#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1m26 s LYS 2 N 0.00 3.41 0.53 1.61 2.20 0.17 -4.84 119.74 122.82 1m26 s LYS 2 Ca 0.00 -0.61 -0.20 0.00 -0.36 0.00 0.00 55.97 54.80 1m26 s LYS 2 Cb 0.00 -3.04 -0.06 0.00 -1.51 0.00 0.00 37.83 33.22 1m26 s LYS 2 CO 0.00 -0.19 1.12 0.00 -0.36 0.00 0.00 175.35 175.93 1m26 s ALA 3 N 1.47 2.74 0.04 3.13 0.00 -1.26 -2.07 121.76 125.81 1m26 s ALA 3 Ca 0.06 0.82 -0.02 0.00 0.00 0.00 0.00 51.96 52.82 1m26 s ALA 3 Cb -0.14 -3.35 -0.03 0.00 0.00 0.00 0.00 23.12 19.60 1m26 s ALA 3 CO -0.02 -0.71 -0.00 -0.59 0.00 0.00 0.00 175.76 174.43 1m26 s PHE 4 N -1.76 0.35 -0.28 0.00 -0.71 0.67 -4.94 117.98 111.30 1m26 s PHE 4 Ca 0.71 -0.73 0.01 0.00 -1.04 0.00 0.00 56.93 55.88 1m26 s PHE 4 Cb -0.24 -0.26 0.15 0.00 -1.21 0.00 0.00 43.02 41.47 1m26 s PHE 4 CO 0.27 -0.30 0.38 0.34 -1.34 0.00 0.00 175.22 174.58 1m26 s ASP 5 N -2.16 0.60 0.26 1.98 -1.08 -1.26 -0.93 116.67 114.08 1m26 s ASP 5 Ca -0.05 -0.37 0.07 0.00 -0.52 0.00 0.00 52.55 51.68 1m26 s ASP 5 Cb -0.01 1.00 0.33 0.00 -1.46 0.00 0.00 42.92 42.78 1m26 s ASP 5 CO -0.05 -0.35 1.61 0.44 0.52 0.00 0.00 175.17 177.33 1m26 h ASP 6 N 8.18 0.16 -3.16 -0.34 3.32 -1.50 -3.49 116.42 119.59 1m26 h ASP 6 Ca -0.11 -0.09 0.00 0.00 0.02 0.00 0.00 57.03 56.85 1m26 h ASP 6 Cb 1.12 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.62 1m26 h ASP 6 CO 0.28 0.70 0.00 0.61 -1.72 0.00 0.00 179.24 179.11 1m26 n GLY 7 N 0.17 -1.80 3.75 2.75 0.00 -1.25 -4.96 105.19 103.85 1m26 n GLY 7 Ca -0.02 -1.84 -0.34 0.00 0.00 0.00 0.00 46.02 43.82 1m26 n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1m26 s ALA 8 N -1.68 3.49 0.00 4.61 0.00 -1.26 -3.98 121.76 122.93 1m26 s ALA 8 Ca 0.00 -0.81 0.00 0.00 0.00 0.00 0.00 51.96 51.15 1m26 s ALA 8 Cb 0.00 -1.59 0.00 0.00 0.00 0.00 0.00 23.12 21.53 1m26 s ALA 8 CO 0.00 0.63 0.00 1.19 0.00 0.00 0.00 175.76 177.58 1m26 n PHE 9 N 1.75 0.00 0.08 0.00 3.01 0.69 -5.00 117.46 117.99 1m26 n PHE 9 Ca -0.17 0.00 0.06 0.00 1.01 0.00 0.00 57.45 58.36 1m26 n PHE 9 Cb 0.53 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.98 1m26 n PHE 9 CO 0.00 0.00 0.00 1.15 1.01 0.00 0.00 176.76 178.92 1m26 h THR 10 N 0.27 0.23 0.00 4.37 2.02 -1.43 -3.46 112.91 114.91 1m26 h THR 10 Ca 0.00 -1.44 0.00 0.00 0.77 0.00 0.00 66.41 65.74 1m26 h THR 10 Cb 0.00 1.76 0.00 0.00 -1.74 0.00 0.00 68.15 68.17 1m26 h THR 10 CO 0.00 0.13 0.00 0.61 0.37 0.00 0.00 175.52 176.63 1m26 n GLY 11 N 1.27 -1.35 3.13 2.16 0.00 -1.16 -4.92 105.19 104.32 1m26 n GLY 11 Ca -0.04 -0.99 -0.28 0.00 0.00 0.00 0.00 46.02 44.71 1m26 n GLY 11 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1m26 s ILE 12 N -2.91 1.62 -0.18 -0.61 1.01 -1.26 -1.15 121.20 117.72 1m26 s ILE 12 Ca 0.00 -0.77 0.05 0.00 0.00 0.00 0.00 60.65 59.93 1m26 s ILE 12 Cb 0.00 -1.43 -0.14 0.00 0.01 0.00 0.00 42.46 40.90 1m26 s ILE 12 CO 0.00 0.46 -0.11 0.54 0.00 0.00 0.00 174.94 175.83 1m26 n ARG 13 N 3.62 0.76 -3.61 2.79 1.74 0.01 -4.79 116.66 117.19 1m26 n ARG 13 Ca -0.21 0.08 -0.16 0.00 -0.77 0.00 0.00 57.85 56.79 1m26 n ARG 13 Cb 0.52 -1.39 -0.07 0.00 -1.02 0.00 0.00 32.46 30.50 1m26 n ARG 13 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 1m26 s GLU 14 N -2.39 0.89 -0.09 5.56 2.12 -0.69 -1.69 118.70 122.42 1m26 s GLU 14 Ca -0.21 0.29 0.02 0.00 0.36 0.00 0.00 54.97 55.43 1m26 s GLU 14 Cb 0.06 0.42 0.01 0.00 0.26 0.00 0.00 34.13 34.88 1m26 s GLU 14 CO 0.50 -0.24 -0.15 0.42 -0.54 0.00 0.00 175.26 175.25 1m26 s ILE 15 N -0.87 1.41 -0.23 -3.70 1.01 0.07 0.07 121.20 118.95 1m26 s ILE 15 Ca -0.09 -0.62 0.00 0.00 0.00 0.00 0.00 60.65 59.95 1m26 s ILE 15 Cb -0.02 -1.27 0.03 0.00 0.01 0.00 0.00 42.46 41.21 1m26 s ILE 15 CO 0.07 0.42 -0.11 0.20 0.00 0.00 0.00 174.94 175.51 1m26 s ASN 16 N 0.76 4.01 0.24 3.58 0.01 0.17 -0.18 114.94 123.52 1m26 s ASN 16 Ca -0.12 -0.93 0.02 0.00 -0.71 0.00 0.00 52.86 51.12 1m26 s ASN 16 Cb -0.16 -1.58 -0.05 0.00 0.41 0.00 0.00 41.25 39.87 1m26 s ASN 16 CO 0.02 -0.10 0.05 -1.48 -1.51 0.00 0.00 177.10 174.08 1m26 s LEU 17 N 1.26 1.93 0.08 0.60 0.05 -0.65 0.06 118.68 122.01 1m26 s LEU 17 Ca -0.01 -1.29 0.02 0.00 0.05 0.00 0.00 54.13 52.90 1m26 s LEU 17 Cb -0.16 -0.10 -0.04 0.00 -2.05 0.00 0.00 46.19 43.84 1m26 s LEU 17 CO -0.07 -0.63 -0.07 -0.94 -0.55 0.00 0.00 176.35 174.09 1m26 s SER 18 N -3.29 1.09 0.31 1.48 1.04 -0.82 0.14 113.70 113.65 1m26 s SER 18 Ca 0.32 -0.84 -0.13 0.00 0.48 0.00 