#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3c60 s SER 2 N 0.00 -0.51 0.18 1.67 1.04 -0.54 -4.97 113.70 110.57 3c60 s SER 2 Ca 0.00 0.97 0.03 0.00 0.48 0.00 0.00 55.95 57.44 3c60 s SER 2 Cb 0.00 0.99 -0.03 0.00 0.10 0.00 0.00 66.02 67.08 3c60 s SER 2 CO 0.00 -0.18 0.31 -0.69 0.98 0.00 0.00 173.24 173.67 3c60 s VAL 3 N 0.22 5.30 -0.28 5.02 1.01 -1.26 -1.45 120.40 128.96 3c60 s VAL 3 Ca -0.00 -0.79 0.00 0.00 0.00 0.00 0.00 61.98 61.19 3c60 s VAL 3 Cb -0.03 -3.79 0.14 0.00 0.00 0.00 0.00 36.38 32.70 3c60 s VAL 3 CO 0.01 -0.18 0.35 -0.89 0.00 0.00 0.00 175.10 174.39 3c60 s THR 4 N -1.83 -0.53 -0.50 3.92 2.01 -0.33 -4.76 115.64 113.62 3c60 s THR 4 Ca 0.34 -0.34 -0.18 0.00 0.31 0.00 0.00 61.69 61.83 3c60 s THR 4 Cb -0.10 -0.96 0.07 0.00 0.01 0.00 0.00 72.50 71.52 3c60 s THR 4 CO 0.29 -0.34 0.55 -1.10 -0.69 0.00 0.00 174.62 173.33 3c60 s GLN 5 N 2.46 3.06 0.50 4.92 -0.21 -1.26 -1.30 119.66 127.83 3c60 s GLN 5 Ca 0.10 -1.13 0.29 0.00 0.02 0.00 0.00 55.36 54.64 3c60 s GLN 5 Cb -0.13 -4.14 1.19 0.00 1.00 0.00 0.00 33.01 30.93 3c60 s GLN 5 CO -0.29 -1.19 1.93 1.98 -2.12 0.00 0.00 175.29 175.60 3c60 h MET 6 N 8.93 0.00 -6.14 2.91 1.85 -1.95 -3.43 114.93 117.10 3c60 h MET 6 Ca -0.28 0.00 -0.55 0.00 -0.61 0.00 0.00 59.70 58.26 3c60 h MET 6 Cb 1.10 0.00 -0.03 0.00 0.43 0.00 0.00 31.60 33.10 3c60 h MET 6 CO 0.95 0.11 1.33 -0.65 -0.40 0.00 0.00 176.91 178.26 3c60 s GLN 7 N -3.72 3.06 -0.03 0.39 -1.52 -1.26 -4.89 119.66 111.69 3c60 s GLN 7 Ca 0.00 1.26 -0.19 0.00 -1.95 0.00 0.00 55.36 54.48 3c60 s GLN 7 Cb 0.10 -4.28 -0.12 0.00 -0.22 0.00 0.00 33.01 28.49 3c60 s GLN 7 CO 0.59 -2.19 0.80 0.78 -0.25 0.00 0.00 175.29 175.02 3c60 h GLY 8 N 14.86 -0.46 -5.19 3.09 0.00 -1.83 -3.38 103.07 110.16 3c60 h GLY 8 Ca -0.31 0.17 -0.09 0.00 0.00 0.00 0.00 47.33 47.09 3c60 h GLY 8 CO 1.08 -0.17 -0.13 1.62 0.00 0.00 0.00 176.54 178.94 3c60 s GLN 9 N -3.56 0.58 -0.03 4.80 -0.44 -1.26 -3.80 119.66 115.94 3c60 s GLN 9 Ca -0.11 0.73 0.06 0.00 -2.50 0.00 0.00 55.36 53.54 3c60 s GLN 9 Cb 0.01 0.26 -0.01 0.00 -1.64 0.00 0.00 33.01 31.63 3c60 s GLN 9 CO 0.36 -0.08 -0.20 0.08 0.50 0.00 0.00 175.29 175.95 3c60 s VAL 10 N 0.40 1.61 -0.02 1.34 1.01 0.28 -4.91 120.40 120.11 3c60 s VAL 10 Ca -0.01 -0.85 -0.00 0.00 0.00 0.00 0.00 61.98 61.12 3c60 s VAL 10 Cb -0.04 -1.36 0.03 0.00 0.00 0.00 0.00 36.38 35.01 3c60 s VAL 10 CO -0.01 0.46 0.03 0.28 0.00 0.00 0.00 175.10 175.86 3c60 s THR 11 N -0.26 -0.05 0.01 3.92 -1.32 -1.26 -1.18 115.64 115.50 3c60 s THR 11 Ca 0.02 0.20 -0.27 0.00 -1.21 0.00 0.00 61.69 60.43 3c60 s THR 11 Cb -0.10 -0.08 0.07 0.00 -1.51 0.00 0.00 72.50 70.87 3c60 s THR 11 CO 0.01 0.08 0.63 -1.48 -2.21 0.00 0.00 174.62 171.65 3c60 s LEU 12 N 1.00 -0.50 0.66 9.08 0.05 -0.67 -4.97 118.68 123.34 3c60 s LEU 12 Ca -0.08 0.46 -0.17 0.00 0.05 0.00 0.00 54.13 54.38 3c60 s LEU 12 Cb -0.12 2.44 -0.00 0.00 -2.05 0.00 0.00 46.19 46.47 3c60 s LEU 12 CO -0.03 -0.70 1.28 -0.44 -0.55 0.00 0.00 176.35 175.91 3c60 s SER 13 N -1.65 4.50 0.60 1.48 0.01 -1.26 -2.99 113.70 114.38 3c60 s SER 13 Ca -0.08 2.58 -0.19 0.00 1.31 0.00 0.00 55.95 59.58 3c60 s SER 13 Cb -0.00 -2.61 -0.04 0.00 0.21 0.00 0.00 66.02 63.57 3c60 s SER 13 CO 0.03 -2.07 1.04 1.21 0.41 0.00 0.00 173.24 173.86 3c60 n GLU 14 N -2.06 0.99 -3.42 12.44 2.13 -0.44 -3.00 120.64 127.28 3c60 n GLU 14 Ca 0.15 0.38 -0.23 0.00 0.66 0.00 0.00 57.16 58.13 3c60 n GLU 14 Cb 0.48 -2.24 0.07 0.00 0.27 0.00 0.00 31.44 30.02 3c60 n GLU 14 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 3c60 n ASN 15 N -0.92 -6.18 -4.61 4.31 4.13 0.05 -4.97 115.26 107.07 3c60 n ASN 15 Ca 0.14 -0.46 -0.24 0.00 1.68 0.00 0.00 54.58 55.70 3c60 n ASN 15 Cb 0.47 -4.85 0.00 0.00 -1.54 0.00 0.00 39.78 33.86 3c60 n ASN 15 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 3c60 n ASP 16 N -2.72 2.62 -4.57 6.41 9.92 -1.16 -4.74 116.55 122.30 3c60 n ASP 16 Ca -0.02 -2.74 -0.40 0.00 -0.53 0.00 0.00 54.79 51.10 3c60 n ASP 16 Cb 0.57 -0.04 -0.09 0.00 -0.64 0.00 0.00 41.12 40.92 3c60 n ASP 16 CO 0.00 0.00 0.00 0.12 0.13 0.00 0.00 177.20 177.45 3c60 s PHE 17 N -2.52 3.22 -0.10 1.24 5.36 -1.24 -2.29 117.98 121.66 3c60 s PHE 17 Ca 0.29 0.13 -0.17 0.00 -0.96 0.00 0.00 56.93 56.22 3c60 s PHE 17 Cb -0.02 -2.62 -0.05 0.00 -0.34 0.00 0.00 43.02 39.99 3c60 s PHE 17 CO 0.18 -0.35 0.45 -1.17 -1.46 0.00 0.00 175.22 172.88 3c60 s LEU 18 N 2.02 4.31 -0.31 6.12 1.98 0.61 -4.96 118.68 128.45 3c60 s LEU 18 Ca 0.13 0.82 -0.00 0.00 -2.89 0.00 0.00 54.13 52.18 3c60 s LEU 18 Cb -0.16 -2.65 0.14 0.00 0.66 0.00 0.00 46.19 44.18 3c60 s LEU 18 CO 0.11 0.07 0.29 0.12 -1.89 0.00 0.00 176.35 175.05 3c60 s PHE 19 N 0.27 -0.26 -0.22 5.38 5.36 -1.25 -1.70 117.98 125.55 3c60 s PHE 19 Ca 0.25 -0.48 -0.10 0.00 -0.96 0.00 0.00 56.93 55.64 3c60 s PHE 19 Cb -0.15 -0.53 -0.05 0.00 -0.34 0.00 0.00 43.02 41.95 3c60 s PHE 19 CO 0.10 -0.92 0.13 0.42 -1.46 0.00 0.00 175.22 173.50 3c60 s ILE 20 N 2.06 5.19 0.06 3.12 1.01 -0.34 -4.95 121.20 127.35 3c60 s ILE 20 Ca 0.11 0.12 -0.20 0.00 0.00 0.00 0.00 60.65 60.68 3c60 s ILE 20 Cb -0.15 -3.39 -0.06 0.00 0.01 0.00 0.00 42.46 38.86 3c60 s ILE 20 CO -0.25 0.39 0.59 0.21 0.00 0.00 0.00 174.94 175.87 3c60 s ASN 21 N 0.81 7.06 -0.05 3.58 3.84 -1.26 -0.67 114.94 128.25 3c60 s ASN 21 Ca 0.07 1.26 -0.02 0.00 0.21 0.00 0.00 52.86 54.38 3c60 s ASN 21 Cb -0.13 -2.37 0.03 0.00 -0.55 0.00 0.00 41.25 38.24 3c60 s ASN 21 CO 0.02 0.23 0.11 0.00 -2.79 0.00 0.00 177.10 174.67 3c60 s THR 23 N 1.09 0.96 0.55 0.00 2.01 -0.42 -0.96 115.64 118.86 3c60 s THR 23 Ca -0.09 -0.31 0.08 0.00 0.31 0.00 0.00 61.69 61.68 3c60 s THR 23 Cb -0.11 -0.94 0.06 0.00 0.01 0.00 0.00 72.50 71.52 3c60 s THR 23 CO -0.05 0.34 0.63 -0.72 -0.69 0.00 0.00 174.62 174.13 3c60 s TYR 24 N 1.21 1.62 -0.29 4.92 -0.85 -0.48 -1.19 117.35 122.29 3c60 s TYR 24 Ca -0.05 -0.73 0.01 0.00 -0.52 0.00 0.00 57.07 55.78 3c60 s TYR 24 Cb -0.14 -2.12 0.19 0.00 0.38 0.00 0.00 41.96 40.27 3c60 s TYR 24 CO -0.02 -0.84 0.67 -1.54 -1.52 0.00 0.00 175.55 172.30 3c60 s SER 25 N -4.49 -1.36 0.27 -0.18 1.04 -0.53 -4.83 113.70 103.62 3c60 s SER 25 Ca 0.52 0.39 0.01 0.00 0.48 0.00 0.00 55.95 57.34 3c60 s SER 25 Cb -0.05 1.95 -0.00 0.00 0.10 0.00 0.00 66.02 68.03 3c60 s SER 25 CO 0.32 -0.25 0.02 0.35 0.98 0.00 0.00 173.24 174.67 3c60 n THR 26 N 5.39 0.00 -0.05 2.02 -2.24 -1.26 -1.47 114.28 116.67 3c60 n THR 26 Ca 0.03 -1.35 0.00 0.00 -2.27 0.00 0.00 64.05 60.45 3c60 n THR 26 Cb 0.53 0.33 0.00 0.00 -2.10 0.00 0.00 70.33 69.10 3c60 n THR 26 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3c60 n THR 27 N -0.66 0.00 -0.34 4.28 -2.24 -1.26 -4.80 114.28 109.26 3c60 n THR 27 Ca -0.09 -0.46 0.00 0.00 -2.27 0.00 0.00 64.05 61.23 3c60 n THR 27 Cb 0.36 1.05 0.00 0.00 -2.10 0.00 0.00 70.33 69.64 3c60 n THR 27 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3c60 n GLY 28 N 0.30 4.97 2.50 3.38 0.00 -1.26 -5.09 105.19 110.00 3c60 n GLY 28 Ca 0.00 -1.65 -0.27 0.00 0.00 0.00 0.00 46.02 44.11 3c60 n GLY 28 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3c60 n TYR 29 N 0.00 1.27 -1.47 1.61 4.02 -1.26 -5.11 117.16 116.22 3c60 n TYR 29 Ca 0.00 -3.81 -0.33 0.00 -0.01 0.00 0.00 57.90 53.75 3c60 n TYR 29 Cb 0.00 -0.28 0.08 0.00 -0.02 0.00 0.00 39.34 39.12 3c60 n TYR 29 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 176.86 174.60 3c60 s PRO 30 N -1.14 2.35 -0.09 -0.72 0.04 -1.26 -4.81 135.00 129.37 3c60 s PRO 30 Ca 0.32 1.46 -0.05 0.00 0.04 0.00 0.00 61.00 62.77 3c60 s PRO 30 Cb 0.07 -1.89 -0.04 0.00 0.04 0.00 0.00 34.50 32.68 3c60 s PRO 30 CO -0.14 -1.61 0.13 0.99 0.04 0.00 0.00 177.00 176.41 3c60 s THR 31 N -2.39 5.33 -0.06 1.26 2.01 -0.67 -4.86 115.64 116.27 3c60 s THR 31 Ca 0.68 0.06 0.00 0.00 0.31 0.00 0.00 61.69 62.74 3c60 s THR 31 Cb -0.22 -3.35 -0.03 0.00 0.01 0.00 0.00 72.50 68.90 3c60 s THR 31 CO 0.47 0.55 -0.04 -0.76 -0.69 0.00 0.00 174.62 174.15 3c60 s LEU 32 N -1.22 3.35 0.23 4.42 1.43 -0.11 -1.36 118.68 125.43 3c60 s LEU 32 Ca 0.17 0.02 0.03 0.00 -1.03 0.00 0.00 54.13 53.33 3c60 s LEU 32 Cb -0.12 -1.79 -0.05 0.00 0.03 0.00 0.00 46.19 44.25 3c60 s LEU 32 CO 0.07 0.35 0.00 -0.36 0.23 0.00 0.00 176.35 176.64 3c60 s PHE 33 N -0.89 1.56 -0.05 0.29 0.40 0.25 -0.28 117.98 119.26 3c60 s PHE 33 Ca 0.14 -0.94 0.00 0.00 -0.60 0.00 0.00 56.93 55.53 3c60 s PHE 33 Cb -0.11 -0.91 0.02 0.00 0.51 0.00 0.00 43.02 42.53 3c60 s PHE 33 CO 0.04 -0.06 -0.02 -1.58 0.70 0.00 0.00 175.22 174.29 3c60 s TRP 34 N -3.44 0.61 -0.05 0.36 0.52 0.63 -1.44 118.94 116.13 3c60 s TRP 34 Ca 0.29 -0.14 0.06 0.00 0.02 0.00 0.00 56.10 56.33 3c60 s TRP 34 Cb 0.06 -0.62 -0.01 0.00 -1.15 0.00 0.00 33.47 31.75 3c60 s TRP 34 CO 0.09 -0.20 -0.24 0.71 0.02 0.00 0.00 176.95 177.33 3c60 s TYR 35 N 1.14 2.28 -0.20 -1.98 1.51 0.30 -0.72 117.35 119.69 3c60 s TYR 35 Ca -0.08 -0.64 -0.05 0.00 -1.01 0.00 0.00 57.07 55.30 3c60 s TYR 35 Cb -0.14 -1.50 -0.02 0.00 -0.11 0.00 0.00 41.96 40.19 3c60 s TYR 35 CO -0.01 -0.18 -0.01 0.54 -1.11 0.00 0.00 175.55 174.78 3c60 s VAL 36 N -0.20 3.91 -0.31 0.71 0.11 0.11 0.15 120.40 124.88 3c60 s VAL 36 Ca -0.02 -0.33 0.01 0.00 -2.93 0.00 0.00 61.98 58.71 3c60 s VAL 36 Cb -0.13 -2.76 0.07 0.00 -1.53 0.00 0.00 36.38 32.03 3c60 s VAL 36 CO 0.03 0.43 -0.01 -1.58 -3.33 0.00 0.00 175.10 170.65 3c60 s GLN 37 N 0.96 2.12 0.03 1.54 0.74 0.19 -2.07 119.66 123.16 3c60 s GLN 37 Ca 0.01 -1.48 -0.30 0.00 0.05 0.00 0.00 55.36 53.64 3c60 s GLN 37 Cb -0.14 -3.13 -0.04 0.00 1.10 0.00 0.00 33.01 30.80 3c60 s GLN 37 CO 0.02 -0.72 0.99 0.71 -0.55 0.00 0.00 175.29 175.74 3c60 s TYR 38 N 1.11 3.68 -0.22 1.67 1.51 -1.26 -1.47 117.35 122.37 3c60 s TYR 38 Ca -0.02 1.69 -0.43 0.00 -1.01 0.00 0.00 57.07 57.30 3c60 s TYR 38 Cb -0.20 -3.13 -0.20 0.00 -0.11 0.00 0.00 41.96 38.32 3c60 s TYR 38 CO -0.04 -0.07 1.32 0.45 -1.11 0.00 0.00 175.55 176.10 3c60 n SER 39 N 3.63 0.59 0.00 2.29 2.88 -1.26 -1.45 113.62 120.30 3c60 n SER 39 Ca 0.05 1.17 0.00 0.00 -1.33 0.00 0.00 58.87 58.76 3c60 n SER 39 Cb 0.50 -0.91 0.00 0.00 -0.75 0.00 0.00 64.21 63.05 3c60 n SER 39 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3c60 n GLY 40 N 2.65 2.80 3.94 0.46 0.00 -1.26 -5.05 105.19 108.73 3c60 n GLY 40 Ca 0.25 -0.49 -0.23 0.00 0.00 0.00 0.00 46.02 45.55 3c60 n GLY 40 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3c60 s GLU 41 N 0.00 2.35 0.55 1.61 -1.05 -0.53 -5.12 118.70 116.51 3c60 s GLU 41 Ca 0.00 -1.77 -0.05 0.00 -0.15 0.00 0.00 54.97 53.00 3c60 s GLU 41 Cb 0.00 -2.35 -0.01 0.00 -0.44 0.00 0.00 34.13 31.33 3c60 s GLU 41 CO 0.00 -0.59 0.85 0.20 0.95 0.00 0.00 175.26 176.67 3c60 s GLY 42 N -4.37 1.57 0.46 -3.83 0.00 -1.26 -4.62 107.32 95.27 3c60 s GLY 42 Ca 0.46 -0.67 -0.24 0.00 0.00 0.00 0.00 44.72 44.28 3c60 s GLY 42 CO 0.29 -0.43 1.28 2.56 0.00 0.00 0.00 173.10 176.80 3c60 s PRO 43 N -4.88 3.68 0.20 2.90 0.04 -1.26 -4.64 135.00 131.03 3c60 s PRO 43 Ca 0.51 2.08 0.04 0.00 0.04 0.00 0.00 61.00 63.68 3c60 s PRO 43 Cb -0.10 -2.52 -0.05 0.00 0.04 0.00 0.00 34.50 31.87 3c60 s PRO 43 CO 0.44 -0.71 -0.05 1.14 0.04 0.00 0.00 177.00 177.86 3c60 s GLN 44 N -2.55 1.23 0.13 4.56 -2.07 -0.88 -4.97 119.66 115.10 3c60 s GLN 44 Ca 0.63 -1.58 -0.30 0.00 -1.82 0.00 0.00 55.36 52.29 3c60 s GLN 44 Cb -0.36 -0.65 -0.06 0.00 -1.09 0.00 0.00 33.01 30.84 3c60 s GLN 44 CO 0.45 -0.01 1.01 -1.17 -1.32 0.00 0.00 175.29 174.25 3c60 s LEU 45 N -3.25 4.49 -0.13 2.60 2.96 -1.26 -0.72 118.68 123.38 3c60 s LEU 45 Ca 0.23 1.88 -0.14 0.00 -0.22 0.00 0.00 54.13 55.89 3c60 s LEU 45 Cb 0.04 -3.59 -0.05 0.00 0.50 0.00 0.00 46.19 43.09 3c60 s LEU 45 CO 0.05 -0.12 -0.27 -0.11 -1.32 0.00 0.00 176.35 174.58 3c60 n LEU 46 N 2.72 1.63 -3.49 -0.68 7.94 0.11 -4.81 117.00 120.42 3c60 n LEU 46 Ca 0.03 0.27 -0.14 0.00 -1.11 0.00 0.00 56.01 55.06 3c60 n LEU 46 Cb 0.48 -0.66 -0.04 0.00 0.53 0.00 0.00 43.42 43.74 3c60 n LEU 46 CO 0.52 -0.35 0.37 -1.48 -1.11 0.00 0.00 177.39 175.34 3c60 s LEU 47 N -7.49 -0.44 0.11 -1.96 0.05 -1.13 -4.66 118.68 103.17 3c60 s LEU 47 Ca -0.22 0.19 -0.07 0.00 0.05 0.00 0.00 54.13 54.08 3c60 s LEU 47 Cb 0.03 2.45 -0.01 0.00 -2.05 0.00 0.00 46.19 46.60 3c60 s LEU 47 CO 0.33 -0.82 0.17 0.00 -0.55 0.00 0.00 176.35 175.48 3c60 s GLN 48 N -2.87 0.92 -0.19 1.48 -2.07 -1.26 -0.27 119.66 115.41 3c60 s GLN 48 Ca -0.03 -1.13 -0.04 0.00 -1.82 0.00 0.00 55.36 52.34 3c60 s GLN 48 Cb -0.01 0.32 0.09 0.00 -1.09 0.00 0.00 33.01 32.32 3c60 s GLN 48 CO -0.05 -0.29 0.24 0.08 -1.32 0.00 0.00 175.29 173.94 3c60 s VAL 49 N -3.93 -0.36 -0.13 3.63 1.01 0.61 -4.68 120.40 116.56 3c60 s VAL 49 Ca 0.12 -0.02 -0.18 0.00 0.00 0.00 0.00 61.98 61.90 3c60 s VAL 49 Cb 0.05 -0.63 -0.16 0.00 0.00 0.00 0.00 36.38 35.64 3c60 s VAL 49 CO -0.05 -0.13 0.47 0.71 0.00 0.00 0.00 175.10 176.10 3c60 h THR 50 N 6.30 1.11 -3.46 3.92 1.35 -1.90 -0.25 112.91 119.98 3c60 h THR 50 Ca -0.17 -1.84 -0.52 0.00 -0.55 0.00 0.00 66.41 63.34 3c60 h THR 50 Cb 1.14 2.09 -0.00 0.00 -1.73 0.00 0.00 68.15 69.66 3c60 h THR 50 CO 0.25 0.37 0.47 -0.89 -0.25 0.00 0.00 175.52 175.47 3c60 s THR 51 N -1.97 4.10 1.24 6.82 2.01 -1.26 -4.48 115.64 122.09 3c60 s THR 51 Ca -0.12 1.69 -0.14 0.00 0.31 0.00 0.00 61.69 63.42 3c60 s THR 51 Cb -0.02 -4.08 0.32 0.00 0.01 0.00 0.00 72.50 68.73 3c60 s THR 