#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h1m s SER 4 N 0.00 4.50 0.12 -3.46 0.01 -1.26 -4.97 113.70 108.64 1h1m s SER 4 Ca 0.00 2.26 -0.14 0.00 1.31 0.00 0.00 55.95 59.38 1h1m s SER 4 Cb 0.00 -2.58 -0.05 0.00 0.21 0.00 0.00 66.02 63.61 1h1m s SER 4 CO 0.00 -2.05 1.50 0.25 0.41 0.00 0.00 173.24 173.34 1h1m h LEU 5 N -0.14 0.77 -9.45 2.44 5.85 -1.94 -3.42 115.31 109.42 1h1m h LEU 5 Ca -0.48 -0.40 -0.55 0.00 0.84 0.00 0.00 57.88 57.29 1h1m h LEU 5 Cb 1.28 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 42.05 1h1m h LEU 5 CO 0.51 1.00 0.12 -0.63 -0.34 0.00 0.00 178.44 179.10 1h1m s ILE 6 N -4.65 4.90 0.19 4.05 1.01 -1.26 -0.94 121.20 124.52 1h1m s ILE 6 Ca -0.12 1.54 0.07 0.00 0.00 0.00 0.00 60.65 62.13 1h1m s ILE 6 Cb 0.10 -4.08 -0.05 0.00 0.01 0.00 0.00 42.46 38.44 1h1m s ILE 6 CO 0.82 0.30 -0.13 0.68 0.00 0.00 0.00 174.94 176.62 1h1m s VAL 7 N 0.40 1.58 -0.04 2.92 -7.23 -0.19 -4.93 120.40 112.91 1h1m s VAL 7 Ca 0.38 -2.17 0.21 0.00 -1.81 0.00 0.00 61.98 58.60 1h1m s VAL 7 Cb -0.19 -2.02 -0.33 0.00 0.56 0.00 0.00 36.38 34.40 1h1m s VAL 7 CO 0.21 -0.62 0.44 -0.62 -0.31 0.00 0.00 175.10 174.20 1h1m n GLU 8 N -0.34 0.66 -4.12 4.82 -0.58 -1.26 -4.40 120.64 115.42 1h1m n GLU 8 Ca -0.08 -0.18 -0.15 0.00 -0.42 0.00 0.00 57.16 56.32 1h1m n GLU 8 Cb 0.61 -1.51 -0.12 0.00 -0.57 0.00 0.00 31.44 29.84 1h1m n GLU 8 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1h1m s ASP 9 N -4.57 1.20 0.43 1.62 1.01 -1.26 -0.95 116.67 114.15 1h1m s ASP 9 Ca -0.08 -0.56 -0.26 0.00 0.71 0.00 0.00 52.55 52.36 1h1m s ASP 9 Cb 0.13 -0.01 -0.09 0.00 1.01 0.00 0.00 42.92 43.97 1h1m s ASP 9 CO 0.89 -0.14 1.45 0.00 0.21 0.00 0.00 175.17 177.59 1h1m s ALA 10 N -1.27 3.33 0.95 5.23 0.00 -1.26 -4.94 121.76 123.79 1h1m s ALA 10 Ca -0.06 1.51 -0.11 0.00 0.00 0.00 0.00 51.96 53.30 1h1m s ALA 10 Cb -0.10 -3.60 0.16 0.00 0.00 0.00 0.00 23.12 19.59 1h1m s ALA 10 CO 0.01 -1.17 1.12 -2.14 0.00 0.00 0.00 175.76 173.58 1h1m s PRO 11 N -2.36 0.75 -0.04 0.00 0.02 -1.26 -4.91 135.00 127.20 1h1m s PRO 11 Ca 0.59 1.37 0.10 0.00 0.02 0.00 0.00 61.00 63.08 1h1m s PRO 11 Cb -0.45 -1.71 0.34 0.00 0.02 0.00 0.00 34.50 32.70 1h1m s PRO 11 CO 0.59 -2.75 1.21 -0.40 -0.33 0.00 0.00 177.00 175.31 1h1m n ASP 12 N -4.30 2.34 -3.75 2.53 5.68 -1.26 -3.59 116.55 114.20 1h1m n ASP 12 Ca 0.10 -2.14 -0.06 0.00 -0.50 0.00 0.00 54.79 52.19 1h1m n ASP 12 Cb 0.53 -0.35 -0.01 0.00 -1.14 0.00 0.00 41.12 40.14 1h1m n ASP 12 CO 0.00 0.00 0.00 -1.38 -1.33 0.00 0.00 177.20 174.49 1h1m s HIS 13 N -1.63 -0.14 -0.17 2.11 -3.43 -1.25 -4.78 115.29 106.00 1h1m s HIS 13 Ca 0.25 -0.27 -0.29 0.00 -0.80 0.00 0.00 55.06 53.94 1h1m s HIS 13 Cb 0.15 0.69 -0.00 0.00 -1.43 0.00 0.00 32.58 31.99 1h1m s HIS 13 CO 0.14 -1.10 1.02 0.08 -2.00 0.00 0.00 174.74 172.88 1h1m s VAL 14 N -3.54 4.73 0.15 -5.38 1.01 -1.25 -4.51 120.40 111.61 1h1m s VAL 14 Ca 0.12 2.03 -0.23 0.00 0.00 0.00 0.00 61.98 63.90 1h1m s VAL 14 Cb -0.04 -4.31 0.07 0.00 0.00 0.00 0.00 36.38 32.10 1h1m s VAL 14 CO 0.05 -0.09 0.63 0.00 0.00 0.00 0.00 175.10 175.69 1h1m s ARG 15 N 2.65 1.26 0.43 2.72 1.70 -1.26 -5.05 118.95 121.39 1h1m s ARG 15 Ca 0.46 -0.47 -0.25 0.00 -0.47 0.00 0.00 55.73 55.00 1h1m s ARG 15 Cb -0.16 0.57 -0.08 0.00 -0.57 0.00 0.00 34.95 34.71 1h1m s ARG 15 CO 0.11 -0.55 1.26 -2.14 -1.08 0.00 0.00 175.30 172.90 1h1m s PRO 16 N -3.70 3.84 0.08 3.89 0.02 -1.26 -4.59 135.00 133.29 1h1m s PRO 16 Ca 0.02 2.03 -0.26 0.00 0.02 0.00 0.00 61.00 62.81 1h1m s PRO 16 Cb -0.01 -2.61 0.08 0.00 0.02 0.00 0.00 34.50 31.98 1h1m s PRO 16 CO -0.12 -0.56 0.80 1.52 -0.33 0.00 0.00 177.00 178.31 1h1m s TYR 17 N -1.35 -0.37 -0.03 6.54 1.13 -0.94 -4.88 117.35 117.45 1h1m s TYR 17 Ca 0.60 0.17 0.06 0.00 -1.41 0.00 0.00 57.07 56.49 1h1m s TYR 17 Cb -0.35 0.57 -0.01 0.00 -1.10 0.00 0.00 41.96 41.07 1h1m s TYR 17 CO 0.44 -0.72 -0.21 0.08 -2.51 0.00 0.00 175.55 172.63 1h1m s VAL 18 N -3.39 1.68 -0.08 -3.49 1.01 -0.11 -0.29 120.40 115.73 1h1m s VAL 18 Ca 0.05 -0.88 0.00 0.00 0.00 0.00 0.00 61.98 61.15 1h1m s VAL 18 Cb -0.01 -1.41 0.02 0.00 0.00 0.00 0.00 36.38 34.98 1h1m s VAL 18 CO -0.08 0.48 -0.06 -0.51 0.00 0.00 0.00 175.10 174.93 1h1m s ILE 19 N -0.28 0.76 0.43 2.22 2.07 -0.19 -1.02 121.20 125.19 1h1m s ILE 19 Ca 0.03 -0.18 -0.23 0.00 -1.41 0.00 0.00 60.65 58.85 1h1m s ILE 19 Cb -0.10 -0.79 -0.08 0.00 0.13 0.00 0.00 42.46 41.61 1h1m s ILE 19 CO 0.01 0.30 1.10 -0.13 -1.91 0.00 0.00 174.94 174.31 1h1m s ARG 20 N 1.36 3.96 0.10 3.50 1.81 -1.26 -0.72 118.95 127.70 1h1m s ARG 20 Ca -0.03 1.61 -0.35 0.00 -1.72 0.00 0.00 55.73 55.24 1h1m s ARG 20 Cb -0.14 -2.44 -0.18 0.00 -0.45 0.00 0.00 34.95 31.74 1h1m s ARG 20 CO -0.03 -0.34 0.97 1.58 -0.68 0.00 0.00 175.30 176.80 1h1m n HIS 21 N -0.33 0.57 -1.29 -0.53 -0.00 -1.24 -1.63 115.22 110.77 1h1m n HIS 21 Ca 0.06 0.91 -0.10 0.00 0.46 0.00 0.00 57.72 59.05 1h1m n HIS 21 Cb 0.49 -2.12 -0.04 0.00 -0.12 0.00 0.00 29.99 28.20 1h1m n HIS 21 CO 0.00 0.00 0.00 0.66 0.46 0.00 0.00 176.34 177.46 1h1m n TYR 22 N 1.16 0.00 -0.88 1.57 4.01 -1.26 -4.98 117.16 116.78 1h1m n TYR 22 Ca 0.18 0.00 -0.33 0.00 -0.16 0.00 0.00 57.90 57.59 1h1m n TYR 22 Cb 0.17 -2.51 0.12 0.00 -0.31 0.00 0.00 39.34 36.82 1h1m n TYR 22 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 1h1m n SER 23 N -0.92 -1.34 -0.20 7.72 7.64 -0.65 -4.79 113.62 121.09 1h1m n SER 23 Ca -0.10 0.41 -0.08 0.00 1.01 0.00 0.00 58.87 60.10 1h1m n SER 23 Cb 0.53 -1.27 -0.03 0.00 -1.01 0.00 0.00 64.21 62.42 1h1m n SER 23 CO 0.00 0.00 0.00 -0.74 -3.01 0.00 0.00 175.04 171.29 1h1m h HIS 24 N -1.37 -1.23 -6.57 1.43 2.76 -1.89 -3.46 115.15 104.82 1h1m h HIS 24 Ca -0.44 0.08 -0.52 0.00 -2.20 0.00 0.00 60.37 57.29 1h1m h HIS 24 Cb 1.29 0.62 -0.09 0.00 1.55 0.00 0.00 27.41 30.78 1h1m h HIS 24 CO 0.40 -0.42 -0.87 0.00 -1.30 0.00 0.00 177.93 175.74 1h1m n ALA 25 N -3.14 -1.81 -3.82 5.26 0.00 -0.13 -1.04 120.51 115.82 1h1m n ALA 25 Ca 0.02 -0.20 -0.27 0.00 0.00 0.00 0.00 53.44 52.99 1h1m n ALA 25 Cb 0.35 -2.02 0.03 0.00 0.00 0.00 0.00 19.45 17.81 1h1m n ALA 25 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1h1m n ARG 26 N -4.42 -5.40 -1.69 0.00 1.74 -1.26 -0.38 116.66 105.26 1h1m n ARG 26 Ca -0.21 0.61 -0.41 0.00 -0.77 0.00 0.00 57.85 57.07 1h1m n ARG 26 Cb 0.64 -5.38 0.01 0.00 -1.02 0.00 0.00 32.46 26.70 1h1m n ARG 26 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1h1m n ALA 27 N -4.55 1.14 -2.49 7.54 0.00 -0.21 -4.70 120.51 117.24 1h1m n ALA 27 Ca -0.09 0.28 -0.09 0.00 0.00 0.00 0.00 53.44 53.53 1h1m n ALA 27 Cb 0.58 -2.24 -0.11 0.00 0.00 0.00 0.00 19.45 17.69 1h1m n ALA 27 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1h1m s VAL 28 N -1.19 0.34 0.11 0.00 -7.23 -1.03 -1.72 120.40 109.69 1h1m s VAL 28 Ca 0.60 -1.46 0.05 0.00 -1.81 0.00 0.00 61.98 59.37 1h1m s VAL 28 Cb -0.53 -1.05 -0.04 0.00 0.56 0.00 0.00 36.38 35.33 1h1m s VAL 28 CO 0.58 -0.73 0.01 0.42 -0.31 0.00 0.00 175.10 175.08 1h1m s THR 29 N -2.74 4.00 -0.27 5.32 -4.23 0.03 -1.34 115.64 116.40 1h1m s THR 29 Ca -0.01 -1.08 0.01 0.00 -1.18 0.00 0.00 61.69 59.43 1h1m s THR 29 Cb -0.01 -2.94 0.08 0.00 1.34 0.00 0.00 72.50 70.98 1h1m s THR 29 CO -0.05 0.06 0.02 -0.69 -0.54 0.00 0.00 174.62 173.42 1h1m s VAL 30 N -1.42 1.39 0.00 2.29 1.01 -0.12 -0.22 120.40 123.33 1h1m s VAL 30 Ca 0.26 -1.43 0.00 0.00 0.00 0.00 0.00 61.98 60.82 1h1m s VAL 30 Cb -0.11 -1.86 0.00 0.00 0.00 0.00 0.00 36.38 34.41 1h1m s VAL 30 CO 0.19 -0.37 0.00 0.47 0.00 0.00 0.00 175.10 175.38 1h1m n ASP 31 N 4.68 0.00 -0.03 3.32 8.00 -1.26 -1.55 116.55 129.71 1h1m n ASP 31 Ca -0.06 0.00 0.14 0.00 0.71 0.00 0.00 54.79 55.58 1h1m n ASP 31 Cb 0.43 0.00 0.58 0.00 -0.02 0.00 0.00 41.12 42.12 1h1m n ASP 31 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1h1m n THR 32 N 0.00 0.00 -3.43 -3.53 -2.24 -1.26 -4.87 114.28 98.95 1h1m n THR 32 Ca 0.00 -0.01 -0.38 0.00 -2.27 0.00 0.00 64.05 61.38 1h1m n THR 32 Cb 0.00 -0.28 -0.06 0.00 -2.10 0.00 0.00 70.33 67.89 1h1m n THR 32 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1h1m s GLN 33 N -2.78 4.01 -0.14 -0.78 -0.21 -0.59 -4.51 119.66 114.65 1h1m s GLN 33 Ca 0.20 0.51 0.02 0.00 0.02 0.00 0.00 55.36 56.11 1h1m s GLN 33 Cb 0.19 -3.23 0.01 0.00 1.00 0.00 0.00 33.01 30.98 1h1m s GLN 33 CO 0.53 0.66 -0.20 -1.17 -2.12 0.00 0.00 175.29 172.99 1h1m s LEU 34 N -1.03 2.03 -0.10 2.90 0.20 -0.02 -0.95 118.68 121.70 1h1m s LEU 34 Ca 0.25 -0.58 -0.04 0.00 0.69 0.00 0.00 54.13 54.45 1h1m s LEU 34 Cb -0.17 -1.38 -0.04 0.00 -0.43 0.00 0.00 46.19 44.17 1h1m s LEU 34 CO 0.15 0.05 0.07 -0.31 -0.29 0.00 0.00 176.35 176.01 1h1m s TYR 35 N 0.98 3.36 -0.01 5.38 1.51 -0.45 -0.39 117.35 127.72 1h1m s TYR 35 Ca -0.04 0.34 0.02 0.00 -1.01 0.00 0.00 57.07 56.39 1h1m s TYR 35 Cb -0.15 -1.86 -0.00 0.00 -0.11 0.00 0.00 41.96 39.84 1h1m s TYR 35 CO -0.05 0.58 -0.08 1.03 -1.11 0.00 0.00 175.55 175.92 1h1m s ARG 36 N -0.91 0.72 -0.62 -0.62 0.52 0.33 -2.46 118.95 115.90 1h1m s ARG 36 Ca 0.14 -0.29 -0.04 0.00 -0.52 0.00 0.00 55.73 55.02 1h1m s ARG 36 Cb -0.12 -0.69 0.16 0.00 0.52 0.00 0.00 34.95 34.82 1h1m s ARG 36 CO 0.03 0.15 0.45 -0.06 0.02 0.00 0.00 175.30 175.90 1h1m s PHE 37 N -0.08 3.46 0.07 -0.53 0.08 0.49 -0.96 117.98 120.51 1h1m s PHE 37 Ca 0.01 -2.58 -0.10 0.00 0.12 0.00 0.00 56.93 54.38 1h1m s PHE 37 Cb -0.05 -3.28 -0.26 0.00 -0.57 0.00 0.00 43.02 38.86 1h1m s PHE 37 CO -0.00 -0.87 1.14 1.88 -0.10 0.00 0.00 175.22 177.26 1h1m h TYR 38 N 7.25 0.81 -3.67 0.36 0.05 -1.61 -3.39 116.97 116.76 1h1m h TYR 38 Ca -0.02 -0.52 -0.54 0.00 0.05 0.00 0.00 58.73 57.69 1h1m h TYR 38 Cb 0.97 -0.06 -0.32 0.00 1.01 0.00 0.00 36.73 38.33 1h1m h TYR 38 CO 0.73 1.38 -0.83 0.08 -1.05 0.00 0.00 178.16 178.47 1h1m s VAL 39 N -2.90 1.32 0.45 -2.88 1.01 -0.52 -4.60 120.40 112.28 1h1m s VAL 39 Ca -0.07 -0.62 0.03 0.00 0.00 0.00 0.00 61.98 61.32 1h1m s VAL 39 Cb 0.06 -1.16 -0.03 0.00 0.00 0.00 0.00 36.38 35.25 1h1m s VAL 39 CO 0.91 0.39 0.03 0.42 0.00 0.00 0.00 175.10 176.85 1h1m s THR 40 N 0.31 1.26 0.07 3.92 -4.23 -1.26 -1.61 115.64 114.10 1h1m s THR 40 Ca -0.09 -2.00 -0.29 0.00 -1.18 0.00 0.00 61.69 58.13 1h1m s THR 40 Cb -0.13 -2.44 -0.13 0.00 1.34 0.00 0.00 72.50 71.13 1h1m s THR 40 CO 0.03 0.00 1.45 1.23 -0.54 0.00 0.00 174.62 176.79 1h1m h GLY 41 N 1.59 -1.17 0.16 3.99 0.00 -1.85 -1.81 103.07 103.99 1h1m h GLY 41 Ca -0.42 0.57 0.19 0.00 0.00 0.00 0.00 47.33 47.67 1h1m h GLY 41 CO 0.72 -0.33 0.61 -2.55 0.00 0.00 0.00 176.54 174.99 1h1m h PRO 42 N -0.73 0.72 0.00 4.80 0.11 -1.91 0.13 132.00 135.12 1h1m h PRO 42 Ca -0.03 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 65.99 1h1m h PRO 42 Cb 0.67 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.61 1h1m h PRO 42 CO -0.12 0.48 -0.22 0.66 -0.21 0.00 0.00 178.00 178.58 1h1m h SER 43 N 0.75 0.00 -0.37 -2.05 4.64 -1.57 -3.11 113.55 111.84 1h1m h SER 43 Ca 0.57 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.89 1h1m h SER 43 Cb 0.91 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.00 1h1m h SER 43 CO -0.36 0.22 0.00 -1.54 -0.87 0.00 0.00 176.83 174.29 1h1m n SER 44 N -3.23 2.99 -3.57 4.97 3.41 -0.69 -4.19 113.62 113.31 1h1m n SER 44 Ca 0.02 -1.95 -0.26 0.00 -0.26 0.00 0.00 58.87 56.42 1h1m n SER 44 Cb 0.53 -0.24 0.02 0.00 -0.26 0.00 0.00 64.21 64.26 1h1m n SER 44 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1h1m n GLY 45 N 0.72 -0.50 1.99 5.00 0.00 -0.33 -2.74 105.19 109.33 1h1m n GLY 45 Ca 0.13 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.31 1h1m n GLY 45 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1h1m n TYR 46 N -4.45 0.00 -0.01 1.61 4.01 0.30 -4.92 117.16 113.69 