0.00 55.95 55.79 1m26 s SER 18 Cb 0.07 0.06 0.02 0.00 0.10 0.00 0.00 66.02 66.27 1m26 s SER 18 CO 0.10 -0.36 0.61 -0.72 0.98 0.00 0.00 173.24 173.86 1m26 s TYR 19 N -2.76 0.34 -0.06 5.02 1.13 -0.66 -0.51 117.35 119.84 1m26 s TYR 19 Ca 0.04 -0.78 -0.01 0.00 -1.41 0.00 0.00 57.07 54.91 1m26 s TYR 19 Cb -0.01 0.41 0.03 0.00 -1.10 0.00 0.00 41.96 41.29 1m26 s TYR 19 CO -0.02 -1.23 0.01 1.21 -2.51 0.00 0.00 175.55 173.00 1m26 s ASN 20 N -3.06 1.38 0.00 -0.18 3.04 -1.04 0.21 114.94 115.30 1m26 s ASN 20 Ca 0.20 -0.05 0.00 0.00 0.04 0.00 0.00 52.86 53.05 1m26 s ASN 20 Cb -0.03 -0.37 0.00 0.00 -1.54 0.00 0.00 41.25 39.31 1m26 s ASN 20 CO 0.12 -0.19 0.59 0.29 -3.04 0.00 0.00 177.10 174.87 1m26 n LYS 21 N 5.03 0.00 -0.00 0.43 5.02 -1.26 -1.47 118.16 125.90 1m26 n LYS 21 Ca -0.09 0.11 0.03 0.00 -2.02 0.00 0.00 58.31 56.34 1m26 n LYS 21 Cb 0.50 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 33.97 1m26 n LYS 21 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1m26 n GLU 22 N -1.09 2.10 0.00 1.97 1.02 -1.26 -4.69 120.64 118.68 1m26 n GLU 22 Ca 0.00 -0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.11 1m26 n GLU 22 Cb 0.00 -0.99 0.00 0.00 -0.02 0.00 0.00 31.44 30.43 1m26 n GLU 22 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1m26 n THR 23 N -1.48 0.00 -2.81 2.62 -2.24 -0.55 -5.03 114.28 104.79 1m26 n THR 23 Ca -0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1m26 n THR 23 Cb 0.12 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.35 1m26 n THR 23 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1m26 n ALA 24 N -3.00 0.00 -1.76 6.98 0.00 -1.22 -4.54 120.51 116.97 1m26 n ALA 24 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.04 1m26 n ALA 24 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 1m26 n ALA 24 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1m26 s ILE 25 N -2.96 3.44 0.00 0.00 -1.09 -0.97 -2.48 121.20 117.14 1m26 s ILE 25 Ca 0.00 1.44 0.00 0.00 -2.23 0.00 0.00 60.65 59.86 1m26 s ILE 25 Cb 0.00 -3.91 0.00 0.00 -1.58 0.00 0.00 42.46 36.97 1m26 s ILE 25 CO 0.00 0.33 0.00 0.61 -1.23 0.00 0.00 174.94 174.65 1m26 n GLY 26 N 1.12 -0.12 3.93 6.18 0.00 0.33 -0.95 105.19 115.68 1m26 n GLY 26 Ca -0.01 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 1m26 n GLY 26 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1m26 s ASP 27 N -0.20 6.35 -0.19 1.61 1.01 -1.24 -4.11 116.67 119.90 1m26 s ASP 27 Ca 0.00 0.50 -0.06 0.00 0.71 0.00 0.00 52.55 53.70 1m26 s ASP 27 Cb 0.00 -2.05 0.09 0.00 1.01 0.00 0.00 42.92 41.97 1m26 s ASP 27 CO 0.00 -0.22 0.39 0.12 0.21 0.00 0.00 175.17 175.67 1m26 s PHE 28 N -2.17 -0.74 -0.01 4.23 5.36 -0.37 -1.95 117.98 122.32 1m26 s PHE 28 Ca 0.41 1.39 0.00 0.00 -0.96 0.00 0.00 56.93 57.77 1m26 s PHE 28 Cb -0.10 0.23 0.01 0.00 -0.34 0.00 0.00 43.02 42.82 1m26 s PHE 28 CO 0.33 -0.48 -0.00 -1.14 -1.46 0.00 0.00 175.22 172.47 1m26 s GLN 29 N 2.58 0.08 -0.03 10.12 0.74 0.11 -1.35 119.66 131.92 1m26 s GLN 29 Ca -0.00 0.02 0.07 0.00 0.05 0.00 0.00 55.36 55.51 1m26 s GLN 29 Cb -0.12 -0.17 -0.02 0.00 1.10 0.00 0.00 33.01 33.80 1m26 s GLN 29 CO -0.12 -0.04 -0.25 0.08 -0.55 0.00 0.00 175.29 174.41 1m26 s VAL 30 N 0.34 1.97 -0.36 1.34 1.01 -1.26 0.41 120.40 123.85 1m26 s VAL 30 Ca -0.03 -1.06 -0.10 0.00 0.00 0.00 0.00 61.98 60.79 1m26 s VAL 30 Cb -0.05 -1.64 0.02 0.00 0.00 0.00 0.00 36.38 34.72 1m26 s VAL 30 CO -0.01 0.56 0.18 -0.69 0.00 0.00 0.00 175.10 175.14 1m26 s VAL 31 N -0.50 4.43 0.53 2.92 1.01 0.11 -1.10 120.40 127.80 1m26 s VAL 31 Ca 0.07 -0.83 0.00 0.00 0.00 0.00 0.00 61.98 61.22 1m26 s VAL 31 Cb -0.10 -3.44 0.02 0.00 0.00 0.00 0.00 36.38 32.86 1m26 s VAL 31 CO -0.00 -0.17 0.76 -0.31 0.00 0.00 0.00 175.10 175.38 1m26 s TYR 32 N 1.54 3.01 -0.12 5.22 1.51 0.28 -0.81 117.35 127.98 1m26 s TYR 32 Ca 0.02 0.14 -0.06 0.00 -1.01 0.00 0.00 57.07 56.16 1m26 s TYR 32 Cb -0.19 -2.63 -0.04 0.00 -0.11 0.00 0.00 41.96 38.99 1m26 s TYR 32 CO 0.06 -0.73 0.10 0.34 -1.11 0.00 0.00 175.55 174.20 1m26 s ASP 33 N -4.35 6.04 -0.33 2.29 2.15 -0.30 -0.28 116.67 121.88 1m26 s ASP 33 Ca 0.54 0.36 -0.00 0.00 0.43 0.00 0.00 52.55 53.88 1m26 s ASP 33 Cb -0.10 -1.90 0.11 0.00 -0.30 0.00 0.00 42.92 40.72 1m26 s ASP 33 CO 0.39 0.38 0.12 -0.22 -0.17 0.00 0.00 175.17 175.67 1m26 s LEU 34 N -0.88 2.24 -1.40 -1.34 2.96 0.19 -1.22 118.68 119.23 1m26 s LEU 34 Ca 0.14 -1.78 -0.06 0.00 -0.22 0.00 0.00 54.13 