#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bwd n SER 2 N 0.00 0.83 0.13 6.15 3.41 -0.87 -4.85 113.62 118.41 1bwd n SER 2 Ca 0.00 0.83 0.12 0.00 -0.26 0.00 0.00 58.87 59.56 1bwd n SER 2 Cb 0.00 -1.39 0.23 0.00 -0.26 0.00 0.00 64.21 62.79 1bwd n SER 2 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1bwd h LEU 3 N 0.60 0.00 -8.06 1.04 3.38 -1.83 -3.42 115.31 107.02 1bwd h LEU 3 Ca -0.48 -0.05 -0.75 0.00 0.09 0.00 0.00 57.88 56.69 1bwd h LEU 3 Cb 1.36 0.00 -0.23 0.00 0.09 0.00 0.00 40.66 41.88 1bwd h LEU 3 CO 0.51 0.03 -0.07 -0.69 0.09 0.00 0.00 178.44 178.31 1bwd s VAL 4 N -3.18 5.18 -0.18 1.22 1.01 -1.26 -4.54 120.40 118.65 1bwd s VAL 4 Ca 0.07 -1.55 -0.05 0.00 0.00 0.00 0.00 61.98 60.45 1bwd s VAL 4 Cb 0.10 -4.40 0.07 0.00 0.00 0.00 0.00 36.38 32.15 1bwd s VAL 4 CO 0.67 -0.96 0.13 -0.55 0.00 0.00 0.00 175.10 174.39 1bwd s SER 5 N 3.38 2.05 -0.29 3.32 0.15 -0.75 -3.74 113.70 117.82 1bwd s SER 5 Ca 0.08 -0.49 -0.12 0.00 0.70 0.00 0.00 55.95 56.12 1bwd s SER 5 Cb -0.25 -0.06 0.11 0.00 -1.71 0.00 0.00 66.02 64.10 1bwd s SER 5 CO 0.02 -0.34 0.65 0.54 1.20 0.00 0.00 173.24 175.31 1bwd s VAL 6 N 2.19 -0.57 -0.53 4.45 0.11 -0.80 -1.73 120.40 123.54 1bwd s VAL 6 Ca 0.03 0.01 0.10 0.00 -2.93 0.00 0.00 61.98 59.19 1bwd s VAL 6 Cb -0.16 -0.98 -0.10 0.00 -1.53 0.00 0.00 36.38 33.61 1bwd s VAL 6 CO -0.10 0.00 0.45 1.41 -3.33 0.00 0.00 175.10 173.54 1bwd n HIS 7 N 4.97 0.00 -3.84 1.54 8.25 -1.26 -3.67 115.22 121.21 1bwd n HIS 7 Ca -0.15 0.00 -0.06 0.00 -0.26 0.00 0.00 57.72 57.25 1bwd n HIS 7 Cb 0.53 0.00 0.02 0.00 1.12 0.00 0.00 29.99 31.66 1bwd n HIS 7 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1bwd s ASN 8 N -1.91 -0.03 0.11 0.41 2.20 -1.26 -0.48 114.94 113.99 1bwd s ASN 8 Ca 0.04 -0.88 0.25 0.00 -0.94 0.00 0.00 52.86 51.33 1bwd s ASN 8 Cb 0.08 0.68 0.96 0.00 -2.00 0.00 0.00 41.25 40.97 1bwd s ASN 8 CO 0.41 -1.35 1.77 -0.62 -2.94 0.00 0.00 177.10 174.37 1bwd n GLU 9 N -0.59 0.12 0.00 3.55 4.71 -1.12 -4.42 120.64 122.89 1bwd n GLU 9 Ca -0.06 0.18 0.00 0.00 -0.01 0.00 0.00 57.16 57.27 1bwd n GLU 9 Cb 0.60 -1.66 0.00 0.00 -1.01 0.00 0.00 31.44 29.37 1bwd n GLU 9 CO 0.00 0.00 0.00 -2.67 0.09 0.00 0.00 177.13 174.55 1bwd n TRP 10 N -1.87 0.00 -0.65 -0.32 2.14 -1.26 -4.47 117.44 111.01 1bwd n TRP 10 Ca 0.05 0.00 -0.31 0.00 2.07 0.00 0.00 57.50 59.31 1bwd