1h1m n TYR 46 Ca -0.00 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.57 1h1m n TYR 46 Cb 0.55 -0.27 -0.10 0.00 -0.31 0.00 0.00 39.34 39.21 1h1m n TYR 46 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1h1m h ALA 47 N 0.00 0.11 -2.27 -0.72 0.00 -1.76 0.11 119.26 114.73 1h1m h ALA 47 Ca 0.00 -0.52 0.15 0.00 0.00 0.00 0.00 54.91 54.54 1h1m h ALA 47 Cb 0.00 0.01 -0.12 0.00 0.00 0.00 0.00 17.79 17.69 1h1m h ALA 47 CO 0.00 0.31 0.51 -0.59 0.00 0.00 0.00 179.25 179.47 1h1m s PHE 48 N -3.39 -0.23 0.00 0.00 -0.12 -1.26 -3.33 117.98 109.65 1h1m s PHE 48 Ca -0.13 0.01 0.06 0.00 -0.05 0.00 0.00 56.93 56.81 1h1m s PHE 48 Cb 0.04 0.59 -0.03 0.00 -0.63 0.00 0.00 43.02 42.99 1h1m s PHE 48 CO 0.81 -0.67 -0.16 0.99 -0.05 0.00 0.00 175.22 176.14 1h1m s THR 49 N -3.16 2.91 -0.16 -4.49 2.01 0.12 -4.25 115.64 108.62 1h1m s THR 49 Ca 0.09 -0.98 -0.00 0.00 0.31 0.00 0.00 61.69 61.10 1h1m s THR 49 Cb -0.01 -2.19 0.04 0.00 0.01 0.00 0.00 72.50 70.35 1h1m s THR 49 CO -0.03 0.45 -0.07 -0.22 -0.69 0.00 0.00 174.62 174.06 1h1m s LEU 50 N -1.14 1.62 0.12 4.42 0.20 -0.63 -1.21 118.68 122.05 1h1m s LEU 50 Ca 0.13 -0.62 0.04 0.00 0.69 0.00 0.00 54.13 54.38 1h1m s LEU 50 Cb -0.11 -0.95 -0.04 0.00 -0.43 0.00 0.00 46.19 44.67 1h1m s LEU 50 CO 0.03 -0.16 -0.11 0.00 -0.29 0.00 0.00 176.35 175.82 1h1m s MET 51 N 1.61 0.96 -0.02 1.98 0.23 0.23 -1.44 119.30 122.85 1h1m s MET 51 Ca 0.01 -1.28 0.08 0.00 -1.03 0.00 0.00 55.69 53.47 1h1m s MET 51 Cb -0.15 -0.64 -0.02 0.00 -1.53 0.00 0.00 34.83 32.49 1h1m s MET 51 CO -0.08 0.10 -0.26 0.20 -2.03 0.00 0.00 175.02 172.95 1h1m s GLY 52 N -2.70 1.28 -0.12 3.16 0.00 -0.14 -0.22 107.32 108.58 1h1m s GLY 52 Ca 0.10 -1.11 0.02 0.00 0.00 0.00 0.00 44.72 43.73 1h1m s GLY 52 CO 0.01 -0.90 -0.18 -1.59 0.00 0.00 0.00 173.10 170.44 1h1m s THR 53 N -0.56 1.75 -0.03 0.90 2.01 0.47 -0.52 115.64 119.66 1h1m s THR 53 Ca 0.09 -0.80 0.03 0.00 0.31 0.00 0.00 61.69 61.32 1h1m s THR 53 Cb -0.10 -1.57 -0.03 0.00 0.01 0.00 0.00 72.50 70.81 1h1m s THR 53 CO -0.00 0.49 -0.09 0.20 -0.69 0.00 0.00 174.62 174.52 1h1m s ASN 54 N 0.88 4.43 -0.04 3.53 -0.87 0.47 -1.35 114.94 122.00 1h1m s ASN 54 Ca -0.07 -0.14 -0.29 0.00 -1.57 0.00 0.00 52.86 50.79 1h1m s ASN 54 Cb -0.15 -1.02 0.09 0.00 -0.02 0.00 0.00 41.25 40.15 1h1m s ASN 54 CO -0.01 0.32 0.79 0.00 -2.57 0.00 0.00 177.10 175.63 1h1m s ALA 55 N -0.87 -1.79 0.73 0.60 0.00 -0.99 -0.85 121.76 118.60 1h1m s ALA 55 Ca 0.14 1.19 -0.08 0.00 0.00 0.00 0.00 51.96 53.22 1h1m s ALA 55 Cb -0.11 0.04 0.07 0.00 0.00 0.00 0.00 23.12 23.12 1h1m s ALA 55 CO 0.04 -0.48 1.06 -1.25 0.00 0.00 0.00 175.76 175.12 1h1m s PRO 56 N -1.96 2.08 0.30 0.00 0.04 -1.26 -3.07 135.00 131.12 1h1m s PRO 56 Ca -0.04 -0.22 -0.28 0.00 0.04 0.00 0.00 61.00 60.51 1h1m s PRO 56 Cb -0.00 -2.12 -0.14 0.00 0.04 0.00 0.00 34.50 32.28 1h1m s PRO 56 CO 0.00 -1.36 1.08 1.58 0.04 0.00 0.00 177.00 178.35 1h1m n HIS 57 N -3.03 1.53 -4.22 0.56 -0.00 -1.21 -4.77 115.22 104.08 1h1m n HIS 57 Ca 0.08 0.67 -0.17 0.00 -0.00 0.00 0.00 57.72 58.30 1h1m n HIS 57 Cb 0.61 -2.29 -0.13 0.00 -0.00 0.00 0.00 29.99 28.17 1h1m n HIS 57 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1h1m s SER 58 N -0.49 1.05 0.00 0.26 0.15 -0.82 -5.01 113.70 108.84 1h1m s SER 58 Ca 0.58 -0.34 0.30 0.00 0.70 0.00 0.00 55.95 57.19 1h1m s SER 58 Cb -0.67 -0.06 1.41 0.00 -1.71 0.00 0.00 66.02 65.00 1h1m s SER 58 CO 0.60 -0.01 1.98 0.47 1.20 0.00 0.00 173.24 177.48 1h1m n ASP 59 N 2.22 0.16 -4.69 5.45 8.00 -1.26 -4.67 116.55 121.76 1h1m n ASP 59 Ca -0.17 -0.30 -0.24 0.00 0.71 0.00 0.00 54.79 54.79 1h1m n ASP 59 Cb 0.56 -0.20 -0.08 0.00 -0.02 0.00 0.00 41.12 41.38 1h1m n ASP 59 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1h1m s ALA 60 N -2.54 3.40 0.74 2.24 0.00 -1.26 -5.07 121.76 119.27 1h1m s ALA 60 Ca 0.29 -1.99 -0.15 0.00 0.00 0.00 0.00 51.96 50.10 1h1m s ALA 60 Cb 0.20 -0.44 0.04 0.00 0.00 0.00 0.00 23.12 22.92 1h1m s ALA 60 CO 0.47 -0.02 1.22 1.28 0.00 0.00 0.00 175.76 178.70 1h1m n LEU 61 N -1.09 4.98 -0.06 0.00 4.77 -1.26 -4.65 117.00 119.68 1h1m n LEU 61 Ca -0.03 0.69 0.13 0.00 -0.03 0.00 0.00 56.01 56.77 1h1m n LEU 61 Cb 0.63 -1.52 0.43 0.00 -2.33 0.00 0.00 43.42 40.63 1h1m n LEU 61 CO 0.44 -1.45 0.69 0.61 -1.33 0.00 0.00 177.39 176.35 1h1m n GLY 62 N 0.74 -1.15 3.58 -0.72 0.00 0.18 -1.79 105.19 106.04 1h1m n GLY 62 Ca 0.14 -0.28 -0.09 0.00 0.00 0.00 0.00 46.02 45.79 1h1m n GLY 62 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h1m s VAL 63 N -2.81 0.00 0.64 1.61 0.11 -1.23 -4.38 120.40 114.34 1h1m s VAL 63 Ca 0.18 0.00 -0.16 0.00 -2.93 0.00 0.00 61.98 59.07 1h1m s VAL 63 Cb 0.19 -1.00 -0.01 0.00 -1.53 0.00 0.00 36.38 34.03 1h1m s VAL 63 CO 0.58 0.00 1.12 -0.76 -3.33 0.00 0.00 175.10 172.72 1h1m s LEU 64 N -1.12 3.45 0.46 2.54 1.43 -1.26 -4.58 118.68 119.60 1h1m s LEU 64 Ca -0.00 2.07 -0.25 0.00 -1.03 0.00 0.00 54.13 54.92 1h1m s LEU 64 Cb -0.01 -4.56 -0.08 0.00 0.03 0.00 0.00 46.19 41.58 1h1m s LEU 64 CO 0.00 -1.62 1.37 -2.84 0.23 0.00 0.00 176.35 173.50 1h1m s PRO 65 N -3.93 3.66 0.29 1.29 0.02 -1.26 -4.83 135.00 130.24 1h1m s PRO 65 Ca 0.69 2.29 -0.20 0.00 0.02 0.00 0.00 61.00 63.79 1h1m s PRO 65 Cb -0.22 -2.60 0.04 0.00 0.02 0.00 0.00 34.50 31.74 1h1m s PRO 65 CO 0.39 -0.79 0.78 -3.38 -0.33 0.00 0.00 177.00 173.67 1h1m s HIS 66 N -1.25 -0.09 0.13 6.54 -3.43 -0.92 -1.85 115.29 114.42 1h1m s HIS 66 Ca 0.62 -0.42 0.02 0.00 -0.80 0.00 0.00 55.06 54.48 1h1m s HIS 66 Cb -0.41 0.74 -0.04 0.00 -1.43 0.00 0.00 32.58 31.44 1h1m s HIS 66 CO 0.52 -1.28 -0.05 0.96 -2.00 0.00 0.00 174.74 172.88 1h1m s ILE 67 N -3.33 0.80 -0.12 -5.38 -4.36 -0.07 -1.44 121.20 107.30 1h1m s ILE 67 Ca 0.13 -1.98 0.03 0.00 -0.26 0.00 0.00 60.65 58.57 1h1m s ILE 67 Cb -0.05 -1.85 0.01 0.00 1.25 0.00 0.00 42.46 41.82 1h1m s ILE 67 CO 0.08 -0.73 -0.19 -1.00 0.24 0.00 0.00 174.94 173.34 1h1m s HIS 68 N -3.57 2.33 -0.30 1.37 3.76 -1.26 -0.97 115.29 116.66 1h1m s HIS 68 Ca 0.16 -1.10 0.21 0.00 -0.15 0.00 0.00 55.06 54.19 1h1m s HIS 68 Cb 0.05 -1.61 0.15 0.00 1.11 0.00 0.00 32.58 32.28 1h1m s HIS 68 CO -0.01 -0.51 1.35 1.96 -0.85 0.00 0.00 174.74 176.68 1h1m h GLN 69 N 7.21 0.00 0.00 1.40 4.20 -1.96 -0.73 115.11 125.24 1h1m h GLN 69 Ca -0.29 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.42 1h1m h GLN 69 Cb 1.19 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.97 1h1m h GLN 69 CO 0.51 0.12 0.00 1.63 -0.67 0.00 0.00 178.83 180.42 1h1m n LYS 70 N -2.99 -0.30 -4.87 1.46 5.02 -1.26 -4.70 118.16 110.52 1h1m n LYS 70 Ca 0.01 -0.52 -0.26 0.00 -2.02 0.00 0.00 58.31 55.52 1h1m n LYS 70 Cb 0.60 -0.88 -0.16 0.00 -0.02 0.00 0.00 35.03 34.57 1h1m n LYS 70 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1h1m s HIS 71 N -0.12 1.70 -0.26 2.13 3.76 -1.26 -4.37 115.29 116.87 1h1m s HIS 71 Ca 0.00 -0.41 -0.14 0.00 -0.15 0.00 0.00 55.06 54.36 1h1m s HIS 71 Cb 0.00 -1.12 -0.04 0.00 1.11 0.00 0.00 32.58 32.53 1h1m s HIS 71 CO 0.00 -0.10 0.35 -0.47 -0.85 0.00 0.00 174.74 173.67 1h1m s TYR 72 N -0.20 3.26 -0.12 1.40 6.14 0.77 -3.89 117.35 124.71 1h1m s TYR 72 Ca 0.02 0.40 -0.06 0.00 0.64 0.00 0.00 57.07 58.07 1h1m s TYR 72 Cb -0.09 -2.53 -0.04 0.00 0.42 0.00 0.00 41.96 39.71 1h1m s TYR 72 CO 0.01 -0.18 0.10 -1.21 0.64 0.00 0.00 175.55 174.91 1h1m s GLU 73 N 1.89 3.37 -0.11 4.97 2.02 -0.50 -0.81 118.70 129.53 1h1m s GLU 73 Ca 0.14 -0.21 0.01 0.00 0.02 0.00 0.00 54.97 54.93 1h1m s GLU 73 Cb -0.16 -3.10 0.02 0.00 0.10 0.00 0.00 34.13 31.00 1h1m s GLU 73 CO 0.09 0.73 -0.12 -0.80 0.02 0.00 0.00 175.26 175.18 1h1m s ASN 74 N -0.89 2.24 -0.24 -0.19 0.01 -0.29 -0.26 114.94 115.31 1h1m s ASN 74 Ca 0.14 -0.37 -0.06 0.00 -0.71 0.00 0.00 52.86 51.87 1h1m s ASN 74 Cb -0.12 -0.96 -0.02 0.00 0.41 0.00 0.00 41.25 40.57 1h1m s ASN 74 CO 0.03 -0.04 0.01 -0.36 -1.51 0.00 0.00 177.10 175.24 1h1m s PHE 75 N 1.24 3.03 -0.08 2.20 0.40 0.36 -1.69 117.98 123.44 1h1m s PHE 75 Ca -0.03 -0.71 0.04 0.00 -0.60 0.00 0.00 56.93 55.63 1h1m s PHE 75 Cb -0.14 -2.17 0.00 0.00 0.51 0.00 0.00 43.02 41.22 1h1m s PHE 75 CO -0.04 -0.47 -0.19 -0.47 0.70 0.00 0.00 175.22 174.76 1h1m s TYR 76 N 1.54 2.03 -0.45 0.36 5.04 -0.04 -0.26 117.35 125.56 1h1m s TYR 76 Ca 0.06 -0.76 -0.21 0.00 -2.44 0.00 0.00 57.07 53.72 1h1m s TYR 76 Cb -0.15 -1.39 0.03 0.00 0.35 0.00 0.00 41.96 40.80 1h1m s TYR 76 CO 0.00 -0.32 0.66 0.00 -1.34 0.00 0.00 175.55 174.55 1h1m h ASN 78 N 8.91 0.82 -4.99 0.00 -0.73 -1.32 0.24 115.58 118.51 1h1m h ASN 78 Ca -0.25 -0.69 0.08 0.00 1.87 0.00 0.00 56.30 57.31 1h1m h ASN 78 Cb 1.09 -0.25 -0.10 0.00 0.27 0.00 0.00 38.32 39.34 1h1m h ASN 78 CO 0.91 1.39 0.35 -1.59 -0.37 0.00 0.00 177.43 178.12 1h1m s LYS 79 N -3.51 1.26 4.69 6.67 -2.85 -1.19 -4.55 119.74 120.27 1h1m s LYS 79 Ca -0.11 -0.59 0.00 0.00 -1.00 0.00 0.00 55.97 54.27 1h1m s LYS 79 Cb 0.07 0.50 0.00 0.00 -2.06 0.00 0.00 37.83 36.33 1h1m s LYS 79 CO 0.88 -0.57 0.00 0.41 0.10 0.00 0.00 175.35 176.18 1h1m n GLY 80 N -0.39 1.19 3.56 0.59 0.00 -1.18 -0.44 105.19 108.52 1h1m n GLY 80 Ca -0.09 -0.75 -0.12 0.00 0.00 0.00 0.00 46.02 45.06 1h1m n GLY 80 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1h1m s SER 81 N -4.00 -0.44 -0.13 1.61 1.04 -1.26 -3.52 113.70 107.00 1h1m s SER 81 Ca 0.00 0.45 -0.18 0.00 0.48 0.00 0.00 55.95 56.70 1h1m s SER 81 Cb 0.00 0.37 0.04 0.00 0.10 0.00 0.00 66.02 66.53 1h1m s SER 81 CO 0.00 -0.43 0.46 0.72 0.98 0.00 0.00 173.24 174.97 1h1m s PHE 82 N -1.29 -0.46 0.14 5.02 -0.12 -0.81 -0.51 117.98 119.95 1h1m s PHE 82 Ca -0.03 1.02 -0.16 0.00 -0.05 0.00 0.00 56.93 57.71 1h1m s PHE 82 Cb -0.00 0.18 -0.07 0.00 -0.63 0.00 0.00 43.02 42.50 1h1m s PHE 82 CO 0.03 -0.32 0.57 -1.14 -0.05 0.00 0.00 175.22 174.31 1h1m s GLN 83 N -0.27 4.04 -0.04 1.99 0.74 0.11 -0.93 119.66 125.32 1h1m s GLN 83 Ca -0.04 0.57 0.04 0.00 0.05 0.00 0.00 55.36 55.98 1h1m s GLN 83 Cb -0.03 -2.97 -0.00 0.00 1.10 0.00 0.00 33.01 31.11 1h1m s GLN 83 CO 0.03 0.49 -0.15 -1.17 -0.55 0.00 0.00 175.29 173.93 1h1m s LEU 84 N -1.84 1.89 0.04 3.68 2.96 -0.04 -1.25 118.68 124.13 1h1m s LEU 84 Ca 0.37 -0.31 0.09 0.00 -0.22 0.00 0.00 54.13 54.06 1h1m s LEU 84 Cb -0.16 -0.87 -0.03 0.00 0.50 0.00 0.00 46.19 45.63 1h1m s LEU 84 CO 0.19 0.14 -0.25 0.26 -1.32 0.00 0.00 176.35 175.37 1h1m s TRP 85 N 0.05 2.19 -0.02 5.38 0.51 -0.58 -1.60 118.94 124.87 1h1m s TRP 85 Ca -0.03 -0.40 -0.19 0.00 -2.12 0.00 0.00 56.10 53.35 1h1m s TRP 85 Cb -0.11 -1.31 0.04 0.00 -0.81 0.00 0.00 33.47 31.28 1h1m s TRP 85 CO 0.02 0.12 0.42 0.00 -0.51 0.00 0.00 176.95 176.99 1h1m s ALA 86 N -0.80 -1.06 -0.15 0.98 0.00 0.01 -2.44 121.76 118.29 1h1m s ALA 86 Ca 0.11 0.58 -0.14 0.00 0.00 0.00 0.00 51.96 52.51 1h1m s ALA 86 Cb -0.10 0.08 0.04 0.00 0.00 0.00 0.00 23.12 23.14 1h1m s ALA 86 CO 0.02 -0.30 0.41 -1.14 0.00 0.00 0.00 175.76 174.74 1h1m s GLN 87 N -1.39 0.48 -0.10 0.00 0.74 -0.24 -1.58 119.66 117.57 1h1m s GLN 87 Ca -0.12 0.57 0.02 0.00 0.05 0.00 0.00 55.36 55.88 1h1m s GLN 87 Cb -0.03 0.23 -0.01 0.00 1.10 0.00 0.00 33.01 34.29 1h1m s GLN 87 CO 0.05 -0.06 -0.18 0.45 -0.55 0.00 0.00 175.29 175.01 1h1m s SER 88 N 0.23 3.66 0.26 6.67 0.15 -1.26 -1.34 113.70 122.07 1h1m s SER 88 Ca -0.00 -0.40 0.00 0.00 0.70 0.00 0.00 55.95 56.25 1h1m s SER 88 Cb -0.03 -1.38 0.00 0.00 -1.71 0.00 0.00 66.02 62.90 1h1m s SER 88 CO 0.00 0.19 0.00 0.61 1.20 0.00 0.00 173.24 175.25 1h1m n GLY 89 N 3.32 2.50 0.27 9.45 0.00 -1.26 -0.37 105.19 119.09 1h1m n GLY 89 Ca -0.18 0.20 0.14 0.00 0.00 0.00 0.00 46.02 46.18 1h1m n GLY 89 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1h1m n ASN 90 N 2.40 0.92 -4.79 1.61 3.02 -1.26 -4.97 115.26 112.20 1h1m n ASN 90 