52.20 1m26 s LEU 34 Cb -0.12 -0.87 0.04 0.00 0.50 0.00 0.00 46.19 45.74 1m26 s LEU 34 CO 0.03 -0.39 0.85 0.59 -1.32 0.00 0.00 176.35 176.11 1m26 n ASN 35 N 4.66 -2.94 0.00 3.68 5.03 -1.26 -2.03 115.26 122.40 1m26 n ASN 35 Ca -0.00 -0.78 0.00 0.00 0.87 0.00 0.00 54.58 54.66 1m26 n ASN 35 Cb 0.41 -4.07 0.00 0.00 -1.02 0.00 0.00 39.78 35.10 1m26 n ASN 35 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1m26 n GLY 36 N -1.64 0.96 3.29 7.41 0.00 -1.26 -5.05 105.19 108.90 1m26 n GLY 36 Ca -0.15 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.61 1m26 n GLY 36 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1m26 s SER 37 N -3.03 2.68 0.42 1.61 0.15 -0.86 -5.12 113.70 109.55 1m26 s SER 37 Ca 0.00 -0.60 -0.25 0.00 0.70 0.00 0.00 55.95 55.80 1m26 s SER 37 Cb 0.00 -0.20 -0.08 0.00 -1.71 0.00 0.00 66.02 64.03 1m26 s SER 37 CO 0.00 0.15 1.22 -2.84 1.20 0.00 0.00 173.24 172.97 1m26 s PRO 38 N -1.47 3.91 -0.15 5.44 0.02 -1.26 0.53 135.00 142.01 1m26 s PRO 38 Ca 0.08 1.95 -0.01 0.00 0.02 0.00 0.00 61.00 63.04 1m26 s PRO 38 Cb -0.09 -2.62 0.04 0.00 0.02 0.00 0.00 34.50 31.85 1m26 s PRO 38 CO 0.03 -0.48 -0.03 -0.47 -0.33 0.00 0.00 177.00 175.73 1m26 s TYR 39 N -1.38 1.33 -0.42 6.54 6.14 0.62 -4.78 117.35 125.38 1m26 s TYR 39 Ca 0.59 -0.81 -0.27 0.00 0.64 0.00 0.00 57.07 57.22 1m26 s TYR 39 Cb -0.33 -1.14 0.02 0.00 0.42 0.00 0.00 41.96 40.93 1m26 s TYR 39 CO 0.42 -0.54 1.01 0.08 0.64 0.00 0.00 175.55 177.15 1m26 s VAL 40 N 1.76 4.43 0.91 3.14 1.01 -1.26 -0.56 120.40 129.82 1m26 s VAL 40 Ca 0.02 1.13 -0.12 0.00 0.00 0.00 0.00 61.98 63.01 1m26 s VAL 40 Cb -0.15 -4.45 0.13 0.00 0.00 0.00 0.00 36.38 31.91 1m26 s VAL 40 CO -0.07 -0.76 1.11 -0.83 0.00 0.00 0.00 175.10 174.55 1m26 s GLY 41 N 2.14 1.59 0.52 4.51 0.00 -0.26 -4.99 107.32 110.83 1m26 s GLY 41 Ca 0.42 -0.36 -0.21 0.00 0.00 0.00 0.00 44.72 44.57 1m26 s GLY 41 CO 0.24 0.18 1.21 1.20 0.00 0.00 0.00 173.10 175.93 1m26 s GLN 42 N -5.13 3.38 -0.51 2.90 -0.21 -1.26 -4.71 119.66 114.11 1m26 s GLN 42 Ca 0.63 1.85 -0.20 0.00 0.02 0.00 0.00 55.36 57.67 1m26 s GLN 42 Cb -0.16 -2.20 0.06 0.00 1.00 0.00 0.00 33.01 31.71 1m26 s GLN 42 CO 0.55 -0.89 0.65 1.21 -2.12 0.00 0.00 175.29 174.70 1m26 s ASN 43 N -1.40 6.24 -0.56 5.90 2.47 -1.26 -4.44 114.94 121.89 1m26 s ASN 43 Ca 0.70 -0.85 -0.28 0.00 0.42 0.00 0.00 52.86 52.85 1m26 s ASN 43 Cb -0.31 -2.30 0.03 0.00 -1.45 0.00 0.00 41.25 37.22 1m26 s ASN 43 CO 0.36 -0.92 1.18 -1.00 -3.72 0.00 0.00 177.10 173.00 1m26 s HIS 44 N 2.75 2.65 0.07 0.43 3.76 -0.45 -4.94 115.29 119.57 1m26 s HIS 44 Ca 0.17 0.48 0.02 0.00 -0.15 0.00 0.00 55.06 55.58 1m26 s HIS 44 Cb -0.18 -4.50 -0.04 0.00 1.11 0.00 0.00 32.58 28.96 1m26 s HIS 44 CO 0.13 -1.52 0.11 0.15 -0.85 0.00 0.00 174.74 172.76 1m26 s LYS 45 N 4.85 3.02 0.74 1.40 1.02 -1.26 -1.24 119.74 128.27 1m26 s LYS 45 Ca 0.44 -0.63 -0.13 0.00 0.02 0.00 0.00 55.97 55.68 1m26 s LYS 45 Cb -0.07 -2.81 0.04 0.00 -0.52 0.00 0.00 37.83 34.47 1m26 s LYS 45 CO 0.27 0.58 1.12 0.45 -0.92 0.00 0.00 175.35 176.84 1m26 s SER 46 N -2.42 4.53 0.26 2.83 0.15 -1.26 -4.84 113.70 112.95 1m26 s SER 46 Ca 0.31 1.99 0.25 0.00 0.70 0.00 0.00 55.95 59.19 1m26 s SER 46 Cb -0.12 -2.55 0.95 0.00 -1.71 0.00 0.00 66.02 62.59 1m26 s SER 46 CO 0.24 -2.02 1.74 0.49 1.20 0.00 0.00 173.24 174.88 1m26 n PHE 47 N -3.08 0.88 -4.58 3.44 3.72 0.47 -4.78 117.46 113.53 1m26 n PHE 47 Ca 0.10 0.32 -0.27 0.00 -0.05 0.00 0.00 57.45 57.56 1m26 n PHE 47 Cb 0.52 -1.02 -0.10 0.00 -0.94 0.00 0.00 39.48 37.94 1m26 n PHE 47 CO 0.00 0.00 0.00 0.96 -0.05 0.00 0.00 176.76 177.67 1m26 s ILE 48 N -3.27 1.50 0.40 4.37 -4.36 -1.26 -5.03 121.20 113.55 1m26 s ILE 48 Ca 0.06 -2.00 0.04 0.00 -0.26 0.00 0.00 60.65 58.49 1m26 s ILE 48 Cb 0.10 -2.75 -0.02 0.00 1.25 0.00 0.00 42.46 41.04 1m26 s ILE 48 CO 0.45 0.00 0.13 0.42 0.24 0.00 0.00 174.94 176.19 1m26 s THR 49 N -2.96 0.58 0.00 8.37 -4.23 -1.26 -4.92 115.64 111.22 1m26 s THR 49 Ca 0.30 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.81 1m26 s THR 49 Cb 0.08 -2.36 0.00 0.00 1.34 0.00 0.00 72.50 71.56 1m26 s THR 49 CO 0.15 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.84 1m26 n GLY 50 N -0.90 1.47 3.93 3.99 0.00 -1.26 -5.12 105.19 107.30 1m26 n GLY 50 Ca -0.05 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.71 1m26 n GLY 50 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1m26 s PHE 51 N -2.00 3.37 -0.28 