51 CO 0.43 0.23 0.98 0.00 -0.69 0.00 0.00 174.62 175.57 3c60 n ALA 52 N 2.96 -3.39 -3.50 7.40 0.00 -1.26 -4.38 120.51 118.34 3c60 n ALA 52 Ca 0.04 -1.34 -0.21 0.00 0.00 0.00 0.00 53.44 51.93 3c60 n ALA 52 Cb 0.47 -1.93 0.00 0.00 0.00 0.00 0.00 19.45 17.99 3c60 n ALA 52 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3c60 n ASN 53 N -5.12 -3.91 0.00 0.00 5.03 0.11 -4.97 115.26 106.41 3c60 n ASN 53 Ca 0.03 -0.73 0.00 0.00 0.87 0.00 0.00 54.58 54.76 3c60 n ASN 53 Cb 0.55 -1.28 0.00 0.00 -1.02 0.00 0.00 39.78 38.03 3c60 n ASN 53 CO 0.00 0.00 0.00 -0.46 -1.83 0.00 0.00 177.26 174.97 3c60 n ASN 54 N -1.81 0.00 -4.89 6.41 2.04 -1.24 -4.94 115.26 110.82 3c60 n ASN 54 Ca -0.24 0.00 -0.29 0.00 -0.44 0.00 0.00 54.58 53.61 3c60 n ASN 54 Cb 0.56 0.00 -0.04 0.00 -2.53 0.00 0.00 39.78 37.77 3c60 n ASN 54 CO 0.00 0.00 0.00 -1.59 -0.44 0.00 0.00 177.26 175.23 3c60 s LYS 55 N -2.00 3.29 0.10 -3.83 -2.85 -1.26 -2.31 119.74 110.88 3c60 s LYS 55 Ca 0.00 -0.59 0.10 0.00 -1.00 0.00 0.00 55.97 54.49 3c60 s LYS 55 Cb 0.00 -2.92 -0.04 0.00 -2.06 0.00 0.00 37.83 32.82 3c60 s LYS 55 CO 0.00 0.56 -0.27 0.20 0.10 0.00 0.00 175.35 175.94 3c60 s GLY 56 N -2.82 1.51 -0.04 0.59 0.00 -0.11 -4.96 107.32 101.49 3c60 s GLY 56 Ca 0.33 -1.39 -0.10 0.00 0.00 0.00 0.00 44.72 43.56 3c60 s GLY 56 CO 0.27 -1.34 0.24 -1.35 0.00 0.00 0.00 173.10 170.92 3c60 s SER 57 N -1.76 -0.17 -0.06 1.64 1.04 -1.26 -0.99 113.70 112.14 3c60 s SER 57 Ca 0.13 0.19 -0.20 0.00 0.48 0.00 0.00 55.95 56.55 3c60 s SER 57 Cb -0.10 0.38 0.04 0.00 0.10 0.00 0.00 66.02 66.44 3c60 s SER 57 CO 0.05 -0.28 0.47 -0.55 0.98 0.00 0.00 173.24 173.90 3c60 s SER 58 N -0.74 -0.41 -0.34 7.02 0.15 -0.40 -4.96 113.70 114.02 3c60 s SER 58 Ca -0.08 0.48 -0.09 0.00 0.70 0.00 0.00 55.95 56.96 3c60 s SER 58 Cb -0.04 0.53 0.01 0.00 -1.71 0.00 0.00 66.02 64.81 3c60 s SER 58 CO 0.02 -0.44 0.20 0.54 1.20 0.00 0.00 173.24 174.76 3c60 n ARG 59 N 1.49 -0.74 -0.10 5.44 1.74 -1.26 0.11 116.66 123.34 3c60 n ARG 59 Ca -0.19 -0.24 0.00 0.00 -0.77 0.00 0.00 57.85 56.65 3c60 n ARG 59 Cb 0.56 -0.18 0.00 0.00 -1.02 0.00 0.00 32.46 31.83 3c60 n ARG 59 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3c60 n GLY 60 N -1.20 2.68 3.93 -0.13 0.00 -1.26 -5.01 105.19 104.20 3c60 n GLY 60 Ca -0.05 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.77 3c60 n GLY 60 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3c60 s PHE 61 N -3.02 3.21 -0.27 1.61 0.40 0.29 -4.39 117.98 115.81 3c60 s PHE 61 Ca 0.00 -0.13 -0.24 0.00 -0.60 0.00 0.00 56.93 55.96 3c60 s PHE 61 Cb 0.00 -1.67 0.08 0.00 0.51 0.00 0.00 43.02 41.94 3c60 s PHE 61 CO 0.00 0.31 0.80 -1.83 0.70 0.00 0.00 175.22 175.19 3c60 s GLU 62 N -4.00 0.75 -0.02 0.44 -1.05 -0.42 -1.28 118.70 113.13 3c60 s GLU 62 Ca 0.37 0.91 -0.05 0.00 -0.15 0.00 0.00 54.97 56.06 3c60 s GLU 62 Cb -0.08 0.35 0.00 0.00 -0.44 0.00 0.00 34.13 33.96 3c60 s GLU 62 CO 0.28 -0.09 0.10 0.00 0.95 0.00 0.00 175.26 176.50 3c60 s ALA 63 N 0.42 -0.24 -0.09 -0.84 0.00 -0.16 -1.19 121.76 119.65 3c60 s ALA 63 Ca 0.00 0.04 -0.00 0.00 0.00 0.00 0.00 51.96 52.00 3c60 s ALA 63 Cb -0.05 -0.04 -0.03 0.00 0.00 0.00 0.00 23.12 23.00 3c60 s ALA 63 CO -0.02 -0.12 -0.06 0.99 0.00 0.00 0.00 175.76 176.54 3c60 s THR 64 N -0.64 3.71 -1.17 0.00 2.01 -1.26 -0.94 115.64 117.35 3c60 s THR 64 Ca -0.07 -0.46 -0.16 0.00 0.31 0.00 0.00 61.69 61.31 3c60 s THR 64 Cb -0.04 -2.54 0.14 0.00 0.01 0.00 0.00 72.50 70.06 3c60 s THR 64 CO 0.00 0.57 1.45 -0.47 -0.69 0.00 0.00 174.62 175.48 3c60 s TYR 65 N -0.50 3.26 -0.47 4.92 6.04 -0.98 -4.15 117.35 125.48 3c60 s TYR 65 Ca 0.07 -1.87 -0.23 0.00 0.04 0.00 0.00 57.07 55.09 3c60 s TYR 65 Cb -0.12 -4.41 0.03 0.00 -1.04 0.00 0.00 41.96 36.42 3c60 s TYR 65 CO 0.02 -1.51 0.79 0.34 -1.54 0.00 0.00 175.55 173.64 3c60 s ASP 66 N 3.32 6.37 0.14 4.32 2.15 -0.98 0.10 116.67 132.09 3c60 s ASP 66 Ca 0.43 -0.25 -0.07 0.00 0.43 0.00 0.00 52.55 53.10 3c60 s ASP 66 Cb -0.02 -2.38 -0.06 0.00 -0.30 0.00 0.00 42.92 40.17 3c60 s ASP 66 CO -0.00 -0.96 1.36 0.50 -0.17 0.00 0.00 175.17 175.89 3c60 h LYS 67 N 9.03 0.56 -0.13 4.34 1.63 -1.93 0.26 116.57 130.33 3c60 h LYS 67 Ca -0.25 -0.49 -0.00 0.00 -0.85 0.00 0.00 60.65 59.06 3c60 h LYS 67 Cb 1.09 0.11 -0.01 0.00 -0.60 0.00 0.00 32.23 32.82 3c60 h LYS 67 CO 0.98 1.11 0.07 0.78 -3.45 0.00 0.00 179.45 178.94 3c60 h GLY 68 N 0.96 0.19 -0.85 5.01 0.00 -1.97 -2.26 103.07 104.16 3c60 h GLY 68 Ca -0.05 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.20 3c60 h GLY 68 CO 0.15 0.07 -0.11 2.41 0.00 0.00 0.00 176.54 179.06 3c60 n THR 69 N -4.50 0.00 -4.13 4.70 -1.04 -1.21 -4.99 114.28 103.12 3c60 n THR 69 Ca -0.01 -0.45 -0.28 0.00 -2.04 0.00 0.00 64.05 61.27 3c60 n THR 69 Cb 0.10 1.22 -0.06 0.00 -1.82 0.00 0.00 70.33 69.77 3c60 n THR 69 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 3c60 n THR 70 N 0.34 -2.07 -4.28 12.58 -2.24 0.79 -4.86 114.28 114.54 3c60 n THR 70 Ca 0.07 -0.50 -0.16 0.00 -2.27 0.00 0.00 64.05 61.19 3c60 n THR 70 Cb 0.30 -1.86 -0.10 0.00 -2.10 0.00 0.00 70.33 66.57 3c60 n THR 70 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3c60 s SER 71 N -4.38 2.08 -0.38 3.42 1.04 -0.53 -1.39 113.70 113.58 3c60 s SER 71 Ca 0.00 -1.01 0.12 0.00 0.48 0.00 0.00 55.95 55.55 3c60 s SER 71 Cb -0.00 -0.06 0.40 0.00 0.10 0.00 0.00 66.02 66.46 3c60 s SER 71 CO 0.94 -0.26 1.09 0.33 0.98 0.00 0.00 173.24 176.32 3c60 n PHE 72 N -0.23 -0.87 -1.88 5.02 -0.00 -0.13 -2.31 117.46 117.06 3c60 n PHE 72 Ca -0.10 -2.54 -0.40 0.00 -0.00 0.00 0.00 57.45 54.42 3c60 n PHE 72 Cb 0.60 0.62 0.01 0.00 -0.00 0.00 0.00 39.48 40.71 3c60 n PHE 72 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.76 175.75 3c60 s HIS 73 N -1.35 2.58 -0.15 -5.13 3.76 -1.26 -4.52 115.29 109.23 3c60 s HIS 73 Ca 0.26 1.31 -0.14 0.00 -0.15 0.00 0.00 55.06 56.34 3c60 s HIS 73 Cb 0.40 -3.85 -0.05 0.00 1.11 0.00 0.00 32.58 30.20 3c60 s HIS 73 CO -0.04 -2.67 0.31 -1.17 -0.85 0.00 0.00 174.74 170.32 3c60 s LEU 74 N -2.61 4.26 0.05 0.89 2.96 0.15 -4.05 118.68 120.34 3c60 s LEU 74 Ca 0.59 0.55 0.07 0.00 -0.22 0.00 0.00 54.13 55.13 3c60 s LEU 74 Cb -0.42 -2.39 -0.03 0.00 0.50 0.00 0.00 46.19 43.85 3c60 s LEU 74 CO 0.54 0.12 -0.20 -1.10 -1.32 0.00 0.00 176.35 174.39 3c60 s GLN 75 N 0.33 1.34 -0.13 1.98 -0.21 -0.34 -1.20 119.66 121.43 3c60 s GLN 75 Ca 0.17 -0.93 -0.11 0.00 0.02 0.00 0.00 55.36 54.51 3c60 s GLN 75 Cb -0.13 -1.45 0.04 0.00 1.00 0.00 0.00 33.01 32.47 3c60 s GLN 75 CO 0.05 0.37 0.34 0.21 -2.12 0.00 0.00 175.29 174.13 3c60 s LYS 76 N -1.21 0.37 -0.19 2.91 2.47 -0.69 -1.29 119.74 122.11 3c60 s LYS 76 Ca 0.07 0.53 -0.15 0.00 -1.56 0.00 0.00 55.97 54.85 3c60 s LYS 76 Cb -0.09 0.12 -0.10 0.00 -1.46 0.00 0.00 37.83 36.31 3c60 s LYS 76 CO 0.02 -0.08 -0.12 0.25 0.16 0.00 0.00 175.35 175.58 3c60 n THR 77 N 3.27 1.48 -3.26 3.43 -2.24 -1.26 -0.28 114.28 115.42 3c60 n THR 77 Ca -0.16 0.04 -0.39 0.00 -2.27 0.00 0.00 64.05 61.27 3c60 n THR 77 Cb 0.57 -2.20 -0.02 0.00 -2.10 0.00 0.00 70.33 66.57 3c60 n THR 77 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3c60 n SER 78 N -4.48 5.33 -4.62 3.42 3.41 -1.25 -3.62 113.62 111.81 3c60 n SER 78 Ca -0.23 -3.32 -0.43 0.00 -0.26 0.00 0.00 58.87 54.63 3c60 n SER 78 Cb 0.53 -1.12 -0.03 0.00 -0.26 0.00 0.00 64.21 63.34 3c60 n SER 78 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3c60 s VAL 79 N -2.27 3.24 0.78 -3.33 0.11 -0.97 -4.73 120.40 113.24 3c60 s VAL 79 Ca 0.32 0.26 -0.11 0.00 -2.93 0.00 0.00 61.98 59.52 3c60 s VAL 79 Cb 0.03 -3.27 0.07 0.00 -1.53 0.00 0.00 36.38 31.67 3c60 s VAL 79 CO 0.01 -0.14 1.15 -1.58 -3.33 0.00 0.00 175.10 171.21 3c60 s GLN 80 N 5.50 2.11 0.49 1.54 2.00 -1.26 -0.77 119.66 129.28 3c60 s GLN 80 Ca 0.88 0.12 0.30 0.00 -2.00 0.00 0.00 55.36 54.66 3c60 s GLN 80 Cb -0.31 -1.99 1.01 0.00 0.80 0.00 0.00 33.01 32.53 3c60 s GLN 80 CO 0.35 -1.48 1.85 1.05 -0.50 0.00 0.00 175.29 176.56 3c60 h GLU 81 N -0.95 0.00 -0.23 1.67 4.11 -1.92 -2.77 114.58 114.49 3c60 h GLU 81 Ca -0.46 0.00 -0.08 0.00 0.07 0.00 0.00 59.36 58.89 3c60 h GLU 81 Cb 1.32 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.55 3c60 h GLU 81 CO 0.65 0.00 -0.20 0.82 0.07 0.00 0.00 179.01 180.35 3c60 h ILE 82 N 0.00 1.24 0.00 -1.06 2.04 -1.92 -2.72 117.51 115.09 3c60 h ILE 82 Ca 0.00 -1.12 0.00 0.00 1.00 0.00 0.00 64.86 64.74 3c60 h ILE 82 Cb 0.66 1.30 0.00 0.00 -0.74 0.00 0.00 36.82 38.03 3c60 h ILE 82 CO 0.00 0.35 0.00 0.47 0.00 0.00 0.00 178.15 178.97 3c60 n ASP 83 N -4.17 0.02 -4.66 1.72 8.00 -1.05 -4.72 116.55 111.69 3c60 n ASP 83 Ca -0.00 -0.87 -0.43 0.00 0.71 0.00 0.00 54.79 54.20 3c60 n ASP 83 Cb 0.36 -0.01 -0.02 0.00 -0.02 0.00 0.00 41.12 41.43 3c60 n ASP 83 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 3c60 s SER 84 N -1.52 6.93 -0.00 -2.24 0.01 -1.03 -4.87 113.70 110.98 3c60 s SER 84 Ca 0.00 1.73 -0.03 0.00 1.31 0.00 0.00 55.95 58.97 3c60 s SER 84 Cb 0.00 -2.54 0.01 0.00 0.21 0.00 0.00 66.02 63.70 3c60 s SER 84 CO 0.00 -0.76 0.13 0.00 0.41 0.00 0.00 173.24 173.02 3c60 n ALA 85 N 6.56 -0.36 -2.84 1.44 0.00 -0.72 -4.80 120.51 119.78 3c60 n ALA 85 Ca 0.14 -0.08 -0.35 0.00 0.00 0.00 0.00 53.44 53.15 3c60 n ALA 85 Cb 0.45 0.02 -0.10 0.00 0.00 0.00 0.00 19.45 19.81 3c60 n ALA 85 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3c60 s VAL 86 N -2.17 4.70 -0.21 0.00 1.01 -0.54 0.38 120.40 123.57 3c60 s VAL 86 Ca 0.03 -0.06 -0.06 0.00 0.00 0.00 0.00 61.98 61.89 3c60 s VAL 86 Cb -0.00 -3.13 -0.03 0.00 0.00 0.00 0.00 36.38 33.23 3c60 s VAL 86 CO -0.00 0.44 0.01 -0.31 0.00 0.00 0.00 175.10 175.25 3c60 s TYR 87 N 0.55 3.06 -0.13 5.22 2.02 0.20 0.53 117.35 128.79 3c60 s TYR 87 Ca 0.03 -0.44 -0.02 0.00 -0.37 0.00 0.00 57.07 56.27 3c60 s TYR 87 Cb -0.13 -2.11 -0.03 0.00 -0.40 0.00 0.00 41.96 39.29 3c60 s TYR 87 CO 0.01 -0.25 -0.05 0.71 -1.57 0.00 0.00 175.55 174.40 3c60 s TYR 88 N 1.09 2.99 -0.16 2.71 1.51 0.39 -1.59 117.35 124.29 3c60 s TYR 88 Ca 0.03 -0.23 -0.07 0.00 -1.01 0.00 0.00 57.07 55.79 3c60 s TYR 88 Cb -0.14 -1.88 -0.04 0.00 -0.11 0.00 0.00 41.96 39.79 3c60 s TYR 88 CO 0.02 0.07 0.09 0.00 -1.11 0.00 0.00 175.55 174.61 3c60 s ALA 90 N -0.14 -0.05 0.01 0.00 0.00 -0.52 -0.09 121.76 120.98 3c60 s ALA 90 Ca 0.08 -0.49 0.01 0.00 0.00 0.00 0.00 51.96 51.56 3c60 s ALA 90 Cb -0.12 0.18 -0.01 0.00 0.00 0.00 0.00 23.12 23.17 3c60 s ALA 90 CO 0.01 -0.24 -0.03 0.00 0.00 0.00 0.00 175.76 175.50 3c60 s ALA 91 N -2.01 0.18 -0.21 0.00 0.00 -0.47 0.86 121.76 120.11 3c60 s ALA 91 Ca -0.10 -0.34 -0.04 0.00 0.00 0.00 0.00 51.96 51.48 3c60 s ALA 91 Cb -0.05 0.04 0.09 0.00 0.00 0.00 0.00 23.12 23.20 3c60 s ALA 91 CO -0.02 -0.04 0.21 1.21 0.00 0.00 0.00 175.76 177.11 3c60 s ASN 92 N -0.74 1.56 -0.17 0.00 2.47 -0.46 -1.69 114.94 115.91 3c60 s ASN 92 Ca -0.07 -0.32 0.17 0.00 0.42 0.00 0.00 52.86 53.06 3c60 s ASN 92 Cb -0.05 0.30 0.50 0.00 -1.45 0.00 0.00 41.25 40.54 3c60 s ASN 92 CO -0.00 -0.33 1.38 -1.54 -3.72 0.00 0.00 177.10 172.89 3c60 n SER 93 N 5.31 3.67 0.00 -4.21 3.41 -1.26 -1.67 113.62 118.87 3c60 n SER 93 Ca -0.06 -3.02 0.00 0.00 -0.26 0.00 0.00 58.87 55.54 3c60 n SER 93 Cb 0.49 -0.53 0.00 0.00 -0.26 0.00 0.00 64.21 63.91 3c60 n SER 93 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3c60 n GLY 94 N -0.63 3.99 0.04 5.00 0.00 -1.26 -4.73 105.19 107.60 3c60 n GLY 94 Ca 0.21 -0.42 0.02 0.00 0.00 0.00 0.00 46.02 45.83 3c60 n GLY 94 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3c60 n THR 97 N 0.00 0.44 -4.10 2.61 -2.24 -1.26 -5.01 114.28 104.72 3c60 n THR 97 Ca 0.00 -0.51 -0.15 0.00 -2.27 0.00 0.00 64.05 61.12 3c60 n THR 97 Cb 0.00 -0.16 -0.12 0.00 -2.10 0.00 0.00 70.33 67.95 3c60 n THR 97 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 3c60 s TYR 98 N -2.89 0.85 -0.08 4.78 1.13 -1.26 -5.14 117.35 114.75 3c60 s TYR 98 Ca -0.07 -0.49 -0.29 0.00 -1.41 0.00 0.00 57.07 54.81 3c60 s TYR 98 Cb 0.09 -0.50 -0.02 0.00 -1.10 0.00 0.00 41.96 40.43 3c60 s TYR 98 CO 0.70 -0.04 0.97 -0.65 -2.51 0.00 0.00 175.55 174.03 3c60 s GLN 99 N -1.64 4.45 0.04 -3.49 -0.21 -1.26 -4.71 119.66 112.84 3c60 s GLN 99 Ca -0.07 1.35 -0.05 0.00 0.02 0.00 0.00 55.36 56.60 3c60 s GLN 99 Cb -0.10 -3.52 -0.05 0.00 1.00 0.00 0.00 33.01 30.35 3c60 s GLN 99 CO 0.01 -0.22 0.28 1.03 -2.12 0.00 0.00 175.29 174.27 3c60 s ARG 100 N 1.67 3.56 0.30 2.91 0.52 -0.68 -4.92 118.95 122.31 3c60 s ARG 100 Ca 0.48 -0.14 0.08 0.00 -0.52 0.00 0.00 55.73 55.64 3c60 s ARG 100 Cb -0.19 -3.03 -0.04 0.00 0.52 0.00 0.00 34.95 32.21 3c60 s ARG 100 CO 0.20 0.61 0.13 -0.06 0.02 0.00 0.00 175.30 176.21 3c60 s PHE 101 N -1.40 2.81 0.38 -0.53 0.40 -1.26 -1.36 117.98 117.01 3c60 s PHE 101 Ca 0.31 -0.28 -0.01 0.00 -0.60 0.00 0.00 56.93 56.36 3c60 s PHE 101 Cb -0.13 -1.50 0.08 0.00 0.51 0.00 0.00 43.02 41.98 3c60 s PHE 101 CO 0.19 0.43 0.52 0.41 0.70 0.00 0.00 175.22 177.47 3c60 n GLY 102 N -1.12 0.60 0.19 4.36 0.00 0.87 -4.65 105.19 105.45 3c60 n GLY 102 Ca -0.05 -1.98 -0.14 0.00 0.00 0.00 0.00 46.02 43.86 3c60 n GLY 102 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3c60 h THR 103 N -0.54 0.74 0.00 2.61 2.02 -1.87 -3.45 112.91 112.41 3c60 h THR 103 Ca -0.17 -0.39 0.00 0.00 0.77 0.00 0.00 66.41 66.62 3c60 h THR 103 Cb 0.62 0.95 0.00 0.00 -1.74 0.00 0.00 68.15 