n TRP 10 Cb 0.33 0.00 0.18 0.00 -0.81 0.00 0.00 31.31 31.01 1bwd n TRP 10 CO 0.00 0.00 0.00 -0.25 2.07 0.00 0.00 177.69 179.51 1bwd n ASP 11 N -0.75 -1.71 -4.55 -0.67 8.00 -1.26 -2.41 116.55 113.19 1bwd n ASP 11 Ca 0.00 0.06 -0.37 0.00 0.71 0.00 0.00 54.79 55.19 1bwd n ASP 11 Cb 0.00 -1.18 -0.04 0.00 -0.02 0.00 0.00 41.12 39.88 1bwd n ASP 11 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 1bwd n PRO 12 N -3.12 1.03 -1.68 -0.24 -0.02 -1.25 -4.25 135.00 125.46 1bwd n PRO 12 Ca 0.04 0.02 -0.51 0.00 -2.02 0.00 0.00 63.50 61.03 1bwd n PRO 12 Cb 0.56 -3.33 -0.06 0.00 -0.02 0.00 0.00 33.50 30.66 1bwd n PRO 12 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 1bwd n LEU 13 N 15.42 3.04 -0.12 2.45 7.94 0.80 -1.33 117.00 145.20 1bwd n LEU 13 Ca 0.38 0.96 -0.16 0.00 -1.11 0.00 0.00 56.01 56.08 1bwd n LEU 13 Cb 0.51 -1.29 -0.11 0.00 0.53 0.00 0.00 43.42 43.06 1bwd n LEU 13 CO 0.72 -0.22 -1.27 -0.62 -1.11 0.00 0.00 177.39 174.89 1bwd n GLU 14 N 6.38 0.59 -3.72 1.96 1.02 0.62 -4.60 120.64 122.90 1bwd n GLU 14 Ca 0.25 0.14 -0.12 0.00 -0.02 0.00 0.00 57.16 57.41 1bwd n GLU 14 Cb 0.24 -1.47 -0.12 0.00 -0.02 0.00 0.00 31.44 30.06 1bwd n GLU 14 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 1bwd s GLU 15 N -2.47 0.29 0.27 3.49 2.12 -1.12 0.38 118.70 121.65 1bwd s GLU 15 Ca -0.32 0.61 0.05 0.00 0.36 0.00 0.00 54.97 55.67 1bwd s GLU 15 Cb 0.08 -0.06 -0.06 0.00 0.26 0.00 0.00 34.13 34.35 1bwd s GLU 15 CO 0.55 -0.15 -0.01 0.08 -0.54 0.00 0.00 175.26 175.19 1bwd s VAL 16 N 1.21 1.30 -0.10 3.70 1.01 -0.64 -1.63 120.40 125.26 1bwd s VAL 16 Ca -0.09 -2.06 0.02 0.00 0.00 0.00 0.00 61.98 59.86 1bwd s VAL 16 Cb -0.09 -2.50 -0.01 0.00 0.00 0.00 0.00 36.38 33.77 1bwd s VAL 16 CO -0.09 -0.23 -0.18 -0.63 0.00 0.00 0.00 175.10 173.97 1bwd s ILE 17 N -3.23 2.63 -0.08 2.22 1.01 -0.06 -1.29 121.20 122.40 1bwd s ILE 17 Ca 0.31 -0.83 -0.08 0.00 0.00 0.00 0.00 60.65 60.05 1bwd s ILE 17 Cb 0.06 -2.05 -0.03 0.00 0.01 0.00 0.00 42.46 40.45 1bwd s ILE 17 CO 0.12 0.55 -0.16 0.52 0.00 0.00 0.00 174.94 175.96 1bwd n VAL 18 N 3.26 0.80 0.00 2.92 0.31 -0.25 -1.09 118.33 124.29 1bwd n VAL 18 Ca -0.18 0.29 0.00 0.00 -0.01 0.00 0.00 64.34 64.44 1bwd n VAL 18 Cb 0.53 -1.87 0.00 0.00 -0.91 0.00 0.00 33.84 31.58 1bwd n VAL 18 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1bwd n GLY 19 N 1.77 