1.61 0.08 -1.26 -4.94 117.98 114.56 1m26 s PHE 51 Ca 0.00 0.54 -0.14 0.00 0.12 0.00 0.00 56.93 57.45 1m26 s PHE 51 Cb 0.00 -2.37 -0.04 0.00 -0.57 0.00 0.00 43.02 40.04 1m26 s PHE 51 CO 0.00 -0.40 0.32 0.99 -0.10 0.00 0.00 175.22 176.03 1m26 s THR 52 N -2.70 5.21 0.32 0.64 2.01 0.13 -4.84 115.64 116.42 1m26 s THR 52 Ca 0.48 0.38 -0.27 0.00 0.31 0.00 0.00 61.69 62.59 1m26 s THR 52 Cb -0.10 -3.67 -0.10 0.00 0.01 0.00 0.00 72.50 68.64 1m26 s THR 52 CO 0.42 0.14 0.98 -2.16 -0.69 0.00 0.00 174.62 173.31 1m26 s PRO 53 N 1.97 4.55 -0.02 4.92 0.04 -1.26 -1.65 135.00 143.56 1m26 s PRO 53 Ca 0.12 1.45 0.02 0.00 0.04 0.00 0.00 61.00 62.63 1m26 s PRO 53 Cb -0.16 -2.87 0.00 0.00 0.04 0.00 0.00 34.50 31.51 1m26 s PRO 53 CO 0.10 0.23 -0.06 0.08 0.04 0.00 0.00 177.00 177.39 1m26 s VAL 54 N -1.50 0.53 -0.17 -0.36 1.01 0.12 -4.97 120.40 115.05 1m26 s VAL 54 Ca 0.49 -0.24 -0.00 0.00 0.00 0.00 0.00 61.98 62.24 1m26 s VAL 54 Cb -0.22 -0.48 0.00 0.00 0.00 0.00 0.00 36.38 35.69 1m26 s VAL 54 CO 0.28 0.17 -0.14 -0.75 0.00 0.00 0.00 175.10 174.65 1m26 s LYS 55 N 0.15 3.20 -0.40 2.72 2.20 -1.26 -1.63 119.74 124.72 1m26 s LYS 55 Ca -0.02 -0.74 -0.06 0.00 -0.36 0.00 0.00 55.97 54.79 1m26 s LYS 55 Cb -0.06 -2.68 0.09 0.00 -1.51 0.00 0.00 37.83 33.67 1m26 s LYS 55 CO -0.00 -0.06 0.20 0.42 -0.36 0.00 0.00 175.35 175.55 1m26 s ILE 56 N 1.01 3.68 -0.32 5.43 1.01 0.75 -4.99 121.20 127.77 1m26 s ILE 56 Ca -0.01 -1.65 -0.11 0.00 0.00 0.00 0.00 60.65 58.88 1m26 s ILE 56 Cb -0.15 -3.33 -0.02 0.00 0.01 0.00 0.00 42.46 38.98 1m26 s ILE 56 CO -0.03 -0.52 0.19 -0.44 0.00 0.00 0.00 174.94 174.14 1m26 s SER 57 N 1.89 5.78 0.18 3.58 0.01 -1.26 -0.75 113.70 123.13 1m26 s SER 57 Ca 0.04 -0.41 -0.09 0.00 1.31 0.00 0.00 55.95 56.79 1m26 s SER 57 Cb -0.22 -2.07 -0.07 0.00 0.21 0.00 0.00 66.02 63.87 1m26 s SER 57 CO -0.01 -0.19 0.49 -0.76 0.41 0.00 0.00 173.24 173.18 1m26 s LEU 58 N 1.67 4.24 -1.41 2.44 1.43 -0.68 -4.97 118.68 121.40 1m26 s LEU 58 Ca 0.06 0.85 -0.13 0.00 -1.03 0.00 0.00 54.13 53.88 1m26 s LEU 58 Cb -0.17 -3.44 0.08 0.00 0.03 0.00 0.00 46.19 42.69 1m26 s LEU 58 CO 0.08 0.01 2.14 -0.67 0.23 0.00 0.00 176.35 178.14 1m26 n ASP 59 N 0.19 4.30 -4.77 2.29 2.03 -1.26 -4.87 116.55 114.45 1m26 n ASP 59 Ca -0.02 -2.92 -0.40 0.00 0.52 0.00 0.00 54.79 51.96 1m26 n ASP 59 Cb 0.52 -1.60 0.00 0.00 -0.72 0.00 0.00 41.12 39.32 1m26 n ASP 59 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 1m26 s PHE 60 N 2.33 2.57 -0.05 -0.67 5.36 -1.26 -0.41 117.98 125.85 1m26 s PHE 60 Ca 0.45 1.22 0.12 0.00 -0.96 0.00 0.00 56.93 57.77 1m26 s PHE 60 Cb 0.13 -3.96 -0.07 0.00 -0.34 0.00 0.00 43.02 38.78 1m26 s PHE 60 CO -0.06 -2.89 1.28 -1.35 -1.46 0.00 0.00 175.22 170.74 1m26 h PRO 61 N 2.75 0.00 -0.01 10.12 0.11 -1.95 -3.45 132.00 139.57 1m26 h PRO 61 Ca -0.51 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.51 1m26 h PRO 61 Cb 1.25 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 1m26 h PRO 61 CO 0.63 0.65 -0.42 0.66 -0.21 0.00 0.00 178.00 179.31 1m26 h SER 62 N 0.00 0.02 -3.27 -2.05 4.64 -1.87 -3.42 113.55 107.60 1m26 h SER 62 Ca -0.04 -0.01 -0.62 0.00 -0.47 0.00 0.00 61.79 60.66 1m26 h SER 62 Cb 1.57 -0.01 -0.15 0.00 -0.31 0.00 0.00 62.40 63.50 1m26 h SER 62 CO 0.09 0.44 -0.56 -0.70 -0.87 0.00 0.00 176.83 175.23 1m26 s GLU 63 N -4.08 3.95 0.01 4.77 2.12 0.45 -4.94 118.70 120.98 1m26 s GLU 63 Ca -0.03 -0.33 -0.11 0.00 0.36 0.00 0.00 54.97 54.86 1m26 s GLU 63 Cb 0.14 -3.21 0.01 0.00 0.26 0.00 0.00 34.13 31.33 1m26 s GLU 63 CO 0.74 0.31 0.23 1.52 -0.54 0.00 0.00 175.26 177.51 1m26 s TYR 64 N 0.28 -0.04 0.13 5.30 1.13 -1.26 -4.32 117.35 118.57 1m26 s TYR 64 Ca 0.04 -0.04 -0.31 0.00 -1.41 0.00 0.00 57.07 55.35 1m26 s TYR 64 Cb -0.12 0.02 -0.09 0.00 -1.10 0.00 0.00 41.96 40.67 1m26 s TYR 64 CO 0.00 -0.39 1.47 0.42 -2.51 0.00 0.00 175.55 174.54 1m26 s ILE 65 N -1.85 3.04 -0.02 -3.49 1.01 -1.26 -2.65 121.20 115.98 1m26 s ILE 65 Ca -0.10 0.73 0.11 0.00 0.00 0.00 0.00 60.65 61.39 1m26 s ILE 65 Cb -0.04 -3.47 -0.17 0.00 0.01 0.00 0.00 42.46 38.79 1m26 s ILE 65 CO 0.00 0.05 0.23 0.23 0.00 0.00 0.00 174.94 175.46 1m26 n MET 66 N 4.04 0.44 -3.67 2.79 2.81 0.12 -4.74 117.12 118.92 1m26 n MET 66 Ca 0.13 -0.09 -0.13 0.00 -1.81 0.00 0.00 57.70 55.79 1m26 n MET 66 Cb 0.41 -1.26 -0.08 0.00 -0.71 0.00 0.00 33.22 31.58 1m26 n MET 66 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 1m26 s GLU 67 N -2.73 0.69 -0.11 0.03 2.12 -0.88 -0.21 118.70 117.61 1m26 s GLU 67 Ca -0.04 0.87 0.03 0.00 0.36 0.00 0.00 54.97 56.19 1m26 s GLU 67 Cb 0.07 0.31 0.01 0.00 0.26 0.00 0.00 34.13 34.77 1m26 s GLU 67 CO 0.45 -0.09 -0.19 0.08 -0.54 0.00 0.00 175.26 174.97 1m26 s VAL 68 N 0.49 1.77 0.14 3.70 1.01 -0.90 -0.84 120.40 125.76 1m26 s VAL 68 Ca -0.01 -0.83 -0.01 0.00 0.00 0.00 0.00 61.98 61.13 1m26 s VAL 68 Cb -0.04 -1.57 -0.04 0.00 0.00 0.00 0.00 36.38 34.73 1m26 s VAL 68 CO -0.02 0.49 0.05 -0.94 0.00 0.00 0.00 175.10 174.69 1m26 s SER 69 N 0.68 0.45 0.00 3.32 1.04 -0.71 0.10 113.70 118.59 1m26 s SER 69 Ca -0.12 -1.22 0.00 0.00 0.48 0.00 0.00 55.95 55.09 1m26 s SER 69 Cb -0.16 0.27 0.00 0.00 0.10 0.00 0.00 66.02 66.23 1m26 s SER 69 CO 0.03 -0.71 0.00 0.61 0.98 0.00 0.00 173.24 174.14 1m26 n GLY 70 N -0.14 -0.93 3.01 7.32 0.00 -0.65 -0.32 105.19 113.48 1m26 n GLY 70 Ca -0.05 -0.75 -0.16 0.00 0.00 0.00 0.00 46.02 45.06 1m26 n GLY 70 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1m26 s TYR 71 N -3.00 0.61 0.00 1.61 1.51 -1.00 -1.80 117.35 115.28 1m26 s TYR 71 Ca 0.00 -0.23 0.08 0.00 -1.01 0.00 0.00 57.07 55.91 1m26 s TYR 71 Cb 0.00 -0.38 -0.02 0.00 -0.11 0.00 0.00 41.96 41.44 1m26 s TYR 71 CO 0.00 -0.03 -0.24 0.95 -1.11 0.00 0.00 175.55 175.13 1m26 s THR 72 N -0.53 2.28 0.17 -0.71 -4.23 -0.51 -0.22 115.64 111.89 1m26 s THR 72 Ca -0.01 -1.15 -0.18 0.00 -1.18 0.00 0.00 61.69 59.17 1m26 s THR 72 Cb -0.05 -1.85 0.06 0.00 1.34 0.00 0.00 72.50 72.00 1m26 s THR 72 CO 0.00 0.49 0.86 0.61 -0.54 0.00 0.00 174.62 176.04 1m26 n GLY 73 N 2.13 0.74 3.78 3.99 0.00 -0.44 -0.51 105.19 114.87 1m26 n GLY 73 Ca -0.16 -1.12 -0.38 0.00 0.00 0.00 0.00 46.02 44.35 1m26 n GLY 73 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1m26 s ASN 74 N -3.04 6.82 -0.13 1.61 3.84 -1.26 -0.92 114.94 121.86 1m26 s ASN 74 Ca 0.19 0.97 -0.02 0.00 0.21 0.00 0.00 52.86 54.21 1m26 s ASN 74 Cb -0.02 -2.29 0.04 0.00 -0.55 0.00 0.00 41.25 38.42 1m26 s ASN 74 CO 0.05 0.17 0.00 -0.69 -2.79 0.00 0.00 177.10 173.85 1m26 s VAL 75 N -0.35 0.55 -1.47 -5.21 1.01 -0.14 -4.79 120.40 110.00 1m26 s VAL 75 Ca 0.26 -0.24 0.00 0.00 0.00 0.00 0.00 61.98 62.00 1m26 s VAL 75 Cb -0.17 -0.84 0.00 0.00 0.00 0.00 0.00 36.38 35.38 1m26 s VAL 75 CO 0.13 0.08 0.00 -1.20 0.00 0.00 0.00 175.10 174.11 1m26 n SER 76 N 5.07 -5.02 0.00 3.32 7.64 -1.26 -1.73 113.62 121.64 1m26 n SER 76 Ca -0.09 0.08 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1m26 n SER 76 Cb 0.49 -4.22 0.00 0.00 -1.01 0.00 0.00 64.21 59.47 1m26 n SER 76 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1m26 n GLY 77 N -0.91 0.83 3.65 0.23 0.00 -1.26 -5.06 105.19 102.67 1m26 n GLY 77 Ca -0.20 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.47 1m26 n GLY 77 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1m26 s TYR 78 N -2.37 3.10 -0.17 1.61 2.02 -0.70 -5.05 117.35 115.78 1m26 s TYR 78 Ca 0.00 0.14 -0.25 0.00 -0.37 0.00 0.00 57.07 56.59 1m26 s TYR 78 Cb 0.00 -1.78 -0.01 0.00 -0.40 0.00 0.00 41.96 39.77 1m26 s TYR 78 CO 0.00 0.42 0.82 0.08 -1.57 0.00 0.00 175.55 175.30 1m26 s VAL 79 N -0.83 4.89 0.23 0.71 1.01 -1.26 -0.97 120.40 124.18 1m26 s VAL 79 Ca 0.13 1.60 0.00 0.00 0.00 0.00 0.00 61.98 63.71 1m26 s VAL 79 Cb -0.11 -4.12 -0.04 0.00 0.00 0.00 0.00 36.38 32.11 1m26 s VAL 79 CO 0.02 0.03 0.19 0.68 0.00 0.00 0.00 175.10 176.02 1m26 s VAL 80 N 2.16 0.00 -0.51 2.92 -7.23 -0.09 -4.80 120.40 112.84 1m26 s VAL 80 Ca 0.37 -1.96 -0.24 0.00 -1.81 0.00 0.00 61.98 58.34 1m26 s VAL 80 Cb -0.16 -2.49 0.04 0.00 0.56 0.00 0.00 36.38 34.32 1m26 s VAL 80 CO 0.12 0.00 0.88 -0.69 -0.31 0.00 0.00 175.10 175.10 1m26 s VAL 81 N -3.97 4.49 -0.13 1.32 1.01 0.11 -1.33 120.40 121.90 1m26 s VAL 81 Ca 0.38 0.32 0.15 0.00 0.00 0.00 0.00 61.98 62.84 1m26 s VAL 81 Cb 0.05 -4.46 -0.03 0.00 0.00 0.00 0.00 36.38 31.95 1m26 s VAL 81 CO 0.16 -0.97 1.19 0.03 0.00 0.00 0.00 175.10 175.51 1m26 h ARG 82 N 9.19 0.00 -3.41 2.72 3.08 -0.88 -2.58 114.38 122.51 1m26 h ARG 82 Ca -0.26 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 59.67 1m26 h ARG 82 Cb 1.08 0.00 -0.19 0.00 0.08 0.00 0.00 29.97 30.94 1m26 h ARG 82 CO 1.04 0.43 -0.38 -1.54 -1.07 0.00 0.00 179.97 178.45 1m26 s SER 83 N -6.19 -0.03 -0.03 7.04 1.04 -1.12 -0.88 113.70 113.54 1m26 s SER 83 Ca 0.01 -0.21 -0.02 0.00 0.48 0.00 0.00 55.95 56.21 1m26 s SER 83 Cb 0.08 0.27 0.01 0.00 0.10 0.00 0.00 