67.98 3c60 h THR 103 CO 0.18 0.08 0.00 0.61 0.37 0.00 0.00 175.52 176.76 3c60 n GLY 104 N -0.68 3.89 2.75 2.16 0.00 -1.26 -5.04 105.19 107.01 3c60 n GLY 104 Ca -0.10 -1.61 -0.20 0.00 0.00 0.00 0.00 46.02 44.11 3c60 n GLY 104 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3c60 s THR 105 N -2.20 0.16 -0.15 2.61 2.01 -0.62 -4.62 115.64 112.83 3c60 s THR 105 Ca 0.00 0.21 -0.18 0.00 0.31 0.00 0.00 61.69 62.03 3c60 s THR 105 Cb 0.00 -0.33 -0.04 0.00 0.01 0.00 0.00 72.50 72.14 3c60 s THR 105 CO 0.00 0.20 0.48 -0.75 -0.69 0.00 0.00 174.62 173.86 3c60 s LYS 106 N 1.73 4.29 -0.20 4.92 2.20 -1.25 0.60 119.74 132.03 3c60 s LYS 106 Ca 0.00 0.41 -0.04 0.00 -0.36 0.00 0.00 55.97 55.99 3c60 s LYS 106 Cb -0.13 -3.48 -0.02 0.00 -1.51 0.00 0.00 37.83 32.70 3c60 s LYS 106 CO -0.03 0.06 -0.03 -1.17 -0.36 0.00 0.00 175.35 173.82 3c60 s LEU 107 N 0.95 3.05 -0.28 5.43 2.96 0.16 0.10 118.68 131.05 3c60 s LEU 107 Ca 0.25 -0.29 0.01 0.00 -0.22 0.00 0.00 54.13 53.88 3c60 s LEU 107 Cb -0.15 -1.77 0.06 0.00 0.50 0.00 0.00 46.19 44.83 3c60 s LEU 107 CO 0.10 0.04 -0.06 -1.58 -1.32 0.00 0.00 176.35 173.53 3c60 s GLN 108 N 1.13 2.24 -0.49 1.98 2.00 -0.32 -1.76 119.66 124.45 3c60 s GLN 108 Ca 0.02 -1.37 -0.12 0.00 -2.00 0.00 0.00 55.36 51.89 3c60 s GLN 108 Cb -0.15 -3.02 0.12 0.00 0.80 0.00 0.00 33.01 30.76 3c60 s GLN 108 CO 0.00 -0.62 0.39 0.08 -0.50 0.00 0.00 175.29 174.64 3c60 s VAL 109 N 1.14 4.57 0.20 1.34 1.01 -1.26 -1.67 120.40 125.73 3c60 s VAL 109 Ca -0.06 -1.66 -0.30 0.00 0.00 0.00 0.00 61.98 59.97 3c60 s VAL 109 Cb -0.20 -3.96 -0.08 0.00 0.00 0.00 0.00 36.38 32.14 3c60 s VAL 109 CO -0.04 -0.79 1.14 0.68 0.00 0.00 0.00 175.10 176.09 3c60 s VAL 110 N 1.45 3.68 0.96 2.92 -7.23 -1.16 -4.47 120.40 116.54 3c60 s VAL 110 Ca 0.05 1.47 -0.12 0.00 -1.81 0.00 0.00 61.98 61.57 3c60 s VAL 110 Cb -0.27 -3.94 0.16 0.00 0.56 0.00 0.00 36.38 32.89 3c60 s VAL 110 CO 0.01 0.26 1.09 -2.84 -0.31 0.00 0.00 175.10 173.31 3c60 s PRO 111 N -0.52 0.76 -0.36 4.82 0.02 -1.26 -1.33 135.00 137.12 3c60 s PRO 111 Ca 0.50 0.81 -0.14 0.00 0.02 0.00 0.00 61.00 62.19 3c60 s PRO 111 Cb -0.31 -1.75 -0.00 0.00 0.02 0.00 0.00 34.50 32.45 3c60 s PRO 111 CO 0.37 -2.58 0.30 -0.80 -0.33 0.00 0.00 177.00 173.95 3c60 s ASN 112 N -3.25 6.11 -0.38 2.53 0.01 -1.26 -4.64 114.94 114.06 3c60 s ASN 112 Ca 0.65 -0.51 -0.29 0.00 -0.71 0.00 0.00 52.86 52.00 3c60 s ASN 112 Cb -0.19 -2.16 0.02 0.00 0.41 0.00 0.00 41.25 39.32 3c60 s ASN 112 CO 0.58 -0.34 1.23 -0.63 -1.51 0.00 0.00 177.10 176.43 3c60 s ILE 113 N 1.82 4.18 0.15 0.60 -1.09 -1.26 -4.91 121.20 120.69 3c60 s ILE 113 Ca 0.08 1.28 -0.12 0.00 -2.23 0.00 0.00 60.65 59.66 3c60 s ILE 113 Cb -0.18 -4.36 0.02 0.00 -1.58 0.00 0.00 42.46 36.36 3c60 s ILE 113 CO 0.11 -0.70 1.60 -0.61 -1.23 0.00 0.00 174.94 174.11 3c60 h GLN 114 N 9.32 0.87 -2.72 2.79 4.15 -1.96 -3.42 115.11 124.14 3c60 h GLN 114 Ca -0.24 -0.28 -0.45 0.00 0.77 0.00 0.00 58.65 58.45 3c60 h GLN 114 Cb 1.08 -0.08 -0.39 0.00 0.21 0.00 0.00 27.48 28.31 3c60 h GLN 114 CO 1.07 0.91 -0.73 0.54 -1.93 0.00 0.00 178.83 178.69 3c60 s ASN 115 N -6.37 2.63 1.03 -0.69 2.20 -1.26 -5.15 114.94 107.33 3c60 s ASN 115 Ca -0.12 -0.88 -0.15 0.00 -0.94 0.00 0.00 52.86 50.77 3c60 s ASN 115 Cb 0.12 -0.08 0.14 0.00 -2.00 0.00 0.00 41.25 39.43 3c60 s ASN 115 CO 0.82 -0.39 0.18 -2.65 -2.94 0.00 0.00 177.10 172.12 3c60 n PRO 116 N 5.28 -2.07 0.00 3.55 -0.02 -1.26 -5.00 135.00 135.48 3c60 n PRO 116 Ca -0.06 -0.61 0.00 0.00 -2.02 0.00 0.00 63.50 60.82 3c60 n PRO 116 Cb 0.46 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.44 3c60 n PRO 116 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 3c60 n ASP 117 N -1.16 0.00 -4.70 2.55 2.03 -1.17 -5.00 116.55 109.10 3c60 n ASP 117 Ca 0.05 0.00 -0.54 0.00 0.52 0.00 0.00 54.79 54.81 3c60 n ASP 117 Cb 0.42 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 40.76 3c60 n ASP 117 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 3c60 n PRO 118 N 0.00 1.51 -3.89 -0.67 -0.04 -1.26 -4.51 135.00 126.14 3c60 n PRO 118 Ca 0.00 0.55 -0.09 0.00 -0.04 0.00 0.00 63.50 63.92 3c60 n PRO 118 Cb 0.00 -2.29 -0.08 0.00 -0.04 0.00 0.00 33.50 31.09 3c60 n PRO 118 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3c60 s ALA 119 N 3.50 -0.17 -0.31 0.55 0.00 -1.17 0.36 121.76 124.52 3c60 s ALA 119 Ca 0.95 -0.54 -0.03 0.00 0.00 0.00 0.00 51.96 52.34 3c60 s ALA 119 Cb -0.93 0.35 0.11 0.00 0.00 0.00 0.00 23.12 22.65 3c60 s ALA 119 CO 0.60 -0.41 0.16 0.08 0.00 0.00 0.00 175.76 176.19 3c60 s VAL 120 N -3.17 -0.00 0.00 0.00 1.01 -0.99 -2.78 120.40 114.47 3c60 s VAL 120 Ca -0.00 -1.08 0.00 0.00 0.00 0.00 0.00 61.98 60.89 3c60 s VAL 120 Cb 0.02 -1.02 0.00 0.00 0.00 0.00 0.00 36.38 35.38 3c60 s VAL 120 CO -0.07 -0.82 0.01 -1.22 0.00 0.00 0.00 175.10 173.00 3c60 n TYR 121 N 4.84 -3.25 -4.14 5.22 4.01 -1.19 -4.45 117.16 118.19 3c60 n TYR 121 Ca 0.00 -0.01 -0.10 0.00 -0.16 0.00 0.00 57.90 57.63 3c60 n TYR 121 Cb 0.40 -0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.33 3c60 n TYR 121 CO 0.00 0.00 0.00 -1.14 -0.46 0.00 0.00 176.86 175.26 3c60 s GLN 122 N -2.27 0.76 -0.05 -0.72 0.74 -1.26 -2.34 119.66 114.52 3c60 s GLN 122 Ca 0.00 -1.27 -0.04 0.00 0.05 0.00 0.00 55.36 54.10 3c60 s GLN 122 Cb -0.00 -0.11 0.02 0.00 1.10 0.00 0.00 33.01 34.02 3c60 s GLN 122 CO 0.00 -0.04 0.14 -0.51 -0.55 0.00 0.00 175.29 174.33 3c60 s LEU 123 N -2.93 1.36 -0.16 3.68 1.02 0.10 -4.93 118.68 116.82 3c60 s LEU 123 Ca 0.09 0.28 -0.02 0.00 0.02 0.00 0.00 54.13 54.50 3c60 s LEU 123 Cb 0.05 0.45 -0.01 0.00 0.02 0.00 0.00 46.19 46.70 3c60 s LEU 123 CO -0.06 -0.06 -0.08 -0.13 0.02 0.00 0.00 176.35 176.03 3c60 s ARG 124 N 0.25 3.44 0.93 1.70 0.52 -1.26 -1.23 118.95 123.29 3c60 s ARG 124 Ca -0.01 -0.63 -0.11 0.00 -0.52 0.00 0.00 55.73 54.45 3c60 s ARG 124 Cb -0.03 -2.81 0.15 0.00 0.52 0.00 0.00 34.95 32.79 3c60 s ARG 124 CO -0.01 0.09 1.09 0.16 0.02 0.00 0.00 175.30 176.65 3c60 s ASP 125 N 0.72 3.08 0.00 0.23 3.84 -1.20 -4.92 116.67 118.42 3c60 s ASP 125 Ca -0.04 1.64 0.28 0.00 -0.00 0.00 0.00 52.55 54.43 3c60 s ASP 125 Cb -0.15 -2.29 1.08 0.00 -1.38 0.00 0.00 42.92 40.18 3c60 s ASP 125 CO 0.02 -2.91 1.81 -1.20 -0.00 0.00 0.00 175.17 172.89 3c60 n SER 126 N -4.07 0.14 0.00 2.11 7.64 -1.26 -4.11 113.62 114.07 3c60 n SER 126 Ca 0.07 0.25 0.00 0.00 1.01 0.00 0.00 58.87 60.21 3c60 n SER 126 Cb 0.54 -0.30 0.00 0.00 -1.01 0.00 0.00 64.21 63.45 3c60 n SER 126 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 3c60 n LYS 127 N -1.47 0.00 0.00 1.43 4.81 -1.26 -4.97 118.16 116.70 3c60 n LYS 127 Ca 0.07 0.17 0.00 0.00 -0.87 0.00 