Ca 0.00 -1.06 -0.33 0.00 -0.03 0.00 0.00 54.58 53.16 1h1m n ASN 90 Cb 0.00 0.01 0.02 0.00 -0.61 0.00 0.00 39.78 39.20 1h1m n ASN 90 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1h1m s GLU 91 N -2.23 3.22 0.20 3.52 2.02 0.50 -4.96 118.70 120.97 1h1m s GLU 91 Ca 0.34 1.31 -0.32 0.00 0.02 0.00 0.00 54.97 56.33 1h1m s GLU 91 Cb 0.21 -2.01 -0.15 0.00 0.10 0.00 0.00 34.13 32.27 1h1m s GLU 91 CO 0.41 -0.90 1.16 2.41 0.02 0.00 0.00 175.26 178.36 1h1m n THR 92 N -1.97 1.13 -2.32 3.63 -1.04 -1.26 -4.54 114.28 107.90 1h1m n THR 92 Ca 0.10 -0.28 -0.41 0.00 -2.04 0.00 0.00 64.05 61.41 1h1m n THR 92 Cb 0.52 -0.95 -0.03 0.00 -1.82 0.00 0.00 70.33 68.05 1h1m n THR 92 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 1h1m s GLN 93 N -0.62 4.49 -0.01 -2.82 0.74 -1.26 -4.74 119.66 115.44 1h1m s GLN 93 Ca 0.69 1.95 0.07 0.00 0.05 0.00 0.00 55.36 58.13 1h1m s GLN 93 Cb -0.80 -3.18 -0.02 0.00 1.10 0.00 0.00 33.01 30.11 1h1m s GLN 93 CO 0.53 -0.05 -0.24 -0.65 -0.55 0.00 0.00 175.29 174.34 1h1m s GLN 94 N -0.89 2.13 0.00 1.67 -1.52 -0.61 -4.34 119.66 116.10 1h1m s GLN 94 Ca 0.50 -0.92 -0.06 0.00 -1.95 0.00 0.00 55.36 52.93 1h1m s GLN 94 Cb -0.35 -2.09 -0.00 0.00 -0.22 0.00 0.00 33.01 30.35 1h1m s GLN 94 CO 0.41 0.56 0.12 -0.08 -0.25 0.00 0.00 175.29 176.06 1h1m s THR 95 N -0.67 0.08 -0.00 -0.19 -1.32 -0.15 -0.81 115.64 112.58 1h1m s THR 95 Ca 0.11 -0.68 -0.03 0.00 -1.21 0.00 0.00 61.69 59.88 1h1m s THR 95 Cb -0.10 -0.40 -0.00 0.00 -1.51 0.00 0.00 72.50 70.48 1h1m s THR 95 CO -0.00 -0.37 0.05 -0.13 -2.21 0.00 0.00 174.62 171.96 1h1m s ARG 96 N -1.31 0.29 -0.41 7.08 1.81 -0.62 -1.88 118.95 123.91 1h1m s ARG 96 Ca -0.14 -0.32 -0.20 0.00 -1.72 0.00 0.00 55.73 53.35 1h1m s ARG 96 Cb -0.07 0.12 0.01 0.00 -0.45 0.00 0.00 34.95 34.56 1h1m s ARG 96 CO 0.01 -0.06 0.58 0.08 -0.68 0.00 0.00 175.30 175.24 1h1m s VAL 97 N -0.96 4.92 -0.09 3.52 1.01 0.73 -0.86 120.40 128.67 1h1m s VAL 97 Ca -0.11 0.14 -0.26 0.00 0.00 0.00 0.00 61.98 61.75 1h1m s VAL 97 Cb -0.06 -4.11 -0.02 0.00 0.00 0.00 0.00 36.38 32.18 1h1m s VAL 97 CO 0.00 -0.45 0.85 -0.76 0.00 0.00 0.00 175.10 174.74 1h1m s LEU 98 N 2.60 4.28 0.00 3.92 1.02 -0.10 -4.94 118.68 125.46 1h1m s LEU 98 Ca 0.20 1.34 0.00 0.00 0.02 0.00 0.00 54.13 55.69 1h1m s LEU 98 Cb -0.15 -3.31 0.00 0.00 0.02 0.00 0.00 46.19 42.75 1h1m s LEU 98 CO 0.16 -0.28 0.00 -1.54 0.02 0.00 0.00 176.35 174.71 1h1m n SER 99 N 4.42 1.23 -4.69 2.29 3.41 -1.26 -1.93 113.62 117.09 1h1m n SER 99 Ca 0.04 -0.83 -0.44 0.00 -0.26 0.00 0.00 58.87 57.38 1h1m n SER 99 Cb 0.50 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.42 1h1m n SER 99 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1h1m n SER 100 N -1.47 3.72 0.00 4.04 7.64 -1.23 -1.47 113.62 124.85 1h1m n SER 100 Ca 0.00 1.03 0.00 0.00 1.01 0.00 0.00 58.87 60.91 1h1m n SER 100 Cb 0.00 -1.51 0.00 0.00 -1.01 0.00 0.00 64.21 61.69 1h1m n SER 100 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1h1m n GLY 101 N 3.94 0.94 3.87 0.23 0.00 0.85 -4.76 105.19 110.26 1h1m n GLY 101 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 1h1m n GLY 101 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1h1m s ASP 102 N -3.03 6.48 -0.00 1.61 1.01 -0.54 -3.99 116.67 118.20 1h1m s ASP 102 Ca 0.00 1.31 0.01 0.00 0.71 0.00 0.00 52.55 54.58 1h1m s ASP 102 Cb 0.00 -2.40 -0.00 0.00 1.01 0.00 0.00 42.92 41.53 1h1m s ASP 102 CO 0.00 -0.56 -0.04 -0.47 0.21 0.00 0.00 175.17 174.32 1h1m s TYR 103 N -2.63 0.33 -0.04 4.23 5.04 0.21 -1.62 117.35 122.86 1h1m s TYR 103 Ca 0.54 -0.06 0.01 0.00 -2.44 0.00 0.00 57.07 55.12 1h1m s TYR 103 Cb -0.10 -0.22 0.02 0.00 0.35 0.00 0.00 41.96 42.01 1h1m s TYR 103 CO 0.36 -0.01 -0.04 0.20 -1.34 0.00 0.00 175.55 174.72 1h1m s GLY 104 N -0.04 0.43 -0.21 8.97 0.00 0.63 -0.44 107.32 116.68 1h1m s GLY 104 Ca 0.01 -0.04 -0.08 0.00 0.00 0.00 0.00 44.72 44.61 1h1m s GLY 104 CO -0.00 0.47 0.08 -0.45 0.00 0.00 0.00 173.10 173.19 1h1m s SER 105 N 0.95 5.56 -0.53 1.64 0.15 0.05 -0.48 113.70 121.03 1h1m s SER 105 Ca -0.11 0.01 0.04 0.00 0.70 0.00 0.00 55.95 56.59 1h1m s SER 105 Cb -0.14 -1.97 0.14 0.00 -1.71 0.00 0.00 66.02 62.34 1h1m s SER 105 CO -0.00 0.11 0.31 -0.69 1.20 0.00 0.00 173.24 174.17 1h1m s VAL 106 N 0.77 2.11 1.08 4.45 1.01 0.64 -2.85 120.40 127.61 1h1m s VAL 106 Ca 0.04 -3.25 -0.14 0.00 0.00 0.00 0.00 61.98 58.63 1h1m s VAL 106 Cb -0.13 -2.44 0.17 0.00 0.00 0.00 0.00 36.38 33.97 1h1m s VAL 106 CO 0.02 -0.91 0.60 -2.65 0.00 0.00 0.00 175.10 172.16 1h1m n PRO 107 N 2.96 -1.53 -1.59 2.72 -0.02 -1.26 -1.41 135.00 134.88 1h1m n PRO 107 Ca 0.11 -0.41 -0.43 0.00 -2.02 0.00 0.00 63.50 60.75 1h1m n PRO 107 Cb 0.35 -1.99 -0.00 0.00 -0.02 0.00 0.00 33.50 31.83 1h1m n PRO 107 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1h1m n ARG 108 N -3.35 1.31 -2.26 -0.52 1.74 -1.25 -2.69 116.66 109.63 1h1m n ARG 108 Ca 0.04 0.47 -0.16 0.00 -0.77 0.00 0.00 57.85 57.42 1h1m n ARG 108 Cb 0.56 -1.90 -0.01 0.00 -1.02 0.00 0.00 32.46 30.09 1h1m n ARG 108 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1h1m n ASN 109 N 0.95 -4.87 -4.42 0.55 3.02 -0.28 -4.84 115.26 105.37 1h1m n ASN 109 Ca 0.09 0.01 -0.34 0.00 -0.03 0.00 0.00 54.58 54.31 1h1m n ASN 109 Cb 0.35 -3.97 -0.13 0.00 -0.61 0.00 0.00 39.78 35.42 1h1m n ASN 109 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1h1m s VAL 110 N -2.81 3.72 0.19 2.41 1.01 -1.10 -4.58 120.40 119.25 1h1m s VAL 110 Ca 0.00 -0.40 -0.30 0.00 0.00 0.00 0.00 61.98 61.28 1h1m s VAL 110 Cb 0.00 -2.66 -0.08 0.00 0.00 0.00 0.00 36.38 33.64 1h1m s VAL 110 CO 0.00 0.45 1.20 -0.89 0.00 0.00 0.00 175.10 175.86 1h1m s THR 111 N 0.88 3.53 0.11 3.92 2.01 -0.45 -4.54 115.64 121.09 1h1m s THR 111 Ca -0.00 1.31 -0.15 0.00 0.31 0.00 0.00 61.69 63.15 1h1m s THR 111 Cb -0.14 -3.83 0.03 0.00 0.01 0.00 0.00 72.50 68.56 1h1m s THR 111 CO 0.01 0.22 0.37 -1.38 -0.69 0.00 0.00 174.62 173.15 1h1m s HIS 112 N -0.15 -0.16 0.30 4.92 -3.43 -0.52 -1.08 115.29 115.17 1h1m s HIS 112 Ca 0.52 -0.14 -0.15 0.00 -0.80 0.00 0.00 55.06 54.49 1h1m s HIS 112 Cb -0.33 0.21 0.02 0.00 -1.43 0.00 0.00 32.58 31.04 1h1m s HIS 112 CO 0.37 -0.66 0.63 -0.08 -2.00 0.00 0.00 174.74 173.01 1h1m s THR 113 N -3.62 0.00 0.14 -5.38 -1.32 -1.02 -2.17 115.64 102.27 1h1m s THR 113 Ca 0.02 -1.19 -0.05 0.00 -1.21 0.00 0.00 61.69 59.26 1h1m s THR 113 Cb 0.02 -2.32 -0.02 0.00 -1.51 0.00 0.00 72.50 68.67 1h1m s THR 113 CO -0.11 0.00 0.16 0.72 -2.21 0.00 0.00 174.62 173.18 1h1m s PHE 114 N -3.52 0.61 -0.09 9.09 -0.12 -1.26 -1.53 117.98 121.15 1h1m s PHE 114 Ca 0.18 -0.99 -0.04 0.00 -0.05 0.00 0.00 56.93 56.03 1h1m s PHE 114 Cb -0.04 -0.27 0.05 0.00 -0.63 0.00 0.00 43.02 42.13 1h1m s PHE 114 CO 0.10 -0.60 0.19 -1.14 -0.05 0.00 0.00 175.22 173.72 1h1m s GLN 115 N -4.00 0.10 0.00 1.99 0.74 -0.38 0.50 119.66 118.61 1h1m s GLN 115 Ca 0.19 0.55 -0.30 0.00 0.05 0.00 0.00 55.36 55.85 1h1m s GLN 115 Cb 0.06 -0.18 -0.04 0.00 1.10 0.00 0.00 33.01 33.95 1h1m s GLN 115 CO -0.00 -0.24 1.20 0.42 -0.55 0.00 0.00 175.29 176.11 1h1m s ILE 116 N 1.87 4.15 -0.24 -2.34 -1.09 -1.26 -0.71 121.20 121.58 1h1m s ILE 116 Ca -0.02 1.52 -0.15 0.00 -2.23 0.00 0.00 60.65 59.76 1h1m s ILE 116 Cb -0.12 -3.98 -0.11 0.00 -1.58 0.00 0.00 42.46 36.68 1h1m s ILE 116 CO -0.07 0.06 -0.31 1.67 -1.23 0.00 0.00 174.94 175.06 1h1m n GLN 117 N 4.57 0.57 -3.68 2.79 7.27 0.33 -1.95 117.38 127.28 1h1m n GLN 117 Ca 0.10 0.28 -0.29 0.00 0.07 0.00 0.00 57.00 57.15 1h1m n GLN 117 Cb 0.46 -1.50 -0.04 0.00 2.41 0.00 0.00 30.24 31.58 1h1m n GLN 117 CO 0.00 0.00 0.00 -0.51 0.07 0.00 0.00 177.06 176.62 1h1m s ASP 118 N -6.99 6.43 0.27 1.69 1.01 -1.01 -4.33 116.67 113.74 1h1m s ASP 118 Ca -0.35 0.49 -0.01 0.00 0.71 0.00 0.00 52.55 53.39 1h1m s ASP 118 Cb 0.11 -2.05 0.46 0.00 1.01 0.00 0.00 42.92 42.46 1h1m s ASP 118 CO 0.47 0.00 1.87 -0.65 0.21 0.00 0.00 175.17 177.08 1h1m h PRO 119 N 2.41 1.08 -2.44 8.23 0.11 -1.91 -3.19 132.00 136.29 1h1m h PRO 119 Ca -0.47 -0.07 -0.70 0.00 0.11 0.00 0.00 66.00 64.88 1h1m h PRO 119 Cb 1.18 -0.24 -0.35 0.00 0.11 0.00 0.00 31.00 31.69 1h1m h PRO 119 CO 0.70 0.72 0.10 -3.47 -0.21 0.00 0.00 178.00 175.84 1h1m n ASP 120 N -4.54 5.33 -4.80 -2.05 2.03 -1.26 -4.15 116.55 107.11 1h1m n ASP 120 Ca 0.17 -3.52 -0.36 0.00 0.52 0.00 0.00 54.79 51.59 1h1m n ASP 120 Cb 0.24 -0.92 -0.07 0.00 -0.72 0.00 0.00 41.12 39.65 1h1m n ASP 120 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 1h1m s THR 121 N -3.26 5.43 -0.10 5.18 2.01 -1.18 -3.08 115.64 120.65 1h1m s THR 121 Ca 0.39 0.27 0.01 0.00 0.31 0.00 0.00 61.69 62.66 1h1m s THR 121 Cb 0.15 -3.47 0.02 0.00 0.01 0.00 0.00 72.50 69.21 1h1m s THR 121 CO -0.02 0.53 -0.11 -0.70 -0.69 0.00 0.00 174.62 173.63 1h1m s GLU 122 N -0.34 1.74 -0.17 4.92 2.12 0.41 -2.35 118.70 125.03 1h1m s GLU 122 Ca 0.13 -0.37 -0.07 0.00 0.36 0.00 0.00 54.97 55.02 1h1m s GLU 122 Cb -0.12 -1.61 -0.04 0.00 0.26 0.00 0.00 34.13 32.62 1h1m s GLU 122 CO 0.02 -0.14 0.05 -1.64 -0.54 0.00 0.00 175.26 173.01 1h1m s MET 123 N 1.25 3.84 -0.21 4.30 -1.94 -0.46 -0.85 119.30 125.23 1h1m s MET 123 Ca -0.03 -0.35 -0.08 0.00 -1.71 0.00 0.00 55.69 53.51 1h1m s MET 123 Cb -0.14 -3.15 -0.04 0.00 2.01 0.00 0.00 34.83 33.51 1h1m s MET 123 CO -0.04 0.33 0.09 0.99 -0.01 0.00 0.00 175.02 176.39 1h1m s THR 124 N 0.19 4.82 -0.14 2.05 2.01 0.84 -0.39 115.64 125.01 1h1m s THR 124 Ca 0.04 -0.01 -0.04 0.00 0.31 0.00 0.00 61.69 61.98 1h1m s THR 124 Cb -0.12 -3.21 -0.03 0.00 0.01 0.00 0.00 72.50 69.15 1h1m s THR 124 CO 0.01 0.40 -0.01 -0.83 -0.69 0.00 0.00 174.62 173.49 1h1m s GLY 125 N 0.84 1.77 -0.19 4.40 0.00 0.69 -0.86 107.32 113.97 1h1m s GLY 125 Ca 0.05 -0.80 -0.01 0.00 0.00 0.00 0.00 44.72 43.95 1h1m s GLY 125 CO 0.02 -0.15 -0.13 0.14 0.00 0.00 0.00 173.10 172.98 1h1m s VAL 126 N 0.11 2.68 -0.06 1.40 1.01 -0.68 -0.60 120.40 124.26 1h1m s VAL 126 Ca 0.01 -0.73 0.04 0.00 0.00 0.00 0.00 61.98 61.30 1h1m s VAL 126 Cb -0.13 -2.17 -0.00 0.00 0.00 0.00 0.00 36.38 34.07 1h1m s VAL 126 CO 0.02 0.49 -0.19 -0.63 0.00 0.00 0.00 175.10 174.79 1h1m s ILE 127 N 1.33 1.62 -0.05 2.22 1.01 -0.35 -1.14 121.20 125.83 1h1m s ILE 127 Ca 0.04 -0.81 0.03 0.00 0.00 0.00 0.00 60.65 59.91 1h1m s ILE 127 Cb -0.14 -1.39 0.01 0.00 0.01 0.00 0.00 42.46 40.95 1h1m s ILE 127 CO -0.08 0.46 -0.12 -0.69 0.00 0.00 0.00 174.94 174.51 1h1m s VAL 128 N 0.08 1.11 0.90 2.92 1.01 0.01 -0.70 120.40 125.73 1h1m s VAL 128 Ca -0.07 -0.49 -0.15 0.00 0.00 0.00 0.00 61.98 61.28 1h1m s VAL 128 Cb -0.13 -1.00 0.21 0.00 0.00 0.00 0.00 36.38 35.46 1h1m s VAL 128 CO 0.03 0.34 1.06 -0.81 0.00 0.00 0.00 175.10 175.73 1h1m n PRO 129 N 3.63 -1.65 -1.71 2.72 -0.04 -1.26 -0.17 135.00 136.53 1h1m n PRO 129 Ca -0.22 -1.66 -0.30 0.00 -0.04 0.00 0.00 63.50 61.29 1h1m n PRO 129 Cb 0.52 -1.23 0.08 0.00 -0.04 0.00 0.00 33.50 32.83 1h1m n PRO 129 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1h1m s GLY 130 N -5.05 1.62 0.00 0.55 0.00 0.37 -4.42 107.32 100.39 1h1m s GLY 130 Ca 0.63 -0.32 0.00 0.00 0.00 0.00 0.00 44.72 45.02 1h1m s GLY 130 CO 0.45 0.10 0.00 0.61 0.00 0.00 0.00 173.10 174.26 1h1m n GLY 131 N -2.56 0.54 0.25 0.20 0.00 -1.26 -4.72 105.19 97.64 1h1m n GLY 131 Ca 0.07 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.19 1h1m n GLY 131 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1h1m h PHE 132 N 0.00 0.00 0.00 1.61 3.57 -1.94 -3.08 116.94 117.10 1h1m h PHE 132 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1h1m h PHE 132 Cb 0.00 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.74 1h1m h PHE 132 CO 0.00 0.17 0.10 1.05 -2.23 0.00 0.00 178.31 177.39 1h1m h GLU 133 N 0.00 0.00 -1.11 1.11 9.09 -1.95 -1.14 114.58 120.58 1h1m h GLU 133 Ca -0.00 0.00 0.31 0.00 0.05 0.00 0.00 59.36 59.71 1h1m h GLU 133 Cb 0.41 0.00 -0.08 0.00 -1.65 0.00 0.00 28.75 27.43 1h1m h GLU 133 CO 0.02 0.00 0.75 -0.44 0.05 0.00 0.00 179.01 179.39 1h1m h ASP 134 N 0.00 0.26 -0.73 3.06 3.32 -1.96 0.49 116.42 120.86 1h1m h ASP 134 Ca 0.00 0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.09 1h1m h ASP 134 Cb 0.19 0.01 -0.03 0.00 0.22 0.00 0.00 39.33 39.72 1h1m h ASP 134 CO 0.00 0.03 0.40 0.25 -1.72 0.00 0.00 179.24 178.20 1h1m h LEU 135 N 0.22 0.91 -0.27 1.55 7.12 -1.48 0.17 115.31 123.53 1h1m h LEU 135 Ca 0.59 -0.10 -0.21 0.00 0.13 0.00 0.00 57.88 58.30 1h1m h LEU 135 Cb 1.86 -0.23 0.00 0.00 -0.53 0.00 0.00 40.66 41.76 1h1m h LEU 135 CO -0.19 0.75 -0.83 -0.26 -0.13 0.00 0.00 178.44 177.77 1h1m h PHE 136 N 1.00 0.64 -0.13 1.25 0.04 -0.28 -1.53 116.94 117.94 1h1m h PHE 136 Ca 0.26 -0.31 0.04 0.00 2.80 0.00 0.00 57.97 60.75 1h1m h PHE 136 Cb 0.04 -0.09 -0.04 0.00 2.20 0.00 0.00 35.95 38.06 1h1m h PHE 136 CO -0.00 1.11 -0.13 1.88 -0.60 0.00 0.00 178.31 180.56 1h1m h TYR 137 N 0.29 -0.33 0.15 -0.55 0.05 -0.88 0.16 116.97 115.86 1h1m h TYR 137 Ca -0.06 0.02 0.01 0.00 0.05 0.00 0.00 58.73 58.75 1h1m h TYR 137 Cb 1.44 0.17 -0.02 0.00 1.01 0.00 0.00 36.73 39.33 1h1m h TYR 137 CO 0.06 -0.19 -0.16 -0.92 -1.05 0.00 0.00 178.16 175.89 1h1m h TYR 138 N -0.15 -0.41 0.00 4.88 3.20 -0.45 -2.97 116.97 121.06 1h1m h TYR 138 Ca 0.09 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.94 1h1m h TYR 138 Cb 0.29 0.16 -0.00 0.00 1.54 0.00 0.00 36.73 38.72 1h1m h TYR 138 CO -0.25 -0.24 -0.45 -0.07 -1.64 0.00 0.00 178.16 175.51 1h1m h LEU 139 N -0.34 0.00-10.59 2.82 3.38 -1.30 -3.46 115.31 105.82 1h1m h LEU 139 Ca 0.01 0.00 -0.46 0.00 0.09 0.00 0.00 57.88 57.52 1h1m h LEU 139 Cb 0.33 0.00 0.09 0.00 0.09 0.00 0.00 40.66 41.16 1h1m h LEU 139 CO -0.05 0.10 0.29 -0.83 0.09 0.00 0.00 178.44 178.04 1h1m s GLY 140 N -4.32 1.66 -0.14 0.83 0.00 0.57 -4.89 107.32 101.02 1h1m s GLY 140 Ca 0.04 -0.86 -0.01 0.00 0.00 0.00 0.00 44.72 43.88 1h1m s GLY 140 CO 0.72 -0.42 -0.10 -1.59 0.00 0.00 0.00 173.10 171.71 1h1m s THR 141 N -3.36 3.25 0.27 0.90 2.01 0.70 -4.91 115.64 114.50 1h1m s THR 141 Ca 0.61 -0.58 -0.29 0.00 0.31 0.00 0.00 61.69 61.74 1h1m s THR 141 Cb -0.11 -2.39 -0.14 0.00 0.01 0.00 0.00 72.50 69.87 1h1m s THR 141 CO 0.46 0.51 1.00 -0.46 -0.69 0.00 0.00 174.62 175.44 1h1m n ASN 142 N 3.66 1.15 -4.00 3.53 0.23 -1.26 -0.79 115.26 117.78 1h1m n ASN 142 Ca -0.18 1.17 -0.28 0.00 -0.53 0.00 0.00 54.58 54.76 1h1m n ASN 142 Cb 0.52 -1.26 -0.17 0.00 -2.08 0.00 0.00 39.78 36.80 1h1m n ASN 142 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1h1m s ALA 143 N -0.95 1.64 -0.04 -2.53 0.00 -0.70 -4.70 121.76 114.48 1h1m s ALA 143 Ca 0.60 -0.73 -0.25 0.00 0.00 0.00 0.00 51.96 51.59 1h1m s ALA 143 Cb -0.73 -0.91 -0.21 0.00 0.00 0.00 0.00 23.12 21.26 1h1m s ALA 143 CO 0.59 -0.26 1.13 1.15 0.00 0.00 0.00 175.76 178.37 1h1m h THR 144 N 6.05 1.49 -6.54 0.00 2.02 -1.93 -3.40 112.91 110.59 1h1m h THR 144 Ca -0.33 -1.61 -0.46 0.00 0.77 0.00 0.00 66.41 64.78 1h1m h THR 144 Cb 1.15 2.50 0.02 0.00 -1.74 0.00 0.00 68.15 70.07 1h1m h THR 144 CO 0.48 0.43 -0.93 -0.67 0.37 0.00 0.00 175.52 175.21 1h1m n ASP 145 N -4.66 -5.06 -0.32 4.18 2.03 -1.26 -4.84 116.55 106.62 1h1m n ASP 145 Ca -0.09 -0.99 0.09 0.00 0.52 0.00 0.00 54.79 54.32 1h1m n ASP 145 Cb 0.38 -2.44 0.26 0.00 -0.72 0.00 0.00 41.12 38.60 1h1m n ASP 145 CO 0.00 0.00 0.00 0.74 -1.92 0.00 0.00 177.20 176.02 1h1m h THR 146 N -1.31 0.73 -0.00 5.18 2.02 -1.98 -1.39 112.91 116.16 1h1m h THR 146 Ca -0.60 -0.24 0.00 0.00 0.77 0.00 0.00 66.41 66.33 1h1m h THR 146 Cb 1.35 -0.04 0.00 0.00 -1.74 0.00 0.00 68.15 67.73 1h1m h THR 146 CO 0.43 0.13 -0.03 0.35 0.37 0.00 0.00 175.52 176.77 1h1m n THR 147 N -4.81 0.00 -2.16 3.16 -2.24 -1.26 -4.92 114.28 102.05 1h1m n THR 147 Ca 0.20 -0.06 -0.19 0.00 -2.27 0.00 0.00 64.05 61.72 1h1m n THR 147 Cb 0.48 -0.21 -0.03 0.00 -2.10 0.00 0.00 70.33 68.47 1h1m n THR 147 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1h1m n HIS 148 N -0.83 -0.79 -1.76 4.78 -0.00 -0.52 -4.96 115.22 111.14 1h1m n HIS 148 Ca 0.19 0.00 -0.41 0.00 -0.00 0.00 0.00 57.72 57.50 1h1m n HIS 148 Cb 0.22 -3.61 0.00 0.00 -0.00 0.00 0.00 29.99 26.61 1h1m n HIS 148 CO 0.00 0.00 0.00 -2.37 -0.00 0.00 0.00 176.34 173.97 1h1m n THR 149 N -3.41 2.20 -0.26 1.59 5.66 -1.26 -4.89 114.28 113.90 1h1m n THR 149 Ca -0.22 -0.50 0.00 0.00 -3.05 0.00 0.00 64.05 60.29 1h1m n THR 149 Cb 0.66 -1.86 0.13 0.00 -1.55 0.00 0.00 70.33 67.71 1h1m n THR 149 CO 0.00 0.00 0.00 -0.65 -3.05 0.00 0.00 175.07 171.37 1h1m h PRO 150 N 2.69 0.73 -4.11 1.09 0.11 -1.95 -3.43 132.00 127.13 1h1m h PRO 150 Ca -0.50 -0.04 -0.14 0.00 0.11 0.00 0.00 66.00 65.43 1h1m h PRO 150 Cb 1.26 -0.16 -0.14 0.00 0.11 0.00 0.00 31.00 32.07 1h1m h PRO 150 CO 0.63 0.48 -0.47 1.52 -0.21 0.00 0.00 178.00 179.95 1h1m s TYR 151 N -6.07 0.58 -0.25 0.65 -0.85 -1.26 -4.60 117.35 105.56 1h1m s TYR 151 Ca -0.13 -0.96 -0.29 0.00 -0.52 0.00 0.00 57.07 55.18 1h1m s TYR 151 Cb 0.18 -0.24 0.01 0.00 0.38 0.00 0.00 41.96 42.29 1h1m s TYR 151 CO 0.77 -0.62 1.08 0.42 -1.52 0.00 0.00 175.55 175.68 1h1m s ILE 152 N -4.00 4.57 0.44 -3.49 -1.09 -1.26 -5.00 121.20 111.38 1h1m s ILE 152 Ca 0.19 1.87 -0.25 0.00 -2.23 0.00 0.00 60.65 60.24 1h1m s ILE 152 Cb 0.05 -4.30 -0.09 0.00 -1.58 0.00 0.00 42.46 36.55 1h1m s ILE 152 CO 0.00 -0.26 1.31 -2.65 -1.23 0.00 0.00 174.94 172.11 1h1m n PRO 153 N 6.53 1.97 0.00 2.79 -0.02 -1.26 -5.04 135.00 139.97 1h1m n PRO 153 Ca 0.12 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 62.31 1h1m n PRO 153 Cb 0.46 -2.46 0.00 0.00 -0.02 0.00 0.00 33.50 31.48 1h1m n PRO 153 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1h1m n SER 154 N -0.01 0.00 -3.15 2.55 7.64 -1.26 -5.21 113.62 114.17 1h1m n SER 154 Ca 0.07 0.00 0.04 0.00 1.01 0.00 0.00 58.87 59.99 1h1m n SER 154 Cb 0.41 0.00 -0.00 0.00 -1.01 0.00 0.00 64.21 63.61 1h1m n SER 154 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1h1m s SER 159 N 1.87 -1.55 0.54 6.43 0.15 -1.26 -5.13 113.70 114.76 1h1m s SER 159 Ca 0.00 0.10 -0.16 0.00 0.70 0.00 0.00 55.95 56.60 1h1m s SER 159 Cb 0.00 1.98 -0.07 0.00 -1.71 0.00 0.00 66.02 66.22 1h1m s SER 159 CO 0.00 -0.27 1.00 -0.44 1.20 0.00 0.00 173.24 174.73 1h1m s SER 160 N 2.76 6.41 0.31 5.45 0.01 -1.26 -4.64 113.70 122.74 1h1m s SER 160 Ca 0.12 1.60 -0.29 0.00 1.31 0.00 0.00 55.95 58.68 1h1m s SER 160 Cb -0.09 -2.51 -0.13 0.00 0.21 0.00 0.00 66.02 63.51 1h1m s SER 160 CO -0.24 -0.74 1.35 0.41 0.41 0.00 0.00 173.24 174.43 1h1m n THR 161 N -1.82 1.61 -2.63 1.44 -1.04 -1.26 -4.77 114.28 105.81 1h1m n THR 161 Ca 0.07 -0.40 -0.36 0.00 -2.04 0.00 0.00 64.05 61.32 1h1m n THR 161 Cb 0.54 -1.57 -0.05 0.00 -1.82 0.00 0.00 70.33 67.43 1h1m n THR 161 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1h1m s THR 162 N -0.70 3.91 0.00 12.58 2.01 -0.74 -4.89 115.64 127.81 1h1m s THR 162 Ca 0.60 1.43 0.00 0.00 0.31 0.00 0.00 61.69 64.03 1h1m s THR 162 Cb -0.59 -3.72 0.00 0.00 0.01 0.00 0.00 72.50 68.20 1h1m s THR 162 CO 0.57 -0.02 0.00 0.61 -0.69 0.00 0.00 174.62 175.09 1h1m n GLY 163 N 0.22 -1.72 3.78 4.40 0.00 -1.26 -3.56 105.19 107.05 1h1m n GLY 163 Ca 0.05 -1.92 -0.41 0.00 0.00 0.00 0.00 46.02 43.74 1h1m n GLY 163 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1h1m s PRO 164 N 0.00 4.15 1.16 1.61 0.04 -1.26 -5.01 135.00 135.69 1h1m s PRO 164 Ca 0.00 2.52 -0.17 0.00 0.04 0.00 0.00 61.00 63.39 1h1m s PRO 164 Cb 0.00 -2.98 0.27 0.00 0.04 0.00 0.00 34.50 31.82 1h1m s PRO 164 CO 0.00 -0.48 1.08 0.16 0.04 0.00 0.00 177.00 177.80 1h1m s ASP 165 N -0.20 1.20 0.26 6.66 1.47 -1.26 -4.65 116.67 120.15 1h1m s ASP 165 Ca 0.52 0.89 -0.04 0.00 1.18 0.00 0.00 52.55 55.10 1h1m s ASP 165 Cb -0.45 -1.32 0.32 0.00 -0.34 0.00 0.00 42.92 41.13 1h1m s ASP 165 CO 0.62 -3.98 1.83 0.77 0.68 0.00 0.00 175.17 175.09 1h1m h SER 166 N -2.48 0.91 -0.47 2.11 4.64 -1.99 -0.76 113.55 115.51 1h1m h SER 166 Ca -0.49 -0.14 0.04 0.00 -0.47 0.00 0.00 61.79 60.73 1h1m h SER 166 Cb 1.32 -0.24 -0.04 0.00 -0.31 0.00 0.00 62.40 63.13 1h1m h SER 166 CO 0.42 0.83 0.25 0.28 -0.87 0.00 0.00 176.83 177.74 1h1m h SER 167 N 0.97 0.37 -0.09 4.97 0.02 -2.00 -3.12 113.55 114.68 1h1m h SER 167 Ca 0.22 0.02 -0.14 0.00 -0.84 0.00 0.00 61.79 61.05 1h1m h SER 167 Cb 0.21 -0.05 0.01 0.00 0.14 0.00 0.00 62.40 62.70 1h1m h SER 167 CO -0.02 0.26 -0.50 0.74 -1.14 0.00 0.00 176.83 176.17 1h1m h THR 168 N 0.49 1.38 0.00 -2.27 2.02 -1.64 -3.22 112.91 109.67 1h1m h THR 168 Ca 0.20 -1.85 0.00 0.00 0.77 0.00 0.00 66.41 65.53 1h1m h THR 168 Cb 0.09 2.25 0.00 0.00 -1.74 0.00 0.00 68.15 68.75 1h1m h THR 168 CO -0.13 0.55 0.00 -0.29 0.37 0.00 0.00 175.52 176.02 1h1m h ILE 169 N 0.07 0.00 -0.10 3.11 2.10 -1.22 -2.38 117.51 119.09 1h1m h ILE 169 Ca -0.04 -0.21 0.00 0.00 1.08 0.00 0.00 64.86 65.69 1h1m h ILE 169 Cb 1.16 0.98 0.00 0.00 -1.09 0.00 0.00 36.82 37.86 1h1m h ILE 169 CO 0.10 0.00 0.00 -1.20 -1.08 0.00 0.00 178.15 175.97 1h1m n SER 170 N -2.54 0.54 0.00 2.19 7.64 -1.18 -3.78 113.62 116.49 1h1m n SER 170 Ca 0.00 -1.93 0.00 0.00 1.01 0.00 0.00 58.87 57.96 1h1m n SER 170 Cb 0.18 -0.06 0.00 0.00 -1.01 0.00 0.00 64.21 63.32 1h1m n SER 170 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1h1m n THR 171 N -0.24 0.27 -1.08 0.44 -1.04 -0.90 -4.79 114.28 106.94 1h1m n THR 171 Ca 0.05 -0.47 0.04 0.00 -2.04 0.00 0.00 64.05 61.63 1h1m n THR 171 Cb 0.10 1.06 0.26 0.00 -1.82 0.00 0.00 70.33 69.93 1h1m n THR 171 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1h1m n LEU 172 N -0.13 4.28 0.00 -4.42 4.77 -1.26 -4.63 117.00 115.61 1h1m n LEU 172 Ca 0.00 -3.18 0.15 0.00 -0.03 0.00 0.00 56.01 52.95 1h1m n LEU 172 Cb 0.18 -0.59 0.61 0.00 -2.33 0.00 0.00 43.42 41.29 1h1m n LEU 172 CO 0.00 0.80 1.17 1.56 -1.33 0.00 0.00 177.39 179.59 1h1m h GLN 173 N 1.83 0.15 -0.12 3.23 4.20 -1.85 0.10 115.11 122.66 1h1m h GLN 173 Ca 0.08 -0.01 -0.03 0.00 0.06 0.00 0.00 58.65 58.75 1h1m h GLN 173 Cb 1.62 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 29.36 1h1m h GLN 173 CO 0.33 0.10 -0.05 1.03 -0.67 0.00 0.00 178.83 179.57 1h1m h SER 174 N 0.16 0.16 -0.43 1.46 0.87 -1.87 -0.51 113.55 113.39 1h1m h SER 174 Ca 0.23 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.77 1h1m h SER 174 Cb 0.70 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 62.62 1h1m h SER 174 CO -0.03 0.24 0.00 0.49 -0.53 0.00 0.00 176.83 177.00 1h1m n PHE 175 N -4.38 0.80 -3.27 2.24 3.72 0.34 -4.91 117.46 112.00 1h1m n PHE 175 Ca -0.01 -0.34 -0.19 0.00 -0.05 0.00 0.00 57.45 56.85 1h1m n PHE 175 Cb 0.19 -0.10 0.06 0.00 -0.94 0.00 0.00 39.48 38.69 1h1m n PHE 175 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1h1m n ASP 176 N 0.71 -5.53 -4.18 4.37 2.03 -0.20 -4.90 116.55 108.85 1h1m n ASP 176 Ca 0.16 -0.39 -0.31 0.00 0.52 0.00 0.00 54.79 54.77 1h1m n ASP 176 Cb 0.51 -4.20 -0.17 0.00 -0.72 0.00 0.00 41.12 36.54 1h1m n ASP 176 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1h1m s VAL 177 N -3.21 1.89 -0.06 5.18 1.01 -1.09 -4.20 120.40 119.92 1h1m s VAL 177 Ca 0.42 -0.92 0.01 0.00 0.00 0.00 0.00 61.98 61.49 1h1m s VAL 177 Cb -0.19 -1.64 0.02 0.00 0.00 0.00 0.00 36.38 34.57 1h1m s VAL 177 CO 0.52 0.52 -0.05 -0.31 0.00 0.00 0.00 175.10 175.78 1h1m s TYR 178 N 0.43 0.94 0.39 5.22 1.51 -0.14 -3.03 117.35 122.66 1h1m s TYR 178 Ca -0.17 -0.32 -0.27 0.00 -1.01 0.00 0.00 57.07 55.30 1h1m s TYR 178 Cb -0.17 -0.83 -0.09 0.00 -0.11 0.00 0.00 41.96 40.76 1h1m s TYR 178 CO 0.07 -0.27 1.34 0.00 -1.11 0.00 0.00 175.55 175.58 1h1m s