66.02 66.48 1m26 s SER 83 CO 0.78 -0.48 0.07 -0.22 0.98 0.00 0.00 173.24 174.36 1m26 s LEU 84 N -1.71 1.69 -0.04 2.42 2.96 -0.86 -2.39 118.68 120.75 1m26 s LEU 84 Ca -0.10 0.14 0.01 0.00 -0.22 0.00 0.00 54.13 53.96 1m26 s LEU 84 Cb -0.04 0.24 0.02 0.00 0.50 0.00 0.00 46.19 46.91 1m26 s LEU 84 CO -0.00 -0.03 -0.03 -0.89 -1.32 0.00 0.00 176.35 174.07 1m26 s THR 85 N 0.09 0.42 -0.17 3.68 2.01 0.56 -1.60 115.64 120.63 1m26 s THR 85 Ca -0.00 -0.07 -0.01 0.00 0.31 0.00 0.00 61.69 61.91 1m26 s THR 85 Cb -0.01 -0.46 -0.00 0.00 0.01 0.00 0.00 72.50 72.03 1m26 s THR 85 CO -0.00 0.19 -0.12 -0.36 -0.69 0.00 0.00 174.62 173.64 1m26 s PHE 86 N 0.86 2.84 -0.21 4.92 0.40 0.08 -1.73 117.98 125.13 1m26 s PHE 86 Ca -0.11 -1.01 -0.04 0.00 -0.60 0.00 0.00 56.93 55.17 1m26 s PHE 86 Cb -0.13 -1.95 -0.02 0.00 0.51 0.00 0.00 43.02 41.43 1m26 s PHE 86 CO -0.00 -0.49 -0.02 0.21 0.70 0.00 0.00 175.22 175.62 1m26 s LYS 87 N 0.99 3.50 0.56 0.44 2.20 -0.02 -0.04 119.74 127.36 1m26 s LYS 87 Ca -0.02 -0.57 0.06 0.00 -0.36 0.00 0.00 55.97 55.08 1m26 s LYS 87 Cb -0.15 -3.05 0.06 0.00 -1.51 0.00 0.00 37.83 33.18 1m26 s LYS 87 CO -0.02 -0.10 0.47 0.25 -0.36 0.00 0.00 175.35 175.60 1m26 n THR 88 N 4.54 0.00 1.32 3.43 -2.24 0.57 0.14 114.28 122.05 1m26 n THR 88 Ca -0.18 -2.17 0.11 0.00 -2.27 0.00 0.00 64.05 59.54 1m26 n THR 88 Cb 0.51 -0.09 0.64 0.00 -2.10 0.00 0.00 70.33 69.29 1m26 n THR 88 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1m26 n ASN 89 N -1.90 0.00 -0.01 3.42 6.94 -1.09 -3.68 115.26 118.95 1m26 n ASN 89 Ca 0.01 -0.56 -0.01 0.00 -0.02 0.00 0.00 54.58 54.00 1m26 n ASN 89 Cb 0.63 -0.06 -0.00 0.00 -2.36 0.00 0.00 39.78 37.98 1m26 n ASN 89 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 1m26 n LYS 90 N -1.06 0.03 -4.02 -3.83 5.02 -1.26 -5.06 118.16 107.98 1m26 n LYS 90 Ca 0.15 0.01 -0.10 0.00 -2.02 0.00 0.00 58.31 56.35 1m26 n LYS 90 Cb 0.10 -1.00 -0.05 0.00 -0.02 0.00 0.00 35.03 34.05 1m26 n LYS 90 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1m26 s LYS 91 N -2.02 1.62 -0.20 1.97 -0.14 -1.24 -5.14 119.74 114.59 1m26 s LYS 91 Ca -0.01 -1.37 -0.02 0.00 -1.36 0.00 0.00 55.97 53.20 1m26 s LYS 91 Cb 0.00 0.46 -0.00 0.00 -1.68 0.00 0.00 37.83 36.61 1m26 s LYS 91 CO 0.02 -0.67 -0.08 0.99 -0.76 0.00 0.00 175.35 174.85 1m26 s THR 92 N -3.78 3.07 -0.36 2.17 2.01 -1.26 -0.31 115.64 117.18 1m26 s THR 92 Ca 0.24 -0.60 -0.10 0.00 0.31 0.00 0.00 61.69 61.54 1m26 s THR 92 Cb -0.00 -2.37 0.02 0.00 0.01 0.00 0.00 72.50 70.16 1m26 s THR 92 CO 0.11 0.46 0.19 -0.31 -0.69 0.00 0.00 174.62 174.38 1m26 s TYR 93 N 1.33 3.23 0.00 4.92 1.51 0.94 -4.99 117.35 124.30 1m26 s TYR 93 Ca 0.04 -0.90 0.00 0.00 -1.01 0.00 0.00 57.07 55.21 1m26 s TYR 93 Cb -0.14 -2.41 0.00 0.00 -0.11 0.00 0.00 41.96 39.30 1m26 s TYR 93 CO -0.05 -0.61 0.00 0.41 -1.11 0.00 0.00 175.55 174.20 1m26 n GLY 94 N 4.98 1.02 3.75 0.71 0.00 -1.26 -0.74 105.19 113.65 1m26 n GLY 94 Ca -0.12 -2.10 -0.40 0.00 0.00 0.00 0.00 46.02 43.40 1m26 n GLY 94 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1m26 s PRO 95 N -1.02 4.75 -0.15 1.61 0.04 -1.26 -4.98 135.00 133.98 1m26 s PRO 95 Ca 0.00 1.61 -0.03 0.00 0.04 0.00 0.00 61.00 62.61 1m26 s PRO 95 Cb 0.00 -3.26 -0.03 0.00 0.04 0.00 0.00 34.50 31.25 1m26 s PRO 95 CO 0.00 0.36 -0.04 0.71 0.04 0.00 0.00 177.00 178.06 1m26 s TYR 96 N -0.99 3.01 0.00 0.56 2.02 -0.63 -4.95 117.35 116.37 1m26 s TYR 96 Ca 0.43 -0.30 0.00 0.00 -0.37 0.00 0.00 57.07 56.83 1m26 s TYR 96 Cb -0.28 -1.94 0.00 0.00 -0.40 0.00 0.00 41.96 39.34 1m26 s TYR 96 CO 0.35 -0.03 0.00 0.41 -1.57 0.00 0.00 175.55 174.71 1m26 n GLY 97 N 3.47 -0.34 3.40 0.71 0.00 -1.26 -2.03 105.19 109.14 1m26 n GLY 97 Ca -0.17 -1.95 -0.37 0.00 0.00 0.00 0.00 46.02 43.52 1m26 n GLY 97 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1m26 s VAL 98 N 0.00 4.22 -1.53 1.61 1.01 -0.06 -4.78 120.40 120.87 1m26 s VAL 98 Ca 0.00 -0.41 -0.09 0.00 0.00 0.00 0.00 61.98 61.48 1m26 s VAL 98 Cb 0.00 -3.08 -0.02 0.00 0.00 0.00 0.00 36.38 33.28 1m26 s VAL 98 CO 0.00 0.20 2.75 0.35 0.00 0.00 0.00 175.10 178.40 1m26 n THR 99 N 4.91 4.51 -4.37 3.92 -2.24 -1.26 -3.74 114.28 116.01 1m26 n THR 99 Ca -0.15 -3.09 -0.19 0.00 -2.27 0.00 0.00 64.05 58.35 1m26 n THR 99 Cb 0.50 -2.47 -0.14 0.00 -2.10 0.00 0.00 70.33 66.11 1m26 n THR 99 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1m26 s SER 100 N 1.74 1.13 0.00 3.42 0.15 -1.26 -5.07 