#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 0.46 0.32 6.43 0.15 -1.26 -5.01 113.70 114.79 1h1m s SER 4 Ca 0.00 -0.06 0.09 0.00 0.70 0.00 0.00 55.95 56.68 1h1m s SER 4 Cb 0.00 -0.11 0.90 0.00 -1.71 0.00 0.00 66.02 65.10 1h1m s SER 4 CO 0.00 0.01 1.69 0.25 1.20 0.00 0.00 173.24 176.39 1h1m h LEU 5 N 6.38 0.49 -9.48 3.45 5.85 -1.94 -3.41 115.31 116.65 1h1m h LEU 5 Ca -0.31 0.16 -0.53 0.00 0.84 0.00 0.00 57.88 58.04 1h1m h LEU 5 Cb 1.18 0.11 -0.02 0.00 0.37 0.00 0.00 40.66 42.29 1h1m h LEU 5 CO 0.50 -0.02 0.32 -0.63 -0.34 0.00 0.00 178.44 178.28 1h1m s ILE 6 N -5.78 4.72 0.11 4.05 1.01 -1.26 -0.95 121.20 123.10 1h1m s ILE 6 Ca -0.11 1.98 0.06 0.00 0.00 0.00 0.00 60.65 62.58 1h1m s ILE 6 Cb 0.28 -4.28 -0.04 0.00 0.01 0.00 0.00 42.46 38.43 1h1m s ILE 6 CO 0.79 0.25 -0.15 0.68 0.00 0.00 0.00 174.94 176.51 1h1m s VAL 7 N 0.49 1.30 -0.16 2.92 -7.23 -0.32 -4.93 120.40 112.47 1h1m s VAL 7 Ca 0.48 -1.60 0.22 0.00 -1.81 0.00 0.00 61.98 59.27 1h1m s VAL 7 Cb -0.22 -1.41 -0.13 0.00 0.56 0.00 0.00 36.38 35.18 1h1m s VAL 7 CO 0.28 -0.34 0.82 -0.62 -0.31 0.00 0.00 175.10 174.92 1h1m n GLU 8 N 0.77 0.63 -4.21 4.82 -0.58 -1.26 -4.39 120.64 116.41 1h1m n GLU 8 Ca -0.17 0.02 -0.18 0.00 -0.42 0.00 0.00 57.16 56.41 1h1m n GLU 8 Cb 0.56 -1.72 -0.11 0.00 -0.57 0.00 0.00 31.44 29.60 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 -5.12 1.86 0.26 1.62 1.11 -1.26 -1.29 116.67 113.85 1h1m s ASP 9 Ca -0.03 -0.74 -0.31 0.00 0.18 0.00 0.00 52.55 51.65 1h1m s ASP 9 Cb 0.11 -0.06 -0.13 0.00 1.07 0.00 0.00 42.92 43.91 1h1m s ASP 9 CO 0.83 -0.12 1.45 0.00 1.18 0.00 0.00 175.17 178.51 1h1m n ALA 10 N 0.81 1.53 -0.79 5.23 0.00 -1.26 -4.93 120.51 121.11 1h1m n ALA 10 Ca -0.18 0.40 -0.32 0.00 0.00 0.00 0.00 53.44 53.34 1h1m n ALA 10 Cb 0.56 -2.33 0.14 0.00 0.00 0.00 0.00 19.45 17.83 1h1m n ALA 10 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1h1m n PRO 11 N 1.96 -0.30 -0.44 0.00 -0.02 -1.26 -4.92 135.00 130.03 1h1m n PRO 11 Ca 0.10 -0.03 0.06 0.00 -2.02 0.00 0.00 63.50 61.61 1h1m n PRO 11 Cb 0.33 -2.17 0.24 0.00 -0.02 0.00 0.00 33.50 31.87 1h1m n PRO 11 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1h1m n ASP 12 N -2.93 3.40 -3.54 2.55 5.68 -1.26 -3.52 116.55 116.92 1h1m n ASP 12 Ca 0.10 -2.35 -0.09 0.00 -0.50 0.00 0.00 54.79 51.95 1h1m n ASP 12 Cb 0.52 -0.50 -0.02 0.00 -1.14 0.00 0.00 41.12 39.99 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 -1.82 0.15 -0.02 2.11 -3.43 -1.25 -4.76 115.29 106.28 1h1m s HIS 13 Ca 0.33 -0.63 -0.29 0.00 -0.80 0.00 0.00 55.06 53.67 1h1m s HIS 13 Cb 0.22 0.56 -0.03 0.00 -1.43 0.00 0.00 32.58 31.90 1h1m s HIS 13 CO 0.15 -1.28 0.94 0.08 -2.00 0.00 0.00 174.74 172.62 1h1m s VAL 14 N -3.36 4.89 -0.15 -5.38 1.01 -1.24 -4.42 120.40 111.76 1h1m s VAL 14 Ca 0.17 1.96 -0.31 0.00 0.00 0.00 0.00 61.98 63.80 1h1m s VAL 14 Cb -0.04 -4.27 0.13 0.00 0.00 0.00 0.00 36.38 32.20 1h1m s VAL 14 CO 0.10 0.16 1.07 0.00 0.00 0.00 0.00 175.10 176.44 1h1m s ARG 15 N 1.05 0.50 0.27 2.72 1.70 -1.26 -5.07 118.95 118.86 1h1m s ARG 15 Ca 0.49 -0.02 -0.30 0.00 -0.47 0.00 0.00 55.73 55.43 1h1m s ARG 15 Cb -0.20 0.23 -0.13 0.00 -0.57 0.00 0.00 34.95 34.28 1h1m s ARG 15 CO 0.26 -0.19 1.39 -2.30 -1.08 0.00 0.00 175.30 173.38 1h1m n PRO 16 N 0.32 2.09 -3.48 3.89 -0.02 -1.26 -4.67 135.00 131.87 1h1m n PRO 16 Ca -0.06 0.74 -0.13 0.00 -2.02 0.00 0.00 63.50 62.03 1h1m n PRO 16 Cb 0.59 -2.38 -0.03 0.00 -0.02 0.00 0.00 33.50 31.65 1h1m n PRO 16 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 1h1m s TYR 17 N -0.30 -0.50 0.00 6.00 -0.85 -1.02 -4.86 117.35 115.82 1h1m s TYR 17 Ca 0.65 0.40 0.08 0.00 -0.52 0.00 0.00 57.07 57.68 1h1m s TYR 17 Cb -0.62 0.48 -0.02 0.00 0.38 0.00 0.00 41.96 42.18 1h1m s TYR 17 CO 0.53 -0.78 -0.23 0.08 -1.52 0.00 0.00 175.55 173.63 1h1m s VAL 18 N -3.25 1.85 -0.10 -3.49 1.01 -0.12 -0.32 120.40 115.98 1h1m s VAL 18 Ca -0.01 -1.09 0.01 0.00 0.00 0.00 0.00 61.98 60.89 1h1m s VAL 18 Cb -0.00 -1.56 0.02 0.00 0.00 0.00 0.00 36.38 34.84 1h1m s VAL 18 CO -0.08 0.44 -0.13 -0.51 0.00 0.00 0.00 175.10 174.82 1h1m s ILE 19 N -0.63 1.29 0.65 2.22 2.07 -0.21 -1.18 121.20 125.41 1h1m s ILE 19 Ca 0.09 -0.52 -0.16 0.00 -1.41 0.00 0.00 60.65 58.66 1h1m s ILE 19 Cb -0.09 -1.20 -0.01 0.00 0.13 0.00 0.00 42.46 41.29 1h1m s ILE 19 CO 0.00 0.40 1.13 -0.13 -1.91 0.00 0.00 174.94 174.43 1h1m s ARG 20 N 1.06 2.80 0.29 3.50 1.81 -1.26 -1.55 118.95 125.60 1h1m s ARG 20 Ca -0.06 1.50 -0.30 0.00 -1.72 0.00 0.00 55.73 55.15 1h1m s ARG 20 Cb -0.15 -1.94 -0.12 0.00 -0.45 0.00 0.00 34.95 32.29 1h1m s ARG 20 CO -0.02 -1.27 1.45 1.58 -0.68 0.00 0.00 175.30 176.37 1h1m n HIS 21 N -2.24 2.48 -1.23 -0.53 -0.00 -1.25 -1.68 115.22 110.77 1h1m n HIS 21 Ca 0.11 0.40 -0.08 0.00 0.46 0.00 0.00 57.72 58.62 1h1m n HIS 21 Cb 0.51 -2.50 -0.03 0.00 -0.12 0.00 0.00 29.99 27.85 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 1.51 0.00 -0.72 1.57 4.01 -1.26 -4.97 117.16 117.30 1h1m n TYR 22 Ca 0.08 0.00 -0.32 0.00 -0.16 0.00 0.00 57.90 57.50 1h1m n TYR 22 Cb 0.35 -2.16 0.15 0.00 -0.31 0.00 0.00 39.34 37.37 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 -0.69 -1.06 -0.09 7.72 7.64 -0.67 -4.80 113.62 121.67 1h1m n SER 23 Ca -0.08 0.32 -0.07 0.00 1.01 0.00 0.00 58.87 60.05 1h1m n SER 23 Cb 0.46 -1.31 -0.00 0.00 -1.01 0.00 0.00 64.21 62.34 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 -1.80 -0.50 -6.53 1.43 2.76 -1.85 -3.46 115.15 105.20 1h1m h HIS 24 Ca -0.45 0.04 -0.50 0.00 -2.20 0.00 0.00 60.37 57.26 1h1m h HIS 24 Cb 1.28 0.27 -0.03 0.00 1.55 0.00 0.00 27.41 30.48 1h1m h HIS 24 CO 0.42 -0.27 -0.92 0.00 -1.30 0.00 0.00 177.93 175.86 1h1m n ALA 25 N -2.81 -2.17 -3.73 5.26 0.00 -0.41 -0.91 120.51 115.74 1h1m n ALA 25 Ca 0.01 -0.30 -0.28 0.00 0.00 0.00 0.00 53.44 52.86 1h1m n ALA 25 Cb 0.27 -2.06 -0.02 0.00 0.00 0.00 0.00 19.45 17.65 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 -4.43 -3.19 -1.61 0.00 1.74 -1.26 -0.97 116.66 106.95 1h1m n ARG 26 Ca -0.25 0.39 -0.47 0.00 -0.77 0.00 0.00 57.85 56.75 1h1m n ARG 26 Cb 0.66 -5.10 -0.03 0.00 -1.02 0.00 0.00 32.46 26.96 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 -3.86 -0.13 -2.42 7.54 0.00 -0.09 -4.79 120.51 116.76 1h1m n ALA 27 Ca 0.03 0.44 -0.17 0.00 0.00 0.00 0.00 53.44 53.74 1h1m n ALA 27 Cb 0.51 -2.11 -0.11 0.00 0.00 0.00 0.00 19.45 17.75 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 -0.21 1.33 -0.05 0.00 -7.23 -0.86 -1.00 120.40 112.38 1h1m s VAL 28 Ca 0.70 -1.85 -0.01 0.00 -1.81 0.00 0.00 61.98 59.02 1h1m s VAL 28 Cb -0.78 -1.66 -0.03 0.00 0.56 0.00 0.00 36.38 34.47 1h1m s VAL 28 CO 0.52 -0.51 0.01 0.42 -0.31 0.00 0.00 175.10 175.23 1h1m s THR 29 N -2.51 4.33 -0.40 5.32 -4.23 -0.17 -0.83 115.64 117.16 1h1m s THR 29 Ca 0.12 -0.37 -0.00 0.00 -1.18 0.00 0.00 61.69 60.26 1h1m s THR 29 Cb -0.03 -2.88 0.11 0.00 1.34 0.00 0.00 72.50 71.04 1h1m s THR 29 CO 0.03 0.50 0.16 -0.69 -0.54 0.00 0.00 174.62 174.08 1h1m s VAL 30 N -0.99 2.93 0.00 2.29 1.01 0.03 -0.39 120.40 125.28 1h1m s VAL 30 Ca 0.16 -2.24 0.00 0.00 0.00 0.00 0.00 61.98 59.90 1h1m s VAL 30 Cb -0.11 -3.05 0.00 0.00 0.00 0.00 0.00 36.38 33.21 1h1m s VAL 30 CO 0.06 -0.67 0.00 0.47 0.00 0.00 0.00 175.10 174.96 1h1m n ASP 31 N 4.37 0.00 0.01 3.32 8.00 -1.26 -1.56 116.55 129.43 1h1m n ASP 31 Ca 0.01 0.00 0.13 0.00 0.71 0.00 0.00 54.79 55.64 1h1m n ASP 31 Cb 0.41 0.00 0.47 0.00 -0.02 0.00 0.00 41.12 41.98 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 0.05 -3.15 -3.53 -2.24 -1.26 -4.86 114.28 99.28 1h1m n THR 32 Ca 0.00 -0.03 -0.39 0.00 -2.27 0.00 0.00 64.05 61.36 1h1m n THR 32 Cb 0.00 -0.26 -0.06 0.00 -2.10 0.00 0.00 70.33 67.91 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 -3.01 4.35 -0.13 -0.78 -0.21 -0.60 -4.58 119.66 114.70 1h1m s GLN 33 Ca 0.13 0.91 0.01 0.00 0.02 0.00 0.00 55.36 56.42 1h1m s GLN 33 Cb 0.18 -3.25 -0.01 0.00 1.00 0.00 0.00 33.01 30.93 1h1m s GLN 33 CO 0.60 0.60 -0.17 -1.17 -2.12 0.00 0.00 175.29 173.02 1h1m s LEU 34 N -1.07 2.47 -0.09 2.90 0.20 0.06 -0.79 118.68 122.35 1h1m s LEU 34 Ca 0.32 -0.43 0.01 0.00 0.69 0.00 0.00 54.13 54.71 1h1m s LEU 34 Cb -0.21 -1.54 -0.02 0.00 -0.43 0.00 0.00 46.19 43.99 1h1m s LEU 34 CO 0.22 0.15 -0.11 -0.31 -0.29 0.00 0.00 176.35 176.01 1h1m s TYR 35 N 0.45 2.84 -0.05 5.38 1.51 -0.01 -0.86 117.35 126.61 1h1m s TYR 35 Ca -0.12 -0.26 0.03 0.00 -1.01 0.00 0.00 57.07 55.72 1h1m s TYR 35 Cb -0.16 -1.75 0.00 0.00 -0.11 0.00 0.00 41.96 39.94 1h1m s TYR 35 CO 0.05 0.09 -0.15 1.03 -1.11 0.00 0.00 175.55 175.47 1h1m s ARG 36 N -0.33 1.67 -0.79 -0.62 0.52 -0.09 -2.03 118.95 117.29 1h1m s ARG 36 Ca 0.04 -0.52 -0.06 0.00 -0.52 0.00 0.00 55.73 54.66 1h1m s ARG 36 Cb -0.13 -1.43 0.20 0.00 0.52 0.00 0.00 34.95 34.12 1h1m s ARG 36 CO 0.02 0.16 0.67 -0.06 0.02 0.00 0.00 175.30 176.12 1h1m s PHE 37 N 0.23 3.69 0.19 -0.53 0.08 -0.14 -0.23 117.98 121.28 1h1m s PHE 37 Ca -0.07 -2.57 0.05 0.00 0.12 0.00 0.00 56.93 54.46 1h1m s PHE 37 Cb -0.12 -3.45 0.08 0.00 -0.57 0.00 0.00 43.02 38.95 1h1m s PHE 37 CO 0.03 -0.87 1.44 1.88 -0.10 0.00 0.00 175.22 177.59 1h1m h TYR 38 N 6.99 0.18 -3.49 0.36 0.05 -1.56 -3.37 116.97 116.13 1h1m h TYR 38 Ca 0.08 -0.09 -0.47 0.00 0.05 0.00 0.00 58.73 58.29 1h1m h TYR 38 Cb 0.94 -0.02 -0.33 0.00 1.01 0.00 0.00 36.73 38.33 1h1m h TYR 38 CO 0.82 0.87 -0.80 0.08 -1.05 0.00 0.00 178.16 178.08 1h1m s VAL 39 N -3.29 0.93 0.46 -2.88 1.01 -0.67 -4.56 120.40 111.39 1h1m s VAL 39 Ca -0.02 -0.37 0.03 0.00 0.00 0.00 0.00 61.98 61.62 1h1m s VAL 39 Cb 0.11 -0.86 -0.04 0.00 0.00 0.00 0.00 36.38 35.59 1h1m s VAL 39 CO 0.81 0.31 0.02 0.42 0.00 0.00 0.00 175.10 176.65 1h1m s THR 40 N 0.65 1.37 0.10 3.92 -4.23 -1.26 -1.43 115.64 114.76 1h1m s THR 40 Ca -0.12 -2.00 -0.32 0.00 -1.18 0.00 0.00 61.69 58.07 1h1m s THR 40 Cb -0.14 -2.49 -0.13 0.00 1.34 0.00 0.00 72.50 71.08 1h1m s THR 40 CO 0.02 0.00 1.59 1.23 -0.54 0.00 0.00 174.62 176.92 1h1m h GLY 41 N 1.58 -0.94 0.55 3.99 0.00 -1.85 0.06 103.07 106.45 1h1m h GLY 41 Ca -0.43 0.49 0.09 0.00 0.00 0.00 0.00 47.33 47.48 1h1m h GLY 41 CO 0.74 -0.31 0.48 -2.55 0.00 0.00 0.00 176.54 174.91 1h1m h PRO 42 N -0.78 0.79 0.00 4.80 0.11 -1.90 0.31 132.00 135.33 1h1m h PRO 42 Ca -0.02 -0.05 -0.07 0.00 0.11 0.00 0.00 66.00 65.98 1h1m h PRO 42 Cb 0.72 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 31.65 1h1m h PRO 42 CO -0.13 0.52 -0.32 0.66 -0.21 0.00 0.00 178.00 178.53 1h1m h SER 43 N 0.81 0.00 -0.36 -2.05 4.64 -1.57 -3.17 113.55 111.86 1h1m h SER 43 Ca 0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 1h1m h SER 43 Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 1h1m h SER 43 CO -0.24 0.32 0.00 -1.54 -0.87 0.00 0.00 176.83 174.50 1h1m n SER 44 N -3.34 3.02 -3.12 4.97 3.41 -0.01 -4.30 113.62 114.25 1h1m n SER 44 Ca 0.01 -1.91 -0.23 0.00 -0.26 0.00 0.00 58.87 56.48 1h1m n SER 44 Cb 0.54 -0.24 0.03 0.00 -0.26 0.00 0.00 64.21 64.28 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 0.89 -0.52 2.16 5.00 0.00 -0.12 -2.88 105.19 109.72 1h1m n GLY 45 Ca 0.14 0.13 -0.01 0.00 0.00 0.00 0.00 46.02 46.29 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 -4.46 0.00 -0.03 1.61 4.01 0.92 -4.92 117.16 114.29 1h1m n TYR 46 Ca -0.09 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.53 1h1m n TYR 46 Cb 0.60 -0.53 -0.07 0.00 -0.31 0.00 0.00 39.34 39.04 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 0.12 -2.65 -0.72 0.00 -1.78 0.36 119.26 114.60 1h1m h ALA 47 Ca -0.02 -0.17 0.06 0.00 0.00 0.00 0.00 54.91 54.78 1h1m h ALA 47 Cb 0.20 -0.03 -0.12 0.00 0.00 0.00 0.00 17.79 17.83 1h1m h ALA 47 CO 0.03 -0.21 0.35 -0.59 0.00 0.00 0.00 179.25 178.83 1h1m s PHE 48 N -5.02 -0.40 -0.06 0.00 -0.12 -1.26 -3.10 117.98 108.01 1h1m s PHE 48 Ca -0.14 0.19 0.02 0.00 -0.05 0.00 0.00 56.93 56.95 1h1m s PHE 48 Cb 0.05 0.57 -0.03 0.00 -0.63 0.00 0.00 43.02 42.98 1h1m s PHE 48 CO 0.70 -0.75 -0.12 0.99 -0.05 0.00 0.00 175.22 175.98 1h1m s THR 49 N -3.47 3.26 -0.15 -4.49 2.01 0.26 -4.34 115.64 108.72 1h1m s THR 49 Ca 0.04 -0.64 -0.01 0.00 0.31 0.00 0.00 61.69 61.39 1h1m s THR 49 Cb -0.01 -2.30 0.04 0.00 0.01 0.00 0.00 72.50 70.23 1h1m s THR 49 CO -0.08 0.59 -0.04 -0.22 -0.69 0.00 0.00 174.62 174.17 1h1m s LEU 50 N -0.67 1.42 0.10 4.42 0.20 -0.51 -0.97 118.68 122.67 1h1m s LEU 50 Ca 0.10 -0.57 0.07 0.00 0.69 0.00 0.00 54.13 54.41 1h1m s LEU 50 Cb -0.11 -0.83 -0.03 0.00 -0.43 0.00 0.00 46.19 44.79 1h1m s LEU 50 CO 0.01 -0.19 -0.18 0.00 -0.29 0.00 0.00 176.35 175.71 1h1m s MET 51 N 1.70 1.03 -0.07 1.98 0.23 -0.06 -1.54 119.30 122.57 1h1m s MET 51 Ca 0.02 -1.13 0.01 0.00 -1.03 0.00 0.00 55.69 53.55 1h1m s MET 51 Cb -0.15 -1.14 -0.03 0.00 -1.53 0.00 0.00 34.83 31.98 1h1m s MET 51 CO -0.08 0.25 -0.08 0.20 -2.03 0.00 0.00 175.02 173.29 1h1m s GLY 52 N -2.00 1.67 -0.12 3.16 0.00 0.68 -0.01 107.32 110.70 1h1m s GLY 52 Ca 0.05 -0.90 0.00 0.00 0.00 0.00 0.00 44.72 43.87 1h1m s GLY 52 CO 0.04 -0.66 -0.11 -1.59 0.00 0.00 0.00 173.10 170.78 1h1m s THR 53 N -0.75 1.27 -0.09 0.90 2.01 0.12 -0.91 115.64 118.18 1h1m s THR 53 Ca 0.11 -0.46 0.01 0.00 0.31 0.00 0.00 61.69 61.67 1h1m s THR 53 Cb -0.11 -1.22 -0.02 0.00 0.01 0.00 0.00 72.50 71.16 1h1m s THR 53 CO 0.01 0.40 -0.12 0.20 -0.69 0.00 0.00 174.62 174.43 1h1m s ASN 54 N 1.43 4.15 -0.11 3.53 -0.87 -0.04 -0.45 114.94 122.57 1h1m s ASN 54 Ca 0.01 -0.22 -0.30 0.00 -1.57 0.00 0.00 52.86 50.79 1h1m s ASN 54 Cb -0.13 -1.22 0.08 0.00 -0.02 0.00 0.00 41.25 39.96 1h1m s ASN 54 CO -0.07 0.27 0.76 0.00 -2.57 0.00 0.00 177.10 175.49 1h1m s ALA 55 N -0.28 -1.81 0.64 0.60 0.00 -0.86 -0.76 121.76 119.29 1h1m s ALA 55 Ca 0.02 1.50 -0.07 0.00 0.00 0.00 0.00 51.96 53.41 1h1m s ALA 55 Cb -0.13 -0.37 0.02 0.00 0.00 0.00 0.00 23.12 22.65 1h1m s ALA 55 CO 0.03 -0.35 0.96 -1.25 0.00 0.00 0.00 175.76 175.15 1h1m s PRO 56 N -0.88 2.75 0.22 0.00 0.04 -1.26 -2.94 135.00 132.93 1h1m s PRO 56 Ca -0.07 0.03 -0.29 0.00 0.04 0.00 0.00 61.00 60.71 1h1m s PRO 56 Cb -0.01 -2.20 -0.16 0.00 0.04 0.00 0.00 34.50 32.17 1h1m s PRO 56 CO 0.06 -0.88 0.74 1.58 0.04 0.00 0.00 177.00 178.54 1h1m n HIS 57 N -2.74 0.24 -4.08 0.56 -0.00 -1.17 -4.75 115.22 103.27 1h1m n HIS 57 Ca 0.06 0.87 -0.14 0.00 -0.00 0.00 0.00 57.72 58.50 1h1m n HIS 57 Cb 0.58 -2.08 -0.14 0.00 -0.00 0.00 0.00 29.99 28.36 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 -0.77 0.53 0.00 0.26 0.15 -0.42 -4.98 113.70 108.46 1h1m s SER 58 Ca 0.63 -0.19 0.30 0.00 0.70 0.00 0.00 55.95 57.39 1h1m s SER 58 Cb -0.86 -0.03 1.38 0.00 -1.71 0.00 0.00 66.02 64.81 1h1m s SER 58 CO 0.57 -0.02 1.93 0.47 1.20 0.00 0.00 173.24 177.40 1h1m n ASP 59 N 2.62 0.72 -4.51 5.45 8.00 -1.26 -4.62 116.55 122.94 1h1m n ASP 59 Ca -0.15 -1.08 -0.24 0.00 0.71 0.00 0.00 54.79 54.03 1h1m n ASP 59 Cb 0.58 -0.01 -0.09 0.00 -0.02 0.00 0.00 41.12 41.57 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 -2.13 2.86 0.62 2.24 0.00 -1.26 -5.02 121.76 119.06 1h1m s ALA 60 Ca 0.39 -1.83 -0.18 0.00 0.00 0.00 0.00 51.96 50.34 1h1m s ALA 60 Cb 0.21 -0.39 -0.04 0.00 0.00 0.00 0.00 23.12 22.90 1h1m s ALA 60 CO 0.39 0.27 0.94 1.28 0.00 0.00 0.00 175.76 178.64 1h1m n LEU 61 N -0.69 3.61 0.04 0.00 4.77 -1.26 -4.62 117.00 118.84 1h1m n LEU 61 Ca -0.05 0.78 0.13 0.00 -0.03 0.00 0.00 56.01 56.83 1h1m n LEU 61 Cb 0.60 -1.38 0.39 0.00 -2.33 0.00 0.00 43.42 40.69 1h1m n LEU 61 CO 0.39 -1.96 0.70 0.61 -1.33 0.00 0.00 177.39 175.80 1h1m n GLY 62 N 1.31 -1.49 3.55 -0.72 0.00 0.14 -1.36 105.19 106.63 1h1m n GLY 62 Ca 0.14 -0.16 -0.10 0.00 0.00 0.00 0.00 46.02 45.89 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 -3.06 0.00 0.51 1.61 0.11 -1.23 -4.40 120.40 113.93 1h1m s VAL 63 Ca 0.11 0.00 -0.19 0.00 -2.93 0.00 0.00 61.98 58.97 1h1m s VAL 63 Cb 0.16 -1.00 -0.07 0.00 -1.53 0.00 0.00 36.38 33.93 1h1m s VAL 63 CO 0.63 0.00 1.03 -0.76 -3.33 0.00 0.00 175.10 172.67 1h1m s LEU 64 N -1.56 3.76 0.52 2.54 1.43 -1.26 -4.58 118.68 119.53 1h1m s LEU 64 Ca -0.00 1.86 -0.22 0.00 -1.03 0.00 0.00 54.13 54.73 1h1m s LEU 64 Cb -0.01 -4.55 -0.06 0.00 0.03 0.00 0.00 46.19 41.61 1h1m s LEU 64 CO -0.01 -0.83 1.35 -2.84 0.23 0.00 0.00 176.35 174.25 1h1m s PRO 65 N -3.49 3.30 0.19 1.29 0.02 -1.26 -4.86 135.00 130.20 1h1m s PRO 65 Ca 0.65 2.22 -0.23 0.00 0.02 0.00 0.00 61.00 63.66 1h1m s PRO 65 Cb -0.15 -2.35 0.05 0.00 0.02 0.00 0.00 34.50 32.07 1h1m s PRO 65 CO 0.24 -1.05 0.78 -3.38 -0.33 0.00 0.00 177.00 173.26 1h1m s HIS 66 N -1.31 -0.26 0.09 6.54 -3.43 -0.99 -1.24 115.29 114.70 1h1m s HIS 66 Ca 0.69 -0.08 0.07 0.00 -0.80 0.00 0.00 55.06 54.93 1h1m s HIS 66 Cb -0.40 0.64 -0.03 0.00 -1.43 0.00 0.00 32.58 31.37 1h1m s HIS 66 CO 0.48 -0.98 -0.17 0.42 -2.00 0.00 0.00 174.74 172.48 1h1m s ILE 67 N -3.63 1.39 -0.13 -5.38 1.01 -0.33 -1.05 121.20 113.08 1h1m s ILE 67 Ca 0.09 -1.43 -0.01 0.00 0.00 0.00 0.00 60.65 59.30 1h1m s ILE 67 Cb -0.03 -1.30 -0.02 0.00 0.01 0.00 0.00 42.46 41.11 1h1m s ILE 67 CO 0.00 -0.16 -0.10 -1.00 0.00 0.00 0.00 174.94 173.69 1h1m s HIS 68 N -1.25 2.88 -0.17 3.97 3.76 -1.26 -1.29 115.29 121.93 1h1m s HIS 68 Ca 0.02 -0.48 0.18 0.00 -0.15 0.00 0.00 55.06 54.63 1h1m s HIS 68 Cb -0.10 -1.86 -0.04 0.00 1.11 0.00 0.00 32.58 31.69 1h1m s HIS 68 CO 0.03 -0.11 1.06 1.96 -0.85 0.00 0.00 174.74 176.83 1h1m h GLN 69 N 6.56 0.00 0.00 1.40 4.20 -1.95 0.12 115.11 125.44 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 1.20 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.98 1h1m h GLN 69 CO 0.57 0.28 0.00 1.63 -0.67 0.00 0.00 178.83 180.64 1h1m n LYS 70 N -2.95 3.80 -5.11 1.46 5.02 -1.26 -4.64 118.16 114.48 1h1m n LYS 70 Ca -0.04 -0.13 -0.32 0.00 -2.02 0.00 0.00 58.31 55.80 1h1m n LYS 70 Cb 0.75 -0.57 -0.15 0.00 -0.02 0.00 0.00 35.03 35.04 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 -0.58 2.51 -0.24 2.13 3.76 -1.26 -4.43 115.29 117.19 1h1m s HIS 71 Ca 0.00 -0.33 -0.12 0.00 -0.15 0.00 0.00 55.06 54.45 1h1m s HIS 71 Cb 0.00 -1.57 -0.05 0.00 1.11 0.00 0.00 32.58 32.07 1h1m s HIS 71 CO 0.00 0.05 0.25 -0.47 -0.85 0.00 0.00 174.74 173.72 1h1m s TYR 72 N -0.62 3.31 -0.11 1.40 6.14 -0.05 -4.02 117.35 123.39 1h1m s TYR 72 Ca 0.09 0.33 -0.04 0.00 0.64 0.00 0.00 57.07 58.10 1h1m s TYR 72 Cb -0.11 -2.39 -0.04 0.00 0.42 0.00 0.00 41.96 39.85 1h1m s TYR 72 CO 0.00 -0.02 0.04 -2.00 0.64 0.00 0.00 175.55 174.20 1h1m s GLU 73 N 1.34 3.27 -0.10 4.97 2.12 0.05 -1.73 118.70 128.63 1h1m s GLU 73 Ca 0.11 -0.35 0.01 0.00 0.36 0.00 0.00 54.97 55.11 1h1m s GLU 73 Cb -0.14 -2.94 0.02 0.00 0.26 0.00 0.00 34.13 31.32 1h1m s GLU 73 CO 0.07 0.62 -0.13 -0.80 -0.54 0.00 0.00 175.26 174.48 1h1m s ASN 74 N -0.63 2.19 -0.21 -1.70 0.01 -0.57 -0.49 114.94 113.54 1h1m s ASN 74 Ca 0.11 -0.36 -0.04 0.00 -0.71 0.00 0.00 52.86 51.86 1h1m s ASN 74 Cb -0.12 -0.96 -0.01 0.00 0.41 0.00 0.00 41.25 40.57 1h1m s ASN 74 CO 0.02 -0.01 -0.04 -0.36 -1.51 0.00 0.00 177.10 175.20 1h1m s PHE 75 N 1.04 2.96 -0.06 2.20 0.40 -0.12 -1.35 117.98 123.05 1h1m s PHE 75 Ca -0.06 -0.78 0.03 0.00 -0.60 0.00 0.00 56.93 55.51 1h1m s PHE 75 Cb -0.15 -2.07 0.01 0.00 0.51 0.00 0.00 43.02 41.32 1h1m s PHE 75 CO -0.01 -0.44 -0.14 -0.47 0.70 0.00 0.00 175.22 174.86 1h1m s TYR 76 N 1.24 1.59 -0.43 0.36 5.04 -0.40 -0.70 117.35 124.05 1h1m s TYR 76 Ca 0.03 -0.57 -0.18 0.00 -2.44 0.00 0.00 57.07 53.91 1h1m s TYR 76 Cb -0.14 -1.13 0.02 0.00 0.35 0.00 0.00 41.96 41.06 1h1m s TYR 76 CO -0.01 -0.26 0.50 0.00 -1.34 0.00 0.00 175.55 174.43 1h1m h ASN 78 N 8.77 0.81 -5.03 0.00 -1.24 -1.49 0.25 115.58 117.65 1h1m h ASN 78 Ca -0.26 -0.60 0.13 0.00 0.71 0.00 0.00 56.30 56.28 1h1m h ASN 78 Cb 1.11 -0.24 -0.11 0.00 0.73 0.00 0.00 38.32 39.81 1h1m h ASN 78 CO 0.82 1.39 0.45 -1.59 -1.29 0.00 0.00 177.43 177.21 1h1m s LYS 79 N -3.47 1.11 4.27 6.67 -2.85 -1.19 -4.51 119.74 119.77 1h1m s LYS 79 Ca -0.09 -0.54 0.00 0.00 -1.00 0.00 0.00 55.97 54.34 1h1m s LYS 79 Cb 0.08 0.43 0.00 0.00 -2.06 0.00 0.00 37.83 36.28 1h1m s LYS 79 CO 0.90 -0.50 0.00 0.41 0.10 0.00 0.00 175.35 176.26 1h1m n GLY 80 N -0.38 0.95 3.57 0.59 0.00 -1.19 -1.28 105.19 107.44 1h1m n GLY 80 Ca -0.08 -0.78 -0.13 0.00 0.00 0.00 0.00 46.02 45.03 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 -0.49 -0.05 1.61 1.04 -1.26 -3.57 113.70 106.98 1h1m s SER 81 Ca 0.00 0.60 -0.12 0.00 0.48 0.00 0.00 55.95 56.91 1h1m s SER 81 Cb 0.00 0.49 0.02 0.00 0.10 0.00 0.00 66.02 66.63 1h1m s SER 81 CO 0.00 -0.41 0.28 0.72 0.98 0.00 0.00 173.24 174.81 1h1m s PHE 82 N -0.94 -0.20 0.10 5.02 -0.12 -0.65 -0.94 117.98 120.25 1h1m s PHE 82 Ca -0.04 0.40 -0.20 0.00 -0.05 0.00 0.00 56.93 57.03 1h1m s PHE 82 Cb -0.01 0.08 -0.07 0.00 -0.63 0.00 0.00 43.02 42.39 1h1m s PHE 82 CO 0.04 -0.29 0.61 -1.14 -0.05 0.00 0.00 175.22 174.38 1h1m s GLN 83 N -0.80 4.23 -0.07 1.99 0.74 -0.08 0.10 119.66 125.78 1h1m s GLN 83 Ca -0.09 0.78 0.03 0.00 0.05 0.00 0.00 55.36 56.14 1h1m s GLN 83 Cb -0.04 -3.19 0.01 0.00 1.10 0.00 0.00 33.01 30.88 1h1m s GLN 83 CO 0.02 0.60 -0.17 -1.17 -0.55 0.00 0.00 175.29 174.03 1h1m s LEU 84 N -1.26 1.83 0.03 3.68 2.96 -0.05 -1.41 118.68 124.46 1h1m s LEU 84 Ca 0.32 -0.38 0.04 0.00 -0.22 0.00 0.00 54.13 53.88 1h1m s LEU 84 Cb -0.19 -1.02 -0.04 0.00 0.50 0.00 0.00 46.19 45.44 1h1m s LEU 84 CO 0.20 0.09 -0.05 0.26 -1.32 0.00 0.00 176.35 175.54 1h1m s TRP 85 N 0.44 2.92 -0.15 5.38 0.51 -0.39 -1.67 118.94 125.98 1h1m s TRP 85 Ca -0.14 -0.03 -0.19 0.00 -2.12 0.00 0.00 56.10 53.62 1h1m s TRP 85 Cb -0.16 -1.58 0.05 0.00 -0.81 0.00 0.00 33.47 30.97 1h1m s TRP 85 CO 0.05 0.41 0.50 0.00 -0.51 0.00 0.00 176.95 177.40 1h1m s ALA 86 N -1.09 -1.24 -0.16 0.98 0.00 0.93 -2.52 121.76 118.65 1h1m s ALA 86 Ca 0.20 1.26 -0.10 0.00 0.00 0.00 0.00 51.96 53.32 1h1m s ALA 86 Cb -0.11 -0.62 0.06 0.00 0.00 0.00 0.00 23.12 22.45 1h1m s ALA 86 CO 0.11 -0.26 0.40 -1.14 0.00 0.00 0.00 175.76 174.87 1h1m s GLN 87 N -0.11 0.39 -0.15 0.00 0.74 -0.18 -0.51 119.66 119.84 1h1m s GLN 87 Ca -0.03 0.75 -0.06 0.00 0.05 0.00 0.00 55.36 56.06 1h1m s GLN 87 Cb -0.03 0.00 -0.04 0.00 1.10 0.00 0.00 33.01 34.04 1h1m s GLN 87 CO 0.02 -0.15 0.08 0.45 -0.55 0.00 0.00 175.29 175.14 1h1m s SER 88 N 1.24 5.80 0.55 6.67 0.15 -1.26 -0.49 113.70 126.37 1h1m s SER 88 Ca -0.08 0.21 0.00 0.00 0.70 0.00 0.00 55.95 56.78 1h1m s SER 88 Cb -0.08 -1.90 0.00 0.00 -1.71 0.00 0.00 66.02 62.33 1h1m s SER 88 CO -0.11 0.28 0.00 0.61 1.20 0.00 0.00 173.24 175.22 1h1m n GLY 89 N 2.81 2.30 1.99 9.45 0.00 -1.26 -1.09 105.19 119.39 1h1m n GLY 89 Ca -0.18 -0.23 -0.05 0.00 0.00 0.00 0.00 46.02 45.56 1h1m n GLY 89 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1h1m n ASN 90 N 0.36 4.84 -4.77 1.61 0.23 -1.26 -4.96 115.26 111.30 