ALA 179 N 1.18 3.36 -0.61 3.71 0.00 -1.25 -0.89 121.76 127.26 1h1m s ALA 179 Ca -0.06 1.30 0.05 0.00 0.00 0.00 0.00 51.96 53.25 1h1m s ALA 179 Cb -0.14 -3.51 0.17 0.00 0.00 0.00 0.00 23.12 19.64 1h1m s ALA 179 CO -0.01 -0.84 0.46 0.39 0.00 0.00 0.00 175.76 175.75 1h1m n GLU 180 N 0.31 1.34 0.09 0.00 -0.58 -0.77 -4.83 120.64 116.21 1h1m n GLU 180 Ca 0.02 -4.08 0.13 0.00 -0.42 0.00 0.00 57.16 52.81 1h1m n GLU 180 Cb 0.42 -2.09 0.36 0.00 -0.57 0.00 0.00 31.44 29.57 1h1m n GLU 180 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 1h1m n LEU 181 N 2.18 0.77 0.01 -4.62 4.32 -1.26 -1.82 117.00 116.58 1h1m n LEU 181 Ca 0.23 0.50 0.13 0.00 -0.02 0.00 0.00 56.01 56.85 1h1m n LEU 181 Cb 0.39 -0.29 0.55 0.00 -1.62 0.00 0.00 43.42 42.45 1h1m n LEU 181 CO 0.21 -0.15 0.91 -1.54 -1.22 0.00 0.00 177.39 175.61 1h1m n SER 182 N -2.20 0.09 -4.70 -1.43 3.41 -1.26 -4.84 113.62 102.69 1h1m n SER 182 Ca 0.05 0.51 -0.42 0.00 -0.26 0.00 0.00 58.87 58.75 1h1m n SER 182 Cb 0.43 -0.53 -0.03 0.00 -0.26 0.00 0.00 64.21 63.82 1h1m n SER 182 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1h1m s PHE 183 N -3.02 2.97 -0.32 7.33 5.36 -0.76 -5.01 117.98 124.53 1h1m s PHE 183 Ca 0.12 0.84 -0.02 0.00 -0.96 0.00 0.00 56.93 56.91 1h1m s PHE 183 Cb 0.17 -3.69 0.06 0.00 -0.34 0.00 0.00 43.02 39.22 1h1m s PHE 183 CO 0.49 -2.51 0.04 0.99 -1.46 0.00 0.00 175.22 172.77 1h1m s THR 184 N 1.92 3.00 0.12 0.12 2.01 -1.26 -4.93 115.64 116.62 1h1m s THR 184 Ca 0.65 -1.57 -0.35 0.00 0.31 0.00 0.00 61.69 60.73 1h1m s THR 184 Cb -0.34 -2.82 -0.15 0.00 0.01 0.00 0.00 72.50 69.21 1h1m s THR 184 CO 0.28 -0.25 1.53 -2.65 -0.69 0.00 0.00 174.62 172.85 1h1m n PRO 185 N 4.60 1.85 -2.24 4.92 -0.02 -1.26 -4.91 135.00 137.94 1h1m n PRO 185 Ca -0.10 0.67 -0.34 0.00 -2.02 0.00 0.00 63.50 61.70 1h1m n PRO 185 Cb 0.43 -2.41 0.00 0.00 -0.02 0.00 0.00 33.50 31.50 1h1m n PRO 185 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 1h1m s ARG 186 N 1.04 3.37 -0.19 -0.52 1.70 -1.26 -4.96 118.95 118.13 1h1m s ARG 186 Ca 0.82 1.49 0.14 0.00 -0.47 0.00 0.00 55.73 57.71 1h1m s ARG 186 Cb -0.76 -2.02 0.44 0.00 -0.57 0.00 0.00 34.95 32.04 1h1m s ARG 186 CO 0.42 -0.81 1.19 0.25 -1.08 0.00 0.00 175.30 175.27 1h1m n THR 187 N -1.44 1.73 -1.40 4.99 -2.24 -1.26 -4.68 114.28 109.98 1h1m n THR 187 Ca 0.11 -2.97 0.03 0.00 -2.27 0.00 0.00 64.05 58.94 1h1m n THR 187 Cb 0.52 -0.03 0.20 0.00 -2.10 0.00 0.00 70.33 68.92 1h1m n THR 187 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1h1m n ASP 188 N -0.64 2.35 -4.68 3.42 5.75 -1.26 -5.04 116.55 116.46 1h1m n ASP 188 Ca 0.21 -3.65 -0.45 0.00 -0.01 0.00 0.00 54.79 50.89 1h1m n ASP 188 Cb 0.86 -0.56 -0.03 0.00 -1.03 0.00 0.00 41.12 40.36 1h1m n ASP 188 CO 0.00 0.00 0.00 0.41 -0.11 0.00 0.00 177.20 177.50 1h1m n THR 189 N -1.10 0.65 -3.79 2.12 -1.04 -1.26 -4.74 114.28 105.11 1h1m n THR 189 Ca 0.25 -0.16 -0.13 0.00 -2.04 0.00 0.00 64.05 61.97 1h1m n THR 189 Cb 0.85 -1.53 -0.13 0.00 -1.82 0.00 0.00 70.33 67.70 1h1m n THR 189 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1h1m s VAL 190 N 0.25 -0.02 -1.60 12.58 1.01 -0.53 -4.87 120.40 127.23 1h1m s VAL 190 Ca 0.71 0.06 -0.16 0.00 0.00 0.00 0.00 61.98 62.59 1h1m s VAL 190 Cb -0.65 -0.23 0.13 0.00 0.00 0.00 0.00 36.38 35.63 1h1m s VAL 190 CO 0.46 0.02 0.80 0.59 0.00 0.00 0.00 175.10 176.97 1h1m n ASN 191 N 3.41 -3.80 0.00 3.32 3.02 -1.26 -1.63 115.26 118.32 1h1m n ASN 191 Ca -0.17 -0.85 0.00 0.00 -0.03 0.00 0.00 54.58 53.53 1h1m n ASN 191 Cb 0.57 -3.09 0.00 0.00 -0.61 0.00 0.00 39.78 36.65 1h1m n ASN 191 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1h1m n GLY 192 N -1.43 0.45 3.21 7.41 0.00 -1.26 -4.95 105.19 108.62 1h1m n GLY 192 Ca 0.06 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.95 1h1m n GLY 192 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1h1m s THR 193 N -1.91 0.07 -0.02 2.61 -1.32 -0.64 -0.20 115.64 114.22 1h1m s THR 193 Ca 0.00 -0.57 -0.16 0.00 -1.21 0.00 0.00 61.69 59.74 1h1m s THR 193 Cb 0.00 -0.64 0.03 0.00 -1.51 0.00 0.00 72.50 70.38 1h1m s THR 193 CO 0.00 -0.32 0.35 0.00 -2.21 0.00 0.00 174.62 172.44 1h1m s ALA 194 N -1.58 -0.88 1.08 11.08 0.00 -0.79 -1.46 121.76 129.21 1h1m s ALA 194 Ca -0.12 0.46 -0.17 0.00 0.00 0.00 0.00 51.96 52.13 1h1m s ALA 194 Cb -0.05 0.03 0.23 0.00 0.00 0.00 0.00 23.12 23.34 1h1m s ALA 194 CO 0.02 -0.27 1.17 -1.25 0.00 0.00 0.00 175.76 175.44 1h1m s PRO 195 N -1.23 -0.24 0.38 0.00 0.04 -1.26 -0.98 135.00 131.71 1h1m s PRO 195 Ca -0.13 -0.07 0.10 0.00 0.04 0.00 0.00 61.00 60.94 1h1m s PRO 195 Cb -0.05 -1.71 0.74 0.00 0.04 0.00 0.00 34.50 33.52 1h1m s PRO 195 CO 0.05 -3.06 1.88 0.00 0.04 0.00 0.00 177.00 175.91 1h1m h ALA 196 N -2.11 1.45 0.00 8.56 0.00 -1.90 -3.23 119.26 122.02 1h1m h ALA 196 Ca -0.46 -0.25 -0.15 0.00 0.00 0.00 0.00 54.91 54.05 1h1m h ALA 196 Cb 1.29 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.94 1h1m h ALA 196 CO 0.41 0.39 -0.23 -1.71 0.00 0.00 0.00 179.25 178.11 1h1m n ASN 197 N -4.22 4.46 -4.23 0.00 5.15 -1.26 -4.82 115.26 110.34 1h1m n ASN 197 Ca -0.01 -2.32 -0.21 0.00 -0.60 0.00 0.00 54.58 51.44 1h1m n ASN 197 Cb 0.31 -1.18 -0.10 0.00 -0.53 0.00 0.00 39.78 38.28 1h1m n ASN 197 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 1h1m s THR 198 N 1.21 0.69 -0.15 -0.44 -4.23 -1.22 -5.15 115.64 106.34 1h1m s THR 198 Ca 0.52 -2.00 0.01 0.00 -1.18 0.00 0.00 61.69 59.04 1h1m s THR 198 Cb 0.25 -2.58 0.02 0.00 1.34 0.00 0.00 72.50 71.52 1h1m s THR 198 CO 0.00 0.00 -0.18 -0.69 -0.54 0.00 0.00 174.62 173.21 1h1m s VAL 199 N -3.46 1.86 -0.28 2.29 1.01 -1.26 -5.06 120.40 115.50 1h1m s VAL 199 Ca 0.34 -0.83 0.01 0.00 0.00 0.00 0.00 61.98 61.49 1h1m s VAL 199 Cb 0.06 -1.68 0.16 0.00 0.00 0.00 0.00 36.38 34.91 1h1m s VAL 199 CO 0.15 0.51 0.40 0.86 0.00 0.00 0.00 175.10 177.02 1h1m s TRP 200 N 1.16 -0.96 -0.31 5.22 -0.00 -1.26 -4.84 118.94 117.94 1h1m s TRP 200 Ca -0.00 0.39 0.00 0.00 -0.00 0.00 0.00 56.10 56.49 1h1m s TRP 200 Cb -0.14 -0.14 0.00 0.00 -0.00 0.00 0.00 33.47 33.19 1h1m s TRP 200 CO -0.08 -0.94 0.00 0.72 -0.00 0.00 0.00 176.95 176.65 1h1m n HIS 201 N 5.35 0.00 -0.22 5.86 8.25 -1.26 -4.86 115.22 128.34 1h1m n HIS 201 Ca -0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1h1m n HIS 201 Cb 0.49 -1.10 0.00 0.00 1.12 0.00 0.00 29.99 30.51 1h1m n HIS 201 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1h1m n THR 202 N -2.67 0.21 0.00 1.59 -2.24 -1.26 -5.11 114.28 104.80 1h1m n THR 202 Ca -0.03 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.26 1h1m n THR 202 Cb 0.22 1.06 0.00 0.00 -2.10 0.00 0.00 70.33 69.51 1h1m n THR 202 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1h1m n GLY 203 N -0.11 0.10 3.76 3.38 0.00 -1.26 -5.11 105.19 105.95 1h1m n GLY 203 Ca 0.00 -1.02 -0.39 0.00 0.00 0.00 0.00 46.02 44.61 1h1m n GLY 203 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h1m s ALA 204 N -2.00 3.16 -0.10 4.61 0.00 -1.26 -4.77 121.76 121.40 1h1m s ALA 204 Ca 0.00 1.25 0.00 0.00 0.00 0.00 0.00 51.96 53.22 1h1m s ALA 204 Cb 0.00 -3.50 -0.02 0.00 0.00 0.00 0.00 23.12 19.59 1h1m s ALA 204 CO 0.00 -0.95 -0.11 -0.80 0.00 0.00 0.00 175.76 173.91 1h1m s ASN 205 N -0.80 4.26 0.17 0.00 0.02 -0.37 -4.95 114.94 113.27 1h1m s ASN 205 Ca 0.60 -0.20 0.02 0.00 -1.02 0.00 0.00 52.86 52.26 1h1m s ASN 205 Cb -0.38 -1.35 -0.04 0.00 0.02 0.00 0.00 41.25 39.50 1h1m s ASN 205 CO 0.48 0.25 0.32 0.00 0.02 0.00 0.00 177.10 178.17 1h1m s ALA 206 N -0.15 3.93 0.68 0.60 0.00 -1.26 -4.08 121.76 121.47 1h1m s ALA 206 Ca 0.00 -0.98 -0.12 0.00 0.00 0.00 0.00 51.96 50.86 1h1m s ALA 206 Cb -0.13 -1.84 0.00 0.00 0.00 0.00 0.00 23.12 21.15 1h1m s ALA 206 CO 0.03 0.49 1.07 -0.51 0.00 0.00 0.00 175.76 176.84 1h1m s LEU 207 N -3.30 3.24 0.61 0.00 1.02 -1.26 -4.76 118.68 114.23 1h1m s LEU 207 Ca 0.36 1.74 -0.18 0.00 0.02 0.00 0.00 54.13 56.06 1h1m s LEU 207 Cb -0.11 -4.51 -0.03 0.00 0.02 0.00 0.00 46.19 41.56 1h1m s LEU 207 CO 0.29 -1.49 1.22 0.00 0.02 0.00 0.00 176.35 176.39 1h1m s ALA 208 N -2.80 2.49 0.16 4.21 0.00 -1.26 -4.89 121.76 119.68 1h1m s ALA 208 Ca 0.61 1.04 0.35 0.00 0.00 0.00 0.00 51.96 53.96 1h1m s ALA 208 Cb -0.16 -3.47 1.55 0.00 0.00 0.00 0.00 23.12 21.05 1h1m s ALA 208 CO 0.49 -1.28 2.04 0.77 0.00 0.00 0.00 175.76 177.77 1h1m h SER 209 N 0.76 0.00 -5.23 0.00 0.02 -1.96 -3.46 113.55 103.68 1h1m h SER 209 Ca -0.50 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 60.35 1h1m h SER 209 Cb 1.31 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 63.79 1h1m h SER 209 CO 0.54 0.00 0.01 0.28 -1.14 0.00 0.00 176.83 176.52 1h1m s THR 210 N -3.74 0.00 0.59 -2.27 -1.32 -1.26 -4.98 115.64 102.66 1h1m s THR 210 Ca 0.00 -1.30 -0.16 0.00 -1.21 0.00 0.00 61.69 59.02 1h1m s THR 210 Cb 0.10 -2.49 -0.04 0.00 -1.51 0.00 0.00 72.50 68.55 1h1m s THR 210 CO 0.50 0.00 1.05 0.00 -2.21 0.00 0.00 174.62 173.95 1h1m s ALA 211 N -3.25 2.79 0.00 11.08 0.00 -1.21 -4.07 121.76 127.09 1h1m s ALA 211 Ca 0.22 0.35 0.00 0.00 0.00 0.00 0.00 51.96 52.53 1h1m s ALA 211 Cb -0.02 -3.21 0.00 0.00 0.00 0.00 0.00 23.12 19.88 1h1m s ALA 211 CO 0.13 -0.74 0.00 0.41 0.00 0.00 0.00 175.76 175.56 1h1m n GLY 212 N -1.10 1.74 3.68 0.00 0.00 -1.26 -5.06 105.19 103.19 1h1m n GLY 212 Ca 0.08 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.75 1h1m n GLY 212 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1h1m s ASP 213 N -1.53 5.54 0.68 1.61 1.01 -1.26 -4.82 116.67 117.91 1h1m s ASP 213 Ca 0.00 0.15 -0.14 0.00 0.71 0.00 0.00 52.55 53.27 1h1m s ASP 213 Cb 0.00 -1.79 0.01 0.00 1.01 0.00 0.00 42.92 42.15 1h1m s ASP 213 CO 0.00 0.29 1.10 -2.16 0.21 0.00 0.00 175.17 174.61 1h1m s PRO 214 N -0.31 2.71 0.19 8.23 0.04 -1.26 -4.69 135.00 139.91 1h1m s PRO 214 Ca 0.08 1.33 -0.22 0.00 0.04 0.00 0.00 61.00 62.23 1h1m s PRO 214 Cb -0.12 -1.94 0.06 0.00 0.04 0.00 0.00 34.50 32.53 1h1m s PRO 214 CO 0.02 -1.31 0.62 1.52 0.04 0.00 0.00 177.00 177.89 1h1m s TYR 215 N -2.47 -0.43 0.01 0.56 1.13 -1.13 -4.88 117.35 110.13 1h1m s TYR 215 Ca 0.65 0.15 0.03 0.00 -1.41 0.00 0.00 57.07 56.50 1h1m s TYR 215 Cb -0.19 0.58 -0.01 0.00 -1.10 0.00 0.00 41.96 41.24 1h1m s TYR 215 CO 0.45 -0.94 -0.11 -0.06 -2.51 0.00 0.00 175.55 172.37 1h1m s PHE 216 N -3.80 0.94 -0.14 -3.49 0.40 -1.26 -0.77 117.98 109.86 1h1m s PHE 216 Ca 0.04 -0.26 -0.00 0.00 -0.60 0.00 0.00 56.93 56.11 1h1m s PHE 216 Cb -0.02 -0.58 0.03 0.00 0.51 0.00 0.00 43.02 42.95 1h1m s PHE 216 CO -0.08 -0.01 -0.09 0.42 0.70 0.00 0.00 175.22 176.17 1h1m s ILE 217 N -0.54 1.20 0.44 0.64 1.01 0.41 -4.78 121.20 119.59 1h1m s ILE 217 Ca 0.01 -0.47 -0.17 0.00 0.00 0.00 0.00 60.65 60.03 1h1m s ILE 217 Cb -0.06 -1.23 -0.09 0.00 0.01 0.00 0.00 42.46 41.10 1h1m s ILE 217 CO 0.00 0.33 0.90 0.00 0.00 0.00 0.00 174.94 176.18 1h1m s ALA 218 N 1.63 3.14 -0.11 9.38 0.00 -1.26 -0.62 121.76 133.92 1h1m s ALA 218 Ca 0.04 0.17 -0.31 0.00 0.00 0.00 0.00 51.96 51.85 1h1m s ALA 218 Cb -0.13 -3.01 -0.09 0.00 0.00 0.00 0.00 23.12 19.89 1h1m s ALA 218 CO -0.09 0.01 2.04 -1.71 0.00 0.00 0.00 175.76 176.01 1h1m n ASN 219 N -1.05 3.54 0.00 0.00 5.15 -1.26 -1.02 115.26 120.62 1h1m n ASN 219 Ca 0.06 0.67 0.00 0.00 -0.60 0.00 0.00 54.58 54.71 1h1m n ASN 219 Cb 0.54 -1.47 0.00 0.00 -0.53 0.00 0.00 39.78 38.32 1h1m n ASN 219 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1h1m n GLY 220 N 5.05 1.04 0.42 8.20 0.00 -1.26 -4.92 105.19 113.72 1h1m n GLY 220 Ca 0.26 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.37 1h1m n GLY 220 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1h1m n TRP 221 N -2.00 0.00 -2.43 1.61 7.02 -0.19 -4.84 117.44 116.61 1h1m n TRP 221 Ca 0.00 