113.70 113.81 1m26 s SER 100 Ca 0.64 -0.21 0.00 0.00 0.70 0.00 0.00 55.95 57.08 1m26 s SER 100 Cb 0.18 -0.11 0.00 0.00 -1.71 0.00 0.00 66.02 64.37 1m26 s SER 100 CO -0.07 0.09 0.00 0.61 1.20 0.00 0.00 173.24 175.08 1m26 n GLY 101 N 2.72 0.05 3.46 9.45 0.00 -1.26 -4.44 105.19 115.16 1m26 n GLY 101 Ca -0.14 -1.82 -0.34 0.00 0.00 0.00 0.00 46.02 43.72 1m26 n GLY 101 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1m26 s THR 102 N -0.27 3.85 0.71 2.61 -4.23 0.33 -4.89 115.64 113.76 1m26 s THR 102 Ca 0.00 -0.36 -0.11 0.00 -1.18 0.00 0.00 61.69 60.04 1m26 s THR 102 Cb 0.00 -2.72 0.02 0.00 1.34 0.00 0.00 72.50 71.15 1m26 s THR 102 CO 0.00 0.46 1.07 -2.16 -0.54 0.00 0.00 174.62 173.46 1m26 s PRO 103 N 0.72 2.70 0.02 3.99 0.04 -1.26 -1.42 135.00 139.79 1m26 s PRO 103 Ca -0.01 1.09 -0.19 0.00 0.04 0.00 0.00 61.00 61.92 1m26 s PRO 103 Cb -0.14 -1.96 0.04 0.00 0.04 0.00 0.00 34.50 32.48 1m26 s PRO 103 CO 0.02 -1.29 0.43 -0.59 0.04 0.00 0.00 177.00 175.60 1m26 s PHE 104 N -2.89 -0.30 -0.17 0.56 -0.12 -0.75 -4.91 117.98 109.39 1m26 s PHE 104 Ca 0.60 0.36 -0.25 0.00 -0.05 0.00 0.00 56.93 57.60 1m26 s PHE 104 Cb -0.16 0.22 0.06 0.00 -0.63 0.00 0.00 43.02 42.51 1m26 s PHE 104 CO 0.53 -0.54 0.64 0.54 -0.05 0.00 0.00 175.22 176.34 1m26 s ASN 105 N -1.74 -0.64 -0.39 1.98 4.22 -1.26 -1.63 114.94 115.48 1m26 s ASN 105 Ca -0.08 1.06 0.01 0.00 -2.14 0.00 0.00 52.86 51.71 1m26 s ASN 105 Cb -0.02 1.03 0.12 0.00 1.28 0.00 0.00 41.25 43.66 1m26 s ASN 105 CO 0.01 -0.36 0.16 -0.22 -2.04 0.00 0.00 177.10 174.66 1m26 s LEU 106 N -0.23 2.94 0.23 3.54 2.96 0.12 -4.99 118.68 123.25 1m26 s LEU 106 Ca -0.04 -2.25 -0.15 0.00 -0.22 0.00 0.00 54.13 51.47 1m26 s LEU 106 Cb -0.03 -1.10 -0.08 0.00 0.50 0.00 0.00 46.19 45.48 1m26 s LEU 106 CO 0.04 -0.33 0.65 -2.84 -1.32 0.00 0.00 176.35 172.55 1m26 s PRO 107 N 0.82 4.04 -0.15 0.98 0.02 -1.26 -2.13 135.00 137.32 1m26 s PRO 107 Ca 0.14 0.62 0.01 0.00 0.02 0.00 0.00 61.00 61.79 1m26 s PRO 107 Cb -0.21 -2.74 0.02 0.00 0.02 0.00 0.00 34.50 31.58 1m26 s PRO 107 CO -0.09 0.34 -0.19 0.42 -0.33 0.00 0.00 177.00 177.15 1m26 s ILE 108 N -1.67 1.92 -0.08 2.83 1.01 0.71 -4.98 121.20 120.94 1m26 s ILE 108 Ca 0.45 -0.87 -0.09 0.00 0.00 0.00 0.00 60.65 60.14 1m26 s ILE 108 Cb -0.14 -1.73 -0.29 0.00 0.01 0.00 0.00 42.46 40.32 1m26 s ILE 108 CO 0.20 0.52 0.54 -0.33 0.00 0.00 0.00 174.94 175.87 1m26 h GLU 109 N 7.72 0.34 -3.23 2.79 5.08 -1.98 -3.46 114.58 121.84 1m26 h GLU 109 Ca -0.39 -0.59 -0.24 0.00 -1.00 0.00 0.00 59.36 57.15 1m26 h GLU 109 Cb 1.16 0.22 -0.31 0.00 0.50 0.00 0.00 28.75 30.31 1m26 h GLU 109 CO 0.58 1.28 -0.58 1.21 -1.00 0.00 0.00 179.01 180.50 1m26 s ASN 110 N -7.20 -0.13 0.00 1.42 3.04 -1.26 -5.12 114.94 105.69 1m26 s ASN 110 Ca -0.19 0.32 0.00 0.00 0.04 0.00 0.00 52.86 53.04 1m26 s ASN 110 Cb 0.06 0.21 0.00 0.00 -1.54 0.00 0.00 41.25 39.98 1m26 s ASN 110 CO 0.82 -0.15 0.00 0.61 -3.04 0.00 0.00 177.10 175.34 1m26 n GLY 111 N 4.16 1.73 3.07 1.21 0.00 -1.26 -5.01 105.19 109.09 1m26 n GLY 111 Ca -0.26 -2.20 -0.13 0.00 0.00 0.00 0.00 46.02 43.43 1m26 n GLY 111 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1m26 s LEU 112 N 0.00 2.27 -0.15 0.99 1.43 0.16 -4.96 118.68 118.42 1m26 s LEU 112 Ca 0.00 -0.58 -0.25 0.00 -1.03 0.00 0.00 54.13 52.27 1m26 s LEU 112 Cb 0.00 -0.17 -0.02 0.00 0.03 0.00 0.00 46.19 46.03 1m26 s LEU 112 CO 0.00 -0.21 0.83 -0.63 0.23 0.00 0.00 176.35 176.57 1m26 s ILE 113 N -1.50 4.89 -0.04 -0.59 1.01 -1.26 -0.97 121.20 122.75 1m26 s ILE 113 Ca -0.09 1.64 0.05 0.00 0.00 0.00 0.00 60.65 62.26 1m26 s ILE 113 Cb -0.09 -4.14 0.08 0.00 0.01 0.00 0.00 42.46 38.32 1m26 s ILE 113 CO 0.00 0.05 0.99 1.33 0.00 0.00 0.00 174.94 177.31 1m26 n VAL 114 N 4.63 1.08 0.00 2.92 0.24 0.19 -4.49 118.33 122.90 1m26 n VAL 114 Ca 0.04 -1.19 0.00 0.00 -2.04 0.00 0.00 64.34 61.16 1m26 n VAL 114 Cb 0.49 0.35 0.00 0.00 -1.47 0.00 0.00 33.84 33.21 1m26 n VAL 114 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1m26 n GLY 115 N -0.68 1.13 3.13 7.63 0.00 -1.24 -0.22 105.19 114.95 1m26 n GLY 115 Ca 0.04 -0.74 -0.13 0.00 0.00 0.00 0.00 46.02 45.19 1m26 n GLY 115 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1m26 s PHE 116 N -2.00 0.87 0.09 1.61 0.08 -1.26 -0.92 117.98 116.46 1m26 s PHE 116 Ca 0.00 -0.66 -0.12 0.00 0.12 0.00 0.00 56.93 56.26 1m26 s PHE 116 Cb 0.00 -0.50 0.02 0.00 -0.57 0.00 0.00 43.02 41.97 1m26 s PHE 