1h1m n ASN 90 Ca 0.00 -3.17 -0.32 0.00 -0.53 0.00 0.00 54.58 50.56 1h1m n ASN 90 Cb 0.00 -0.74 0.06 0.00 -2.08 0.00 0.00 39.78 37.02 1h1m n ASN 90 CO 0.00 0.00 0.00 -1.61 -0.93 0.00 0.00 177.26 174.72 1h1m s GLU 91 N -2.90 2.60 0.12 -3.83 2.02 -0.25 -4.96 118.70 111.50 1h1m s GLU 91 Ca 0.54 1.27 -0.35 0.00 0.02 0.00 0.00 54.97 56.44 1h1m s GLU 91 Cb 0.43 -1.93 -0.16 0.00 0.10 0.00 0.00 34.13 32.56 1h1m s GLU 91 CO 0.13 -1.39 1.28 2.41 0.02 0.00 0.00 175.26 177.71 1h1m n THR 92 N -2.90 0.37 -2.21 3.63 -1.04 -1.26 -4.65 114.28 106.21 1h1m n THR 92 Ca 0.10 -0.09 -0.42 0.00 -2.04 0.00 0.00 64.05 61.59 1h1m n THR 92 Cb 0.53 -0.85 -0.03 0.00 -1.82 0.00 0.00 70.33 68.15 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 0.14 4.32 0.04 -2.82 0.74 -1.26 -4.74 119.66 116.08 1h1m s GLN 93 Ca 0.80 2.00 0.04 0.00 0.05 0.00 0.00 55.36 58.25 1h1m s GLN 93 Cb -0.90 -3.39 -0.04 0.00 1.10 0.00 0.00 33.01 29.78 1h1m s GLN 93 CO 0.49 -0.47 -0.03 -0.65 -0.55 0.00 0.00 175.29 174.07 1h1m s GLN 94 N 1.62 2.57 0.01 1.67 -1.52 0.33 -4.30 119.66 120.04 1h1m s GLN 94 Ca 0.64 -0.76 -0.10 0.00 -1.95 0.00 0.00 55.36 53.19 1h1m s GLN 94 Cb -0.34 -2.54 0.01 0.00 -0.22 0.00 0.00 33.01 29.92 1h1m s GLN 94 CO 0.29 0.58 0.19 -0.08 -0.25 0.00 0.00 175.29 176.02 1h1m s THR 95 N -1.14 0.08 -0.04 -0.19 -1.32 -0.74 -0.05 115.64 112.24 1h1m s THR 95 Ca 0.21 -0.67 -0.13 0.00 -1.21 0.00 0.00 61.69 59.89 1h1m s THR 95 Cb -0.11 -0.57 0.02 0.00 -1.51 0.00 0.00 72.50 70.33 1h1m s THR 95 CO 0.12 -0.37 0.29 -0.13 -2.21 0.00 0.00 174.62 172.32 1h1m s ARG 96 N -1.59 0.57 -0.33 7.08 1.81 -0.67 -2.30 118.95 123.52 1h1m s ARG 96 Ca -0.13 -0.07 -0.16 0.00 -1.72 0.00 0.00 55.73 53.65 1h1m s ARG 96 Cb -0.06 0.26 -0.01 0.00 -0.45 0.00 0.00 34.95 34.68 1h1m s ARG 96 CO 0.01 -0.14 0.40 0.08 -0.68 0.00 0.00 175.30 174.98 1h1m s VAL 97 N -0.97 5.13 -0.07 3.52 1.01 0.51 -0.87 120.40 128.65 1h1m s VAL 97 Ca -0.10 0.20 -0.24 0.00 0.00 0.00 0.00 61.98 61.83 1h1m s VAL 97 Cb -0.05 -3.84 -0.03 0.00 0.00 0.00 0.00 36.38 32.45 1h1m s VAL 97 CO 0.03 -0.09 0.73 -0.76 0.00 0.00 0.00 175.10 175.01 1h1m s LEU 98 N 2.13 4.31 0.00 3.92 1.02 0.12 -4.93 118.68 125.24 1h1m s LEU 98 Ca 0.14 1.21 0.00 0.00 0.02 0.00 0.00 54.13 55.50 1h1m s LEU 98 Cb -0.16 -3.13 0.00 0.00 0.02 0.00 0.00 46.19 42.92 1h1m s LEU 98 CO 0.12 -0.15 0.00 -1.54 0.02 0.00 0.00 176.35 174.80 1h1m n SER 99 N 3.93 1.37 -4.67 2.29 3.41 -1.26 -1.64 113.62 117.05 1h1m n SER 99 Ca -0.00 -0.78 -0.47 0.00 -0.26 0.00 0.00 58.87 57.35 1h1m n SER 99 Cb 0.51 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 -1.27 3.21 0.00 4.04 7.64 -1.23 -1.31 113.62 124.69 1h1m n SER 100 Ca 0.00 1.04 0.00 0.00 1.01 0.00 0.00 58.87 60.92 1h1m n SER 100 Cb 0.00 -1.39 0.00 0.00 -1.01 0.00 0.00 64.21 61.81 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 3.83 0.79 3.91 0.23 0.00 0.87 -4.77 105.19 110.05 1h1m n GLY 101 Ca 0.20 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.64 6.16 -0.00 1.61 1.01 -0.43 -4.02 116.67 118.36 1h1m s ASP 102 Ca 0.00 0.89 0.01 0.00 0.71 0.00 0.00 52.55 54.16 1h1m s ASP 102 Cb 0.00 -2.16 -0.00 0.00 1.01 0.00 0.00 42.92 41.77 1h1m s ASP 102 CO 0.00 -0.65 -0.02 -0.47 0.21 0.00 0.00 175.17 174.24 1h1m s TYR 103 N -2.77 0.19 -0.04 4.23 5.04 -0.50 -1.33 117.35 122.17 1h1m s TYR 103 Ca 0.48 -0.03 0.02 0.00 -2.44 0.00 0.00 57.07 55.10 1h1m s TYR 103 Cb -0.10 -0.13 0.01 0.00 0.35 0.00 0.00 41.96 42.09 1h1m s TYR 103 CO 0.45 -0.01 -0.07 0.20 -1.34 0.00 0.00 175.55 174.77 1h1m s GLY 104 N 0.01 0.53 -0.25 8.97 0.00 0.12 -1.04 107.32 115.67 1h1m s GLY 104 Ca 0.00 -0.21 -0.08 0.00 0.00 0.00 0.00 44.72 44.43 1h1m s GLY 104 CO -0.00 0.19 0.10 -0.45 0.00 0.00 0.00 173.10 172.94 1h1m s SER 105 N 0.61 5.41 -0.61 1.64 0.15 0.14 -0.95 113.70 120.10 1h1m s SER 105 Ca -0.09 -0.12 0.04 0.00 0.70 0.00 0.00 55.95 56.47 1h1m s SER 105 Cb -0.13 -1.98 0.15 0.00 -1.71 0.00 0.00 66.02 62.35 1h1m s SER 105 CO 0.01 -0.02 0.37 -0.69 1.20 0.00 0.00 173.24 174.12 1h1m s VAL 106 N 1.52 2.80 1.09 4.45 1.01 0.36 -2.55 120.40 129.07 1h1m s VAL 106 Ca 0.06 -3.70 -0.12 0.00 0.00 0.00 0.00 61.98 58.22 1h1m s VAL 106 Cb -0.15 -2.89 0.24 0.00 0.00 0.00 0.00 36.38 33.58 1h1m s VAL 106 CO 0.05 -0.89 1.03 -2.65 0.00 0.00 0.00 175.10 172.65 1h1m n PRO 107 N 2.65 -1.82 -1.64 2.72 -0.02 -1.26 -0.77 135.00 134.86 1h1m n PRO 107 Ca 0.11 -0.49 -0.40 0.00 -2.02 0.00 0.00 63.50 60.70 1h1m n PRO 107 Cb 0.33 -2.22 0.02 0.00 -0.02 0.00 0.00 33.50 31.61 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 -4.67 1.45 -1.24 -0.52 1.74 -1.26 -2.43 116.66 109.74 1h1m n ARG 108 Ca 0.06 0.52 -0.08 0.00 -0.77 0.00 0.00 57.85 57.58 1h1m n ARG 108 Cb 0.53 -2.19 -0.04 0.00 -1.02 0.00 0.00 32.46 29.75 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 0.10 -4.32 -4.58 0.55 3.02 0.42 -4.88 115.26 105.56 1h1m n ASN 109 Ca 0.09 0.20 -0.37 0.00 -0.03 0.00 0.00 54.58 54.48 1h1m n ASN 109 Cb 0.41 -2.54 -0.11 0.00 -0.61 0.00 0.00 39.78 36.93 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 -2.19 5.08 0.26 2.41 1.01 -1.02 -4.49 120.40 121.47 1h1m s VAL 110 Ca 0.00 0.09 -0.29 0.00 0.00 0.00 0.00 61.98 61.77 1h1m s VAL 110 Cb 0.00 -3.39 -0.09 0.00 0.00 0.00 0.00 36.38 32.89 1h1m s VAL 110 CO 0.00 0.31 1.26 -0.89 0.00 0.00 0.00 175.10 175.78 1h1m s THR 111 N 1.46 3.10 0.16 3.92 2.01 0.36 -4.50 115.64 122.15 1h1m s THR 111 Ca 0.07 1.02 -0.16 0.00 0.31 0.00 0.00 61.69 62.92 1h1m s THR 111 Cb -0.15 -3.65 0.03 0.00 0.01 0.00 0.00 72.50 68.74 1h1m s THR 111 CO 0.07 0.20 0.45 -1.38 -0.69 0.00 0.00 174.62 173.27 1h1m s HIS 112 N -0.62 -0.09 0.27 4.92 -3.43 -0.21 -1.01 115.29 115.11 1h1m s HIS 112 Ca 0.51 -0.25 -0.20 0.00 -0.80 0.00 0.00 55.06 54.32 1h1m s HIS 112 Cb -0.37 0.29 0.02 0.00 -1.43 0.00 0.00 32.58 31.09 1h1m s HIS 112 CO 0.44 -0.81 0.68 -0.08 -2.00 0.00 0.00 174.74 172.97 1h1m s THR 113 N -3.86 0.00 0.12 -5.38 -1.32 -1.05 -2.34 115.64 101.81 1h1m s THR 113 Ca 0.08 -1.00 -0.01 0.00 -1.21 0.00 0.00 61.69 59.55 1h1m s THR 113 Cb 0.01 -1.97 -0.04 0.00 -1.51 0.00 0.00 72.50 68.99 1h1m s THR 113 CO -0.06 -0.00 0.05 0.72 -2.21 0.00 0.00 174.62 173.12 1h1m s PHE 114 N -3.92 0.80 -0.07 9.09 -0.71 -1.26 -1.26 117.98 120.64 1h1m s PHE 114 Ca 0.12 -1.20 -0.03 0.00 -1.04 0.00 0.00 56.93 54.78 1h1m s PHE 114 Cb -0.05 -0.45 0.04 0.00 -1.21 0.00 0.00 43.02 41.35 1h1m s PHE 114 CO 0.06 -0.51 0.15 -1.14 -1.34 0.00 0.00 175.22 172.45 1h1m s GLN 115 N -4.03 0.07 0.04 1.99 0.74 -0.50 0.29 119.66 118.26 1h1m s GLN 115 Ca 0.21 0.45 -0.30 0.00 0.05 0.00 0.00 55.36 55.77 1h1m s GLN 115 Cb 0.07 -0.21 -0.06 0.00 1.10 0.00 0.00 33.01 33.91 1h1m s GLN 115 CO 0.00 -0.22 1.30 0.42 -0.55 0.00 0.00 175.29 176.23 1h1m s ILE 116 N 1.63 3.83 -0.15 -2.34 -1.09 -1.26 -0.90 121.20 120.91 1h1m s ILE 116 Ca -0.04 1.27 -0.13 0.00 -2.23 0.00 0.00 60.65 59.51 1h1m s ILE 116 Cb -0.12 -3.81 -0.06 0.00 -1.58 0.00 0.00 42.46 36.89 1h1m s ILE 116 CO -0.06 0.05 -0.28 1.67 -1.23 0.00 0.00 174.94 175.10 1h1m n GLN 117 N 4.55 0.43 -2.99 2.79 7.27 -0.12 -1.31 117.38 128.00 1h1m n GLN 117 Ca 0.11 0.18 -0.31 0.00 0.07 0.00 0.00 57.00 57.05 1h1m n GLN 117 Cb 0.45 -1.24 -0.04 0.00 2.41 0.00 0.00 30.24 31.82 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 -6.24 6.58 0.31 1.69 1.01 -0.99 -4.20 116.67 114.82 1h1m s ASP 118 Ca -0.25 1.13 0.00 0.00 0.71 0.00 0.00 52.55 54.14 1h1m s ASP 118 Cb 0.06 -2.32 0.53 0.00 1.01 0.00 0.00 42.92 42.20 1h1m s ASP 118 CO 0.35 -0.32 1.93 -0.65 0.21 0.00 0.00 175.17 176.70 1h1m h PRO 119 N 1.61 1.00 -2.40 8.23 0.11 -1.91 -3.09 132.00 135.55 1h1m h PRO 119 Ca -0.47 -0.06 -0.71 0.00 0.11 0.00 0.00 66.00 64.87 1h1m h PRO 119 Cb 1.18 -0.22 -0.34 0.00 0.11 0.00 0.00 31.00 31.72 1h1m h PRO 119 CO 0.65 0.66 0.18 -3.47 -0.21 0.00 0.00 178.00 175.81 1h1m n ASP 120 N -4.46 5.62 -4.79 -2.05 2.03 -1.26 -4.14 116.55 107.51 1h1m n ASP 120 Ca 0.12 -3.58 -0.36 0.00 0.52 0.00 0.00 54.79 51.49 1h1m n ASP 120 Cb 0.15 -0.92 -0.07 0.00 -0.72 0.00 0.00 41.12 39.56 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 -3.65 5.42 -0.05 5.18 2.01 -1.15 -3.14 115.64 120.27 1h1m s THR 121 Ca 0.40 0.25 0.02 0.00 0.31 0.00 0.00 61.69 62.68 1h1m s THR 121 Cb 0.17 -3.47 0.01 0.00 0.01 0.00 0.00 72.50 69.23 1h1m s THR 121 CO -0.05 0.50 -0.11 -0.70 -0.69 0.00 0.00 174.62 173.57 1h1m s GLU 122 N -0.18 1.38 -0.07 4.92 2.12 -0.40 -2.02 118.70 124.44 1h1m s GLU 122 Ca 0.12 -0.36 0.04 0.00 0.36 0.00 0.00 54.97 55.12 1h1m s GLU 122 Cb -0.12 -1.20 -0.02 0.00 0.26 0.00 0.00 34.13 33.05 1h1m s GLU 122 CO 0.01 0.06 -0.19 -1.64 -0.54 0.00 0.00 175.26 172.97 1h1m s MET 123 N 0.50 2.77 -0.24 4.30 -1.94 0.40 -1.21 119.30 123.87 1h1m s MET 123 Ca -0.10 -0.78 -0.07 0.00 -1.71 0.00 0.00 55.69 53.03 1h1m s MET 123 Cb -0.13 -2.35 -0.02 0.00 2.01 0.00 0.00 34.83 34.33 1h1m s MET 123 CO 0.02 0.41 0.04 0.99 -0.01 0.00 0.00 175.02 176.47 1h1m s THR 124 N -0.19 4.12 -0.18 2.05 2.01 0.16 0.11 115.64 123.72 1h1m s THR 124 Ca -0.01 -0.24 -0.11 0.00 0.31 0.00 0.00 61.69 61.64 1h1m s THR 124 Cb -0.13 -2.91 -0.05 0.00 0.01 0.00 0.00 72.50 69.41 1h1m s THR 124 CO 0.03 0.36 0.19 -0.83 -0.69 0.00 0.00 174.62 173.68 1h1m s GLY 125 N 1.54 2.11 -0.18 4.40 0.00 0.98 -1.28 107.32 114.89 1h1m s GLY 125 Ca 0.06 -0.60 0.01 0.00 0.00 0.00 0.00 44.72 44.19 1h1m s GLY 125 CO 0.02 0.18 -0.17 0.14 0.00 0.00 0.00 173.10 173.28 1h1m s VAL 126 N 0.23 1.92 -0.06 1.40 1.01 -0.46 -0.88 120.40 123.57 1h1m s VAL 126 Ca 0.12 -0.96 0.05 0.00 0.00 0.00 0.00 61.98 61.18 1h1m s VAL 126 Cb -0.12 -1.81 -0.01 0.00 0.00 0.00 0.00 36.38 34.45 1h1m s VAL 126 CO 0.01 0.41 -0.22 -0.63 0.00 0.00 0.00 175.10 174.67 1h1m s ILE 127 N 1.32 1.87 -0.07 2.22 1.09 -0.14 -1.52 121.20 125.97 1h1m s ILE 127 Ca 0.03 -0.95 0.03 0.00 -1.10 0.00 0.00 60.65 58.66 1h1m s ILE 127 Cb -0.14 -1.60 0.01 0.00 -1.06 0.00 0.00 42.46 39.67 1h1m s ILE 127 CO -0.11 0.52 -0.15 -0.69 -0.10 0.00 0.00 174.94 174.41 1h1m s VAL 128 N 0.04 1.35 1.05 2.92 1.01 -0.71 -0.58 120.40 125.49 1h1m s VAL 128 Ca -0.08 -0.60 -0.18 0.00 0.00 0.00 0.00 61.98 61.12 1h1m s VAL 128 Cb -0.14 -1.21 0.24 0.00 0.00 0.00 0.00 36.38 35.26 1h1m s VAL 128 CO 0.05 0.40 1.28 -2.16 0.00 0.00 0.00 175.10 174.67 1h1m s PRO 129 N 0.61 -0.08 0.67 2.72 0.04 -1.26 -0.87 135.00 136.82 1h1m s PRO 129 Ca -0.15 -0.38 -0.11 0.00 0.04 0.00 0.00 61.00 60.39 1h1m s PRO 129 Cb -0.16 -1.76 -0.00 0.00 0.04 0.00 0.00 34.50 32.62 1h1m s PRO 129 CO 0.05 -2.90 1.06 0.20 0.04 0.00 0.00 177.00 175.45 1h1m s GLY 130 N -4.65 1.63 0.00 0.56 0.00 0.12 -4.36 107.32 100.61 1h1m s GLY 130 Ca 0.74 -0.29 0.00 0.00 0.00 0.00 0.00 44.72 45.18 1h1m s GLY 130 CO 0.54 0.04 0.00 0.61 0.00 0.00 0.00 173.10 174.29 1h1m n GLY 131 N -2.90 0.47 0.29 0.20 0.00 -1.26 -4.73 105.19 97.27 1h1m n GLY 131 Ca 0.06 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.21 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 -0.12 1.61 3.57 -1.94 -2.54 116.94 117.52 1h1m h PHE 132 Ca 0.00 0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.54 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 0.00 0.33 1.05 -2.23 0.00 0.00 178.31 177.46 1h1m h GLU 133 N 0.00 0.00 -0.58 1.11 9.09 -1.95 -1.71 114.58 120.55 1h1m h GLU 133 Ca 0.03 0.00 0.16 0.00 0.05 0.00 0.00 59.36 59.61 1h1m h GLU 133 Cb 0.15 