0.00 -0.25 0.00 -1.02 0.00 0.00 57.50 56.23 1h1m n TRP 221 Cb 0.00 0.00 0.14 0.00 -2.42 0.00 0.00 31.31 29.03 1h1m n TRP 221 CO 0.00 0.00 0.00 0.20 -2.02 0.00 0.00 177.69 175.87 1h1m s GLY 222 N -2.24 1.77 0.64 6.99 0.00 -1.26 -1.23 107.32 111.99 1h1m s GLY 222 Ca 0.16 -1.69 -0.16 0.00 0.00 0.00 0.00 44.72 43.02 1h1m s GLY 222 CO 0.51 -1.03 1.14 2.56 0.00 0.00 0.00 173.10 176.28 1h1m s PRO 223 N -5.38 2.82 0.04 2.90 0.04 -1.26 -4.90 135.00 129.26 1h1m s PRO 223 Ca 0.70 1.53 -0.02 0.00 0.04 0.00 0.00 61.00 63.25 1h1m s PRO 223 Cb -0.04 -1.94 -0.03 0.00 0.04 0.00 0.00 34.50 32.53 1h1m s PRO 223 CO 0.47 -1.26 0.00 0.15 0.04 0.00 0.00 177.00 176.41 1h1m s LYS 224 N -3.83 0.49 -0.03 4.56 1.02 -1.26 -3.81 119.74 116.89 1h1m s LYS 224 Ca 0.70 -0.87 0.02 0.00 0.02 0.00 0.00 55.97 55.84 1h1m s LYS 224 Cb -0.23 0.18 0.01 0.00 -0.52 0.00 0.00 37.83 37.27 1h1m s LYS 224 CO 0.38 -0.10 -0.06 0.71 -0.92 0.00 0.00 175.35 175.37 1h1m s TYR 225 N -2.66 0.73 -0.23 3.18 1.51 -0.71 -1.25 117.35 117.92 1h1m s TYR 225 Ca -0.05 -0.18 -0.15 0.00 -1.01 0.00 0.00 57.07 55.68 1h1m s TYR 225 Cb -0.01 -0.58 -0.04 0.00 -0.11 0.00 0.00 41.96 41.22 1h1m s TYR 225 CO -0.05 -0.12 0.39 -1.17 -1.11 0.00 0.00 175.55 173.48 1h1m s LEU 226 N 0.49 4.10 -0.15 -1.29 2.96 0.13 -0.83 118.68 124.10 1h1m s LEU 226 Ca -0.07 0.42 -0.04 0.00 -0.22 0.00 0.00 54.13 54.22 1h1m s LEU 226 Cb -0.10 -2.48 -0.03 0.00 0.50 0.00 0.00 46.19 44.08 1h1m s LEU 226 CO 0.00 -0.13 0.00 0.21 -1.32 0.00 0.00 176.35 175.12 1h1m s ASN 227 N 1.30 5.18 -0.02 3.68 3.84 0.15 -1.59 114.94 127.48 1h1m s ASN 227 Ca 0.17 0.01 0.09 0.00 0.21 0.00 0.00 52.86 53.34 1h1m s ASN 227 Cb -0.15 -1.76 0.25 0.00 -0.55 0.00 0.00 41.25 39.04 1h1m s ASN 227 CO 0.09 0.23 1.20 -1.20 -2.79 0.00 0.00 177.10 174.63 1h1m n SER 228 N 3.17 2.77 0.08 -4.21 7.64 -1.26 -0.83 113.62 120.98 1h1m n SER 228 Ca -0.17 -2.14 -0.08 0.00 1.01 0.00 0.00 58.87 57.49 1h1m n SER 228 Cb 0.53 -0.21 -0.07 0.00 -1.01 0.00 0.00 64.21 63.44 1h1m n SER 228 CO 0.00 0.00 0.00 -0.61 -3.01 0.00 0.00 175.04 171.42 1h1m h GLN 229 N 1.43 0.05 -1.58 1.43 5.75 -1.94 -3.37 115.11 116.88 1h1m h GLN 229 Ca 0.00 -0.08 -0.47 0.00 -0.15 0.00 0.00 58.65 57.95 1h1m h GLN 229 Cb 0.76 0.03 -0.41 0.00 1.07 0.00 0.00 27.48 28.93 1h1m h GLN 229 CO 0.02 0.97 -1.02 0.66 -2.65 0.00 0.00 178.83 176.82 1h1m n TYR 230 N -3.46 1.77 -3.38 3.99 4.01 -1.26 -5.01 117.16 113.81 1h1m n TYR 230 Ca -0.02 -3.33 0.00 0.00 -0.16 0.00 0.00 57.90 54.39 1h1m n TYR 230 Cb 0.90 -0.35 0.00 0.00 -0.31 0.00 0.00 39.34 39.58 1h1m n TYR 230 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1h1m n GLY 231 N -0.08 -1.74 3.66 2.72 0.00 -1.26 -4.77 105.19 103.72 1h1m n GLY 231 Ca 0.23 -1.46 -0.35 0.00 0.00 0.00 0.00 46.02 44.44 1h1m n GLY 231 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1h1m s TYR 232 N 0.00 3.20 -0.02 1.61 2.02 -1.26 -4.13 117.35 118.78 1h1m s TYR 232 Ca 0.00 0.12 0.01 0.00 -0.37 0.00 0.00 57.07 56.83 1h1m s TYR 232 Cb 0.00 -1.89 0.01 0.00 -0.40 0.00 0.00 41.96 39.68 1h1m s TYR 232 CO 0.00 0.35 -0.02 -0.65 -1.57 0.00 0.00 175.55 173.67 1h1m s GLN 233 N -0.45 0.28 -0.23 -0.62 -0.21 -0.01 -1.23 119.66 117.19 1h1m s GLN 233 Ca 0.09 -0.02 -0.01 0.00 0.02 0.00 0.00 55.36 55.43 1h1m s GLN 233 Cb -0.12 -0.36 0.02 0.00 1.00 0.00 0.00 33.01 33.55 1h1m s GLN 233 CO 0.02 -0.03 -0.09 0.42 -2.12 0.00 0.00 175.29 173.50 1h1m s ILE 234 N 0.44 2.80 -0.16 1.08 1.01 -0.18 0.31 121.20 126.51 1h1m s ILE 234 Ca -0.04 -0.90 -0.15 0.00 0.00 0.00 0.00 60.65 59.56 1h1m s ILE 234 Cb -0.07 -2.35 -0.04 0.00 0.01 0.00 0.00 42.46 40.01 1h1m s ILE 234 CO -0.01 0.31 0.33 -0.69 0.00 0.00 0.00 174.94 174.89 1h1m s VAL 235 N 1.35 5.27 -0.48 2.92 1.01 -0.01 -0.79 120.40 129.67 1h1m s VAL 235 Ca 0.02 0.62 -0.05 0.00 0.00 0.00 0.00 61.98 62.58 1h1m s VAL 235 Cb -0.15 -3.67 0.13 0.00 0.00 0.00 0.00 36.38 32.68 1h1m s VAL 235 CO -0.06 0.36 0.31 0.00 0.00 0.00 0.00 175.10 175.70 1h1m s ALA 236 N 0.65 3.33 0.31 5.51 0.00 0.31 -1.73 121.76 130.14 1h1m s ALA 236 Ca 0.18 -2.73 -0.29 0.00 0.00 0.00 0.00 51.96 49.12 1h1m s ALA 236 Cb -0.14 -2.60 -0.11 0.00 0.00 0.00 0.00 23.12 20.28 1h1m s ALA 236 CO 0.05 -1.91 1.47 -2.14 0.00 0.00 0.00 175.76 173.23 1h1m s PRO 237 N 0.89 4.20 -0.13 0.00 0.02 -1.25 -1.60 135.00 137.13 1h1m s PRO 237 Ca 0.10 2.44 0.02 0.00 0.02 0.00 0.00 61.00 63.57 1h1m s PRO 237 Cb -0.23 -3.04 -0.09 0.00 0.02 0.00 0.00 34.50 31.17 1h1m s PRO 237 CO -0.03 -0.47 -0.11 1.19 -0.33 0.00 0.00 177.00 177.25 1h1m n PHE 238 N 1.45 0.00 -4.24 6.54 3.72 0.70 -4.78 117.46 120.86 1h1m n PHE 238 Ca 0.04 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.23 1h1m n PHE 238 Cb 0.39 -0.51 -0.16 0.00 -0.94 0.00 0.00 39.48 38.26 1h1m n PHE 238 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 1h1m s VAL 239 N -2.26 0.69 0.34 -4.37 1.01 -0.28 -4.96 120.40 110.57 1h1m s VAL 239 Ca -0.17 -0.20 0.00 0.00 0.00 0.00 0.00 61.98 61.61 1h1m s VAL 239 Cb 0.04 -0.69 -0.00 0.00 0.00 0.00 0.00 36.38 35.73 1h1m s VAL 239 CO 0.31 0.26 0.01 0.35 0.00 0.00 0.00 175.10 176.04 1h1m n THR 240 N 4.07 0.00 -0.12 3.92 -2.24 -1.26 -2.15 114.28 116.51 1h1m n THR 240 Ca -0.23 -1.65 0.11 0.00 -2.27 0.00 0.00 64.05 60.01 1h1m n THR 240 Cb 0.51 0.37 0.46 0.00 -2.10 0.00 0.00 70.33 69.57 1h1m n THR 240 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1h1m h ALA 241 N 1.22 1.94 -0.43 6.98 0.00 -1.92 0.42 119.26 127.47 1h1m h ALA 241 Ca -0.28 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 54.66 1h1m h ALA 241 Cb 0.87 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.51 1h1m h ALA 241 CO 0.46 -0.08 0.20 1.15 0.00 0.00 0.00 179.25 180.98 1h1m h THR 242 N 0.50 0.94 0.14 0.00 2.02 -1.95 0.05 112.91 114.62 1h1m h THR 242 Ca 0.30 -0.14 -0.34 0.00 0.77 0.00 0.00 66.41 67.00 1h1m h THR 242 Cb 0.50 0.51 -0.00 0.00 -1.74 0.00 0.00 68.15 67.41 1h1m h THR 242 CO -0.09 0.07 -1.74 1.56 0.37 0.00 0.00 175.52 175.69 1h1m h GLN 243 N 0.40 0.30 -0.28 6.66 7.50 -1.59 -3.21 115.11 124.88 1h1m h GLN 243 Ca 0.19 -0.51 -0.06 0.00 0.50 0.00 0.00 58.65 58.76 1h1m h GLN 243 Cb 0.12 0.19 -0.01 0.00 0.05 0.00 0.00 27.48 27.83 1h1m h GLN 243 CO -0.15 1.18 -0.06 0.00 -1.50 0.00 0.00 178.83 178.31 1h1m h ALA 244 N 0.28 0.39 -0.28 3.87 0.00 -0.93 -3.42 119.26 119.17 1h1m h ALA 244 Ca -0.33 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.31 1h1m h ALA 244 Cb 2.06 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.75 1h1m h ALA 244 CO 0.15 0.19 0.00 1.04 0.00 0.00 0.00 179.25 180.63 1h1m n GLN 245 N -4.52 0.00 0.12 0.00 1.13 -0.00 -1.68 117.38 112.44 1h1m n GLN 245 Ca -0.03 0.00 0.12 0.00 -1.94 0.00 0.00 57.00 55.15 1h1m n GLN 245 Cb 0.30 0.00 0.48 0.00 0.11 0.00 0.00 30.24 31.13 1h1m n GLN 245 CO 0.00 0.00 0.00 -0.40 -1.44 0.00 0.00 177.06 175.22 1h1m n ASP 246 N 2.90 0.65 0.29 1.08 5.75 -1.26 -1.30 116.55 124.65 1h1m n ASP 246 Ca 0.00 0.65 0.17 0.00 -0.01 0.00 0.00 54.79 55.61 1h1m n ASP 246 Cb 0.00 -0.79 0.80 0.00 -1.03 0.00 0.00 41.12 40.10 1h1m n ASP 246 CO 0.00 0.00 0.00 0.71 -0.11 0.00 0.00 177.20 177.80 1h1m h THR 247 N 0.00 0.13 -5.42 2.12 1.35 -1.70 -3.47 112.91 105.91 1h1m h THR 247 Ca 0.00 -0.45 -0.13 0.00 -0.55 0.00 0.00 66.41 65.29 1h1m h THR 247 Cb 0.38 1.39 0.10 0.00 -1.73 0.00 0.00 68.15 68.29 1h1m h THR 247 CO 0.00 0.04 -0.44 -3.20 -0.25 0.00 0.00 175.52 171.67 1h1m n ASN 248 N -3.19 -7.22 -3.81 5.36 5.15 -0.42 -4.87 115.26 106.26 1h1m n ASN 248 Ca -0.01 -0.40 -0.07 0.00 -0.60 0.00 0.00 54.58 53.50 1h1m n ASN 248 Cb 0.25 -5.26 -0.02 0.00 -0.53 0.00 0.00 39.78 34.23 1h1m n ASN 248 CO 0.00 0.00 0.00 -0.72 1.40 0.00 0.00 177.26 177.94 1h1m s TYR 249 N -3.20 -0.13 0.11 1.20 1.13 -1.20 -0.68 117.35 114.58 1h1m s TYR 249 Ca 0.23 -0.33 0.01 0.00 -1.41 0.00 0.00 57.07 55.57 1h1m s TYR 249 Cb -0.03 0.68 -0.04 0.00 -1.10 0.00 0.00 41.96 41.47 1h1m s TYR 249 CO 0.75 -1.24 -0.03 0.95 -2.51 0.00 0.00 175.55 173.46 1h1m s THR 250 N -3.83 0.57 -0.13 -3.49 -4.23 0.10 -4.55 115.64 100.08 1h1m s THR 250 Ca 0.12 -1.93 -0.10 0.00 -1.18 0.00 0.00 61.69 58.60 1h1m s THR 250 Cb -0.06 -1.79 0.04 0.00 1.34 0.00 0.00 72.50 72.04 1h1m s THR 250 CO 0.07 -0.77 0.34 -0.22 -0.54 0.00 0.00 174.62 173.51 1h1m s LEU 251 N -3.06 0.48 0.29 4.79 2.96 -0.91 -1.24 118.68 121.99 1h1m s LEU 251 Ca 0.15 0.70 -0.19 0.00 -0.22 0.00 0.00 54.13 54.57 1h1m s LEU 251 Cb 0.06 1.13 0.06 0.00 0.50 0.00 0.00 46.19 47.94 1h1m s LEU 251 CO -0.03 -0.14 0.89 -0.94 -1.32 0.00 0.00 176.35 174.81 1h1m s SER 252 N 0.64 -0.03 0.08 3.68 1.04 -0.50 -0.21 113.70 118.40 1h1m s SER 252 Ca -0.04 -0.88 0.02 0.00 0.48 0.00 0.00 55.95 55.53 1h1m s SER 252 Cb -0.05 0.68 -0.04 0.00 0.10 0.00 0.00 66.02 66.71 1h1m s SER 252 CO -0.04 -1.35 0.13 0.42 0.98 0.00 0.00 173.24 173.39 1h1m s THR 253 N -2.43 4.86 -0.13 2.02 -4.23 -0.63 -0.46 115.64 114.64 1h1m s THR 253 Ca 0.17 -0.64 0.02 0.00 -1.18 0.00 0.00 61.69 60.07 1h1m s THR 253 Cb -0.04 -3.36 0.00 0.00 1.34 0.00 0.00 72.50 70.44 1h1m s THR 253 CO 0.08 0.12 -0.20 -0.63 -0.54 0.00 0.00 174.62 173.45 1h1m s ILE 254 N -1.45 2.27 0.03 2.99 1.01 -0.41 -0.53 121.20 125.10 1h1m s ILE 254 Ca 0.31 -0.92 0.02 0.00 0.00 0.00 0.00 60.65 60.06 1h1m s ILE 254 Cb -0.12 -1.91 -0.04 0.00 0.01 0.00 0.00 42.46 40.40 1h1m s ILE 254 CO 0.24 0.54 0.05 -0.44 0.00 0.00 0.00 174.94 175.33 1h1m s SER 255 N 0.68 5.39 -0.00 3.58 0.01 0.03 -0.94 113.70 122.45 1h1m s SER 255 Ca -0.10 0.03 -0.01 0.00 1.31 0.00 0.00 55.95 57.18 1h1m s SER 255 Cb -0.16 -1.46 -0.00 0.00 0.21 0.00 0.00 66.02 64.61 1h1m s SER 255 CO 0.01 0.24 0.02 -0.04 0.41 0.00 0.00 173.24 173.89 1h1m s MET 256 N -1.89 0.16 0.82 12.44 1.00 0.64 -1.01 119.30 131.46 1h1m s MET 256 Ca 0.24 -0.21 -0.05 0.00 0.00 0.00 0.00 55.69 55.67 1h1m s MET 256 Cb -0.12 0.06 0.17 0.00 0.00 0.00 0.00 34.83 34.94 1h1m s MET 256 CO 0.15 -0.03 1.12 -1.54 0.00 0.00 0.00 175.02 174.72 1h1m s SER 257 N -0.58 3.80 0.91 3.03 1.04 -0.36 -1.52 113.70 120.02 1h1m s SER 257 Ca -0.06 -0.29 -0.12 0.00 0.48 0.00 0.00 55.95 55.96 1h1m s SER 257 Cb -0.04 0.10 0.13 0.00 0.10 0.00 0.00 66.02 66.31 1h1m s SER 257 CO -0.00 -2.25 1.09 0.42 0.98 0.00 0.00 173.24 173.49 1h1m s THR 258 N -3.41 2.59 -0.23 2.02 -4.23 -1.25 -4.26 115.64 106.87 1h1m s THR 258 Ca 0.70 0.19 -0.16 0.00 -1.18 0.00 0.00 61.69 61.25 1h1m s THR 258 Cb -0.04 -2.69 -0.04 0.00 1.34 0.00 0.00 72.50 71.08 1h1m s THR 258 CO 0.48 -0.25 0.40 -0.89 -0.54 0.00 0.00 174.62 173.82 1h1m s THR 259 N -2.95 5.17 0.54 3.99 2.01 -1.26 -4.47 115.64 118.68 1h1m s THR 259 Ca 0.64 0.67 -0.21 0.00 0.31 0.00 0.00 61.69 63.10 1h1m s THR 259 Cb -0.18 -3.73 -0.05 0.00 0.01 0.00 0.00 72.50 68.55 1h1m s THR 259 CO 0.57 0.20 1.31 -2.84 -0.69 0.00 0.00 174.62 173.16 1h1m s PRO 260 N 1.72 3.20 0.60 4.92 0.02 -1.26 -4.87 135.00 139.32 1h1m s PRO 260 Ca 0.18 2.11 0.40 0.00 0.02 0.00 0.00 61.00 63.71 1h1m s PRO 260 Cb -0.15 -2.23 2.11 0.00 0.02 0.00 0.00 34.50 34.25 1h1m s PRO 260 CO 0.09 -1.11 2.22 0.66 -0.33 0.00 0.00 177.00 178.54 1h1m h SER 261 N 1.46 0.00 -0.17 2.53 4.64 -2.04 -0.73 113.55 119.25 1h1m h SER 261 Ca -0.51 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.81 1h1m h SER 261 Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 1h1m h SER 261 CO 0.57 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.88 1h1m n THR 262 N -2.97 0.21 -4.68 2.95 -2.24 -1.26 -4.83 114.28 101.46 1h1m n THR 262 Ca -0.02 -0.39 -0.33 0.00 -2.27 0.00 0.00 64.05 61.03 1h1m n THR 262 Cb 0.10 0.53 -0.14 0.00 -2.10 0.00 0.00 70.33 68.73 1h1m n THR 262 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1h1m s VAL 263 N -1.79 3.29 0.05 2.28 1.01 -0.28 -5.09 120.40 119.86 1h1m s VAL 263 Ca 0.34 -0.58 -0.28 0.00 0.00 0.00 0.00 61.98 61.46 1h1m s VAL 263 Cb 0.19 -2.39 -0.05 0.00 0.00 0.00 0.00 36.38 34.13 1h1m s VAL 263 CO 0.28 0.52 0.89 -0.89 0.00 0.00 0.00 175.10 175.91 1h1m s THR 264 N 0.28 4.71 0.03 3.92 2.01 -1.26 -4.73 115.64 120.59 1h1m s THR 264 Ca -0.08 1.90 -0.30 0.00 0.31 0.00 0.00 61.69 63.52 1h1m s THR 264 Cb -0.15 -4.24 -0.07 0.00 0.01 0.00 0.00 72.50 68.04 1h1m s THR 264 CO 0.05 0.28 1.66 -0.69 -0.69 0.00 0.00 174.62 175.23 1h1m s VAL 265 N 0.34 3.23 0.62 3.82 1.01 -1.26 -4.94 120.40 123.22 1h1m s VAL 265 Ca 0.45 0.55 -0.16 0.00 0.00 0.00 0.00 61.98 62.82 1h1m s VAL 265 Cb -0.21 -3.35 -0.02 0.00 0.00 0.00 0.00 36.38 32.79 1h1m s VAL 265 CO 0.26 -0.02 1.09 -2.16 0.00 0.00 0.00 175.10 174.28 1h1m s PRO 266 N 3.18 3.07 -0.04 2.72 0.04 -1.26 -5.02 135.00 137.68 1h1m s PRO 266 Ca 0.74 1.36 -0.13 0.00 0.04 0.00 0.00 61.00 63.02 1h1m s PRO 266 Cb -0.38 -1.99 -0.05 0.00 0.04 0.00 0.00 34.50 32.12 1h1m s PRO 266 CO 0.32 -1.03 0.34 0.99 0.04 0.00 0.00 177.00 177.66 1h1m s THR 267 N -2.29 5.15 0.04 1.26 2.01 -1.26 -4.48 115.64 116.08 1h1m s THR 267 Ca 0.67 0.68 0.09 0.00 0.31 0.00 0.00 61.69 63.44 1h1m s THR 267 Cb -0.19 -3.64 -0.03 0.00 0.01 0.00 0.00 72.50 68.65 1h1m s THR 267 CO 0.37 0.58 -0.26 0.26 -0.69 0.00 0.00 174.62 174.88 1h1m s TRP 268 N -0.98 2.29 -0.18 4.92 0.52 0.00 -4.95 118.94 120.55 1h1m s TRP 268 Ca 0.21 -0.41 -0.04 0.00 0.02 0.00 0.00 56.10 55.88 1h1m s TRP 268 Cb -0.15 -1.37 0.09 0.00 -1.15 0.00 0.00 33.47 30.89 1h1m s TRP 268 CO 0.11 0.12 0.30 0.45 0.02 0.00 0.00 176.95 177.95 1h1m s SER 269 N -1.23 0.49 0.24 2.95 0.15 -1.26 -1.00 113.70 114.04 1h1m s SER 269 Ca 0.11 0.36 0.07 0.00 0.70 0.00 0.00 55.95 57.20 1h1m s SER 269 Cb -0.10 0.81 -0.04 0.00 -1.71 0.00 0.00 66.02 64.98 1h1m s SER 269 CO 0.02 -0.27 0.17 -0.36 1.20 0.00 0.00 173.24 174.00 1h1m s PHE 270 N 2.45 3.08 0.29 3.44 0.08 -1.26 -4.86 117.98 121.20 1h1m s PHE 270 Ca 0.05 -0.10 -0.02 0.00 0.12 0.00 0.00 56.93 56.97 1h1m s PHE 270 Cb -0.14 -1.40 0.41 0.00 -0.57 0.00 0.00 43.02 41.32 1h1m s PHE 270 CO -0.12 0.53 1.92 -1.35 -0.10 0.00 0.00 175.22 176.11 1h1m h PRO 271 N 1.68 1.05 -6.34 0.24 0.11 -1.91 0.15 132.00 126.98 1h1m h PRO 271 Ca -0.48 -0.10 -0.60 0.00 0.11 0.00 0.00 66.00 64.93 1h1m h PRO 271 Cb 1.23 -0.22 -0.12 0.00 0.11 0.00 0.00 31.00 32.01 1h1m h PRO 271 CO 0.61 0.75 -0.67 0.20 -0.21 0.00 0.00 178.00 178.68 1h1m s GLY 272 N -3.36 1.71 0.69 -0.55 0.00 -1.25 -4.26 107.32 100.29 1h1m s GLY 272 Ca -0.11 -1.47 -0.17 0.00 0.00 0.00 0.00 44.72 42.97 1h1m s GLY 272 CO 0.80 -1.50 1.26 0.00 0.00 0.00 0.00 173.10 173.66 1h1m s ALA 273 N -1.86 2.23 0.16 3.20 0.00 -1.26 -3.86 121.76 120.36 1h1m s ALA 273 Ca 0.28 1.08 -0.07 0.00 0.00 0.00 0.00 51.96 53.25 1h1m s ALA 273 Cb -0.08 -3.52 -0.02 0.00 0.00 0.00 0.00 23.12 19.49 1h1m s ALA 273 CO 0.18 -1.77 0.23 0.00 0.00 0.00 0.00 175.76 174.39 1h1m s ALA 275 N -4.00 -1.34 0.04 0.00 0.00 0.03 -0.89 121.76 115.60 1h1m s ALA 275 Ca 0.21 0.57 -0.03 0.00 0.00 0.00 0.00 51.96 52.71 1h1m s ALA 275 Cb 0.04 0.44 -0.02 0.00 0.00 0.00 0.00 23.12 23.58 1h1m s ALA 275 CO 0.02 -0.53 0.04 -0.59 0.00 0.00 0.00 175.76 174.69 1h1m s PHE 276 N -2.61 0.32 -0.10 0.00 -0.12 -0.76 -0.54 117.98 114.16 1h1m s PHE 276 Ca -0.04 -0.72 0.03 0.00 -0.05 0.00 0.00 56.93 56.15 1h1m s PHE 276 Cb -0.00 -0.23 0.01 0.00 -0.63 0.00 0.00 43.02 42.16 1h1m s PHE 276 CO -0.03 -0.36 -0.20 -1.14 -0.05 0.00 0.00 175.22 173.44 1h1m s GLN 277 N -3.02 2.62 0.18 1.99 0.74 0.16 -1.27 119.66 121.07 1h1m s GLN 277 Ca -0.01 -0.72 -0.30 0.00 0.05 0.00 0.00 55.36 54.37 1h1m s GLN 277 Cb 0.01 -2.07 -0.08 0.00 1.10 0.00 0.00 33.01 31.97 1h1m s GLN 277 CO -0.07 0.06 1.30 0.08 -0.55 0.00 0.00 175.29 176.12 1h1m s VAL 278 N 0.63 3.30 -0.20 1.34 1.01 -0.76 -0.17 120.40 125.55 1h1m s VAL 278 Ca -0.13 1.04 -0.05 0.00 0.00 0.00 0.00 61.98 62.84 1h1m s VAL 278 Cb -0.16 -3.67 -0.11 0.00 0.00 0.00 0.00 36.38 32.44 1h1m s VAL 278 CO 0.04 0.14 -0.22 0.00 0.00 0.00 0.00 175.10 175.06 1h1m n GLN 279 N 2.88 0.46 -3.88 2.72 1.13 -0.08 0.22 117.38 120.83 1h1m n GLN 279 Ca 0.07 0.16 -0.12 0.00 -1.94 0.00 0.00 57.00 55.17 1h1m n GLN 279 Cb 0.43 -1.30 -0.13 0.00 0.11 0.00 0.00 30.24 29.34 1h1m n GLN 279 CO 0.00 0.00 0.00 -2.00 -1.44 0.00 0.00 177.06 173.62 1h1m s GLU 280 N -2.38 0.08 0.11 -1.09 2.12 -0.88 -4.67 118.70 111.99 1h1m s GLU 280 Ca -0.28 -0.06 0.00 0.00 0.36 0.00 0.00 54.97 55.00 1h1m s GLU 280 Cb 0.09 0.03 0.00 0.00 0.26 0.00 0.00 34.13 34.51 1h1m s GLU 280 CO 0.40 -0.01 0.00 0.41 -0.54 0.00 0.00 175.26 175.52 1h1m n GLY 281 N 2.84 -1.89 2.78 -1.50 0.00 -1.26 -1.01 105.19 105.15 1h1m n GLY 281 Ca -0.14 -1.97 -0.16 0.00 0.00 0.00 0.00 46.02 43.75 1h1m n GLY 281 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1h1m s ARG 282 N 0.00 0.23 -0.09 1.61 0.52 -1.26 -4.32 118.95 115.63 1h1m s ARG 282 Ca 0.00 0.25 0.04 0.00 -0.52 0.00 0.00 55.73 55.50 1h1m s ARG 282 Cb 0.00 -1.05 -0.01 0.00 0.52 0.00 0.00 34.95 34.42 1h1m s ARG 282 CO 0.00 -0.67 -0.21 0.08 0.02 0.00 0.00 175.30 174.52 1h1m s VAL 283 N 2.37 2.34 -0.20 3.52 1.01 -0.68 -0.32 120.40 128.44 1h1m s VAL 283 Ca 0.08 -0.93 -0.11 0.00 0.00 0.00 0.00 61.98 61.02 1h1m s VAL 283 Cb -0.16 -1.91 -0.05 0.00 0.00 0.00 0.00 36.38 34.27 1h1m s VAL 283 CO -0.14 0.56 0.17 -0.69 0.00 0.00 0.00 175.10 175.00 1h1m s VAL 284 N 0.15 5.38 -0.07 2.92 1.01 0.68 -0.44 120.40 130.03 1h1m s VAL 284 Ca -0.11 0.26 0.06 0.00 0.00 0.00 0.00 61.98 62.18 1h1m s VAL 284 Cb -0.16 -3.51 -0.01 0.00 0.00 0.00 0.00 36.38 32.70 1h1m s VAL 284 CO 0.06 0.40 -0.24 0.54 0.00 0.00 0.00 175.10 175.86 1h1m s VAL 285 N 0.58 2.09 -0.29 2.92 0.11 0.45 -1.57 120.40 124.69 1h1m s VAL 285 Ca 0.09 -1.05 0.02 0.00 -2.93 0.00 0.00 61.98 58.12 1h1m s VAL 285 Cb -0.12 -1.76 0.08 0.00 -1.53 0.00 0.00 36.38 33.05 1h1m s VAL 285 CO 0.01 0.57 0.01 -1.58 -3.33 0.00 0.00 175.10 170.78 1h1m s GLN 286 N -0.08 1.43 -0.12 1.54 0.74 0.11 -0.52 119.66 122.76 1h1m s GLN 286 Ca -0.06 -1.37 0.01 0.00 0.05 0.00 0.00 55.36 53.99 1h1m s GLN 286 Cb -0.14 -2.72 -0.01 0.00 1.10 0.00 0.00 33.01 31.24 1h1m s GLN 286 CO 0.05 -0.80 -0.15 0.42 -0.55 0.00 0.00 175.29 174.25 1h1m s ILE 287 N 1.23 2.88 0.00 -2.34 1.01 -1.26 -1.31 121.20 121.42 1h1m s ILE 287 Ca 0.03 -0.73 0.00 0.00 0.00 0.00 0.00 60.65 59.96 1h1m s ILE 287 Cb -0.19 -2.19 0.00 0.00 0.01 0.00 0.00 42.46 40.09 1h1m s ILE 287 CO -0.11 0.53 0.00 0.61 0.00 0.00 0.00 174.94 175.98 1h1m n GLY 288 N 3.45 3.36 1.26 6.18 0.00 0.28 -1.89 105.19 117.83 1h1m n GLY 288 Ca -0.18 -0.10 0.12 0.00 0.00 0.00 0.00 46.02 45.86 1h1m n GLY 288 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1h1m n ASP 289 N 3.93 3.70 -4.85 1.61 8.00 -1.26 -4.99 116.55 122.68 1h1m n ASP 289 Ca 0.00 -1.99 -0.31 0.00 0.71 0.00 0.00 54.79 53.20 1h1m n ASP 289 Cb 0.00 -0.38 0.04 0.00 -0.02 0.00 0.00 41.12 40.75 1h1m n ASP 289 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1h1m s TYR 290 N -1.23 3.35 0.40 1.24 2.02 -0.79 -5.02 117.35 117.30 1h1m s TYR 290 Ca 0.44 1.26 -0.26 0.00 -0.37 0.00 0.00 57.07 58.15 1h1m s TYR 290 Cb 0.24 -2.87 -0.09 0.00 -0.40 0.00 0.00 41.96 38.84 1h1m s TYR 290 CO 0.33 -1.05 1.32 0.00 -1.57 0.00 0.00 175.55 174.58 1h1m s ALA 291 N -3.17 3.31 -0.05 3.71 0.00 -1.26 -4.33 121.76 119.96 1h1m s ALA 291 Ca 0.57 1.26 -0.35 0.00 0.00 0.00 0.00 51.96 53.44 1h1m s ALA 291 Cb -0.12 -3.50 -0.13 0.00 0.00 0.00 0.00 23.12 19.37 1h1m s ALA 291 CO 0.54 -0.83 1.74 0.00 0.00 0.00 0.00 175.76 177.21 1h1m n ALA 292 N 0.22 0.65 -2.99 0.00 0.00 -1.26 -4.67 120.51 112.45 1h1m n ALA 292 Ca 0.03 0.36 -0.25 0.00 0.00 0.00 0.00 53.44 53.58 1h1m n ALA 292 Cb 0.43 -2.38 -0.16 0.00 0.00 0.00 0.00 19.45 17.34 1h1m n ALA 292 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1h1m s THR 293 N 2.92 1.30 -0.15 0.00 2.01 0.32 -4.91 115.64 117.14 1h1m s THR 293 Ca 0.90 -0.64 -0.15 0.00 0.31 0.00 0.00 61.69 62.11 1h1m s THR 293 Cb -0.78 -1.13 -0.05 0.00 0.01 0.00 0.00 72.50 70.56 1h1m s THR 293 CO 0.50 0.38 0.34 -0.70 -0.69 0.00 0.00 174.62 174.45 1h1m s GLU 294 N 0.14 4.28 -0.10 4.92 2.12 -1.26 -0.41 118.70 128.38 1h1m s GLU 294 Ca -0.05 0.18 -0.02 0.00 0.36 0.00 0.00 54.97 55.44 1h1m s GLU 294 Cb -0.12 -3.43 -0.03 0.00 0.26 0.00 0.00 34.13 30.81 1h1m s GLU 294 CO 0.02 0.21 -0.02 -0.51 -0.54 0.00 0.00 175.26 174.42 1h1m s LEU 295 N 0.54 3.42 0.00 2.70 1.02 0.41 -4.93 118.68 121.83 1h1m s LEU 295 Ca 0.19 0.04 0.00 0.00 0.02 0.00 0.00 54.13 54.38 1h1m s LEU 295 Cb -0.13 -1.78 0.00 0.00 0.02 0.00 0.00 46.19 44.29 1h1m s LEU 295 CO 0.05 0.32 0.00 0.61 0.02 0.00 0.00 176.35 177.36 1h1m n GLY 296 N 2.50 3.40 3.68 -3.19 0.00 -1.26 -1.69 105.19 108.62 1h1m n GLY 296 Ca -0.18 -2.14 -0.45 0.00 0.00 0.00 0.00 46.02 43.25 1h1m n GLY 296 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1h1m n SER 297 N -1.62 3.02 0.00 1.61 3.41 -1.26 -1.44 113.62 117.35 1h1m n SER 297 Ca 0.00 1.11 0.00 0.00 -0.26 0.00 0.00 58.87 59.72 1h1m n SER 297 Cb 0.00 -1.44 0.00 0.00 -0.26 0.00 0.00 64.21 62.51 1h1m n SER 297 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1h1m n GLY 298 N 2.78 2.78 3.79 5.00 0.00 0.13 -4.54 105.19 115.13 1h1m n GLY 298 Ca 0.14 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.82 1h1m n GLY 298 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1h1m s ASP 299 N -3.79 6.25 -0.04 1.61 1.01 -0.52 -3.64 116.67 117.54 1h1m s ASP 299 Ca 0.00 1.98 0.05 0.00 0.71 0.00 0.00 52.55 55.29 1h1m s ASP 299 Cb 0.00 -2.57 -0.01 0.00 1.01 0.00 0.00 42.92 41.36 1h1m s ASP 299 CO 0.00 -0.85 -0.19 -0.69 0.21 0.00 0.00 175.17 173.65 1h1m s VAL 300 N -1.92 1.58 -0.05 -1.27 1.01 0.10 -1.82 120.40 118.02 1h1m s VAL 300 Ca 0.68 -0.81 0.04 0.00 0.00 0.00 0.00 61.98 61.90 1h1m s VAL 300 Cb -0.18 -1.34 -0.02 0.00 0.00 0.00 0.00 36.38 34.83 1h1m s VAL 300 CO 0.22 0.45 -0.17 0.00 0.00 0.00 0.00 175.10 175.60 1h1m s ALA 301 N -0.06 2.55 -0.09 5.51 0.00 -0.39 -1.03 121.76 128.25 1h1m s ALA 301 Ca -0.02 -1.00 0.02 0.00 0.00 0.00 0.00 51.96 50.96 1h1m s ALA 301 Cb -0.12 -0.90 0.01 0.00 0.00 0.00 0.00 23.12 22.12 1h1m s ALA 301 CO 0.02 0.53 -0.16 0.12 0.00 0.00 0.00 175.76 176.28 1h1m s PHE 302 N -0.63 1.89 -0.21 0.00 5.36 0.60 -1.83 117.98 123.15 1h1m s PHE 302 Ca 0.09 -0.81 0.01 0.00 -0.96 0.00 0.00 56.93 55.27 1h1m s PHE 302 Cb -0.11 -1.35 0.03 0.00 -0.34 0.00 0.00 43.02 41.25 1h1m s PHE 302 CO 0.01 -0.40 -0.16 0.42 -1.46 0.00 0.00 175.22 173.63 1h1m s ILE 303 N 0.77 2.18 0.61 3.12 1.09 -0.07 -2.21 121.20 126.70 1h1m s ILE 303 Ca -0.11 -1.17 -0.19 0.00 -1.10 0.00 0.00 60.65 58.08 1h1m s ILE 303 Cb -0.16 -2.06 -0.03 0.00 -1.06 0.00 0.00 42.46 39.16 1h1m s ILE 303 CO 0.02 0.33 1.17 -2.65 -0.10 0.00 0.00 174.94 173.71 1h1m n PRO 304 N 4.56 1.12 -1.66 2.79 -0.02 -1.26 -1.48 135.00 139.05 1h1m n PRO 304 Ca -0.18 0.43 -0.39 0.00 -2.02 0.00 0.00 63.50 61.33 1h1m n PRO 304 Cb 0.47 -2.39 0.03 0.00 -0.02 0.00 0.00 33.50 31.59 1h1m n PRO 304 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1h1m n GLY 305 N 1.04 0.09 2.74 -1.23 0.00 -1.25 -2.27 105.19 104.31 1h1m n GLY 305 Ca 0.14 0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1h1m n GLY 305 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h1m n GLY 306 N 1.06 0.94 3.62 -0.02 0.00 0.51 -4.89 105.19 106.41 1h1m n GLY 306 Ca 0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.78 1h1m n GLY 306 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1h1m s VAL 307 N -3.76 4.55 0.28 1.61 1.01 -0.96 -4.95 120.40 118.19 1h1m s VAL 307 Ca 0.00 -0.12 -0.29 0.00 0.00 0.00 0.00 61.98 61.56 1h1m s VAL 307 