0.00 -0.03 0.00 0.00 56.01 55.84 1x5n n LEU 76 Cb 0.83 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.82 1x5n n LEU 76 CO 0.13 -0.35 -0.26 -0.62 -1.33 0.00 0.00 177.39 174.97 1x5n s ASP 77 N -1.00 1.50 0.00 -1.43 2.15 -1.26 -4.73 116.67 111.89 1x5n s ASP 77 Ca 0.00 -1.39 0.16 0.00 0.43 0.00 0.00 52.55 51.75 1x5n s ASP 77 Cb 0.00 0.12 0.78 0.00 -0.30 0.00 0.00 42.92 43.52 1x5n s ASP 77 CO 0.00 -0.71 1.48 1.57 -0.17 0.00 0.00 175.17 177.34 1x5n n HIS 78 N -0.53 0.00 -0.07 -5.34 -0.00 -1.26 0.53 115.22 108.55 1x5n n HIS 78 Ca -0.01 0.00 -0.10 0.00 -0.00 0.00 0.00 57.72 57.62 1x5n n HIS 78 Cb 0.66 -0.35 -0.07 0.00 -0.00 0.00 0.00 29.99 30.24 1x5n n HIS 78 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.34 177.51 1x5n n LYS 79 N -1.35 0.51 0.05 1.57 4.81 -1.26 -3.88 118.16 118.62 1x5n n LYS 79 Ca 0.07 0.08 -0.15 0.00 -0.87 0.00 0.00 58.31 57.44 1x5n n LYS 79 Cb 0.14 -1.30 -0.05 0.00 0.02 0.00 0.00 35.03 33.84 1x5n n LYS 79 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 1x5n h GLU 80 N 0.00 0.49 -0.22 1.64 5.08 -1.89 0.85 114.58 120.54 1x5n h GLU 80 Ca -0.33 -0.51 -0.18 0.00 -1.00 0.00 0.00 59.36 57.34 1x5n h GLU 80 Cb 1.53 0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.93 1x5n h GLU 80 CO -0.05 1.15 -0.55 0.00 -1.00 0.00 0.00 179.01 178.56 1x5n h ALA 81 N 0.68 0.36 -0.41 3.43 0.00 -0.17 -1.25 119.26 121.90 1x5n h ALA 81 Ca -0.08 -0.52 -0.15 0.00 0.00 0.00 0.00 54.91 54.16 1x5n h ALA 81 Cb 1.57 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.30 1x5n h ALA 81 CO 0.17 0.57 -0.35 0.28 0.00 0.00 0.00 179.25 179.92 1x5n h VAL 82 N 0.48 1.27 -0.03 0.00 2.07 -1.67 0.12 116.25 118.50 1x5n h VAL 82 Ca -0.01 -1.52 0.00 0.00 0.82 0.00 0.00 66.70 65.99 1x5n h VAL 82 Cb 1.17 1.32 -0.00 0.00 -1.52 0.00 0.00 31.29 32.26 1x5n h VAL 82 CO 0.12 0.51 0.02 -1.13 0.02 0.00 0.00 177.57 177.11 1x5n h ASN 83 N 0.78 0.03 0.74 0.57 -1.24 -0.78 1.62 115.58 117.30 1x5n h ASN 83 Ca 0.07 -0.01 -0.01 0.00 0.71 0.00 0.00 56.30 57.07 1x5n h ASN 83 Cb 0.94 -0.01 -0.00 0.00 0.73 0.00 0.00 38.32 39.98 1x5n h ASN 83 CO 0.09 0.03 -0.04 0.58 -1.29 0.00 0.00 177.43 176.80 1x5n h VAL 84 N 0.03 0.14 0.00 2.57 2.07 -1.16 1.54 116.25 121.44 1x5n h VAL 84 Ca 0.01 -0.49 -0.18 0.00 0.82 0.00 0.00 66.70 66.86 1x5n h VAL 84 Cb 0.00 1.43 -0.03 0.00 -1.52 0.00 0.00 31.29 31.17 1x5n h VAL 84 CO -0.00 0.04 -1.23 -0.07 0.02 0.00 0.00 177.57 176.33 1x5n h LEU 85 N 0.00 0.00 -1.64 2.57 3.38 0.56 -3.29 115.31 116.89 1x5n h LEU 85 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1x5n h LEU 85 Cb 0.42 