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.23 1h1m h GLU 133 CO -0.00 0.00 0.41 -0.44 0.05 0.00 0.00 179.01 179.03 1h1m h ASP 134 N 0.00 0.02 -0.56 3.06 3.32 -1.89 -0.40 116.42 119.97 1h1m h ASP 134 Ca 0.06 0.00 0.04 0.00 0.02 0.00 0.00 57.03 57.15 1h1m h ASP 134 Cb 0.71 -0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.22 1h1m h ASP 134 CO -0.00 0.01 0.31 0.25 -1.72 0.00 0.00 179.24 178.09 1h1m h LEU 135 N 0.02 0.48 -0.76 1.55 5.85 -1.57 -2.71 115.31 118.17 1h1m h LEU 135 Ca 0.27 0.02 -0.11 0.00 0.84 0.00 0.00 57.88 58.90 1h1m h LEU 135 Cb 1.07 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 42.01 1h1m h LEU 135 CO -0.01 0.33 -0.51 -0.26 -0.34 0.00 0.00 178.44 177.65 1h1m h PHE 136 N 0.61 0.00 -0.58 1.25 0.04 -1.29 -0.51 116.94 116.46 1h1m h PHE 136 Ca 0.24 0.00 0.01 0.00 2.80 0.00 0.00 57.97 61.01 1h1m h PHE 136 Cb 0.09 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.21 1h1m h PHE 136 CO -0.08 0.51 0.39 1.88 -0.60 0.00 0.00 178.31 180.41 1h1m h TYR 137 N 0.00 0.73 0.00 -0.55 0.05 -1.14 0.48 116.97 116.55 1h1m h TYR 137 Ca -0.01 0.02 -0.00 0.00 0.05 0.00 0.00 58.73 58.79 1h1m h TYR 137 Cb 1.05 -0.25 -0.00 0.00 1.01 0.00 0.00 36.73 38.54 1h1m h TYR 137 CO 0.00 0.46 -0.02 -0.92 -1.05 0.00 0.00 178.16 176.63 1h1m h TYR 138 N 0.79 0.00 -0.03 4.88 3.20 -1.20 -3.36 116.97 121.26 1h1m h TYR 138 Ca 0.21 0.00 -0.15 0.00 3.14 0.00 0.00 58.73 61.93 1h1m h TYR 138 Cb -0.09 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.16 1h1m h TYR 138 CO -0.00 1.00 -0.67 -0.07 -1.64 0.00 0.00 178.16 176.78 1h1m h LEU 139 N -1.00 0.15-10.36 2.82 3.38 -1.08 -3.46 115.31 105.76 1h1m h LEU 139 Ca -0.01 -0.10 -0.47 0.00 0.09 0.00 0.00 57.88 57.40 1h1m h LEU 139 Cb 1.00 -0.04 0.03 0.00 0.09 0.00 0.00 40.66 41.74 1h1m h LEU 139 CO -0.00 0.78 -0.01 -0.83 0.09 0.00 0.00 178.44 178.47 1h1m s GLY 140 N -4.43 1.55 -0.13 0.83 0.00 0.17 -4.84 107.32 100.47 1h1m s GLY 140 Ca -0.03 -0.88 -0.03 0.00 0.00 0.00 0.00 44.72 43.78 1h1m s GLY 140 CO 0.79 -0.69 0.00 -1.59 0.00 0.00 0.00 173.10 171.61 1h1m s THR 141 N -2.67 4.28 0.39 0.90 2.01 0.48 -4.84 115.64 116.19 1h1m s THR 141 Ca 0.49 -0.24 -0.26 0.00 0.31 0.00 0.00 61.69 61.99 1h1m s THR 141 Cb -0.10 -2.85 -0.11 0.00 0.01 0.00 0.00 72.50 69.45 1h1m s THR 141 CO 0.40 0.54 1.26 0.59 -0.69 0.00 0.00 174.62 176.73 1h1m n ASN 142 N 2.84 2.55 -4.12 3.53 3.02 -1.26 -1.00 115.26 120.81 1h1m n ASN 142 Ca -0.18 1.14 -0.29 0.00 -0.03 0.00 0.00 54.58 55.22 1h1m n ASN 142 Cb 0.53 -1.49 -0.17 0.00 -0.61 0.00 0.00 39.78 38.05 1h1m n ASN 142 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1h1m s ALA 143 N -1.17 1.84 0.14 5.41 0.00 -0.17 -4.77 121.76 123.05 1h1m s ALA 143 Ca 0.59 -0.80 -0.11 0.00 0.00 0.00 0.00 51.96 51.64 1h1m s ALA 143 Cb -0.53 -0.79 -0.02 0.00 0.00 0.00 0.00 23.12 21.78 1h1m s ALA 143 CO 0.59 0.10 1.51 1.15 0.00 0.00 0.00 175.76 179.11 1h1m h THR 144 N 5.86 1.27 -6.80 0.00 2.02 -1.94 -3.41 112.91 109.91 1h1m h THR 144 Ca -0.27 -1.41 -0.51 0.00 0.77 0.00 0.00 66.41 64.99 1h1m h THR 144 Cb 1.20 1.26 -0.01 0.00 -1.74 0.00 0.00 68.15 68.86 1h1m h THR 144 CO 0.49 0.48 -1.03 -0.67 0.37 0.00 0.00 175.52 175.15 1h1m n ASP 145 N -4.15 -4.32 -0.35 4.18 -0.08 -1.26 -4.83 116.55 105.74 1h1m n ASP 145 Ca -0.01 -1.05 -0.02 0.00 -1.51 0.00 0.00 54.79 52.20 1h1m n ASP 145 Cb 0.47 -1.51 0.11 0.00 2.34 0.00 0.00 41.12 42.53 1h1m n ASP 145 CO 0.00 0.00 0.00 0.74 0.12 0.00 0.00 177.20 178.06 1h1m h THR 146 N -0.97 1.21 -0.00 5.18 2.02 -1.98 -1.50 112.91 116.87 1h1m h THR 146 Ca -0.64 -0.43 0.00 0.00 0.77 0.00 0.00 66.41 66.11 1h1m h THR 146 Cb 1.34 -0.15 0.00 0.00 -1.74 0.00 0.00 68.15 67.60 1h1m h THR 146 CO 0.40 0.23 -0.00 0.35 0.37 0.00 0.00 175.52 176.86 1h1m n THR 147 N -4.45 0.00 -2.31 3.16 -2.24 -1.26 -4.90 114.28 102.27 1h1m n THR 147 Ca 0.11 -0.02 -0.20 0.00 -2.27 0.00 0.00 64.05 61.68 1h1m n THR 147 Cb 0.04 -0.43 -0.02 0.00 -2.10 0.00 0.00 70.33 67.83 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 -0.95 -0.87 -1.83 4.78 -0.00 -0.57 -4.96 115.22 110.82 1h1m n HIS 148 Ca 0.22 0.00 -0.41 0.00 -0.00 0.00 0.00 57.72 57.53 1h1m n HIS 148 Cb 0.14 -3.79 -0.00 0.00 -0.00 0.00 0.00 29.99 26.34 1h1m n HIS 148 CO 0.00 0.00 0.00 -0.08 -0.00 0.00 0.00 176.34 176.26 1h1m s THR 149 N -2.97 2.10 0.26 1.59 -1.32 -1.26 -4.89 115.64 109.16 1h1m s THR 149 Ca 0.00 0.10 -0.01 0.00 -1.21 0.00 0.00 61.69 60.57 1h1m s THR 149 Cb 0.00 -3.06 0.25 0.00 -1.51 0.00 0.00 72.50 68.17 1h1m s THR 149 CO 0.00 0.02 1.72 -0.65 -2.21 0.00 0.00 174.62 173.50 1h1m h PRO 150 N 3.01 0.43 -3.51 7.08 0.11 -1.94 -3.43 132.00 133.75 1h1m h PRO 150 Ca -0.51 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 65.52 1h1m h PRO 150 Cb 1.24 -0.10 -0.13 0.00 0.11 0.00 0.00 31.00 32.12 1h1m h PRO 150 CO 0.64 0.29 -0.14 1.52 -0.21 0.00 0.00 178.00 180.09 1h1m s TYR 151 N -5.97 -0.07 -0.16 0.65 -0.85 -1.26 -4.61 117.35 105.08 1h1m s TYR 151 Ca -0.12 -0.28 -0.29 0.00 -0.52 0.00 0.00 57.07 55.86 1h1m s TYR 151 Cb 0.22 0.18 -0.01 0.00 0.38 0.00 0.00 41.96 42.74 1h1m s TYR 151 CO 0.77 -0.69 1.11 0.42 -1.52 0.00 0.00 175.55 175.64 1h1m s ILE 152 N -3.84 4.55 -0.71 -3.49 -1.09 -1.26 -5.09 121.20 110.27 1h1m s ILE 152 Ca 0.05 1.85 -0.25 0.00 -2.23 0.00 0.00 60.65 60.08 1h1m s ILE 152 Cb 0.02 -4.20 -0.14 0.00 -1.58 0.00 0.00 42.46 36.57 1h1m s ILE 152 CO -0.10 -0.11 2.44 -2.65 -1.23 0.00 0.00 174.94 173.29 1h1m n PRO 153 N 5.96 0.64 -3.26 2.79 -0.02 -1.26 -5.04 135.00 134.82 1h1m n PRO 153 Ca 0.12 -0.26 0.03 0.00 -2.02 0.00 0.00 63.50 61.37 1h1m n PRO 153 Cb 0.46 -2.99 -0.02 0.00 -0.02 0.00 0.00 33.50 30.93 1h1m n PRO 153 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1h1m s SER 159 N 10.18 -1.31 0.43 2.55 0.15 -1.26 -5.20 113.70 119.24 1h1m s SER 159 Ca 1.06 1.01 -0.25 0.00 0.70 0.00 0.00 55.95 58.47 1h1m s SER 159 Cb -0.39 2.18 -0.08 0.00 -1.71 0.00 0.00 66.02 66.02 1h1m s SER 159 CO 0.27 -0.25 1.27 -0.55 1.20 0.00 0.00 173.24 175.18 1h1m s SER 160 N 2.87 6.21 0.14 5.45 0.15 -1.26 -4.73 113.70 122.52 1h1m s SER 160 Ca 0.15 2.56 -0.35 0.00 0.70 0.00 0.00 55.95 59.01 1h1m s SER 160 Cb -0.14 -2.63 -0.15 0.00 -1.71 0.00 0.00 66.02 61.39 1h1m s SER 160 CO -0.20 -0.91 1.45 0.41 1.20 0.00 0.00 173.24 175.19 1h1m n THR 161 N -0.10 0.12 -2.05 6.45 -1.04 -1.26 -4.75 114.28 111.65 1h1m n THR 161 Ca 0.05 -0.03 -0.39 0.00 -2.04 0.00 0.00 64.05 61.64 1h1m n THR 161 Cb 0.45 -1.23 -0.00 0.00 -1.82 0.00 0.00 70.33 67.73 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 0.62 2.61 0.00 12.58 2.01 -0.46 -4.84 115.64 128.16 1h1m s THR 162 Ca 0.80 0.54 0.00 0.00 0.31 0.00 0.00 61.69 63.33 1h1m s THR 162 Cb -0.79 -3.31 0.00 0.00 0.01 0.00 0.00 72.50 68.41 1h1m s THR 162 CO 0.43 0.07 0.00 0.61 -0.69 0.00 0.00 174.62 175.04 1h1m n GLY 163 N 0.65 -1.81 3.75 4.40 0.00 -1.26 -3.56 105.19 107.36 1h1m n GLY 163 Ca 0.04 -1.85 -0.40 0.00 0.00 0.00 0.00 46.02 43.82 1h1m n GLY 163 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1h1m n PRO 164 N 0.00 2.09 -1.41 1.61 -0.04 -1.26 -5.02 135.00 130.96 1h1m n PRO 164 Ca 0.00 0.75 -0.30 0.00 -0.04 0.00 0.00 63.50 63.91 1h1m n PRO 164 Cb 0.00 -2.58 0.23 0.00 -0.04 0.00 0.00 33.50 31.11 1h1m n PRO 164 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1h1m n ASP 165 N -0.28 -1.15 -0.15 3.54 5.68 -1.26 -4.57 116.55 118.36 1h1m n ASP 165 Ca 0.06 -1.30 -0.05 0.00 -0.50 0.00 0.00 54.79 53.00 1h1m n ASP 165 Cb 0.42 -1.01 0.04 0.00 -1.14 0.00 0.00 41.12 39.43 1h1m n ASP 165 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 1h1m h SER 166 N -2.31 0.26 -0.26 -1.12 4.64 -1.99 -1.43 113.55 111.34 1h1m h SER 166 Ca -0.42 0.04 0.05 0.00 -0.47 0.00 0.00 61.79 60.99 1h1m h SER 166 Cb 1.23 -0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 63.24 1h1m h SER 166 CO 0.28 0.19 -0.45 0.28 -0.87 0.00 0.00 176.83 176.27 1h1m h SER 167 N 0.40 -1.44 -0.05 4.97 0.02 -1.98 -3.12 113.55 112.35 1h1m h SER 167 Ca 0.21 0.20 -0.02 0.00 -0.84 0.00 0.00 61.79 61.34 1h1m h SER 167 Cb 0.16 0.60 -0.00 0.00 0.14 0.00 0.00 62.40 63.30 1h1m h SER 167 CO -0.18 -0.41 -0.06 0.74 -1.14 0.00 0.00 176.83 175.78 1h1m h THR 168 N -0.43 1.39 0.00 -2.27 2.02 -1.78 -2.29 112.91 109.54 1h1m h THR 168 Ca 0.10 -1.24 0.00 0.00 0.77 0.00 0.00 66.41 66.03 1h1m h THR 168 Cb 0.61 2.10 0.00 0.00 -1.74 0.00 0.00 68.15 69.13 1h1m h THR 168 CO -0.49 0.34 0.15 -0.29 0.37 0.00 0.00 175.52 175.61 1h1m h ILE 169 N -0.33 0.00 -0.33 3.11 2.10 -1.34 -0.06 117.51 120.66 1h1m h ILE 169 Ca 0.01 0.00 -0.08 0.00 1.08 0.00 0.00 64.86 65.87 1h1m h ILE 169 Cb 0.58 0.58 -0.05 0.00 -1.09 0.00 0.00 36.82 36.84 1h1m h ILE 169 CO 0.01 0.00 0.10 -1.20 -1.08 0.00 0.00 178.15 175.98 1h1m n SER 170 N -2.52 3.23 0.00 2.19 7.64 -0.86 -3.96 113.62 119.35 1h1m n SER 170 Ca -0.02 -2.53 0.00 0.00 1.01 0.00 0.00 58.87 57.34 1h1m n SER 170 Cb 0.20 -0.61 0.00 0.00 -1.01 0.00 0.00 64.21 62.79 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 0.11 0.00 -0.73 0.44 -1.04 -0.04 -4.80 114.28 108.23 1h1m n THR 171 Ca 0.17 0.00 0.07 0.00 -2.04 0.00 0.00 64.05 62.26 1h1m n THR 171 Cb 0.80 1.02 0.13 0.00 -1.82 0.00 0.00 70.33 70.47 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 0.00 2.65 0.11 -4.42 4.77 -1.25 -4.67 117.00 114.18 1h1m n LEU 172 Ca 0.00 -2.73 0.11 0.00 -0.03 0.00 0.00 56.01 53.36 1h1m n LEU 172 Cb 0.47 -0.34 0.60 0.00 -2.33 0.00 0.00 43.42 41.82 1h1m n LEU 172 CO 0.00 0.66 1.13 1.56 -1.33 0.00 0.00 177.39 179.41 1h1m h GLN 173 N 0.57 0.15 0.00 3.23 4.20 -1.81 -0.70 115.11 120.75 1h1m h GLN 173 Ca 0.00 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.69 1h1m h GLN 173 Cb 0.95 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.70 1h1m h GLN 173 CO 0.05 0.10 -0.05 0.77 -0.67 0.00 0.00 178.83 179.03 1h1m h SER 174 N 0.15 0.00 -0.30 1.46 0.02 -1.86 0.00 113.55 113.02 1h1m h SER 174 Ca 0.12 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.07 1h1m h SER 174 Cb 0.30 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.84 1h1m h SER 174 CO -0.02 0.05 0.00 0.49 -1.14 0.00 0.00 176.83 176.21 1h1m n PHE 175 N -3.21 0.59 -3.13 3.45 3.72 -0.30 -4.93 117.46 113.66 1h1m n PHE 175 Ca -0.00 -0.25 -0.18 0.00 -0.05 0.00 0.00 57.45 56.97 1h1m n PHE 175 Cb 0.27 -0.09 0.05 0.00 -0.94 0.00 0.00 39.48 38.77 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 0.40 -5.22 -4.03 4.37 2.03 -0.01 -4.94 116.55 109.15 1h1m n ASP 176 Ca 0.11 -0.33 -0.28 0.00 0.52 0.00 0.00 54.79 54.81 1h1m n ASP 176 Cb 0.40 -3.92 -0.17 0.00 -0.72 0.00 0.00 41.12 36.72 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 -3.16 1.43 -0.11 5.18 1.01 -1.00 -4.28 120.40 119.47 1h1m s VAL 177 Ca 0.36 -0.58 0.03 0.00 0.00 0.00 0.00 61.98 61.79 1h1m s VAL 177 Cb -0.16 -1.33 0.01 0.00 0.00 0.00 0.00 36.38 34.90 1h1m s VAL 177 CO 0.45 0.43 -0.22 -0.31 0.00 0.00 0.00 175.10 175.45 1h1m s TYR 178 N 1.16 2.45 0.49 5.22 1.51 -0.41 -2.58 117.35 125.19 1h1m s TYR 178 Ca -0.03 -1.09 -0.22 0.00 -1.01 0.00 0.00 57.07 54.72 1h1m s TYR 178 Cb -0.14 -1.66 -0.07 0.00 -0.11 0.00 0.00 41.96 39.98 1h1m s TYR 178 CO -0.04 -0.48 1.16 0.00 -1.11 0.00 0.00 175.55 175.09 1h1m s ALA 179 N 0.58 2.88 -0.48 3.71 0.00 -1.25 -1.19 121.76 126.00 1h1m s ALA 179 Ca -0.14 0.92 0.07 0.00 0.00 0.00 0.00 51.96 52.82 1h1m s ALA 179 Cb -0.17 -3.39 0.25 0.00 0.00 0.00 0.00 23.12 19.82 1h1m s ALA 179 CO 0.04 -0.73 0.62 0.39 0.00 0.00 0.00 175.76 176.08 1h1m n GLU 180 N -0.76 1.43 0.25 0.00 -0.58 -0.37 -4.81 120.64 115.80 1h1m n GLU 180 Ca 0.09 -3.79 0.14 0.00 -0.42 0.00 0.00 57.16 53.18 1h1m n GLU 180 Cb 0.49 -1.62 0.43 0.00 -0.57 0.00 0.00 31.44 30.16 1h1m n GLU 180 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 1h1m h LEU 181 N 4.02 0.00 -0.71 -4.62 3.38 -1.95 -2.22 115.31 113.21 1h1m h LEU 181 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1h1m h LEU 181 Cb 0.80 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.55 1h1m h LEU 181 CO 0.61 0.02 0.00 0.77 0.09 0.00 0.00 178.44 179.93 1h1m h SER 182 N 0.00 0.00 -2.81 -0.43 4.64 -1.95 -3.45 113.55 109.54 1h1m h SER 182 Ca -0.00 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.78 1h1m h SER 182 Cb 0.76 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.87 1h1m h SER 182 CO 0.00 0.00 0.90 0.12 -0.87 0.00 0.00 176.83 176.98 1h1m s PHE 183 N -3.33 2.73 -0.32 4.77 5.36 -0.83 -4.99 117.98 121.35 1h1m s PHE 183 Ca 0.04 0.59 -0.06 0.00 -0.96 0.00 0.00 56.93 56.54 1h1m s PHE 183 Cb 0.09 -3.83 0.03 0.00 -0.34 0.00 0.00 43.02 38.97 1h1m s PHE 183 CO 0.43 -3.20 0.09 0.99 -1.46 0.00 0.00 175.22 172.07 1h1m s THR 184 N 2.21 3.79 0.26 0.12 2.01 -1.26 -4.92 115.64 117.85 1h1m s THR 184 Ca 0.69 -0.97 -0.31 0.00 0.31 0.00 0.00 61.69 61.41 1h1m s THR 184 Cb -0.37 -3.07 -0.12 0.00 0.01 0.00 0.00 72.50 68.95 1h1m s THR 184 CO 0.30 -0.07 1.64 -2.65 -0.69 0.00 0.00 174.62 173.15 1h1m n PRO 185 N 4.82 2.72 -1.82 4.92 -0.02 -1.26 -4.92 135.00 139.44 1h1m n PRO 185 Ca -0.13 0.97 -0.33 0.00 -2.02 0.00 0.00 63.50 61.99 1h1m n PRO 185 Cb 0.46 -2.77 0.04 0.00 -0.02 0.00 0.00 33.50 31.20 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 0.07 2.97 -0.11 -0.52 1.70 -1.26 -4.96 118.95 116.84 1h1m s ARG 186 Ca 0.68 1.27 0.17 0.00 -0.47 0.00 0.00 55.73 57.38 1h1m s ARG 186 Cb -0.50 -1.98 0.39 0.00 -0.57 0.00 0.00 34.95 32.28 1h1m s ARG 186 CO 0.43 -1.10 1.18 0.25 -1.08 0.00 0.00 175.30 174.98 1h1m n THR 187 N -2.40 1.17 -1.69 4.99 -2.24 -1.26 -4.71 114.28 108.15 1h1m n THR 187 Ca 0.09 -2.08 -0.16 0.00 -2.27 0.00 0.00 64.05 59.63 1h1m n THR 187 Cb 0.52 0.30 0.11 0.00 -2.10 0.00 0.00 70.33 69.16 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 -0.43 4.19 -4.75 3.42 5.75 -1.26 -5.04 116.55 118.41 1h1m n ASP 188 Ca 0.12 -3.79 -0.41 0.00 -0.01 0.00 0.00 54.79 50.70 1h1m n ASP 188 Cb 0.87 -0.56 -0.02 0.00 -1.03 0.00 0.00 41.12 40.38 1h1m n ASP 188 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 1h1m s THR 189 N -4.05 2.83 -0.03 2.12 2.01 -1.26 -4.74 115.64 112.52 1h1m s THR 189 Ca 0.50 0.75 -0.01 0.00 0.31 0.00 0.00 61.69 63.24 1h1m s THR 189 Cb 0.42 -3.48 0.03 0.00 0.01 0.00 0.00 72.50 69.48 1h1m s THR 189 CO 0.01 0.14 0.06 -0.69 -0.69 0.00 0.00 174.62 173.44 1h1m s VAL 190 N -0.45 -0.05 -1.60 3.82 1.01 -0.54 -4.83 120.40 117.76 1h1m s VAL 190 Ca 0.54 0.19 -0.16 0.00 0.00 0.00 0.00 61.98 62.55 1h1m s VAL 190 Cb -0.40 -0.11 0.13 0.00 0.00 0.00 0.00 36.38 36.00 1h1m s VAL 190 CO 0.46 0.08 0.78 0.59 0.00 0.00 0.00 175.10 177.01 1h1m n ASN 191 N 4.08 -3.69 -0.06 3.32 3.02 -1.26 -1.74 115.26 118.93 1h1m n ASN 191 Ca -0.26 -0.86 -0.01 0.00 -0.03 0.00 0.00 54.58 53.42 1h1m n ASN 191 Cb 0.51 -3.00 -0.00 0.00 -0.61 0.00 0.00 39.78 36.68 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 -1.41 0.48 3.22 7.41 0.00 -1.26 -4.96 105.19 108.68 1h1m n GLY 192 Ca 0.06 -0.31 -0.10 0.00 0.00 0.00 0.00 46.02 45.68 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 -1.95 0.12 -0.03 2.61 -1.32 -0.71 -0.36 115.64 113.99 1h1m s THR 193 Ca 0.00 -0.98 -0.30 0.00 -1.21 0.00 0.00 61.69 59.20 1h1m s THR 193 Cb 0.00 -1.19 0.07 0.00 -1.51 0.00 0.00 72.50 69.87 1h1m s THR 193 CO 0.00 -0.54 0.68 0.00 -2.21 0.00 0.00 174.62 172.55 1h1m s ALA 194 N -3.45 -1.76 1.13 11.08 0.00 -0.97 -1.46 121.76 126.33 1h1m s ALA 194 Ca 0.02 1.25 -0.16 0.00 0.00 0.00 0.00 51.96 53.07 1h1m s ALA 194 Cb 0.03 0.07 0.22 0.00 0.00 0.00 0.00 23.12 23.44 1h1m s ALA 194 CO -0.09 -0.40 0.96 -0.35 0.00 0.00 0.00 175.76 175.88 1h1m n PRO 195 N 0.79 -2.14 -1.48 0.00 -0.04 -1.26 -1.79 135.00 129.08 1h1m n PRO 195 Ca -0.19 -1.51 -0.33 0.00 -0.04 0.00 0.00 63.50 61.43 1h1m n PRO 195 Cb 0.58 -1.25 0.08 0.00 -0.04 0.00 0.00 33.50 32.87 1h1m n PRO 195 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1h1m s ALA 196 N -3.36 2.21 0.00 0.55 0.00 -1.26 -3.46 121.76 116.43 1h1m s ALA 196 Ca 0.59 0.68 0.00 0.00 0.00 0.00 0.00 51.96 53.23 1h1m s ALA 196 Cb -0.04 -3.40 0.00 0.00 0.00 0.00 0.00 23.12 19.68 1h1m s ALA 196 CO 0.44 -1.72 0.00 0.09 0.00 0.00 0.00 175.76 174.57 1h1m n ASN 197 N -2.79 -1.49 -4.84 0.00 5.03 -1.26 -4.99 115.26 104.92 1h1m n ASN 197 Ca 0.12 0.00 -0.30 0.00 0.87 0.00 0.00 54.58 55.27 1h1m n ASN 197 Cb 0.51 -0.54 0.06 0.00 -1.02 0.00 0.00 39.78 38.80 1h1m n ASN 197 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 1h1m s THR 198 N -2.87 3.49 -0.19 3.41 -4.23 -1.22 -5.08 115.64 108.94 1h1m s THR 198 Ca 0.00 0.48 -0.02 0.00 -1.18 0.00 0.00 61.69 60.98 1h1m s THR 198 Cb 0.00 -3.33 -0.00 0.00 1.34 0.00 0.00 72.50 70.51 1h1m s THR 198 CO 0.00 -0.63 -0.11 -0.69 -0.54 0.00 0.00 174.62 172.65 1h1m s VAL 199 N -3.21 2.89 -0.30 2.29 1.01 -1.26 -5.06 120.40 116.76 1h1m s VAL 199 Ca 0.59 -0.67 0.01 0.00 0.00 0.00 0.00 61.98 61.91 1h1m s VAL 199 Cb -0.13 -2.27 0.15 0.00 0.00 0.00 0.00 36.38 34.13 1h1m s VAL 199 CO 0.53 0.48 0.34 0.86 0.00 0.00 0.00 175.10 177.31 1h1m s TRP 200 N 1.24 -0.66 -1.11 5.22 -0.00 -1.26 -4.83 118.94 117.55 1h1m s TRP 200 Ca 0.03 -0.04 0.00 0.00 -0.00 0.00 0.00 56.10 56.09 1h1m s TRP 200 Cb -0.14 -0.35 0.00 0.00 -0.00 0.00 0.00 33.47 32.98 1h1m s TRP 200 CO -0.05 -0.95 0.00 0.72 -0.00 0.00 0.00 176.95 176.67 1h1m n HIS 201 N 5.25 0.00 -0.41 5.86 8.25 -1.26 -4.85 115.22 128.06 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 0.47 -2.14 0.00 0.00 1.12 0.00 0.00 29.99 29.44 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 -2.57 0.43 -0.13 1.59 -2.24 -1.26 -5.11 114.28 104.98 1h1m n THR 202 Ca -0.10 -0.51 0.00 0.00 -2.27 0.00 0.00 64.05 61.17 1h1m n THR 202 Cb 0.41 0.89 0.00 0.00 -2.10 0.00 0.00 70.33 69.53 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 -0.22 -2.08 3.76 3.38 0.00 -1.26 -5.10 105.19 103.68 1h1m n GLY 203 Ca 0.00 -1.18 -0.38 0.00 0.00 0.00 0.00 46.02 44.46 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 -1.96 3.06 -0.15 4.61 0.00 -1.26 -4.76 121.76 121.30 1h1m s ALA 204 Ca 0.00 1.14 0.00 0.00 0.00 0.00 0.00 51.96 53.10 1h1m s ALA 204 Cb 0.00 -3.46 -0.00 0.00 0.00 0.00 0.00 23.12 19.65 1h1m s ALA 204 CO 0.00 -0.87 -0.15 -0.80 0.00 0.00 0.00 175.76 173.93 1h1m s ASN 205 N -1.02 3.71 0.21 0.00 0.02 0.03 -4.95 114.94 112.95 1h1m s ASN 205 Ca 0.62 -0.44 -0.05 0.00 -1.02 0.00 0.00 52.86 51.97 1h1m s ASN 205 Cb -0.35 -1.57 -0.06 0.00 0.02 0.00 0.00 41.25 39.30 1h1m s ASN 205 CO 0.43 0.10 0.46 0.00 0.02 0.00 0.00 177.10 178.12 1h1m s ALA 206 N 0.71 3.71 0.59 0.60 0.00 -1.26 -4.09 121.76 122.02 1h1m s ALA 206 Ca -0.07 -0.55 -0.20 0.00 0.00 0.00 0.00 51.96 51.14 1h1m s ALA 206 Cb -0.16 -2.21 -0.03 0.00 0.00 0.00 0.00 23.12 20.72 1h1m s ALA 206 CO 0.02 0.48 1.30 -0.51 0.00 0.00 0.00 175.76 177.04 1h1m s LEU 207 N -3.05 3.71 0.14 0.00 1.02 -1.26 -4.80 118.68 114.43 1h1m s LEU 207 Ca 0.43 2.62 -0.35 0.00 0.02 0.00 0.00 54.13 56.85 1h1m s LEU 207 Cb -0.11 -4.47 -0.15 0.00 0.02 0.00 0.00 46.19 41.47 1h1m s LEU 207 CO 0.26 -1.73 1.44 0.00 0.02 0.00 0.00 176.35 176.35 1h1m n ALA 208 N -1.47 0.26 0.75 4.21 0.00 -1.26 -4.90 120.51 118.11 1h1m n ALA 208 Ca 0.13 0.47 0.12 0.00 0.00 0.00 0.00 53.44 54.17 1h1m n ALA 208 Cb 0.47 -2.21 0.29 0.00 0.00 0.00 0.00 19.45 18.00 1h1m n ALA 208 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1h1m n SER 209 N 2.88 0.56 -4.62 0.00 3.41 -1.26 -4.79 113.62 109.81 1h1m n SER 209 Ca 0.17 0.15 -0.35 0.00 -0.26 0.00 0.00 58.87 58.59 1h1m n SER 209 Cb 0.25 -0.06 -0.10 0.00 -0.26 0.00 0.00 64.21 64.04 1h1m n SER 209 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1h1m s THR 210 N -3.09 4.73 0.39 6.66 2.01 -1.26 -5.01 115.64 120.07 1h1m s THR 210 Ca 0.09 -0.05 -0.26 0.00 0.31 0.00 0.00 61.69 61.78 1h1m s THR 210 Cb 0.15 -3.14 -0.09 0.00 0.01 0.00 0.00 72.50 69.44 1h1m s THR 210 CO 0.67 0.45 1.25 0.00 -0.69 0.00 0.00 174.62 176.30 1h1m s ALA 211 N 0.46 3.25 0.00 7.40 0.00 -1.26 -2.97 121.76 128.64 1h1m s ALA 211 Ca 0.03 1.14 0.00 0.00 0.00 0.00 0.00 51.96 53.13 1h1m s ALA 211 Cb -0.13 -3.45 0.00 0.00 0.00 0.00 0.00 23.12 19.55 1h1m s ALA 211 CO 0.01 -0.69 0.00 0.41 0.00 0.00 0.00 175.76 175.48 1h1m n GLY 212 N 0.69 1.24 3.79 0.00 0.00 -1.26 -5.06 105.19 104.60 1h1m n GLY 212 Ca 0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.60 6.97 0.77 1.61 1.01 -1.16 -4.78 116.67 118.50 1h1m s ASP 213 Ca 0.00 1.15 -0.13 0.00 0.71 0.00 0.00 52.55 54.29 1h1m s ASP 213 Cb 0.00 -2.34 0.06 0.00 1.01 0.00 0.00 42.92 41.65 1h1m s ASP 213 CO 0.00 0.21 1.15 -2.16 0.21 0.00 0.00 175.17 174.57 1h1m s PRO 214 N -0.67 2.01 0.28 8.23 0.04 -1.26 -4.70 135.00 138.93 1h1m s PRO 214 Ca 0.29 1.50 -0.18 0.00 0.04 0.00 0.00 61.00 62.64 1h1m s PRO 214 Cb -0.18 -1.84 0.02 0.00 0.04 0.00 0.00 34.50 32.53 1h1m s PRO 214 CO 0.17 -1.88 0.67 1.52 0.04 0.00 0.00 177.00 177.52 1h1m s TYR 215 N -2.44 -0.01 -0.05 0.56 1.13 -1.06 -4.84 117.35 110.65 1h1m s TYR 215 Ca 0.68 -0.44 -0.04 0.00 -1.41 0.00 0.00 57.07 55.86 1h1m s TYR 215 Cb -0.23 0.59 0.02 0.00 -1.10 0.00 0.00 41.96 41.23 1h1m s TYR 215 CO 0.50 -1.21 0.12 -0.06 -2.51 0.00 0.00 175.55 172.40 1h1m s PHE 216 N -3.78 -0.14 -0.13 -3.49 0.40 -1.26 0.27 117.98 109.85 1h1m s PHE 216 Ca 0.14 0.35 0.00 0.00 -0.60 0.00 0.00 56.93 56.83 1h1m s PHE 216 Cb -0.05 0.02 0.02 0.00 0.51 0.00 0.00 43.02 43.52 1h1m s PHE 216 CO 0.08 -0.08 -0.11 0.42 0.70 0.00 0.00 175.22 176.23 1h1m s ILE 217 N 0.29 1.28 0.41 0.64 1.01 -0.20 -4.80 121.20 119.82 1h1m s ILE 217 Ca -0.02 -0.45 -0.23 0.00 0.00 0.00 0.00 60.65 59.95 1h1m s ILE 217 Cb -0.03 -1.24 -0.10 0.00 0.01 0.00 0.00 42.46 41.10 1h1m s ILE 217 CO -0.01 0.41 0.98 0.00 0.00 0.00 0.00 174.94 176.32 1h1m s ALA 218 N 1.57 3.06 -0.29 9.38 0.00 -1.26 -1.41 121.76 132.82 1h1m s ALA 218 Ca 0.04 0.51 -0.36 0.00 0.00 0.00 0.00 51.96 52.15 1h1m s ALA 218 Cb -0.13 -3.19 -0.12 0.00 0.00 0.00 0.00 23.12 19.68 1h1m s ALA 218 CO -0.09 0.02 2.06 -1.71 0.00 0.00 0.00 175.76 176.04 1h1m n ASN 219 N -0.31 2.45 0.00 0.00 5.15 -1.26 -0.96 115.26 120.33 1h1m n ASN 219 Ca 0.06 0.62 0.00 0.00 -0.60 0.00 0.00 54.58 54.66 1h1m n ASN 219 Cb 0.52 -1.27 0.00 0.00 -0.53 0.00 0.00 39.78 38.50 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 5.73 1.20 0.70 8.20 0.00 -1.26 -4.91 105.19 114.84 1h1m n GLY 220 Ca 0.35 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.48 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 -2.15 1.61 7.02 -0.13 -4.85 117.44 116.93 1h1m n TRP 221 Ca 0.00 0.00 -0.28 0.00 -1.02 0.00 0.00 57.50 56.20 1h1m n TRP 221 Cb 0.00 0.00 0.15 0.00 -2.42 0.00 0.00 31.31 29.04 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 -2.08 1.76 0.43 6.99 0.00 -1.26 -0.79 107.32 112.38 1h1m s GLY 222 Ca 0.22 -1.33 -0.25 0.00 0.00 0.00 0.00 44.72 