Cb 0.00 -3.02 -0.10 0.00 0.00 0.00 0.00 36.38 33.26 1h1m s VAL 307 CO 0.00 0.49 1.11 -1.61 0.00 0.00 0.00 175.10 175.09 1h1m s GLU 308 N 0.17 4.62 0.10 2.72 2.02 -1.26 -4.55 118.70 122.52 1h1m s GLU 308 Ca 0.03 1.82 -0.14 0.00 0.02 0.00 0.00 54.97 56.70 1h1m s GLU 308 Cb -0.13 -3.18 0.02 0.00 0.10 0.00 0.00 34.13 30.95 1h1m s GLU 308 CO 0.01 0.19 0.33 -0.59 0.02 0.00 0.00 175.26 175.22 1h1m s PHE 309 N -1.17 -0.09 0.04 1.61 -0.71 -0.17 -0.56 117.98 116.93 1h1m s PHE 309 Ca 0.45 -0.23 0.06 0.00 -1.04 0.00 0.00 56.93 56.17 1h1m s PHE 309 Cb -0.32 0.14 -0.02 0.00 -1.21 0.00 0.00 43.02 41.61 1h1m s PHE 309 CO 0.41 -0.63 -0.18 0.15 -1.34 0.00 0.00 175.22 173.64 1h1m s LYS 310 N -3.62 1.18 0.06 1.99 1.02 -0.43 -0.82 119.74 119.13 1h1m s LYS 310 Ca 0.02 -0.85 -0.00 0.00 0.02 0.00 0.00 55.97 55.16 1h1m s LYS 310 Cb 0.02 -1.25 -0.04 0.00 -0.52 0.00 0.00 37.83 36.05 1h1m s LYS 310 CO -0.10 0.32 -0.04 1.52 -0.92 0.00 0.00 175.35 176.12 1h1m s TYR 311 N -0.80 0.58 0.14 3.18 1.13 -1.26 0.05 117.35 120.37 1h1m s TYR 311 Ca 0.05 -0.94 -0.24 0.00 -1.41 0.00 0.00 57.07 54.53 1h1m s TYR 311 Cb -0.08 -0.39 0.07 0.00 -1.10 0.00 0.00 41.96 40.46 1h1m s TYR 311 CO 0.01 -0.29 0.63 1.52 -2.51 0.00 0.00 175.55 174.92 1h1m s TYR 312 N -3.41 -0.52 -0.21 -3.49 -0.85 -0.60 -4.85 117.35 103.42 1h1m s TYR 312 Ca 0.04 0.31 -0.16 0.00 -0.52 0.00 0.00 57.07 56.75 1h1m s TYR 312 Cb 0.04 0.56 -0.04 0.00 0.38 0.00 0.00 41.96 42.90 1h1m s TYR 312 CO -0.07 -0.82 0.40 0.45 -1.52 0.00 0.00 175.55 173.99 1h1m s SER 313 N -2.72 6.43 0.06 -0.18 0.15 -1.26 -0.23 113.70 115.95 1h1m s SER 313 Ca 0.01 0.51 0.14 0.00 0.70 0.00 0.00 55.95 57.31 1h1m s SER 313 Cb -0.01 -2.23 -0.15 0.00 -1.71 0.00 0.00 66.02 61.91 1h1m s SER 313 CO -0.12 -0.09 0.92 -0.08 1.20 0.00 0.00 173.24 175.07 1h1m h GLU 314 N 7.42 0.00 -7.09 5.44 4.57 -1.02 -3.40 114.58 120.50 1h1m h GLU 314 Ca -0.36 0.00 -0.46 0.00 -1.18 0.00 0.00 59.36 57.36 1h1m h GLU 314 Cb 1.16 0.00 0.02 0.00 -0.16 0.00 0.00 28.75 29.77 1h1m h GLU 314 CO 0.71 0.50 0.37 0.00 -1.18 0.00 0.00 179.01 179.41 1h1m s ALA 315 N -2.78 2.92 0.51 2.92 0.00 -1.04 -4.95 121.76 119.34 1h1m s ALA 315 Ca -0.02 0.49 0.21 0.00 0.00 0.00 0.00 51.96 52.63 1h1m s ALA 315 Cb 0.08 -3.21 1.28 0.00 0.00 0.00 0.00 23.12 21.28 1h1m s ALA 315 CO 0.81 -0.23 2.03 1.88 0.00 0.00 0.00 175.76 180.25 1h1m h TYR 316 N 1.48 0.10 -3.47 0.00 0.05 -1.91 -3.38 116.97 109.85 1h1m h TYR 316 Ca -0.49 0.00 -0.29 0.00 0.05 0.00 0.00 58.73 58.01 1h1m h TYR 316 Cb 1.21 -0.03 -0.33 0.00 1.01 0.00 0.00 36.73 38.58 1h1m h TYR 316 CO 0.59 0.05 -0.70 0.12 -1.05 0.00 0.00 178.16 177.16 1h1m s PHE 317 N -5.11 -0.01 0.11 4.88 2.19 -1.26 -3.88 117.98 114.90 1h1m s PHE 317 Ca -0.06 0.20 0.05 0.00 0.33 0.00 0.00 56.93 57.46 1h1m s PHE 317 Cb 0.19 -0.21 -0.04 0.00 -1.31 0.00 0.00 43.02 41.66 1h1m s PHE 317 CO 0.72 -0.10 -0.13 -1.12 1.83 0.00 0.00 175.22 176.41 1h1m s SER 318 N 1.09 1.84 -0.02 6.13 0.01 -0.58 -4.34 113.70 117.83 1h1m s SER 318 Ca -0.09 -0.77 0.02 0.00 1.31 0.00 0.00 55.95 56.42 1h1m s SER 318 Cb -0.13 -0.05 0.01 0.00 0.21 0.00 0.00 66.02 66.06 1h1m s SER 318 CO -0.04 -0.15 -0.06 -0.75 0.41 0.00 0.00 173.24 172.66 1h1m s LYS 319 N -2.49 0.65 0.10 12.44 2.20 -0.18 -0.26 119.74 132.20 1h1m s LYS 319 Ca 0.06 -0.18 0.05 0.00 -0.36 0.00 0.00 55.97 55.54 1h1m s LYS 319 Cb -0.06 -0.64 -0.04 0.00 -1.51 0.00 0.00 37.83 35.59 1h1m s LYS 319 CO 0.02 0.05 -0.13 0.14 -0.36 0.00 0.00 175.35 175.08 1h1m s VAL 320 N 0.29 1.17 -0.16 4.02 -7.23 -0.12 -0.90 120.40 117.47 1h1m s VAL 320 Ca -0.03 -1.61 -0.15 0.00 -1.81 0.00 0.00 61.98 58.38 1h1m s VAL 320 Cb -0.08 -1.38 -0.04 0.00 0.56 0.00 0.00 36.38 35.44 1h1m s VAL 320 CO -0.00 -0.42 0.35 -0.22 -0.31 0.00 0.00 175.10 174.50 1h1m s LEU 321 N -2.30 4.24 -0.06 1.32 2.96 0.76 -1.29 118.68 124.31 1h1m s LEU 321 Ca 0.06 0.57 0.03 0.00 -0.22 0.00 0.00 54.13 54.57 1h1m s LEU 321 Cb -0.05 -2.46 0.00 0.00 0.50 0.00 0.00 46.19 44.18 1h1m s LEU 321 CO 0.02 0.05 -0.15 0.12 -1.32 0.00 0.00 176.35 175.07 1h1m s PHE 322 N 0.62 1.65 0.00 5.38 5.36 0.39 -0.66 117.98 130.73 1h1m s PHE 322 Ca 0.19 -0.54 0.04 0.00 -0.96 0.00 0.00 56.93 55.65 1h1m s PHE 322 Cb -0.14 -1.14 -0.01 0.00 -0.34 0.00 0.00 43.02 41.39 1h1m s PHE 322 CO 0.06 -0.23 -0.13 0.54 -1.46 0.00 0.00 175.22 174.00 1h1m s VAL 323 N 0.30 1.00 -0.00 3.12 0.11 0.30 -1.41 120.40 123.82 1h1m s VAL 323 Ca -0.09 -0.66 0.01 0.00 -2.93 0.00 0.00 61.98 58.31 1h1m s VAL 323 Cb -0.13 -0.86 -0.00 0.00 -1.53 0.00 0.00 36.38 33.85 1h1m s VAL 323 CO 0.03 0.19 -0.04 -0.55 -3.33 0.00 0.00 175.10 171.41 1h1m s SER 324 N -0.53 0.50 0.01 3.54 0.15 -0.37 -0.79 113.70 116.20 1h1m s SER 324 Ca 0.04 -0.07 -0.27 0.00 0.70 0.00 0.00 55.95 56.34 1h1m s SER 324 Cb -0.06 -0.07 -0.04 0.00 -1.71 0.00 0.00 66.02 64.14 1h1m s SER 324 CO -0.00 0.04 0.85 -0.55 1.20 0.00 0.00 173.24 174.78 1h1m s SER 325 N -0.05 7.25 0.00 5.45 0.15 -0.04 -0.72 113.70 125.74 1h1m s SER 325 Ca 0.01 1.50 0.00 0.00 0.70 0.00 0.00 55.95 58.16 1h1m s SER 325 Cb -0.02 -2.50 0.00 0.00 -1.71 0.00 0.00 66.02 61.78 1h1m s SER 325 CO -0.00 -0.12 0.00 0.61 1.20 0.00 0.00 173.24 174.93 1h1m n GLY 326 N 2.72 1.88 0.42 9.45 0.00 0.14 -3.97 105.19 115.84 1h1m n GLY 326 Ca 0.01 -2.10 0.11 0.00 0.00 0.00 0.00 46.02 44.05 1h1m n GLY 326 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1h1m n SER 327 N 0.00 1.83 -2.44 1.61 3.41 -1.26 -3.24 113.62 113.53 1h1m n SER 327 Ca 0.00 -1.40 -0.13 0.00 -0.26 0.00 0.00 58.87 57.08 1h1m n SER 327 Cb 0.00 0.51 0.03 0.00 -0.26 0.00 0.00 64.21 64.49 1h1m n SER 327 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1h1m n ASP 328 N -0.25 3.28 -2.79 4.04 8.00 -1.26 -4.88 116.55 122.69 1h1m n ASP 328 Ca 0.09 -2.95 -0.12 0.00 0.71 0.00 0.00 54.79 52.51 1h1m n ASP 328 Cb 0.44 -0.42 0.09 0.00 -0.02 0.00 0.00 41.12 41.21 1h1m n ASP 328 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1h1m n GLY 329 N -0.61 -1.43 0.27 0.44 0.00 -1.26 -4.63 105.19 97.97 1h1m n GLY 329 Ca 0.26 -1.66 -0.07 0.00 0.00 0.00 0.00 46.02 44.55 1h1m n GLY 329 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1h1m h LEU 330 N 0.00 -0.74 -0.47 0.99 5.85 -1.97 -0.25 115.31 118.71 1h1m h LEU 330 Ca -0.18 0.15 0.04 0.00 0.84 0.00 0.00 57.88 58.73 1h1m h LEU 330 Cb 0.49 0.37 -0.04 0.00 0.37 0.00 0.00 40.66 41.85 1h1m h LEU 330 CO 0.12 -0.26 0.25 -2.24 -0.34 0.00 0.00 178.44 175.97 1h1m h ASP 331 N -0.19 0.37 -0.20 1.25 2.03 -1.97 -0.44 116.42 117.27 1h1m h ASP 331 Ca 0.16 0.02 -0.11 0.00 -0.73 0.00 0.00 57.03 56.37 1h1m h ASP 331 Cb 0.45 -0.05 -0.01 0.00 -0.83 0.00 0.00 39.33 38.88 1h1m h ASP 331 CO -0.43 0.26 -0.24 -0.61 -1.03 0.00 0.00 179.24 177.18 1h1m h GLN 332 N 0.49 0.66 -0.29 4.15 5.75 -1.75 -0.83 115.11 123.29 1h1m h GLN 332 Ca 0.20 -0.26 0.01 0.00 -0.15 0.00 0.00 58.65 58.45 1h1m h GLN 332 Cb 0.09 -0.03 -0.02 0.00 1.07 0.00 0.00 27.48 28.59 1h1m h GLN 332 CO -0.13 0.84 0.18 -0.97 -2.65 0.00 0.00 178.83 176.10 1h1m h ASN 333 N 0.58 0.30 -0.35 -0.69 -0.73 -0.62 0.14 115.58 114.21 1h1m h ASN 333 Ca 0.08 -0.00 -0.09 0.00 1.87 0.00 0.00 56.30 58.16 1h1m h ASN 333 Cb 0.72 -0.07 -0.02 0.00 0.27 0.00 0.00 38.32 39.23 1h1m h ASN 333 CO 0.06 0.22 -0.08 -0.07 -0.37 0.00 0.00 177.43 177.19 1h1m h LEU 334 N 0.37 0.75 0.30 0.34 3.38 -0.63 -1.15 115.31 118.67 1h1m h LEU 334 Ca 0.11 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 1h1m h LEU 334 Cb -0.02 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.53 1h1m h LEU 334 CO -0.04 0.87 -0.14 0.58 0.09 0.00 0.00 178.44 179.79 1h1m h VAL 335 N 0.70 0.73 -0.74 1.22 2.07 -0.89 -1.86 116.25 117.48 1h1m h VAL 335 Ca 0.13 -0.15 0.02 0.00 0.82 0.00 0.00 66.70 67.52 1h1m h VAL 335 Cb 0.54 0.81 -0.04 0.00 -1.52 0.00 0.00 31.29 31.09 1h1m h VAL 335 CO 0.03 0.03 0.49 0.78 0.02 0.00 0.00 177.57 178.93 1h1m h ASN 336 N -0.48 0.81 0.13 0.57 2.35 -0.50 -0.40 115.58 118.07 1h1m h ASN 336 Ca -0.04 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.69 1h1m h ASN 336 Cb 0.36 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.54 1h1m h ASN 336 CO 0.07 0.57 -0.01 0.61 -1.65 0.00 0.00 177.43 177.01 1h1m n GLY 337 N -1.43 -0.90 0.00 2.83 0.00 -0.46 -4.94 105.19 100.30 1h1m n GLY 337 Ca 0.09 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.87 1h1m n GLY 337 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h1m n GLY 338 N 1.10 4.26 3.14 -0.02 0.00 -0.16 -4.78 105.19 108.74 1h1m n GLY 338 Ca 0.21 -1.83 -0.09 0.00 0.00 0.00 0.00 46.02 44.30 1h1m n GLY 338 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1h1m s GLU 339 N 2.50 0.65 0.45 1.61 -1.05 -0.62 -4.97 118.70 117.28 1h1m s GLU 339 Ca 0.00 -0.80 -0.24 0.00 -0.15 0.00 0.00 54.97 53.79 1h1m s GLU 339 Cb 0.00 0.26 -0.10 0.00 -0.44 0.00 0.00 34.13 33.85 1h1m s GLU 339 CO 0.00 -0.18 1.04 0.39 0.95 0.00 0.00 175.26 177.47 1h1m n GLU 340 N 0.56 1.37 -3.75 -4.83 1.02 -1.26 -0.70 120.64 113.05 1h1m n GLU 340 Ca -0.18 0.50 -0.13 0.00 -0.02 0.00 0.00 57.16 57.33 1h1m n GLU 340 Cb 0.59 -2.11 -0.11 0.00 -0.02 0.00 0.00 31.44 29.79 1h1m n GLU 340 CO 0.00 0.00 0.00 -0.46 1.18 0.00 0.00 177.13 177.85 1h1m s TRP 341 N -1.30 -0.39 -0.22 -0.32 -0.00 -0.38 -4.61 118.94 111.72 1h1m s TRP 341 Ca 0.65 0.94 0.15 0.00 -0.00 0.00 0.00 56.10 57.83 1h1m s TRP 341 Cb -0.53 0.13 0.61 0.00 -0.00 0.00 0.00 33.47 33.69 1h1m s TRP 341 CO 0.55 -0.19 1.54 0.43 -0.00 0.00 0.00 176.95 179.28 1h1m n SER 342 N 3.02 4.22 -4.13 5.86 7.64 -1.26 -3.98 113.62 124.98 1h1m n SER 342 Ca -0.14 -3.11 -0.15 0.00 1.01 0.00 0.00 58.87 56.49 1h1m n SER 342 Cb 0.57 -0.61 -0.11 0.00 -1.01 0.00 0.00 64.21 63.05 1h1m n SER 342 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1h1m s SER 343 N -1.68 1.27 0.05 6.43 0.15 -1.26 -5.00 113.70 113.67 1h1m s SER 343 Ca 0.46 -0.66 0.24 0.00 0.70 0.00 0.00 55.95 56.69 1h1m s SER 343 Cb 0.38 0.01 0.99 0.00 -1.71 0.00 0.00 66.02 65.68 1h1m s SER 343 CO 0.10 -0.19 1.76 1.33 1.20 0.00 0.00 173.24 177.44 1h1m n VAL 344 N 1.09 0.43 -3.99 4.45 0.24 -1.26 -4.79 118.33 114.50 1h1m n VAL 344 Ca -0.20 0.05 -0.30 0.00 -2.04 0.00 0.00 64.34 61.85 1h1m n VAL 344 Cb 0.56 -0.70 -0.05 0.00 -1.47 0.00 0.00 33.84 32.17 1h1m n VAL 344 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1h1m s SER 345 N -3.31 5.96 0.56 -1.34 0.01 -1.26 -5.04 113.70 109.28 1h1m s SER 345 Ca 0.11 0.11 0.01 0.00 1.31 0.00 0.00 55.95 57.48 1h1m s SER 345 Cb 0.15 -1.72 0.04 0.00 0.21 0.00 0.00 66.02 64.69 1h1m s SER 345 CO 0.45 0.14 0.79 0.72 0.41 0.00 0.00 173.24 175.76 1h1m s PHE 346 N -1.53 2.83 0.69 2.43 -0.12 -1.26 -5.02 117.98 116.00 1h1m s PHE 346 Ca 0.32 0.01 -0.17 0.00 -0.05 0.00 0.00 56.93 57.05 1h1m s PHE 346 Cb -0.12 -2.79 0.01 0.00 -0.63 0.00 0.00 43.02 39.49 1h1m s PHE 346 CO 0.25 -0.93 1.25 -2.14 -0.05 0.00 0.00 175.22 173.60 1h1m s PRO 347 N -4.80 2.36 0.38 1.99 0.02 -1.26 -4.92 135.00 128.78 1h1m s PRO 347 Ca 0.58 1.91 0.28 0.00 0.02 0.00 0.00 61.00 63.79 1h1m s PRO 347 Cb -0.10 -1.84 1.04 0.00 0.02 0.00 0.00 34.50 33.62 1h1m s PRO 347 CO 0.39 -1.70 1.81 0.00 -0.33 0.00 0.00 177.00 177.17 1h1m h ALA 348 N 0.16 1.00 -3.80 -1.55 0.00 -2.08 -3.45 119.26 109.55 1h1m h ALA 348 Ca -0.49 0.00 -0.62 0.00 0.00 0.00 0.00 54.91 53.80 1h1m h ALA 348 Cb 1.32 0.00 -0.22 0.00 0.00 0.00 0.00 17.79 18.88 1h1m h ALA 348 CO 0.51 0.00 -0.85 -0.51 0.00 0.00 0.00 179.25 178.41 1h1m s ASP 349 N -5.03 2.87 0.00 0.00 1.01 -1.26 -5.29 116.67 108.97 1h1m s ASP 349 Ca 0.04 -0.70 0.17 0.00 0.71 0.00 0.00 52.55 52.77 1h1m s ASP 349 Cb 0.09 -0.18 1.02 0.00 1.01 0.00 0.00 42.92 44.86 1h1m s ASP 349 CO 0.50 0.12 1.42 0.79 0.21 0.00 0.00 175.17 178.21