116 CO 0.00 -0.07 0.29 -1.59 -0.10 0.00 0.00 175.22 173.75 1m26 s LYS 117 N -2.59 0.90 0.00 0.44 -2.85 -0.99 -1.08 119.74 113.57 1m26 s LYS 117 Ca 0.01 -0.74 0.00 0.00 -1.00 0.00 0.00 55.97 54.24 1m26 s LYS 117 Cb -0.03 0.38 0.00 0.00 -2.06 0.00 0.00 37.83 36.12 1m26 s LYS 117 CO -0.01 -0.31 0.00 0.41 0.10 0.00 0.00 175.35 175.54 1m26 n GLY 118 N 0.09 -0.64 3.39 0.59 0.00 -0.11 -0.79 105.19 107.72 1m26 n GLY 118 Ca -0.16 -0.54 -0.14 0.00 0.00 0.00 0.00 46.02 45.17 1m26 n GLY 118 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1m26 s SER 119 N -4.00 -0.48 -0.03 1.61 0.15 -0.84 -0.24 113.70 109.89 1m26 s SER 119 Ca 0.00 0.76 0.00 0.00 0.70 0.00 0.00 55.95 57.42 1m26 s SER 119 Cb 0.00 0.79 0.03 0.00 -1.71 0.00 0.00 66.02 65.13 1m26 s SER 119 CO 0.00 -0.31 0.01 -0.63 1.20 0.00 0.00 173.24 173.52 1m26 s ILE 120 N -0.33 0.07 0.00 6.45 1.01 -0.88 -0.43 121.20 127.09 1m26 s ILE 120 Ca -0.05 0.15 0.00 0.00 0.00 0.00 0.00 60.65 60.75 1m26 s ILE 120 Cb -0.03 -0.18 0.00 0.00 0.01 0.00 0.00 42.46 42.25 1m26 s ILE 120 CO 0.03 0.12 0.00 0.61 0.00 0.00 0.00 174.94 175.70 1m26 n GLY 121 N 4.18 1.34 0.23 6.18 0.00 -1.26 -0.65 105.19 115.22 1m26 n GLY 121 Ca -0.27 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.65 1m26 n GLY 121 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1m26 h TYR 122 N 0.00 0.82 -4.19 1.61 0.99 -1.95 0.13 116.97 114.39 1m26 h TYR 122 Ca 0.00 -0.26 -0.37 0.00 2.00 0.00 0.00 58.73 60.10 1m26 h TYR 122 Cb 0.00 -0.17 -0.14 0.00 1.00 0.00 0.00 36.73 37.42 1m26 h TYR 122 CO 0.00 1.01 -0.57 -1.58 -0.00 0.00 0.00 178.16 177.01 1m26 s TRP 123 N -4.21 1.51 -0.24 4.88 0.51 -1.26 -4.47 118.94 115.66 1m26 s TRP 123 Ca -0.09 -1.38 -0.29 0.00 -2.12 0.00 0.00 56.10 52.22 1m26 s TRP 123 Cb 0.12 -0.78 -0.03 0.00 -0.81 0.00 0.00 33.47 31.97 1m26 s TRP 123 CO 0.85 -0.57 1.79 -1.17 -0.51 0.00 0.00 176.95 177.34 1m26 s LEU 124 N -3.32 3.74 -0.07 2.99 2.96 -0.13 -4.41 118.68 120.45 1m26 s LEU 124 Ca 0.37 1.63 -0.26 0.00 -0.22 0.00 0.00 54.13 55.65 1m26 s LEU 124 Cb 0.06 -3.53 -0.21 0.00 0.50 0.00 0.00 46.19 43.01 1m26 s LEU 124 CO 0.17 -1.49 0.98 0.44 -1.32 0.00 0.00 176.35 175.12 1m26 h ASP 125 N 12.05 -0.03 -5.01 3.68 3.32 -1.06 0.34 116.42 129.72 1m26 h ASP 125 Ca -0.36 -0.64 0.07 0.00 0.02 0.00 0.00 57.03 56.12 1m26 h ASP 125 Cb 1.18 0.01 -0.09 0.00 0.22 0.00 0.00 39.33 40.64 1m26 h ASP 125 CO 1.00 0.66 0.31 -0.72 -1.72 0.00 0.00 179.24 178.77 1m26 s TYR 126 N -3.28 -0.32 0.14 4.55 -0.85 -1.22 -4.09 117.35 112.28 1m26 s TYR 126 Ca -0.16 0.01 -0.20 0.00 -0.52 0.00 0.00 57.07 56.20 1m26 s TYR 126 Cb -0.00 0.62 0.06 0.00 0.38 0.00 0.00 41.96 43.01 1m26 s TYR 126 CO 0.63 -0.93 0.52 -0.59 -1.52 0.00 0.00 175.55 173.66 1m26 s PHE 127 N -3.63 -0.41 0.14 -3.49 -0.71 -1.26 -1.98 117.98 106.65 1m26 s PHE 127 Ca 0.07 0.17 0.01 0.00 -1.04 0.00 0.00 56.93 56.14 1m26 s PHE 127 Cb -0.03 0.43 -0.04 0.00 -1.21 0.00 0.00 43.02 42.17 1m26 s PHE 127 CO -0.03 -0.78 -0.00 -1.12 -1.34 0.00 0.00 175.22 171.95 1m26 s SER 128 N -2.72 0.93 -0.00 1.98 0.01 0.03 -4.96 113.70 108.96 1m26 s SER 128 Ca 0.01 -1.14 0.04 0.00 1.31 0.00 0.00 55.95 56.18 1m26 s SER 128 Cb 0.00 0.16 -0.01 0.00 0.21 0.00 0.00 66.02 66.38 1m26 s SER 128 CO -0.12 -0.59 -0.12 -0.04 0.41 0.00 0.00 173.24 172.78 1m26 s MET 129 N -3.93 0.96 -0.04 12.44 -1.94 -1.26 -2.35 119.30 123.18 1m26 s MET 129 Ca 0.20 -0.49 -0.24 0.00 -1.71 0.00 0.00 55.69 53.46 1m26 s MET 129 Cb 0.06 -0.94 -0.04 0.00 2.01 0.00 0.00 34.83 35.93 1m26 s MET 129 CO 0.01 0.25 0.72 0.71 -0.01 0.00 0.00 175.02 176.70 1m26 s TYR 130 N -0.39 3.62 -0.01 -0.03 1.51 -0.09 -4.98 117.35 116.97 1m26 s TYR 130 Ca 0.04 1.32 0.07 0.00 -1.01 0.00 0.00 57.07 57.49 1m26 s TYR 130 Cb -0.05 -2.82 -0.02 0.00 -0.11 0.00 0.00 41.96 38.96 1m26 s TYR 130 CO -0.00 0.13 -0.23 -0.51 -1.11 0.00 0.00 175.55 173.83 1m26 s LEU 131 N 0.60 2.25 0.23 -1.29 1.43 -1.26 -0.64 118.68 120.00 1m26 s LEU 131 Ca 0.38 -0.43 -0.17 0.00 -1.03 0.00 0.00 54.13 52.88 1m26 s LEU 131 Cb -0.18 -1.39 0.02 0.00 0.03 0.00 0.00 46.19 44.66 1m26 s LEU 131 CO 0.20 0.31 0.56 -0.55 0.23 0.00 0.00 176.35 177.09 1m26 s SER 132 N -0.81 -0.21 0.00 2.29 0.15 -0.14 -4.93 113.70 110.04 1m26 s SER 132 Ca 0.11 -0.64 0.26 0.00 0.70 0.00 0.00 55.95 56.38 1m26 s SER 132 Cb -0.10 0.62 0.55 0.00 -1.71 0.00 0.00 66.02 65.38 1m26 s SER 132 CO 0.00 -1.15 1.46 0.18 1.20 0.00 0.00 173.24 174.94