43.36 1h1m s GLY 222 CO 0.40 -0.66 1.24 2.56 0.00 0.00 0.00 173.10 176.64 1h1m s PRO 223 N -5.61 3.87 0.12 2.90 0.04 -1.26 -4.88 135.00 130.19 1h1m s PRO 223 Ca 0.70 1.99 0.04 0.00 0.04 0.00 0.00 61.00 63.78 1h1m s PRO 223 Cb -0.05 -2.61 -0.04 0.00 0.04 0.00 0.00 34.50 31.84 1h1m s PRO 223 CO 0.50 -0.52 -0.10 0.15 0.04 0.00 0.00 177.00 177.06 1h1m s LYS 224 N -2.41 0.97 -0.02 4.56 1.02 -1.25 -3.85 119.74 118.76 1h1m s LYS 224 Ca 0.60 -1.32 0.02 0.00 0.02 0.00 0.00 55.97 55.29 1h1m s LYS 224 Cb -0.34 -0.60 0.00 0.00 -0.52 0.00 0.00 37.83 36.37 1h1m s LYS 224 CO 0.43 0.08 -0.07 0.71 -0.92 0.00 0.00 175.35 175.59 1h1m s TYR 225 N -2.91 0.69 -0.26 3.18 1.51 -0.08 -1.39 117.35 118.10 1h1m s TYR 225 Ca 0.12 -0.15 -0.10 0.00 -1.01 0.00 0.00 57.07 55.93 1h1m s TYR 225 Cb 0.00 -0.50 -0.04 0.00 -0.11 0.00 0.00 41.96 41.30 1h1m s TYR 225 CO 0.00 -0.07 0.15 -1.17 -1.11 0.00 0.00 175.55 173.36 1h1m s LEU 226 N 0.17 3.88 -0.21 -1.29 2.96 0.06 -0.24 118.68 124.01 1h1m s LEU 226 Ca -0.02 -0.04 -0.08 0.00 -0.22 0.00 0.00 54.13 53.77 1h1m s LEU 226 Cb -0.07 -2.06 -0.04 0.00 0.50 0.00 0.00 46.19 44.52 1h1m s LEU 226 CO -0.00 -0.02 0.09 0.21 -1.32 0.00 0.00 176.35 175.30 1h1m s ASN 227 N 1.58 5.61 -0.10 3.68 3.84 0.17 -1.25 114.94 128.48 1h1m s ASN 227 Ca 0.07 0.01 0.15 0.00 0.21 0.00 0.00 52.86 53.30 1h1m s ASN 227 Cb -0.15 -1.98 0.49 0.00 -0.55 0.00 0.00 41.25 39.05 1h1m s ASN 227 CO 0.08 0.10 1.40 -1.20 -2.79 0.00 0.00 177.10 174.69 1h1m n SER 228 N 4.05 3.72 0.09 -4.21 7.64 -1.26 -0.69 113.62 122.96 1h1m n SER 228 Ca -0.16 -2.52 -0.08 0.00 1.01 0.00 0.00 58.87 57.12 1h1m n SER 228 Cb 0.52 -0.43 -0.03 0.00 -1.01 0.00 0.00 64.21 63.25 1h1m n SER 228 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 1h1m h GLN 229 N 2.36 0.13 -2.02 1.43 4.20 -1.94 -3.39 115.11 115.88 1h1m h GLN 229 Ca 0.00 -0.16 -0.51 0.00 0.06 0.00 0.00 58.65 58.04 1h1m h GLN 229 Cb 1.19 0.05 -0.40 0.00 0.30 0.00 0.00 27.48 28.62 1h1m h GLN 229 CO 0.15 0.95 -1.12 0.66 -0.67 0.00 0.00 178.83 178.80 1h1m n TYR 230 N -3.58 0.34 -3.66 2.96 4.01 -1.26 -5.04 117.16 110.93 1h1m n TYR 230 Ca -0.03 -3.76 0.00 0.00 -0.16 0.00 0.00 57.90 53.95 1h1m n TYR 230 Cb 0.84 -0.41 -0.00 0.00 -0.31 0.00 0.00 39.34 39.47 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 0.62 -2.05 3.76 2.72 0.00 -1.26 -4.82 105.19 104.15 1h1m n GLY 231 Ca 0.24 -1.41 -0.35 0.00 0.00 0.00 0.00 46.02 44.50 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 -0.11 3.43 -0.02 1.61 2.02 -1.26 -4.16 117.35 118.87 1h1m s TYR 232 Ca 0.00 0.35 0.02 0.00 -0.37 0.00 0.00 57.07 57.06 1h1m s TYR 232 Cb 0.00 -2.07 0.00 0.00 -0.40 0.00 0.00 41.96 39.49 1h1m s TYR 232 CO 0.00 0.41 -0.06 -0.65 -1.57 0.00 0.00 175.55 173.68 1h1m s GLN 233 N -0.09 0.65 -0.20 -0.62 -0.21 0.13 -1.44 119.66 117.89 1h1m s GLN 233 Ca 0.10 -0.20 -0.02 0.00 0.02 0.00 0.00 55.36 55.25 1h1m s GLN 233 Cb -0.11 -0.64 -0.00 0.00 1.00 0.00 0.00 33.01 33.25 1h1m s GLN 233 CO 0.00 0.08 -0.09 0.42 -2.12 0.00 0.00 175.29 173.58 1h1m s ILE 234 N 0.18 3.09 -0.19 1.08 1.01 0.34 0.46 121.20 127.17 1h1m s ILE 234 Ca -0.02 -0.60 -0.07 0.00 0.00 0.00 0.00 60.65 59.96 1h1m s ILE 234 Cb -0.07 -2.37 -0.04 0.00 0.01 0.00 0.00 42.46 40.00 1h1m s ILE 234 CO -0.00 0.46 0.05 -0.69 0.00 0.00 0.00 174.94 174.76 1h1m s VAL 235 N 1.23 4.54 -0.49 2.92 1.01 0.67 -0.86 120.40 129.42 1h1m s VAL 235 Ca 0.03 -0.12 -0.05 0.00 0.00 0.00 0.00 61.98 61.83 1h1m s VAL 235 Cb -0.14 -3.05 0.13 0.00 0.00 0.00 0.00 36.38 33.31 1h1m s VAL 235 CO -0.03 0.44 0.32 0.00 0.00 0.00 0.00 175.10 175.83 1h1m s ALA 236 N 0.62 3.36 0.42 5.51 0.00 -0.17 -0.90 121.76 130.60 1h1m s ALA 236 Ca 0.02 -2.72 -0.26 0.00 0.00 0.00 0.00 51.96 49.01 1h1m s ALA 236 Cb -0.13 -2.65 -0.09 0.00 0.00 0.00 0.00 23.12 20.25 1h1m s ALA 236 CO 0.02 -1.92 1.36 -2.14 0.00 0.00 0.00 175.76 173.08 1h1m s PRO 237 N 0.94 3.85 -0.03 0.00 0.02 -1.25 -1.79 135.00 136.73 1h1m s PRO 237 Ca 0.09 2.27 0.00 0.00 0.02 0.00 0.00 61.00 63.39 1h1m s PRO 237 Cb -0.23 -2.71 -0.02 0.00 0.02 0.00 0.00 34.50 31.56 1h1m s PRO 237 CO -0.03 -0.63 -0.03 1.19 -0.33 0.00 0.00 177.00 177.16 1h1m n PHE 238 N -0.01 0.00 -4.16 6.54 3.72 0.76 -4.79 117.46 119.53 1h1m n PHE 238 Ca 0.04 0.00 -0.23 0.00 -0.05 0.00 0.00 57.45 57.22 1h1m n PHE 238 Cb 0.43 -0.13 -0.17 0.00 -0.94 0.00 0.00 39.48 38.67 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 -2.07 0.74 0.29 -4.37 1.01 0.04 -4.94 120.40 111.10 1h1m s VAL 239 Ca -0.05 -0.20 0.00 0.00 0.00 0.00 0.00 61.98 61.74 1h1m s VAL 239 Cb 0.01 -0.75 0.00 0.00 0.00 0.00 0.00 36.38 35.64 1h1m s VAL 239 CO 0.08 0.29 0.03 0.35 0.00 0.00 0.00 175.10 175.84 1h1m n THR 240 N 4.32 0.00 -0.14 3.92 -2.24 -1.26 -2.04 114.28 116.84 1h1m n THR 240 Ca -0.19 -1.36 0.12 0.00 -2.27 0.00 0.00 64.05 60.35 1h1m n THR 240 Cb 0.51 0.21 0.46 0.00 -2.10 0.00 0.00 70.33 69.41 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 1.09 1.97 -1.01 6.98 0.00 -1.91 0.34 119.26 126.73 1h1m h ALA 241 Ca -0.24 -0.01 0.14 0.00 0.00 0.00 0.00 54.91 54.80 1h1m h ALA 241 Cb 0.73 -0.10 -0.09 0.00 0.00 0.00 0.00 17.79 18.33 1h1m h ALA 241 CO 0.39 -0.13 0.63 1.15 0.00 0.00 0.00 179.25 181.29 1h1m h THR 242 N 0.50 0.87 0.07 0.00 2.02 -1.95 -1.16 112.91 113.25 1h1m h THR 242 Ca 0.33 -0.32 -0.37 0.00 0.77 0.00 0.00 66.41 66.81 1h1m h THR 242 Cb 0.59 -0.16 -0.04 0.00 -1.74 0.00 0.00 68.15 66.81 1h1m h THR 242 CO -0.11 0.17 -2.16 0.00 0.37 0.00 0.00 175.52 173.79 1h1m n GLN 243 N -4.65 0.70 -0.21 6.66 3.00 -0.15 -4.41 117.38 118.32 1h1m n GLN 243 Ca 0.20 0.24 -0.09 0.00 -0.01 0.00 0.00 57.00 57.34 1h1m n GLN 243 Cb 0.41 -1.63 0.02 0.00 0.00 0.00 0.00 30.24 29.04 1h1m n GLN 243 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1h1m h ALA 244 N -0.03 0.81 -0.34 -1.58 0.00 -0.93 -3.43 119.26 113.77 1h1m h ALA 244 Ca -0.49 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.11 1h1m h ALA 244 Cb 1.93 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 19.50 1h1m h ALA 244 CO -0.01 0.65 0.00 1.04 0.00 0.00 0.00 179.25 180.92 1h1m n GLN 245 N -4.20 0.00 0.15 0.00 6.02 -0.45 -1.41 117.38 117.49 1h1m n GLN 245 Ca 0.03 0.00 0.11 0.00 -0.01 0.00 0.00 57.00 57.13 1h1m n GLN 245 Cb 0.34 0.00 0.55 0.00 1.02 0.00 0.00 30.24 32.16 1h1m n GLN 245 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.06 175.65 1h1m n ASP 246 N 1.94 0.58 0.10 1.08 5.75 -1.26 -0.66 116.55 124.08 1h1m n ASP 246 Ca 0.00 0.73 0.10 0.00 -0.01 0.00 0.00 54.79 55.61 1h1m n ASP 246 Cb 0.00 -0.82 0.44 0.00 -1.03 0.00 0.00 41.12 39.70 1h1m n ASP 246 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 1h1m n THR 247 N -2.24 0.92 -3.52 2.12 -2.24 -0.50 -4.93 114.28 103.89 1h1m n THR 247 Ca -0.00 0.28 -0.24 0.00 -2.27 0.00 0.00 64.05 61.81 1h1m n THR 247 Cb 0.09 -1.17 0.05 0.00 -2.10 0.00 0.00 70.33 67.19 1h1m n THR 247 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1h1m n ASN 248 N -2.03 -5.89 -3.92 3.42 5.15 0.16 -4.88 115.26 107.28 1h1m n ASN 248 Ca 0.02 -0.86 -0.10 0.00 -0.60 0.00 0.00 54.58 53.05 1h1m n ASN 248 Cb 0.19 -3.96 -0.05 0.00 -0.53 0.00 0.00 39.78 35.44 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 -3.38 0.42 0.12 1.20 1.13 -1.24 -1.36 117.35 114.25 1h1m s TYR 249 Ca 0.41 -0.78 0.05 0.00 -1.41 0.00 0.00 57.07 55.34 1h1m s TYR 249 Cb -0.12 0.17 -0.04 0.00 -1.10 0.00 0.00 41.96 40.88 1h1m s TYR 249 CO 0.82 -1.01 -0.13 0.95 -2.51 0.00 0.00 175.55 173.67 1h1m s THR 250 N -3.90 1.24 -0.08 -3.49 -4.23 -0.17 -4.55 115.64 100.47 1h1m s THR 250 Ca 0.23 -1.77 -0.08 0.00 -1.18 0.00 0.00 61.69 58.88 1h1m s THR 250 Cb -0.01 -1.56 0.02 0.00 1.34 0.00 0.00 72.50 72.29 1h1m s THR 250 CO 0.10 -0.51 0.23 -0.22 -0.54 0.00 0.00 174.62 173.68 1h1m s LEU 251 N -2.60 1.13 0.14 4.79 2.96 -0.87 -1.02 118.68 123.21 1h1m s LEU 251 Ca 0.10 0.39 -0.25 0.00 -0.22 0.00 0.00 54.13 54.15 1h1m s LEU 251 Cb -0.03 0.82 0.07 0.00 0.50 0.00 0.00 46.19 47.55 1h1m s LEU 251 CO 0.02 -0.13 1.02 -0.94 -1.32 0.00 0.00 176.35 175.00 1h1m s SER 252 N -0.10 -0.12 0.08 3.68 1.04 -0.65 -0.17 113.70 117.47 1h1m s SER 252 Ca -0.02 -0.44 0.01 0.00 0.48 0.00 0.00 55.95 55.99 1h1m s SER 252 Cb -0.02 0.45 -0.04 0.00 0.10 0.00 0.00 66.02 66.51 1h1m s SER 252 CO 0.01 -0.85 0.18 0.42 0.98 0.00 0.00 173.24 173.98 1h1m s THR 253 N -2.91 5.12 -0.16 2.02 -4.23 -0.74 -0.17 115.64 114.56 1h1m s THR 253 Ca 0.15 -0.57 0.01 0.00 -1.18 0.00 0.00 61.69 60.10 1h1m s THR 253 Cb -0.01 -3.52 0.02 0.00 1.34 0.00 0.00 72.50 70.33 1h1m s THR 253 CO 0.02 0.09 -0.17 -0.63 -0.54 0.00 0.00 174.62 173.39 1h1m s ILE 254 N -1.53 1.80 0.01 2.99 1.01 -0.37 -1.00 121.20 124.11 1h1m s ILE 254 Ca 0.33 -0.79 -0.04 0.00 0.00 0.00 0.00 60.65 60.15 1h1m s ILE 254 Cb -0.12 -1.66 -0.04 0.00 0.01 0.00 0.00 42.46 40.64 1h1m s ILE 254 CO 0.26 0.49 0.23 -0.44 0.00 0.00 0.00 174.94 175.49 1h1m s SER 255 N 1.39 6.43 -0.01 3.58 0.01 -0.04 -0.69 113.70 124.38 1h1m s SER 255 Ca 0.05 0.45 0.00 0.00 1.31 0.00 0.00 55.95 57.75 1h1m s SER 255 Cb -0.13 -2.04 0.01 0.00 0.21 0.00 0.00 66.02 64.07 1h1m s SER 255 CO -0.12 0.24 0.01 -0.04 0.41 0.00 0.00 173.24 173.74 1h1m s MET 256 N -1.96 -0.01 1.02 12.44 1.00 0.15 -0.51 119.30 131.43 1h1m s MET 256 Ca 0.29 0.06 -0.17 0.00 0.00 0.00 0.00 55.69 55.87 1h1m s MET 256 Cb -0.13 -0.10 0.23 0.00 0.00 0.00 0.00 34.83 34.83 1h1m s MET 256 CO 0.19 -0.06 1.30 -1.54 0.00 0.00 0.00 175.02 174.90 1h1m s SER 257 N 0.38 2.56 0.94 3.03 1.04 -0.52 -1.03 113.70 120.10 1h1m s SER 257 Ca -0.03 0.28 -0.12 0.00 0.48 0.00 0.00 55.95 56.56 1h1m s SER 257 Cb -0.05 -0.32 0.15 0.00 0.10 0.00 0.00 66.02 65.90 1h1m s SER 257 CO -0.01 -3.08 1.11 0.42 0.98 0.00 0.00 173.24 172.66 1h1m s THR 258 N -3.75 2.22 -0.27 2.02 -4.23 -1.25 -4.30 115.64 106.08 1h1m s THR 258 Ca 0.74 0.07 -0.13 0.00 -1.18 0.00 0.00 61.69 61.20 1h1m s THR 258 Cb -0.04 -2.68 -0.04 0.00 1.34 0.00 0.00 72.50 71.07 1h1m s THR 258 CO 0.54 -0.09 0.26 -0.89 -0.54 0.00 0.00 174.62 173.90 1h1m s THR 259 N -3.09 5.26 0.64 3.99 2.01 -1.26 -4.44 115.64 118.75 1h1m s THR 259 Ca 0.64 0.34 -0.18 0.00 0.31 0.00 0.00 61.69 62.80 1h1m s THR 259 Cb -0.17 -3.60 -0.02 0.00 0.01 0.00 0.00 72.50 68.73 1h1m s THR 259 CO 0.56 0.22 1.19 -2.65 -0.69 0.00 0.00 174.62 173.25 1h1m n PRO 260 N 5.08 1.02 0.14 4.92 -0.02 -1.26 -4.87 135.00 140.00 1h1m n PRO 260 Ca -0.12 0.40 0.11 0.00 -2.02 0.00 0.00 63.50 61.87 1h1m n PRO 260 Cb 0.51 -2.42 0.51 0.00 -0.02 0.00 0.00 33.50 32.08 1h1m n PRO 260 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1h1m n SER 261 N -1.61 0.59 -0.31 2.55 3.41 -1.26 -1.38 113.62 115.61 1h1m n SER 261 Ca 0.15 0.69 0.13 0.00 -0.26 0.00 0.00 58.87 59.59 1h1m n SER 261 Cb 0.48 -0.80 0.43 0.00 -0.26 0.00 0.00 64.21 64.06 1h1m n SER 261 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1h1m n THR 262 N -2.21 0.00 -4.59 6.66 -2.24 -1.26 -4.82 114.28 105.82 1h1m n THR 262 Ca 0.01 -0.16 -0.33 0.00 -2.27 0.00 0.00 64.05 61.29 1h1m n THR 262 Cb 0.15 0.42 -0.14 0.00 -2.10 0.00 0.00 70.33 68.66 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 -2.35 3.35 -0.14 2.28 1.01 -0.48 -5.09 120.40 118.99 1h1m s VAL 263 Ca 0.29 -0.55 -0.29 0.00 0.00 0.00 0.00 61.98 61.42 1h1m s VAL 263 Cb 0.20 -2.44 -0.01 0.00 0.00 0.00 0.00 36.38 34.13 1h1m s VAL 263 CO 0.46 0.51 1.17 -0.89 0.00 0.00 0.00 175.10 