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.17 1x5n h LEU 85 CO 0.01 0.66 -0.09 2.29 0.09 0.00 0.00 178.44 181.39 1x5n n LYS 86 N -3.02 1.82 -0.06 1.13 2.85 0.54 -4.14 118.16 117.29 1x5n n LYS 86 Ca -0.07 -1.58 0.06 0.00 -1.05 0.00 0.00 58.31 55.66 1x5n n LYS 86 Cb 0.86 -1.40 0.25 0.00 -0.65 0.00 0.00 35.03 34.08 1x5n n LYS 86 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 177.40 177.78 1x5n n SER 87 N 0.92 0.75 -3.61 -5.58 7.64 0.52 -4.87 113.62 109.39 1x5n n SER 87 Ca 0.11 -1.79 -0.01 0.00 1.01 0.00 0.00 58.87 58.19 1x5n n SER 87 Cb 0.50 -0.07 -0.01 0.00 -1.01 0.00 0.00 64.21 63.62 1x5n n SER 87 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1x5n s SER 88 N -1.26 -0.06 -0.06 6.43 1.04 -1.26 -5.03 113.70 113.51 1x5n s SER 88 Ca 0.19 -0.03 -0.03 0.00 0.48 0.00 0.00 55.95 56.56 1x5n s SER 88 Cb 0.09 0.08 -0.01 0.00 0.10 0.00 0.00 66.02 66.29 1x5n s SER 88 CO 0.14 -0.14 -0.06 0.03 0.98 0.00 0.00 173.24 174.19 1x5n h ARG 89 N 2.00 0.00 -6.57 4.02 2.47 -1.87 -3.45 114.38 110.98 1x5n h ARG 89 Ca -0.15 0.00 -0.56 0.00 -1.26 0.00 0.00 59.98 58.01 1x5n h ARG 89 Cb 1.16 0.00 -0.08 0.00 -1.65 0.00 0.00 29.97 29.41 1x5n h ARG 89 CO 0.24 0.00 0.90 -1.12 0.56 0.00 0.00 179.97 180.55 1x5n s SER 90 N -4.38 6.53 0.26 7.04 0.01 -1.26 -2.50 113.70 119.40 1x5n s SER 90 Ca -0.05 0.24 0.11 0.00 1.31 0.00 0.00 55.95 57.55 1x5n s SER 90 Cb 0.01 -2.54 -0.05 0.00 0.21 0.00 0.00 66.02 63.65 1x5n s SER 90 CO 0.08 -1.34 -0.18 -0.76 0.41 0.00 0.00 173.24 171.45 1x5n s LEU 91 N 4.59 2.58 -0.41 2.44 1.02 -0.56 -4.98 118.68 123.36 1x5n s LEU 91 Ca 0.44 -1.03 -0.00 0.00 0.02 0.00 0.00 54.13 53.56 1x5n s LEU 91 Cb -0.08 -0.96 0.11 0.00 0.02 0.00 0.00 46.19 45.29 1x5n s LEU 91 CO 0.28 -0.03 0.18 -0.89 0.02 0.00 0.00 176.35 175.91 1x5n s THR 92 N -2.66 2.97 -0.01 5.49 2.01 -1.26 -0.62 115.64 121.55 1x5n s THR 92 Ca 0.28 -2.31 -0.22 0.00 0.31 0.00 0.00 61.69 59.75 1x5n s THR 92 Cb -0.03 -3.07 -0.05 0.00 0.01 0.00 0.00 72.50 69.36 1x5n s THR 92 CO 0.12 -0.69 0.64 -0.63 -0.69 0.00 0.00 174.62 173.37 1x5n s ILE 93 N 0.87 4.91 -0.42 1.82 1.01 0.11 0.15 121.20 129.65 1x5n s ILE 93 Ca 0.10 1.33 0.03 0.00 0.00 0.00 0.00 60.65 62.11 1x5n s ILE 93 Cb -0.22 -3.98 0.11 0.00 0.01 0.00 0.00 42.46 38.39 1x5n s ILE 93 CO -0.05 0.38 0.15 -0.44 0.00 0.00 0.00 174.94 174.98 1x5n s SER 94 N 0.01 4.73 0.41 3.58 0.01 0.52 0.58 113.70 123.55 1x5n s SER 94 Ca 0.33 -2.43 0.08 0.00 1.31 0.00 0.00 55.95 55.23 1x5n s SER 94 Cb -0.18 -1.67 0.01 0.00 0.21 0.00 0.00 66.02 64.38 1x5n s SER 94 CO 0.18 -0.36 0.57 0.27 0.41 0.00 0.00 173.24 174.31 1x5n s