0.00 58.31 57.68 3c60 n LYS 127 Cb 0.33 -0.88 0.00 0.00 0.02 0.00 0.00 35.03 34.50 3c60 n LYS 127 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00 3c60 n SER 128 N -1.01 0.00 0.00 3.14 7.64 -1.26 -5.08 113.62 117.05 3c60 n SER 128 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 3c60 n SER 128 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 3c60 n SER 128 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 3c60 n SER 129 N 0.00 0.00 0.20 6.43 2.88 -1.26 -4.66 113.62 117.21 3c60 n SER 129 Ca 0.00 0.00 0.08 0.00 -1.33 0.00 0.00 58.87 57.62 3c60 n SER 129 Cb 0.00 0.00 0.25 0.00 -0.75 0.00 0.00 64.21 63.71 3c60 n SER 129 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 3c60 h ASP 130 N 0.00 0.00 -3.55 -3.46 5.19 -1.98 -3.42 116.42 109.20 3c60 h ASP 130 Ca 0.00 0.00 -0.62 0.00 -0.62 0.00 0.00 57.03 55.79 3c60 h ASP 130 Cb 0.00 0.00 -0.13 0.00 0.18 0.00 0.00 39.33 39.38 3c60 h ASP 130 CO 0.00 0.26 0.08 -0.75 -3.12 0.00 0.00 179.24 175.71 3c60 s LYS 131 N -3.30 3.91 0.24 3.56 2.47 -1.26 -5.04 119.74 120.31 3c60 s LYS 131 Ca 0.03 0.25 0.00 0.00 -1.56 0.00 0.00 55.97 54.70 3c60 s LYS 131 Cb 0.08 -3.72 -0.00 0.00 -1.46 0.00 0.00 37.83 32.73 3c60 s LYS 131 CO 0.68 -0.52 0.02 -1.13 0.16 0.00 0.00 175.35 174.55 3c60 n SER 132 N 5.78 2.31 -3.67 1.43 3.41 -1.26 -3.21 113.62 118.41 3c60 n SER 132 Ca -0.02 -2.10 -0.12 0.00 -0.26 0.00 0.00 58.87 56.38 3c60 n SER 132 Cb 0.49 0.26 -0.08 0.00 -0.26 0.00 0.00 64.21 64.61 3c60 n SER 132 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3c60 s VAL 133 N -2.00 -0.00 -0.18 -3.33 1.01 -0.37 -4.86 120.40 110.67 3c60 s VAL 133 Ca 0.02 0.02 -0.11 0.00 0.00 0.00 0.00 61.98 61.91 3c60 s VAL 133 Cb 0.00 -0.82 -0.05 0.00 0.00 0.00 0.00 36.38 35.51 3c60 s VAL 133 CO 0.02 0.01 0.18 0.00 0.00 0.00 0.00 175.10 175.30 3c60 s LEU 135 N 0.21 5.23 -0.82 0.00 2.96 -0.99 -2.59 118.68 122.68 3c60 s LEU 135 Ca 0.11 -2.24 -0.24 0.00 -0.22 0.00 0.00 54.13 51.54 3c60 s LEU 135 Cb -0.12 -1.83 0.06 0.00 0.50 0.00 0.00 46.19 44.80 3c60 s LEU 135 CO 0.01 -0.50 1.24 0.12 -1.32 0.00 0.00 176.35 175.90 3c60 s PHE 136 N 0.83 2.53 0.47 5.38 5.36 -0.98 -3.18 117.98 128.39 3c60 s PHE 136 Ca 0.10 -0.53 0.02 0.00 -0.96 0.00 0.00 56.93 55.57 3c60 s PHE 136 Cb -0.22 -4.54 -0.02 0.00 -0.34 0.00 0.00 43.02 37.90 3c60 s PHE 136 CO -0.04 -1.88 0.05 -0.08 -1.46 0.00 0.00 175.22 171.81 3c60 s THR 137 N 4.82 1.00 0.00 0.12 -1.32 -1.12 -1.65 115.64 117.49 3c60 s THR 137 Ca 0.35 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 58.83 3c60 s THR 137 Cb -0.07 -2.26 0.00 0.00 -1.51 0.00 0.00 72.50 68.65 3c60 s THR 137 CO 0.04 0.00 0.00 0.47 -2.21 0.00 0.00 174.62 172.92 3c60 n ASP 138 N -1.26 0.00 -4.72 8.08 9.92 -1.23 -3.03 116.55 124.30 3c60 n ASP 138 Ca -0.14 0.00 -0.39 0.00 -0.53 0.00 0.00 54.79 53.73 3c60 n ASP 138 Cb 0.66 -1.14 0.04 0.00 -0.64 0.00 0.00 41.12 40.04 3c60 n ASP 138 CO 0.00 0.00 0.00 2.22 0.13 0.00 0.00 177.20 179.55 3c60 n PHE 139 N -2.00 2.08 -1.64 1.24 1.16 -1.26 -3.05 117.46 113.98 3c60 n PHE 139 Ca 0.00 0.45 -0.35 0.00 -1.87 0.00 0.00 57.45 55.68 3c60 n PHE 139 Cb 0.00 -2.34 0.07 0.00 -1.61 0.00 0.00 39.48 35.60 3c60 n PHE 139 CO 0.00 0.00 0.00 0.16 -1.87 0.00 0.00 176.76 175.05 3c60 s ASP 140 N -0.85 4.54 -1.21 5.98 -4.77 -1.26 -4.41 116.67 114.70 3c60 s ASP 140 Ca 0.69 2.41 -0.20 0.00 -3.30 0.00 0.00 52.55 52.15 3c60 s ASP 140 Cb -0.44 -2.60 0.03 0.00 -1.09 0.00 0.00 42.92 38.82 3c60 s ASP 140 CO 0.51 -2.03 1.73 -0.44 0.70 0.00 0.00 175.17 175.65 3c60 s SER 141 N -1.81 6.35 0.00 2.11 0.01 -1.26 -3.18 113.70 115.91 3c60 s SER 141 Ca 0.77 -2.02 0.00 0.00 1.31 0.00 0.00 55.95 56.00 3c60 s SER 141 Cb -0.31 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.34 3c60 s SER 141 CO 0.41 -1.68 0.00 0.00 0.41 0.00 0.00 173.24 172.38 3c60 n GLN 142 N 8.49 0.00 -2.47 12.44 1.13 -1.26 -4.90 117.38 130.81 3c60 n GLN 142 Ca 0.45 0.00 -0.33 0.00 -1.94 0.00 0.00 57.00 55.17 3c60 n GLN 142 Cb 0.47 0.00 -0.03 0.00 0.11 0.00 0.00 30.24 30.79 3c60 n GLN 142 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 3c60 s THR 143 N 0.00 3.94 -0.27 5.09 -4.23 -1.19 -5.04 115.64 113.94 3c60 s THR 143 Ca 0.00 1.13 -0.06 0.00 -1.18 0.00 0.00 61.69 61.57 3c60 s THR 143 Cb 0.00 -3.48 -0.00 0.00 1.34 0.00 0.00 72.50 70.36 3c60 s THR 143 CO 0.00 -0.34 0.05 0.20 -0.54 0.00 0.00 174.62 174.00 3c60 s ASN 144 N -2.25 4.97 -0.64 3.99 0.01 -1.26 -5.06 114.94 114.71 3c60 s ASN 144 Ca 0.65 -0.55 -0.22 0.00 -0.71 0.00 0.00 52.86 52.03 3c60 s ASN 144 Cb -0.15 -1.86 0.07 0.00 0.41 0.00 0.00 41.25 39.72 3c60 s ASN 144 CO 0.23 -0.13 0.92 -0.69 -1.51 0.00 0.00 177.10 175.93 3c60 s VAL 145 N 1.52 4.40 0.88 1.60 1.01 -1.26 -4.19 120.40 124.36 3c60 s VAL 145 Ca 0.04 -0.37 -0.12 0.00 0.00 0.00 0.00 61.98 61.53 3c60 s VAL 145 Cb -0.16 -4.64 0.12 0.00 0.00 0.00 0.00 36.38 31.70 3c60 s VAL 145 CO 0.02 -1.37 1.13 -0.44 0.00 0.00 0.00 175.10 174.44 3c60 s SER 146 N 3.56 3.78 0.00 3.32 0.01 -1.26 -4.82 113.70 118.28 3c60 s SER 146 Ca 0.21 1.04 0.00 0.00 1.31 0.00 0.00 55.95 58.52 3c60 s SER 146 Cb -0.17 -1.65 0.00 0.00 0.21 0.00 0.00 66.02 64.40 3c60 s SER 146 CO 0.11 -2.39 0.00 0.00 0.41 0.00 0.00 173.24 171.36 3c60 n GLN 147 N -3.67 3.29 -3.85 12.44 1.13 -1.26 -4.94 117.38 120.51 3c60 n GLN 147 Ca 0.07 0.00 -0.36 0.00 -1.94 0.00 0.00 57.00 54.77 3c60 n GLN 147 Cb 0.59 0.00 -0.13 0.00 0.11 0.00 0.00 30.24 30.80 3c60 n GLN 147 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 3c60 s SER 148 N -1.00 4.94 0.55 1.08 0.15 -1.26 -4.91 113.70 113.25 3c60 s SER 148 Ca 0.00 -1.05 0.36 0.00 0.70 0.00 0.00 55.95 55.96 3c60 s SER 148 Cb 0.00 -1.78 1.64 0.00 -1.71 0.00 0.00 66.02 64.17 3c60 s SER 148 CO 0.00 -0.24 2.06 0.50 1.20 0.00 0.00 173.24 176.76 3c60 h LYS 149 N 8.11 0.00 0.00 5.44 3.11 -1.96 -3.38 116.57 127.89 3c60 h LYS 149 Ca -0.26 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.58 3c60 h LYS 149 Cb 1.09 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.32 3c60 h LYS 149 CO 0.57 0.00 0.00 -3.47 -2.81 0.00 0.00 179.45 173.74 3c60 n ASP 150 N -2.97 0.00 0.00 4.20 2.03 -1.26 -5.07 116.55 113.48 3c60 n ASP 150 Ca -0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 3c60 n ASP 150 Cb 0.22 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.62 3c60 n ASP 150 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 3c60 n SER 151 N 0.00 0.00 -0.01 1.67 2.88 -1.26 -4.94 113.62 111.95 3c60 n SER 151 Ca 0.00 0.00 0.15 0.00 -1.33 0.00 0.00 58.87 57.69 3c60 n SER 151 Cb 0.00 0.00 0.72 0.00 -0.75 0.00 0.00 64.21 64.18 3c60 n SER 151 