176.35 1h1m s THR 264 N 0.43 4.41 0.01 3.92 2.01 -1.26 -4.76 115.64 120.39 1h1m s THR 264 Ca -0.08 1.71 -0.30 0.00 0.31 0.00 0.00 61.69 63.33 1h1m s THR 264 Cb -0.15 -4.10 -0.09 0.00 0.01 0.00 0.00 72.50 68.17 1h1m s THR 264 CO 0.04 -0.09 2.00 0.52 -0.69 0.00 0.00 174.62 176.40 1h1m n VAL 265 N 5.06 0.72 -2.11 3.82 0.31 -1.26 -4.93 118.33 119.94 1h1m n VAL 265 Ca 0.12 -0.17 -0.36 0.00 -0.01 0.00 0.00 64.34 63.93 1h1m n VAL 265 Cb 0.46 -2.32 0.02 0.00 -0.91 0.00 0.00 33.84 31.09 1h1m n VAL 265 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1h1m s PRO 266 N 4.64 3.12 -0.22 5.55 0.04 -1.26 -5.02 135.00 141.84 1h1m s PRO 266 Ca 0.90 1.75 -0.11 0.00 0.04 0.00 0.00 61.00 63.58 1h1m s PRO 266 Cb -0.44 -1.96 -0.05 0.00 0.04 0.00 0.00 34.50 32.09 1h1m s PRO 266 CO 0.42 -1.07 0.19 0.99 0.04 0.00 0.00 177.00 177.58 1h1m s THR 267 N -1.66 5.35 0.22 1.26 2.01 -1.26 -4.53 115.64 117.03 1h1m s THR 267 Ca 0.76 0.28 0.07 0.00 0.31 0.00 0.00 61.69 63.10 1h1m s THR 267 Cb -0.28 -3.53 -0.04 0.00 0.01 0.00 0.00 72.50 68.66 1h1m s THR 267 CO 0.31 0.36 0.12 0.26 -0.69 0.00 0.00 174.62 174.97 1h1m s TRP 268 N 0.91 3.02 -0.21 4.92 0.52 0.85 -4.92 118.94 124.02 1h1m s TRP 268 Ca 0.10 -0.11 -0.14 0.00 0.02 0.00 0.00 56.10 55.97 1h1m s TRP 268 Cb -0.13 -1.40 0.06 0.00 -1.15 0.00 0.00 33.47 30.85 1h1m s TRP 268 CO 0.04 0.54 0.53 0.45 0.02 0.00 0.00 176.95 178.52 1h1m s SER 269 N -3.46 -0.65 0.04 2.95 0.15 -1.26 -0.66 113.70 110.81 1h1m s SER 269 Ca 0.31 1.13 0.02 0.00 0.70 0.00 0.00 55.95 58.11 1h1m s SER 269 Cb -0.08 1.05 -0.02 0.00 -1.71 0.00 0.00 66.02 65.25 1h1m s SER 269 CO 0.23 -0.20 -0.08 -0.36 1.20 0.00 0.00 173.24 174.03 1h1m s PHE 270 N 1.09 0.66 0.40 3.44 0.08 -1.26 -4.97 117.98 117.42 1h1m s PHE 270 Ca -0.06 -0.46 0.11 0.00 0.12 0.00 0.00 56.93 56.64 1h1m s PHE 270 Cb -0.06 -0.40 0.84 0.00 -0.57 0.00 0.00 43.02 42.84 1h1m s PHE 270 CO -0.10 -0.07 1.93 -1.00 -0.10 0.00 0.00 175.22 175.87 1h1m h PRO 271 N 4.64 0.15 -6.14 0.24 0.13 -1.92 0.44 132.00 129.53 1h1m h PRO 271 Ca -0.35 -0.03 -0.56 0.00 -0.87 0.00 0.00 66.00 64.18 1h1m h PRO 271 Cb 1.20 -0.02 -0.03 0.00 0.13 0.00 0.00 31.00 32.28 1h1m h PRO 271 CO 0.42 0.32 -0.37 0.20 -0.23 0.00 0.00 178.00 178.33 1h1m s GLY 272 N -4.11 1.97 0.59 1.56 0.00 -1.25 -3.99 107.32 102.08 1h1m s GLY 272 Ca -0.05 -0.78 -0.19 0.00 0.00 0.00 0.00 44.72 43.70 1h1m s GLY 272 CO 0.72 -0.73 0.98 0.00 0.00 0.00 0.00 173.10 174.06 1h1m n ALA 273 N -0.30 0.22 -2.53 3.20 0.00 -1.26 -4.03 120.51 115.81 1h1m n ALA 273 Ca -0.04 0.02 -0.10 0.00 0.00 0.00 0.00 53.44 53.33 1h1m n ALA 273 Cb 0.53 -2.11 -0.08 0.00 0.00 0.00 0.00 19.45 17.78 1h1m n ALA 273 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1h1m s ALA 275 N -3.99 -0.72 0.03 0.00 0.00 -0.44 -0.46 121.76 116.17 1h1m s ALA 275 Ca 0.19 -0.10 -0.07 0.00 0.00 0.00 0.00 51.96 51.97 1h1m s ALA 275 Cb 0.05 0.49 -0.00 0.00 0.00 0.00 0.00 23.12 23.66 1h1m s ALA 275 CO 0.00 -0.52 0.14 -0.59 0.00 0.00 0.00 175.76 174.79 1h1m s PHE 276 N -3.27 0.11 -0.13 0.00 -0.12 -0.71 -1.34 117.98 112.51 1h1m s PHE 276 Ca -0.00 -0.32 0.03 0.00 -0.05 0.00 0.00 56.93 56.59 1h1m s PHE 276 Cb 0.01 -0.08 0.01 0.00 -0.63 0.00 0.00 43.02 42.33 1h1m s PHE 276 CO -0.08 -0.37 -0.22 -1.14 -0.05 0.00 0.00 175.22 173.36 1h1m s GLN 277 N -2.28 3.01 0.16 1.99 0.74 0.05 -1.26 119.66 122.08 1h1m s GLN 277 Ca -0.08 -0.86 -0.31 0.00 0.05 0.00 0.00 55.36 54.16 1h1m s GLN 277 Cb -0.03 -2.39 -0.10 0.00 1.10 0.00 0.00 33.01 31.60 1h1m s GLN 277 CO -0.03 0.04 1.53 0.08 -0.55 0.00 0.00 175.29 176.36 1h1m s VAL 278 N 0.69 2.74 -0.23 1.34 1.01 -0.15 -0.24 120.40 125.57 1h1m s VAL 278 Ca -0.10 0.54 0.00 0.00 0.00 0.00 0.00 61.98 62.42 1h1m s VAL 278 Cb -0.16 -3.35 -0.14 0.00 0.00 0.00 0.00 36.38 32.73 1h1m s VAL 278 CO 0.01 0.05 -0.21 0.00 0.00 0.00 0.00 175.10 174.94 1h1m n GLN 279 N 3.83 0.56 -3.84 2.72 1.13 0.85 0.02 117.38 122.66 1h1m n GLN 279 Ca 0.13 0.14 -0.12 0.00 -1.94 0.00 0.00 57.00 55.21 1h1m n GLN 279 Cb 0.39 -1.45 -0.11 0.00 0.11 0.00 0.00 30.24 29.19 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 -2.45 0.37 0.41 -1.09 2.12 -0.51 -4.67 118.70 112.88 1h1m s GLU 280 Ca -0.31 -0.10 0.00 0.00 0.36 0.00 0.00 54.97 54.92 1h1m s GLU 280 Cb 0.08 0.16 0.00 0.00 0.26 0.00 0.00 34.13 34.64 1h1m s GLU 280 CO 0.51 -0.08 0.00 0.41 -0.54 0.00 0.00 175.26 175.57 1h1m n GLY 281 N 2.12 -1.48 2.84 -1.50 0.00 -1.26 -0.26 105.19 105.65 1h1m n GLY 281 Ca -0.18 -1.84 -0.16 0.00 0.00 0.00 0.00 46.02 43.83 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 0.16 -0.12 1.61 0.52 -1.26 -4.36 118.95 115.50 1h1m s ARG 282 Ca 0.00 0.42 0.03 0.00 -0.52 0.00 0.00 55.73 55.66 1h1m s ARG 282 Cb 0.00 -0.72 0.01 0.00 0.52 0.00 0.00 34.95 34.75 1h1m s ARG 282 CO 0.00 -0.50 -0.23 0.08 0.02 0.00 0.00 175.30 174.67 1h1m s VAL 283 N 2.36 2.06 -0.18 3.52 1.01 -0.80 -1.16 120.40 127.21 1h1m s VAL 283 Ca 0.05 -0.99 -0.14 0.00 0.00 0.00 0.00 61.98 60.90 1h1m s VAL 283 Cb -0.14 -1.81 -0.05 0.00 0.00 0.00 0.00 36.38 34.39 1h1m s VAL 283 CO -0.10 0.55 0.30 -0.69 0.00 0.00 0.00 175.10 175.16 1h1m s VAL 284 N 0.63 5.29 -0.05 2.92 1.01 0.41 -0.04 120.40 130.58 1h1m s VAL 284 Ca -0.12 0.54 0.05 0.00 0.00 0.00 0.00 61.98 62.46 1h1m s VAL 284 Cb -0.16 -3.64 -0.01 0.00 0.00 0.00 0.00 36.38 32.57 1h1m s VAL 284 CO 0.02 0.36 -0.21 0.54 0.00 0.00 0.00 175.10 175.81 1h1m s VAL 285 N 0.67 1.74 -0.18 2.92 0.11 0.19 -1.74 120.40 124.11 1h1m s VAL 285 Ca 0.16 -0.89 0.00 0.00 -2.93 0.00 0.00 61.98 58.32 1h1m s VAL 285 Cb -0.13 -1.47 0.04 0.00 -1.53 0.00 0.00 36.38 33.28 1h1m s VAL 285 CO 0.04 0.49 -0.08 -1.58 -3.33 0.00 0.00 175.10 170.64 1h1m s GLN 286 N -0.11 1.77 -0.09 1.54 0.74 0.54 -0.84 119.66 123.21 1h1m s GLN 286 Ca -0.02 -0.66 0.04 0.00 0.05 0.00 0.00 55.36 54.77 1h1m s GLN 286 Cb -0.12 -2.18 -0.01 0.00 1.10 0.00 0.00 33.01 31.80 1h1m s GLN 286 CO 0.03 -0.41 -0.22 0.42 -0.55 0.00 0.00 175.29 174.56 1h1m s ILE 287 N 1.52 2.31 0.00 -2.34 1.01 -1.26 -1.19 121.20 121.24 1h1m s ILE 287 Ca 0.00 -0.95 0.00 0.00 0.00 0.00 0.00 60.65 59.71 1h1m s ILE 287 Cb -0.15 -1.89 0.00 0.00 0.01 0.00 0.00 42.46 40.43 1h1m s ILE 287 CO -0.08 0.56 0.00 0.61 0.00 0.00 0.00 174.94 176.03 1h1m n GLY 288 N 3.30 2.86 0.13 6.18 0.00 1.00 -1.79 105.19 116.87 1h1m n GLY 288 Ca -0.18 0.13 0.13 0.00 0.00 0.00 0.00 46.02 46.10 1h1m n GLY 288 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1h1m n ASP 289 N 3.29 0.63 -4.89 1.61 2.03 -1.26 -4.98 116.55 112.98 1h1m n ASP 289 Ca 0.00 -0.54 -0.29 0.00 0.52 0.00 0.00 54.79 54.48 1h1m n ASP 289 Cb 0.00 0.02 0.00 0.00 -0.72 0.00 0.00 41.12 40.42 1h1m n ASP 289 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 1h1m s TYR 290 N -2.62 3.59 0.53 -0.67 1.51 -0.74 -5.06 117.35 113.90 1h1m s TYR 290 Ca 0.23 1.01 -0.21 0.00 -1.01 0.00 0.00 57.07 57.09 1h1m s TYR 290 Cb 0.19 -2.47 -0.05 0.00 -0.11 0.00 0.00 41.96 39.52 1h1m s TYR 290 CO 0.53 -0.44 1.27 0.00 -1.11 0.00 0.00 175.55 175.80 1h1m s ALA 291 N -2.90 2.80 0.36 3.71 0.00 -1.26 -4.40 121.76 120.07 1h1m s ALA 291 Ca 0.51 1.14 -0.28 0.00 0.00 0.00 0.00 51.96 53.32 1h1m s ALA 291 Cb -0.11 -3.49 -0.11 0.00 0.00 0.00 0.00 23.12 19.42 1h1m s ALA 291 CO 0.48 -1.11 1.49 0.00 0.00 0.00 0.00 175.76 176.62 1h1m s ALA 292 N -1.44 3.59 -0.01 0.00 0.00 -1.26 -4.73 121.76 117.92 1h1m s ALA 292 Ca 0.71 1.56 0.04 0.00 0.00 0.00 0.00 51.96 54.26 1h1m s ALA 292 Cb -0.35 -3.61 -0.01 0.00 0.00 0.00 0.00 23.12 19.16 1h1m s ALA 292 CO 0.40 -1.03 -0.12 0.99 0.00 0.00 0.00 175.76 176.00 1h1m s THR 293 N -0.97 0.93 -0.18 0.00 2.01 -0.02 -4.95 115.64 112.46 1h1m s THR 293 Ca 0.54 -0.50 -0.11 0.00 0.31 0.00 0.00 61.69 61.93 1h1m s THR 293 Cb -0.46 -0.78 -0.05 0.00 0.01 0.00 0.00 72.50 71.22 1h1m s THR 293 CO 0.61 0.26 0.18 -0.70 -0.69 0.00 0.00 174.62 174.28 1h1m s GLU 294 N -0.27 4.17 -0.04 4.92 2.12 -1.26 -0.64 118.70 127.69 1h1m s GLU 294 Ca 0.04 -0.12 -0.03 0.00 0.36 0.00 0.00 54.97 55.22 1h1m s GLU 294 Cb -0.05 -3.41 -0.04 0.00 0.26 0.00 0.00 34.13 30.90 1h1m s GLU 294 CO -0.00 0.31 0.13 -0.51 -0.54 0.00 0.00 175.26 174.65 1h1m s LEU 295 N 0.30 4.17 0.00 2.70 1.02 0.95 -4.94 118.68 122.88 1h1m s LEU 295 Ca 0.11 0.30 0.00 0.00 0.02 0.00 0.00 54.13 54.55 1h1m s LEU 295 Cb -0.12 -2.32 0.00 0.00 0.02 0.00 0.00 46.19 43.77 1h1m s LEU 295 CO 0.00 0.31 0.00 0.61 0.02 0.00 0.00 176.35 177.29 1h1m n GLY 296 N 1.34 7.19 3.69 -3.19 0.00 -1.26 -1.90 105.19 111.06 1h1m n GLY 296 Ca -0.14 -2.05 -0.45 0.00 0.00 0.00 0.00 46.02 43.38 1h1m n GLY 296 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1h1m n SER 297 N -0.11 3.38 0.00 1.61 7.64 -1.26 -1.76 113.62 123.11 1h1m n SER 297 Ca 0.00 1.08 0.00 0.00 1.01 0.00 0.00 58.87 60.96 1h1m n SER 297 Cb 0.00 -1.48 0.00 0.00 -1.01 0.00 0.00 64.21 61.72 1h1m n SER 297 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1h1m n GLY 298 N 3.47 2.23 3.76 0.23 0.00 0.10 -4.56 105.19 110.43 1h1m n GLY 298 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 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 -3.31 5.98 -0.08 1.61 1.01 -0.72 -3.92 116.67 117.23 1h1m s ASP 299 Ca 0.00 2.50 0.04 0.00 0.71 0.00 0.00 52.55 55.80 1h1m s ASP 299 Cb 0.00 -2.62 -0.00 0.00 1.01 0.00 0.00 42.92 41.31 1h1m s ASP 299 CO 0.00 -1.06 -0.22 -0.69 0.21 0.00 0.00 175.17 173.40 1h1m s VAL 300 N -1.42 1.92 -0.08 -1.27 1.01 -0.60 -0.97 120.40 118.98 1h1m s VAL 300 Ca 0.64 -0.95 0.01 0.00 0.00 0.00 0.00 61.98 61.68 1h1m s VAL 300 Cb -0.34 -1.65 -0.03 0.00 0.00 0.00 0.00 36.38 34.36 1h1m s VAL 300 CO 0.41 0.53 -0.10 0.00 0.00 0.00 0.00 175.10 175.94 1h1m s ALA 301 N 0.25 2.80 -0.10 5.51 0.00 -0.39 -1.05 121.76 128.79 1h1m s ALA 301 Ca -0.14 -0.91 0.03 0.00 0.00 0.00 0.00 51.96 50.94 1h1m s ALA 301 Cb -0.16 -1.17 0.00 0.00 0.00 0.00 0.00 23.12 21.79 1h1m s ALA 301 CO 0.07 0.46 -0.22 0.12 0.00 0.00 0.00 175.76 176.20 1h1m s PHE 302 N -0.42 2.38 -0.23 0.00 5.36 0.56 -1.74 117.98 123.89 1h1m s PHE 302 Ca 0.06 -1.01 0.02 0.00 -0.96 0.00 0.00 56.93 55.04 1h1m s PHE 302 Cb -0.12 -1.62 0.04 0.00 -0.34 0.00 0.00 43.02 40.99 1h1m s PHE 302 CO 0.02 -0.43 -0.14 0.42 -1.46 0.00 0.00 175.22 173.63 1h1m s ILE 303 N 0.48 2.09 0.64 3.12 1.09 0.39 -2.42 121.20 126.59 1h1m s ILE 303 Ca -0.16 -1.34 -0.18 0.00 -1.10 0.00 0.00 60.65 57.87 1h1m s ILE 303 Cb -0.17 -2.08 -0.01 0.00 -1.06 0.00 0.00 42.46 39.13 1h1m s ILE 303 CO 0.06 0.19 1.30 -2.84 -0.10 0.00 0.00 174.94 173.55 1h1m s PRO 304 N 1.19 2.60 0.37 2.79 0.02 -1.26 -0.89 135.00 139.82 1h1m s PRO 304 Ca -0.03 2.07 -0.28 0.00 0.02 0.00 0.00 61.00 62.78 1h1m s PRO 304 Cb -0.17 -1.87 -0.11 0.00 0.02 0.00 0.00 34.50 32.37 1h1m s PRO 304 CO -0.08 -1.56 1.40 0.41 -0.33 0.00 0.00 177.00 176.83 1h1m n GLY 305 N 0.88 0.91 2.31 0.52 0.00 -1.26 -2.17 105.19 106.38 1h1m n GLY 305 Ca 0.16 0.30 0.00 0.00 0.00 0.00 0.00 46.02 46.48 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 0.60 1.18 3.80 -0.02 0.00 0.16 -4.87 105.19 106.03 1h1m n GLY 306 Ca 0.03 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.69 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 -3.38 5.43 0.37 1.61 1.01 -0.92 -4.89 120.40 119.63 1h1m s VAL 307 Ca 0.00 0.25 -0.26 0.00 0.00 0.00 0.00 61.98 61.97 1h1m s VAL 307 Cb 0.00 -3.46 -0.09 0.00 0.00 0.00 0.00 36.38 32.83 1h1m s