ILE 95 N 0.53 3.12 -0.38 1.44 -4.36 -0.62 -2.24 121.20 118.69 1x5n s ILE 95 Ca 0.13 -0.98 0.06 0.00 -0.26 0.00 0.00 60.65 59.59 1x5n s ILE 95 Cb -0.22 -3.05 0.56 0.00 1.25 0.00 0.00 42.46 41.00 1x5n s ILE 95 CO -0.05 -0.02 1.66 0.52 0.24 0.00 0.00 174.94 177.29 1x5n n VAL 96 N -1.84 2.88 -2.97 8.37 0.31 -1.24 0.58 118.33 124.41 1x5n n VAL 96 Ca 0.07 -2.56 -0.01 0.00 -0.01 0.00 0.00 64.34 61.83 1x5n n VAL 96 Cb 0.59 -0.48 -0.01 0.00 -0.91 0.00 0.00 33.84 33.03 1x5n n VAL 96 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1x5n n ALA 97 N -1.10 -2.21 -3.71 3.52 0.00 -1.26 -3.63 120.51 112.12 1x5n n ALA 97 Ca 0.46 0.51 -0.26 0.00 0.00 0.00 0.00 53.44 54.15 1x5n n ALA 97 Cb 1.24 -1.33 0.03 0.00 0.00 0.00 0.00 19.45 19.38 1x5n n ALA 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1x5n n ALA 98 N 1.69 -2.29 -0.06 0.00 0.00 -1.26 -4.90 120.51 113.69 1x5n n ALA 98 Ca -0.07 -0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.17 1x5n n ALA 98 Cb 0.28 -3.11 0.00 0.00 0.00 0.00 0.00 19.45 16.62 1x5n n ALA 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1x5n n ALA 99 N -4.18 -0.45 -2.55 0.00 0.00 -0.98 -3.72 120.51 108.62 1x5n n ALA 99 Ca -0.19 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 52.85 1x5n n ALA 99 Cb 0.64 0.00 0.02 0.00 0.00 0.00 0.00 19.45 20.11 1x5n n ALA 99 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1x5n n GLY 100 N -0.86 6.03 0.21 0.00 0.00 -0.80 -4.68 105.19 105.09 1x5n n GLY 100 Ca 0.00 -2.58 0.08 0.00 0.00 0.00 0.00 46.02 43.52 1x5n n GLY 100 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1x5n h ARG 101 N 3.94 0.00 -0.21 1.61 3.08 -1.71 -2.77 114.38 118.32 1x5n h ARG 101 Ca 0.52 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 60.41 1x5n h ARG 101 Cb 0.29 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.34 1x5n h ARG 101 CO 1.19 0.27 -0.50 1.05 -1.07 0.00 0.00 179.97 180.91 1x5n h GLU 102 N 0.00 0.59 -0.99 0.04 4.11 -1.90 0.28 114.58 116.71 1x5n h GLU 102 Ca -0.00 -0.35 0.28 0.00 0.07 0.00 0.00 59.36 59.36 1x5n h GLU 102 Cb 0.73 0.03 -0.18 0.00 0.50 0.00 0.00 28.75 29.82 1x5n h GLU 102 CO 0.04 0.95 0.05 -0.07 0.07 0.00 0.00 179.01 180.04 1x5n h LEU 103 N 0.46 -0.45 0.00 3.06 3.38 -1.87 -2.78 115.31 117.10 1x5n h LEU 103 Ca 0.02 0.28 -0.29 0.00 0.09 0.00 0.00 57.88 57.97 1x5n h LEU 103 Cb 1.04 0.48 -0.04 0.00 0.09 0.00 0.00 40.66 42.23 1x5n h LEU 103 CO 0.10 -0.36 -1.86 0.49 0.09 0.00 0.00 178.44 176.90 1x5n n PHE 104 N -5.48 0.24 -2.80 1.13 3.72 -1.18 -5.08 117.46 108.01 1x5n n PHE 104 Ca 0.24 0.10 -0.05 0.00 -0.05 0.00 0.00 57.45 57.69 