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 3c60 n ASP 152 N 0.00 0.05 -4.80 -3.46 -0.08 -1.26 -4.79 116.55 102.22 3c60 n ASP 152 Ca 0.00 -0.11 -0.32 0.00 -1.51 0.00 0.00 54.79 52.84 3c60 n ASP 152 Cb 0.00 -0.28 -0.07 0.00 2.34 0.00 0.00 41.12 43.11 3c60 n ASP 152 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 3c60 s VAL 153 N -2.62 4.78 -0.06 5.18 1.01 -1.26 -4.20 120.40 123.23 3c60 s VAL 153 Ca 0.27 -0.46 0.04 0.00 0.00 0.00 0.00 61.98 61.83 3c60 s VAL 153 Cb 0.20 -3.22 0.00 0.00 0.00 0.00 0.00 36.38 33.36 3c60 s VAL 153 CO 0.47 0.29 -0.18 -0.31 0.00 0.00 0.00 175.10 175.38 3c60 s TYR 154 N -1.26 1.87 -0.04 5.22 2.02 -0.05 -4.71 117.35 120.41 3c60 s TYR 154 Ca 0.25 -0.63 0.00 0.00 -0.37 0.00 0.00 57.07 56.33 3c60 s TYR 154 Cb -0.12 -1.28 0.02 0.00 -0.40 0.00 0.00 41.96 40.19 3c60 s TYR 154 CO 0.17 -0.25 -0.02 0.42 -1.57 0.00 0.00 175.55 174.30 3c60 s ILE 155 N 0.23 0.35 0.27 2.71 1.01 -1.26 -1.06 121.20 123.46 3c60 s ILE 155 Ca -0.09 0.02 -0.11 0.00 0.00 0.00 0.00 60.65 60.47 3c60 s ILE 155 Cb -0.14 -0.44 -0.08 0.00 0.01 0.00 0.00 42.46 41.82 3c60 s ILE 155 CO 0.04 0.20 0.62 0.42 0.00 0.00 0.00 174.94 176.22 3c60 s THR 156 N 1.19 4.86 0.99 2.92 -4.23 -0.62 -4.84 115.64 115.92 3c60 s THR 156 Ca -0.07 0.59 -0.12 0.00 -1.18 0.00 0.00 61.69 60.91 3c60 s THR 156 Cb -0.14 -3.63 0.19 0.00 1.34 0.00 0.00 72.50 70.26 3c60 s THR 156 CO -0.02 -0.15 1.09 -1.81 -0.54 0.00 0.00 174.62 173.20 3c60 s ASP 157 N -2.43 2.64 0.83 3.99 1.01 -1.26 -4.48 116.67 116.97 3c60 s ASP 157 Ca 0.49 1.23 -0.16 0.00 0.71 0.00 0.00 52.55 54.82 3c60 s ASP 157 Cb -0.11 -1.90 -0.09 0.00 1.01 0.00 0.00 42.92 41.83 3c60 s ASP 157 CO 0.21 -3.13 -0.16 0.29 0.21 0.00 0.00 175.17 172.59 3c60 n LYS 158 N -4.18 0.01 -3.67 8.23 5.02 -1.26 -4.72 118.16 117.60 3c60 n LYS 158 Ca 0.05 0.02 -0.09 0.00 -2.02 0.00 0.00 58.31 56.27 3c60 n LYS 158 Cb 0.57 -1.34 -0.10 0.00 -0.02 0.00 0.00 35.03 34.14 3c60 n LYS 158 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3c60 s VAL 160 N 2.35 4.74 0.35 0.00 1.01 -1.26 -1.65 120.40 125.93 3c60 s VAL 160 Ca -0.03 0.04 -0.13 0.00 0.00 0.00 0.00 61.98 61.86 3c60 s VAL 160 Cb -0.11 -4.30 -0.08 0.00 0.00 0.00 0.00 36.38 31.89 3c60 s VAL 160 CO -0.12 -0.75 0.74 -0.22 0.00 0.00 0.00 175.10 174.74 3c60 s LEU 161 N 3.03 3.99 -0.20 3.92 1.98 -0.32 -4.94 118.68 126.15 3c60 s LEU 161 Ca 0.23 1.21 -0.04 0.00 -2.89 0.00 0.00 54.13 52.64 3c60 s LEU 161 Cb -0.15 -4.04 0.09 0.00 0.66 0.00 0.00 46.19 42.76 3c60 s LEU 161 CO 0.18 -0.26 0.25 -0.62 -1.89 0.00 0.00 176.35 174.00 3c60 s ASP 162 N -2.57 1.05 -1.03 3.68 -1.08 -1.26 -1.95 116.67 113.51 3c60 s ASP 162 Ca 0.53 -0.03 -0.18 0.00 -0.52 0.00 0.00 52.55 52.35 3c60 s ASP 162 Cb -0.10 0.53 0.13 0.00 -1.46 0.00 0.00 42.92 42.02 3c60 s ASP 162 CO 0.22 -0.31 1.27 -0.04 0.52 0.00 0.00 175.17 176.83 3c60 s MET 163 N 2.37 3.74 0.00 4.34 -1.94 0.07 -4.93 119.30 122.95 3c60 s MET 163 Ca 0.07 -1.90 0.00 0.00 -1.71 0.00 0.00 55.69 52.14 3c60 s MET 163 Cb -0.15 -5.04 0.00 0.00 2.01 0.00 0.00 34.83 31.65 3c60 s MET 163 CO -0.12 -1.85 0.65 -2.13 -0.01 0.00 0.00 175.02 171.57 3c60 n ARG 164 N 6.68 0.00 -0.51 2.03 0.63 -1.26 -1.08 116.66 123.15 3c60 n ARG 164 Ca 0.29 0.49 -0.13 0.00 -0.92 0.00 0.00 57.85 57.58 3c60 n ARG 164 Cb 0.48 -1.15 -0.03 0.00 0.45 0.00 0.00 32.46 32.21 3c60 n ARG 164 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 3c60 n SER 165 N -1.39 3.24 0.00 6.15 2.88 -1.26 -0.48 113.62 122.77 3c60 n SER 165 Ca 0.00 -2.15 0.00 0.00 -1.33 0.00 0.00 58.87 55.39 3c60 n SER 165 Cb 0.00 -0.84 0.00 0.00 -0.75 0.00 0.00 64.21 62.62 3c60 n SER 165 CO 0.00 0.00 0.00 0.80 -1.23 0.00 0.00 175.04 174.61 3c60 n MET 166 N 3.96 0.00 -3.06 -1.46 0.00 -1.03 -5.06 117.12 110.46 3c60 n MET 166 Ca 0.29 0.00 -0.09 0.00 0.00 0.00 0.00 57.70 57.90 3c60 n MET 166 Cb 0.18 0.00 0.01 0.00 0.00 0.00 0.00 33.22 33.40 3c60 n MET 166 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 175.97 172.50 3c60 n ASP 167 N 0.00 -7.46 -3.57 6.12 4.64 0.37 -5.04 116.55 111.61 3c60 n ASP 167 Ca 0.00 0.12 -0.00 0.00 -1.38 0.00 0.00 54.79 53.53 3c60 n ASP 167 Cb 0.00 -4.77 -0.04 0.00 -1.04 0.00 0.00 41.12 35.27 3c60 n ASP 167 CO 0.00 0.00 0.00 0.12 -0.82 0.00 0.00 177.20 176.50 3c60 s PHE 168 N -2.70 -1.18 -0.05 -0.67 5.36 -1.14 -5.01 117.98 112.58 3c60 s PHE 168 Ca 0.14 2.02 0.04 0.00 -0.96 0.00 0.00 56.93 58.17 3c60 s PHE 168 Cb -0.03 0.70 -0.03 0.00 -0.34 0.00 0.00 43.02 43.32 3c60 s PHE 168 CO 0.78 -0.59 -0.15 0.15 -1.46 0.00 0.00 175.22 173.96 3c60 s LYS 169 N 2.79 2.50 -0.21 10.12 1.02 -1.26 -0.75 119.74 133.94 3c60 s LYS 169 Ca -0.04 -0.70 -0.15 0.00 0.02 0.00 0.00 55.97 55.09 3c60 s LYS 169 Cb -0.11 -2.37 0.06 0.00 -0.52 0.00 0.00 37.83 34.90 3c60 s LYS 169 CO -0.19 0.62 0.54 -1.54 -0.92 0.00 0.00 175.35 173.86 3c60 s SER 170 N -0.72 -0.66 0.57 2.83 1.04 -0.82 -4.95 113.70 110.99 3c60 s SER 170 Ca 0.11 1.15 0.00 0.00 0.48 0.00 0.00 55.95 57.69 3c60 s SER 170 Cb -0.11 1.08 0.00 0.00 0.10 0.00 0.00 66.02 67.09 3c60 s SER 170 CO 0.00 -0.21 0.00 0.59 0.98 0.00 0.00 173.24 174.61 3c60 n ASN 171 N 3.69 -0.94 0.00 7.02 3.02 -1.26 -1.17 115.26 125.61 3c60 n ASN 171 Ca -0.19 -0.10 0.00 0.00 -0.03 0.00 0.00 54.58 54.27 3c60 n ASN 171 Cb 0.57 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.74 3c60 n ASN 171 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 3c60 n SER 172 N -1.70 0.00 0.00 6.41 3.41 -0.66 -3.53 113.62 117.55 3c60 n SER 172 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3c60 n SER 172 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 3c60 n SER 172 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3c60 n ALA 173 N -0.12 0.00 -1.99 7.33 0.00 -0.66 -2.63 120.51 122.43 3c60 n ALA 173 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.12 3c60 n ALA 173 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 3c60 n ALA 173 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3c60 s VAL 174 N 0.00 4.56 -0.03 0.00 1.01 -1.26 -2.33 120.40 122.35 3c60 s VAL 174 Ca 0.00 1.16 -0.12 0.00 0.00 0.00 0.00 61.98 63.02 3c60 s VAL 174 Cb 0.00 -3.62 0.02 0.00 0.00 0.00 0.00 36.38 32.78 3c60 s VAL 174 CO 0.00 -0.30 0.26 0.00 0.00 0.00 0.00 175.10 175.07 3c60 s ALA 175 N -2.13 -0.66 0.34 5.51 0.00 -1.07 -1.59 121.76 122.16 3c60 s ALA 175 Ca 0.57 0.33 -0.11 0.00 0.00 0.00 0.00 51.96 52.76 3c60 s ALA 175 Cb -0.10 -0.05 0.04 0.00 0.00 0.00 0.00 23.12 23.02 3c60 s ALA 175 CO 0.18 -0.22 0.64 -2.67 0.00 0.00 0.00 175.76 173.69 3c60 n TRP 176 N 1.71 -2.03 -3.64 0.00 2.14 -0.22 -2.87 117.44 112.52 3c60 n TRP 176 Ca -0.20 -1.72 -0.03 0.00 2.07 0.00 0.00 57.50 57.63 3c60 n TRP 176 Cb 0.56 0.75 -0.07 0.00 -0.81 0.00 0.00 31.31 31.75 3c60 n TRP 176 CO 0.00 0.00 0.00 0.45 2.07 0.00 0.00 177.69 180.21 3c60 s SER 177 N -2.83 -0.36 0.22 -0.67 0.15 -1.26 -0.87 113.70 108.08 3c60 s SER 177 Ca 0.16 0.60 0.23 0.00 0.70 0.00 0.00 55.95 57.64 3c60 s SER 177 Cb -0.04 1.01 0.93 0.00 -1.71 0.00 0.00 66.02 66.21 3c60 s SER 177 CO 0.12 -0.10 1.69 -0.46 1.20 0.00 0.00 173.24 175.69 3c60 n ASN 178 N 3.13 0.59 -4.67 5.45 0.23 -1.26 -4.70 115.26 114.04 3c60 n ASN 178 Ca -0.16 0.63 -0.42 0.00 -0.53 0.00 0.00 54.58 54.10 3c60 n ASN 178 Cb 0.57 -0.76 -0.03 0.00 -2.08 0.00 0.00 39.78 37.48 3c60 n ASN 178 CO 0.00 0.00 0.00 -0.75 -0.93 0.00 0.00 177.26 175.58 3c60 s LYS 179 N -3.25 4.16 0.17 -3.83 2.20 -1.26 -4.90 119.74 113.03 3c60 s LYS 179 Ca 0.05 2.48 -0.25 0.00 -0.36 0.00 0.00 55.97 57.90 3c60 s LYS 179 Cb 0.10 -3.99 0.05 0.00 -1.51 0.00 0.00 37.83 32.48 3c60 s LYS 179 CO 0.40 -0.89 1.57 1.03 -0.36 0.00 0.00 175.35 177.09 3c60 h SER 180 N 9.86 -1.48 -2.98 1.43 0.87 -2.01 -3.34 113.55 115.90 3c60 h SER 180 Ca -0.46 0.25 -0.60 0.00 -1.23 0.00 0.00 61.79 59.75 3c60 h SER 180 Cb 1.22 0.68 -0.12 0.00 -0.44 0.00 0.00 62.40 63.75 3c60 h SER 180 CO 0.94 -0.33 0.67 -0.62 -0.53 0.00 0.00 176.83 176.97 3c60 s ASP 181 N -5.18 6.29 -0.27 6.23 2.15 -1.26 -4.95 116.67 119.67 3c60 s ASP 181 Ca -0.14 -0.44 -0.02 0.00 0.43 0.00 0.00 52.55 52.38 3c60 s ASP 181 Cb 0.14 -2.46 0.16 0.00 -0.30 0.00 0.00 42.92 40.46 3c60 s ASP 181 CO 0.67 -1.38 0.49 0.12 -0.17 0.00 0.00 175.17 174.89 3c60 s PHE 182 N 4.32 -1.22 0.20 -5.34 2.19 -1.26 -5.13 117.98 111.74 3c60 s PHE 182 Ca 0.31 1.23 0.04 0.00 0.33 0.00 0.00 56.93 58.84 3c60 s PHE 182 Cb -0.12 0.27 -0.03 0.00 -1.31 0.00 0.00 43.02 41.83 3c60 s PHE 182 CO 0.17 -0.81 0.31 0.00 1.83 0.00 0.00 175.22 176.73 3c60 s ALA 183 N 2.70 3.91 -2.00 11.12 0.00 -1.26 -4.98 121.76 131.24 3c60 s ALA 183 Ca 0.16 -1.17 0.08 0.00 0.00 0.00 0.00 51.96 51.04 3c60 s ALA 183 Cb -0.15 -1.71 0.47 0.00 0.00 0.00 0.00 23.12 21.73 3c60 s ALA 183 CO -0.19 0.36 1.01 0.00 0.00 0.00 0.00 175.76 176.95 3c60 n ALA 185 N -0.69 3.35 0.09 0.00 0.00 -1.26 -4.17 120.51 117.82 3c60 n ALA 185 Ca 0.06 -0.65 0.01 0.00 0.00 0.00 0.00 53.44 52.87 3c60 n ALA 185 Cb 0.03 -0.80 -0.02 0.00 0.00 0.00 0.00 19.45 18.65 3c60 n ALA 185 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3c60 n ASN 186 N 0.22 1.72 -0.23 0.00 3.02 -1.01 -4.63 115.26 114.35 3c60 n ASN 186 Ca 0.10 -0.35 0.26 0.00 -0.03 0.00 0.00 54.58 54.56 3c60 n ASN 186 Cb 0.49 1.05 0.64 0.00 -0.61 0.00 0.00 39.78 41.36 3c60 n ASN 186 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3c60 h ALA 187 N 0.38 2.62 -1.39 5.41 0.00 -1.71 -2.82 119.26 121.74 3c60 h ALA 187 Ca 0.00 -0.01 -0.43 0.00 0.00 0.00 0.00 54.91 54.48 3c60 h ALA 187 Cb 0.10 0.04 -0.40 0.00 0.00 0.00 0.00 17.79 17.53 3c60 h ALA 187 CO 0.00 -0.91 -1.13 1.19 0.00 0.00 0.00 179.25 178.40 3c60 n PHE 188 N -4.37 1.25 0.36 0.00 3.01 -1.26 -4.95 117.46 111.49 3c60 n PHE 188 Ca 0.20 -3.17 -0.15 0.00 1.01 0.00 0.00 57.45 55.34 3c60 n PHE 188 Cb 0.91 -0.37 -0.08 0.00 -0.01 0.00 0.00 39.48 39.94 3c60 n PHE 188 CO 0.00 0.00 0.00 -0.91 1.01 0.00 0.00 176.76 176.86 3c60 h ASN 189 N 2.96 -0.79 -0.06 4.37 -0.26 -1.76 -3.03 115.58 117.01 3c60 h ASN 189 Ca 0.01 0.01 -0.01 0.00 -0.56 0.00 0.00 56.30 55.74 3c60 h ASN 189 Cb 1.06 0.20 -0.01 0.00 -1.06 0.00 0.00 38.32 38.52 3c60 h ASN 189 CO 0.55 -0.43 0.02 -0.46 -1.06 0.00 0.00 177.43 176.05 3c60 n ASN 190 N -5.41 1.95 -4.30 5.81 2.04 -1.26 -4.70 115.26 109.39 3c60 n ASN 190 Ca -0.12 -2.10 -0.39 0.00 -0.44 0.00 0.00 54.58 51.53 3c60 n ASN 190 Cb 0.38 -0.52 -0.12 0.00 -2.53 0.00 0.00 39.78 36.99 3c60 n ASN 190 CO 0.00 0.00 0.00 -0.44 -0.44 0.00 0.00 177.26 176.38 3c60 s SER 191 N 0.22 5.46 -0.87 0.53 0.01 -1.15 -4.82 113.70 113.10 3c60 s SER 191 Ca 0.05 -1.15 -0.26 0.00 1.31 0.00 0.00 55.95 55.90 3c60 s SER 191 Cb 0.04 -1.92 -0.13 0.00 0.21 0.00 0.00 66.02 64.21 3c60 s SER 191 CO 0.01 -0.37 2.26 -0.63 0.41 0.00 0.00 173.24 174.93 3c60 s ILE 192 N 1.44 3.12 0.24 1.44 1.09 -1.26 -4.90 121.20 122.37 3c60 s ILE 192 Ca -0.00 -0.12 0.09 0.00 -1.10 0.00 0.00 60.65 59.53 3c60 s ILE 192 Cb -0.20 -3.40 -0.04 0.00 -1.06 0.00 0.00 42.46 37.76 3c60 s ILE 192 CO 0.04 -0.24 -0.03 0.27 -0.10 0.00 0.00 174.94 174.87 3c60 s ILE 193 N 14.08 3.37 -0.29 2.92 -4.36 -1.26 -4.17 121.20 131.49 3c60 s ILE 193 Ca 0.86 -1.83 -0.42 0.00 -0.26 0.00 0.00 60.65 59.00 3c60 s ILE 193 Cb -0.10 -2.76 -0.18 0.00 1.25 0.00 0.00 42.46 40.67 3c60 s ILE 193 CO 0.08 -0.29 1.59 -2.65 0.24 0.00 0.00 174.94 173.91 3c60 n PRO 194 N -0.59 0.65 0.00 0.37 -0.02 -1.26 -4.78 135.00 129.37 3c60 n PRO 194 Ca -0.08 0.24 0.01 0.00 -2.02 0.00 0.00 63.50 61.65 3c60 n PRO 194 Cb 0.58 -1.84 0.06 0.00 -0.02 0.00 0.00 33.50 32.28 3c60 n PRO 194 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 3c60 n GLU 195 N 4.22 0.58 -1.23 -0.52 -0.00 -1.26 -2.40 120.64 120.03 3c60 n GLU 195 Ca 0.26 0.00 -0.10 0.00 -0.00 0.00 0.00 57.16 57.32 3c60 n GLU 195 Cb 0.07 -1.05 0.13 0.00 -0.00 0.00 0.00 31.44 30.58 3c60 n GLU 195 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 3c60 n ASP 196 N -0.55 3.43 -4.76 -1.84 4.64 -1.26 -5.04 116.55 111.17 3c60 n ASP 196 Ca 0.01 -3.82 -0.40 0.00 -1.38 0.00 0.00 54.79 49.21 3c60 n ASP 196 Cb 0.01 -0.51 -0.05 0.00 -1.04 0.00 0.00 41.12 39.52 3c60 n ASP 196 CO 0.00 0.00 0.00 -0.89 -0.82 0.00 0.00 177.20 175.49 3c60 s THR 197 N -3.85 4.61 -0.45 5.18 2.01 -1.01 -4.52 115.64 117.61 3c60 s THR 197 Ca 0.46 1.62 -0.28 0.00 0.31 0.00 0.00 61.69 63.80 3c60 s THR 197 Cb 0.40 -4.11 0.03 0.00 0.01 0.00 0.00 72.50 68.83 3c60 s THR 197 CO -0.01 0.43 1.06 0.12 -0.69 0.00 0.00 174.62 175.53 3c60 s PHE 198 N -0.49 2.89 -0.77 4.92 5.36 0.16 -4.91 117.98 125.13 3c60 s PHE 198 Ca 0.37 0.66 -0.08 0.00 -0.96 0.00 0.00 56.93 56.91 3c60 s PHE 198 Cb -0.21 -4.20 0.20 0.00 -0.34 0.00 0.00 43.02 38.47 3c60 s PHE 198 CO 0.24 -1.16 0.66 -0.06 -1.46 0.00 0.00 175.22 173.45 3c60 s PHE 199 N 4.13 3.66 0.95 10.12 0.40 -1.26 -2.34 117.98 133.64 3c60 s PHE 199 Ca 0.44 -2.40 -0.12 0.00 -0.60 0.00 0.00 56.93 54.25 3c60 s PHE 199 Cb -0.09 -3.54 0.16 0.00 0.51 0.00 0.00 43.02 40.07 3c60 s PHE 199 CO 0.28 -0.91 1.09 -1.25 0.70 0.00 0.00 175.22 175.13 3c60 s PRO 200 N -0.14 0.81 0.00 0.24 0.04 -1.26 -5.08 135.00 129.61 3c60 s PRO 200 Ca 0.19 0.85 0.00 0.00 0.04 0.00 0.00 61.00 62.08 3c60 s PRO 200 Cb -0.14 -1.76 0.00 0.00 0.04 0.00 0.00 34.50 32.65 3c60 s PRO 200 CO -0.07 -2.55 0.00 0.45 0.04 0.00 0.00 177.00 174.87