VAL 307 CO 0.00 0.52 1.09 -1.61 0.00 0.00 0.00 175.10 175.10 1h1m s GLU 308 N -0.31 4.27 0.16 2.72 2.02 -1.26 -4.55 118.70 121.76 1h1m s GLU 308 Ca 0.12 1.67 -0.12 0.00 0.02 0.00 0.00 54.97 56.66 1h1m s GLU 308 Cb -0.12 -2.76 0.01 0.00 0.10 0.00 0.00 34.13 31.36 1h1m s GLU 308 CO 0.02 -0.08 0.35 -0.59 0.02 0.00 0.00 175.26 174.97 1h1m s PHE 309 N -1.46 0.18 0.02 1.61 -0.71 0.17 -0.00 117.98 117.78 1h1m s PHE 309 Ca 0.54 -0.54 0.02 0.00 -1.04 0.00 0.00 56.93 55.91 1h1m s PHE 309 Cb -0.27 0.09 -0.01 0.00 -1.21 0.00 0.00 43.02 41.62 1h1m s PHE 309 CO 0.34 -0.75 -0.07 0.15 -1.34 0.00 0.00 175.22 173.55 1h1m s LYS 310 N -3.92 0.52 0.05 1.99 1.02 -0.33 -0.11 119.74 118.96 1h1m s LYS 310 Ca 0.12 -0.47 -0.05 0.00 0.02 0.00 0.00 55.97 55.60 1h1m s LYS 310 Cb 0.02 -0.41 -0.02 0.00 -0.52 0.00 0.00 37.83 36.91 1h1m s LYS 310 CO -0.03 0.10 0.08 1.52 -0.92 0.00 0.00 175.35 176.09 1h1m s TYR 311 N -0.70 0.27 0.12 3.18 1.13 -1.26 -0.34 117.35 119.75 1h1m s TYR 311 Ca -0.03 -0.66 -0.22 0.00 -1.41 0.00 0.00 57.07 54.76 1h1m s TYR 311 Cb -0.06 -0.19 0.06 0.00 -1.10 0.00 0.00 41.96 40.67 1h1m s TYR 311 CO 0.00 -0.39 0.54 1.52 -2.51 0.00 0.00 175.55 174.71 1h1m s TYR 312 N -3.10 -0.45 -0.26 -3.49 -0.85 -0.71 -4.84 117.35 103.65 1h1m s TYR 312 Ca -0.01 0.30 -0.21 0.00 -0.52 0.00 0.00 57.07 56.64 1h1m s TYR 312 Cb 0.02 0.44 -0.02 0.00 0.38 0.00 0.00 41.96 42.78 1h1m s TYR 312 CO -0.07 -0.76 0.64 0.45 -1.52 0.00 0.00 175.55 174.29 1h1m s SER 313 N -2.53 6.58 0.15 -0.18 0.15 -1.26 -0.45 113.70 116.16 1h1m s SER 313 Ca -0.00 0.69 -0.03 0.00 0.70 0.00 0.00 55.95 57.30 1h1m s SER 313 Cb -0.00 -2.34 -0.04 0.00 -1.71 0.00 0.00 66.02 61.93 1h1m s SER 313 CO -0.09 -0.40 1.35 -0.08 1.20 0.00 0.00 173.24 175.22 1h1m h GLU 314 N 7.93 0.40 -7.19 5.44 4.57 -1.50 -3.40 114.58 120.84 1h1m h GLU 314 Ca -0.26 -0.39 -0.49 0.00 -1.18 0.00 0.00 59.36 57.03 1h1m h GLU 314 Cb 1.12 0.10 0.07 0.00 -0.16 0.00 0.00 28.75 29.88 1h1m h GLU 314 CO 0.79 1.05 0.38 0.00 -1.18 0.00 0.00 179.01 180.04 1h1m s ALA 315 N -3.39 2.73 0.38 2.92 0.00 -1.04 -4.96 121.76 118.39 1h1m s ALA 315 Ca -0.06 0.43 0.20 0.00 0.00 0.00 0.00 51.96 52.53 1h1m s ALA 315 Cb 0.09 -3.24 1.09 0.00 0.00 0.00 0.00 23.12 21.06 1h1m s ALA 315 CO 0.86 -0.82 1.96 1.88 0.00 0.00 0.00 175.76 179.63 1h1m h TYR 316 N 0.49 0.00 -3.24 0.00 0.05 -1.90 -3.37 116.97 108.99 1h1m h TYR 316 Ca -0.47 0.00 -0.26 0.00 0.05 0.00 0.00 58.73 58.05 1h1m h TYR 316 Cb 1.22 0.00 -0.33 0.00 1.01 0.00 0.00 36.73 38.64 1h1m h TYR 316 CO 0.58 0.22 -0.62 0.12 -1.05 0.00 0.00 178.16 177.41 1h1m s PHE 317 N -4.20 -0.15 0.13 4.88 2.19 -1.26 -3.83 117.98 115.74 1h1m s PHE 317 Ca -0.03 0.48 0.06 0.00 0.33 0.00 0.00 56.93 57.77 1h1m s PHE 317 Cb 0.14 -0.13 -0.04 0.00 -1.31 0.00 0.00 43.02 41.67 1h1m s PHE 317 CO 0.65 -0.18 -0.14 -1.12 1.83 0.00 0.00 175.22 176.27 1h1m s SER 318 N 1.39 2.00 -0.04 6.13 0.01 -0.19 -4.35 113.70 118.65 1h1m s SER 318 Ca -0.07 -0.85 0.01 0.00 1.31 0.00 0.00 55.95 56.35 1h1m s SER 318 Cb -0.12 -0.06 0.02 0.00 0.21 0.00 0.00 66.02 66.07 1h1m s SER 318 CO -0.06 -0.17 -0.02 -0.75 0.41 0.00 0.00 173.24 172.65 1h1m s LYS 319 N -2.85 0.59 0.12 12.44 2.20 0.64 0.30 119.74 133.17 1h1m s LYS 319 Ca 0.11 -0.02 0.10 0.00 -0.36 0.00 0.00 55.97 55.79 1h1m s LYS 319 Cb -0.04 -0.68 -0.04 0.00 -1.51 0.00 0.00 37.83 35.56 1h1m s LYS 319 CO 0.03 -0.11 -0.24 0.14 -0.36 0.00 0.00 175.35 174.81 1h1m s VAL 320 N 0.98 1.97 -0.12 4.02 -7.23 0.14 -0.10 120.40 120.05 1h1m s VAL 320 Ca -0.10 -1.65 -0.17 0.00 -1.81 0.00 0.00 61.98 58.24 1h1m s VAL 320 Cb -0.14 -1.77 -0.04 0.00 0.56 0.00 0.00 36.38 34.99 1h1m s VAL 320 CO -0.01 0.01 0.45 -0.22 -0.31 0.00 0.00 175.10 175.02 1h1m s LEU 321 N -1.99 4.27 -0.06 1.32 2.96 0.67 -1.24 118.68 124.62 1h1m s LEU 321 Ca 0.10 0.77 0.03 0.00 -0.22 0.00 0.00 54.13 54.82 1h1m s LEU 321 Cb -0.10 -2.65 0.00 0.00 0.50 0.00 0.00 46.19 43.95 1h1m s LEU 321 CO 0.05 0.02 -0.16 0.12 -1.32 0.00 0.00 176.35 175.06 1h1m s PHE 322 N 0.58 1.70 -0.01 5.38 2.19 0.75 -0.77 117.98 127.80 1h1m s PHE 322 Ca 0.25 -0.58 0.05 0.00 0.33 0.00 0.00 56.93 56.97 1h1m s PHE 322 Cb -0.15 -1.18 -0.01 0.00 -1.31 0.00 0.00 43.02 40.37 1h1m s PHE 322 CO 0.09 -0.25 -0.16 0.54 1.83 0.00 0.00 175.22 177.28 1h1m s VAL 323 N 0.35 1.26 -0.01 3.12 0.11 -0.45 -1.63 120.40 123.15 1h1m s VAL 323 Ca -0.11 -0.71 0.02 0.00 -2.93 0.00 0.00 61.98 58.25 1h1m s VAL 323 Cb -0.14 -1.05 0.00 0.00 -1.53 0.00 0.00 36.38 33.66 1h1m s VAL 323 CO 0.04 0.33 -0.05 -0.55 -3.33 0.00 0.00 175.10 171.54 1h1m s SER 324 N -0.43 0.70 0.12 3.54 0.15 -0.19 -1.33 113.70 116.26 1h1m s SER 324 Ca 0.06 -0.10 -0.30 0.00 0.70 0.00 0.00 55.95 56.31 1h1m s SER 324 Cb -0.06 -0.16 -0.06 0.00 -1.71 0.00 0.00 66.02 64.03 1h1m s SER 324 CO -0.00 0.03 0.98 -0.55 1.20 0.00 0.00 173.24 174.90 1h1m s SER 325 N 0.15 7.47 0.00 5.45 0.15 0.17 -0.99 113.70 126.09 1h1m s SER 325 Ca -0.01 1.84 0.00 0.00 0.70 0.00 0.00 55.95 58.48 1h1m s SER 325 Cb -0.06 -2.59 0.00 0.00 -1.71 0.00 0.00 66.02 61.66 1h1m s SER 325 CO -0.00 -0.09 0.00 0.61 1.20 0.00 0.00 173.24 174.96 1h1m n GLY 326 N 2.21 1.24 0.20 9.45 0.00 -0.46 -3.84 105.19 113.99 1h1m n GLY 326 Ca 0.02 -2.09 0.10 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 1.37 -2.63 1.61 3.41 -1.26 -3.61 113.62 112.50 1h1m n SER 327 Ca 0.00 -1.18 -0.11 0.00 -0.26 0.00 0.00 58.87 57.31 1h1m n SER 327 Cb 0.00 0.78 0.03 0.00 -0.26 0.00 0.00 64.21 64.76 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 -0.87 2.16 -2.68 4.04 8.00 -1.26 -4.87 116.55 121.07 1h1m n ASP 328 Ca 0.06 -2.81 0.00 0.00 0.71 0.00 0.00 54.79 52.75 1h1m n ASP 328 Cb 0.37 -0.50 0.00 0.00 -0.02 0.00 0.00 41.12 40.96 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 -0.25 -1.70 0.12 0.44 0.00 -1.26 -4.62 105.19 97.93 1h1m n GLY 329 Ca 0.15 -1.53 -0.08 0.00 0.00 0.00 0.00 46.02 44.56 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 -0.01 -0.52 0.99 5.85 -1.97 -0.84 115.31 118.80 1h1m h LEU 330 Ca 0.00 0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.73 1h1m h LEU 330 Cb 0.00 0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 1h1m h LEU 330 CO 0.00 0.03 0.19 -2.24 -0.34 0.00 0.00 178.44 176.07 1h1m h ASP 331 N 0.13 0.74 -0.37 1.25 2.03 -1.97 0.17 116.42 118.40 1h1m h ASP 331 Ca 0.12 -0.19 -0.05 0.00 -0.73 0.00 0.00 57.03 56.18 1h1m h ASP 331 Cb 0.13 -0.19 -0.02 0.00 -0.83 0.00 0.00 39.33 38.41 1h1m h ASP 331 CO -0.17 0.73 0.07 -0.61 -1.03 0.00 0.00 179.24 178.23 1h1m h GLN 332 N 0.71 0.70 -0.41 4.15 5.75 -1.77 -1.04 115.11 123.20 1h1m h GLN 332 Ca 0.17 -0.15 -0.08 0.00 -0.15 0.00 0.00 58.65 58.44 1h1m h GLN 332 Cb 0.24 -0.10 -0.01 0.00 1.07 0.00 0.00 27.48 28.67 1h1m h GLN 332 CO -0.01 0.67 -0.06 -0.97 -2.65 0.00 0.00 178.83 175.81 1h1m h ASN 333 N 0.67 0.76 -0.44 -0.69 -0.73 -0.17 -0.47 115.58 114.51 1h1m h ASN 333 Ca 0.15 -0.34 -0.03 0.00 1.87 0.00 0.00 56.30 57.95 1h1m h ASN 333 Cb 0.32 -0.21 -0.02 0.00 0.27 0.00 0.00 38.32 38.68 1h1m h ASN 333 CO 0.00 0.92 0.17 -0.07 -0.37 0.00 0.00 177.43 178.08 1h1m h LEU 334 N 0.58 0.62 -0.11 0.34 3.38 -0.37 -1.49 115.31 118.25 1h1m h LEU 334 Ca 0.11 -0.18 0.04 0.00 0.09 0.00 0.00 57.88 57.94 1h1m h LEU 334 Cb 0.57 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 41.11 1h1m h LEU 334 CO 0.03 0.63 -0.13 0.58 0.09 0.00 0.00 178.44 179.64 1h1m h VAL 335 N 0.57 0.64 -0.42 1.22 2.07 -1.03 -2.00 116.25 117.31 1h1m h VAL 335 Ca 0.15 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.66 1h1m h VAL 335 Cb 0.21 0.64 -0.02 0.00 -1.52 0.00 0.00 31.29 30.60 1h1m h VAL 335 CO -0.01 0.00 0.22 0.78 0.02 0.00 0.00 177.57 178.58 1h1m h ASN 336 N -0.17 0.50 -0.35 0.57 -0.26 -0.95 -0.28 115.58 114.65 1h1m h ASN 336 Ca 0.08 -0.03 0.00 0.00 -0.56 0.00 0.00 56.30 55.79 1h1m h ASN 336 Cb 0.29 -0.13 0.00 0.00 -1.06 0.00 0.00 38.32 37.42 1h1m h ASN 336 CO -0.21 0.41 0.00 0.61 -1.06 0.00 0.00 177.43 177.18 1h1m n GLY 337 N -1.33 0.82 0.00 2.83 0.00 -0.57 -4.94 105.19 102.00 1h1m n GLY 337 Ca 0.03 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.59 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 1.18 6.21 3.12 -0.02 0.00 -0.12 -4.70 105.19 110.86 1h1m n GLY 338 Ca 0.15 -2.09 -0.10 0.00 0.00 0.00 0.00 46.02 43.97 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 0.02 0.69 0.37 1.61 -1.05 -0.38 -4.94 118.70 115.01 1h1m s GLU 339 Ca 0.00 -1.13 -0.27 0.00 -0.15 0.00 0.00 54.97 53.41 1h1m s GLU 339 Cb 0.00 -0.13 -0.11 0.00 -0.44 0.00 0.00 34.13 33.45 1h1m s GLU 339 CO 0.00 -0.02 1.32 0.39 0.95 0.00 0.00 175.26 177.90 1h1m n GLU 340 N 0.44 2.19 -3.81 -4.83 1.02 -1.26 -0.76 120.64 113.62 1h1m n GLU 340 Ca -0.16 0.77 -0.13 0.00 -0.02 0.00 0.00 57.16 57.63 1h1m n GLU 340 Cb 0.59 -2.41 -0.12 0.00 -0.02 0.00 0.00 31.44 29.48 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 -1.12 -0.19 -1.14 -0.32 -0.11 -0.48 -4.68 118.94 110.90 1h1m s TRP 341 Ca 0.56 0.46 0.17 0.00 1.22 0.00 0.00 56.10 58.51 1h1m s TRP 341 Cb -0.54 0.06 0.56 0.00 -1.50 0.00 0.00 33.47 32.05 1h1m s TRP 341 CO 0.62 -0.09 1.48 -1.13 -4.62 0.00 0.00 176.95 173.20 1h1m n SER 342 N 3.06 3.94 -4.01 5.86 3.41 -1.26 -3.86 113.62 120.77 1h1m n SER 342 Ca -0.13 -2.29 -0.13 0.00 -0.26 0.00 0.00 58.87 56.06 1h1m n SER 342 Cb 0.58 -0.45 -0.12 0.00 -0.26 0.00 0.00 64.21 63.96 1h1m n SER 342 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1h1m s SER 343 N -1.08 0.61 0.00 4.04 0.15 -1.26 -5.02 113.70 111.14 1h1m s SER 343 Ca 0.41 -0.40 0.19 0.00 0.70 0.00 0.00 55.95 56.86 1h1m s SER 343 Cb 0.25 0.02 0.82 0.00 -1.71 0.00 0.00 66.02 65.41 1h1m s SER 343 CO 0.22 -0.15 1.62 1.33 1.20 0.00 0.00 173.24 177.46 1h1m n VAL 344 N 1.94 0.67 -4.15 4.45 0.24 -1.26 -4.83 118.33 115.39 1h1m n VAL 344 Ca -0.20 0.17 -0.29 0.00 -2.04 0.00 0.00 64.34 61.98 1h1m n VAL 344 Cb 0.56 -0.84 -0.08 0.00 -1.47 0.00 0.00 33.84 32.01 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 -3.00 4.95 0.54 -1.34 0.01 -1.26 -5.03 113.70 108.57 1h1m s SER 345 Ca 0.09 -0.25 0.02 0.00 1.31 0.00 0.00 55.95 57.13 1h1m s SER 345 Cb 0.13 -1.14 0.03 0.00 0.21 0.00 0.00 66.02 65.25 1h1m s SER 345 CO 0.35 0.14 0.75 0.72 0.41 0.00 0.00 173.24 175.61 1h1m s PHE 346 N -1.45 2.81 0.76 2.43 -0.12 -1.26 -5.03 117.98 116.12 1h1m s PHE 346 Ca 0.26 -0.09 -0.15 0.00 -0.05 0.00 0.00 56.93 56.91 1h1m s PHE 346 Cb -0.11 -2.70 0.05 0.00 -0.63 0.00 0.00 43.02 39.64 1h1m s PHE 346 CO 0.18 -0.83 1.21 -2.30 -0.05 0.00 0.00 175.22 173.44 1h1m n PRO 347 N -2.28 0.45 0.04 1.99 -0.02 -1.26 -4.92 135.00 129.01 1h1m n PRO 347 Ca 0.08 0.22 0.13 0.00 -2.02 0.00 0.00 63.50 61.92 1h1m n PRO 347 Cb 0.60 -2.45 0.50 0.00 -0.02 0.00 0.00 33.50 32.13 1h1m n PRO 347 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1h1m n ALA 348 N -2.88 2.38 -2.44 3.55 0.00 -1.26 -4.77 120.51 115.09 1h1m n ALA 348 Ca 0.14 -0.08 -0.27 0.00 0.00 0.00 0.00 53.44 53.23 1h1m n ALA 348 Cb 0.50 -1.45 -0.14 0.00 0.00 0.00 0.00 19.45 18.36 1h1m n ALA 348 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1h1m s ASP 349 N -3.66 2.79 0.00 0.00 1.01 -1.26 -5.30 116.67 110.25 1h1m s ASP 349 Ca 0.12 -0.61 0.21 0.00 0.71 0.00 0.00 52.55 52.99 1h1m s ASP 349 Cb 0.16 -0.22 1.25 0.00 1.01 0.00 0.00 42.92 45.13 1h1m s ASP 349 CO 0.57 0.17 1.64 0.79 0.21 0.00 0.00 175.17 178.54