1x5n n PHE 104 Cb 0.78 -0.89 0.01 0.00 -0.94 0.00 0.00 39.48 38.43 1x5n n PHE 104 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 176.76 175.38 1x5n n MET 105 N -4.35 -2.84 -1.81 -1.08 2.81 0.97 -4.79 117.12 106.03 1x5n n MET 105 Ca -0.39 2.40 0.00 0.00 -1.81 0.00 0.00 57.70 57.90 1x5n n MET 105 Cb 0.73 -5.58 0.00 0.00 -0.71 0.00 0.00 33.22 27.66 1x5n n MET 105 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 1x5n n THR 106 N 0.10-10.75 -3.79 2.03 -1.04 -1.26 -5.08 114.28 94.49 1x5n n THR 106 Ca 0.07 2.86 -0.09 0.00 -2.04 0.00 0.00 64.05 64.85 1x5n n THR 106 Cb 0.28 -4.71 -0.06 0.00 -1.82 0.00 0.00 70.33 64.02 1x5n n THR 106 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1x5n s ASP 107 N -0.73 0.02 -0.29 8.00 2.15 -1.26 -5.16 116.67 119.40 1x5n s ASP 107 Ca 0.00 -0.56 -0.14 0.00 0.43 0.00 0.00 52.55 52.28 1x5n s ASP 107 Cb 0.00 0.38 0.14 0.00 -0.30 0.00 0.00 42.92 43.14 1x5n s ASP 107 CO 0.00 -0.76 0.88 -0.60 -0.17 0.00 0.00 175.17 174.52 1x5n s ARG 108 N -3.84 0.43 -0.02 4.34 3.52 -1.26 -5.11 118.95 117.01 1x5n s ARG 108 Ca 0.04 0.91 0.04 0.00 -0.13 0.00 0.00 55.73 56.60 1x5n s ARG 108 Cb 0.04 0.37 -0.01 0.00 -1.56 0.00 0.00 34.95 33.80 1x5n s ARG 108 CO -0.11 -0.12 -0.13 0.45 -0.81 0.00 0.00 175.30 174.58 1x5n s SER 109 N 2.09 1.59 -0.18 -2.12 0.15 -1.26 -5.09 113.70 108.89 1x5n s SER 109 Ca -0.06 -0.25 -0.28 0.00 0.70 0.00 0.00 55.95 56.06 1x5n s SER 109 Cb -0.06 -0.29 -0.06 0.00 -1.71 0.00 0.00 66.02 63.91 1x5n s SER 109 CO -0.17 0.14 2.15 -0.83 1.20 0.00 0.00 173.24 175.72 1x5n s GLY 110 N -0.13 0.71 -0.05 9.45 0.00 -1.26 -4.86 107.32 111.18 1x5n s GLY 110 Ca 0.02 0.85 -0.25 0.00 0.00 0.00 0.00 44.72 45.34 1x5n s GLY 110 CO 0.00 3.71 1.05 -0.56 0.00 0.00 0.00 173.10 177.31 1x5n h PRO 111 N 14.08 0.15 -6.03 2.90 0.13 -2.03 -3.45 132.00 137.75 1x5n h PRO 111 Ca -0.42 -0.14 -0.83 0.00 -0.87 0.00 0.00 66.00 63.74 1x5n h PRO 111 Cb 1.23 0.04 0.02 0.00 0.13 0.00 0.00 31.00 32.42 1x5n h PRO 111 CO 0.96 0.86 0.55 -1.13 -0.23 0.00 0.00 178.00 179.01 1x5n n SER 112 N -4.56 1.08 -3.15 1.44 3.41 -1.26 -4.90 113.62 105.68 1x5n n SER 112 Ca -0.09 1.16 0.05 0.00 -0.26 0.00 0.00 58.87 59.73 1x5n n SER 112 Cb 0.46 -0.94 -0.02 0.00 -0.26 0.00 0.00 64.21 63.45 1x5n n SER 112 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1x5n s SER 113 N 2.17 -0.36 0.00 4.04 0.15 -1.26 -5.25 113.70 113.19 1x5n s SER 113 Ca 0.99 0.22 0.32 0.00 0.70 0.00 0.00 55.95 58.19 1x5n s SER 113 Cb -1.35 1.30 1.91 0.00 -1.71 0.00 0.00 66.02 66.16 1x5n s SER 113 CO 0.71 -0.07 2.23 0.61 1.20 0.00 0.00 173.24 177.92