2.78 4.02 2.92 0.00 -1.26 -4.13 105.19 111.28 1bwd n GLY 19 Ca -0.07 -1.52 -0.18 0.00 0.00 0.00 0.00 46.02 44.25 1bwd n GLY 19 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1bwd s THR 20 N -0.86 2.57 -0.34 2.61 -4.23 -0.95 -4.86 115.64 109.58 1bwd s THR 20 Ca 0.00 -0.99 0.03 0.00 -1.18 0.00 0.00 61.69 59.55 1bwd s THR 20 Cb 0.00 -2.57 0.04 0.00 1.34 0.00 0.00 72.50 71.31 1bwd s THR 20 CO 0.00 0.00 0.72 0.00 -0.54 0.00 0.00 174.62 174.80 1bwd n ALA 21 N -2.06 2.37 -0.36 3.99 0.00 -1.26 -2.64 120.51 120.55 1bwd n ALA 21 Ca 0.12 -0.66 0.01 0.00 0.00 0.00 0.00 53.44 52.91 1bwd n ALA 21 Cb 0.60 -0.10 0.07 0.00 0.00 0.00 0.00 19.45 20.02 1bwd n ALA 21 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1bwd n VAL 22 N 0.06 -0.47 -2.00 0.00 0.31 -1.26 -1.90 118.33 113.07 1bwd n VAL 22 Ca 0.02 2.20 0.01 0.00 -0.01 0.00 0.00 64.34 66.57 1bwd n VAL 22 Cb 0.13 -2.95 0.12 0.00 -0.91 0.00 0.00 33.84 30.23 1bwd n VAL 22 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1bwd n GLY 23 N -1.50 3.83 3.60 2.92 0.00 -1.26 -5.08 105.19 107.71 1bwd n GLY 23 Ca 0.11 -1.32 -0.48 0.00 0.00 0.00 0.00 46.02 44.34 1bwd n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bwd n ALA 24 N -0.55 -0.41 -2.61 4.61 0.00 -0.80 -4.73 120.51 116.02 1bwd n ALA 24 Ca 0.17 0.45 -0.12 0.00 0.00 0.00 0.00 53.44 53.95 1bwd n ALA 24 Cb 0.87 -2.08 -0.08 0.00 0.00 0.00 0.00 19.45 18.17 1bwd n ALA 24 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 1bwd s ARG 25 N -0.38 1.44 -0.22 0.00 1.70 -0.40 -1.96 118.95 119.14 1bwd s ARG 25 Ca 0.72 -1.55 -0.07 0.00 -0.47 0.00 0.00 55.73 54.36 1bwd s ARG 25 Cb -0.81 0.36 -0.03 0.00 -0.57 0.00 0.00 34.95 33.89 1bwd s ARG 25 CO 0.52 -0.54 0.06 0.08 -1.08 0.00 0.00 175.30 174.33 1bwd s VAL 26 N -3.93 4.41 1.12 4.99 1.01 0.17 -4.64 120.40 123.52 1bwd s VAL 26 Ca 0.33 -0.15 -0.14 0.00 0.00 0.00 0.00 61.98 62.02 1bwd s VAL 26 Cb 0.03 -3.02 0.25 0.00 0.00 0.00 0.00 36.38 33.64 1bwd s VAL 26 CO 0.13 0.39 1.06 -2.16 0.00 0.00 0.00 175.10 174.52 1bwd s PRO 27 N 1.09 -0.55 0.65 2.72 0.04 -1.26 -0.87 135.00 136.82 1bwd s PRO 27 Ca 0.04 0.54 -0.18 0.00 0.04 0.00 0.00 61.00 61.44 1bwd s PRO 27 Cb -0.14 -1.62 -0.01 0.00 0.04 0.00 0.00 34.50 32.77 1bwd s PRO 27 CO 0.03 -3.40 1.29 -0.08 0.04 0.00 0.00 177.00 174.88 1bwd s THR 28 N -2.73 2.07 0.47 1.26 -1.32 -1.26 -4.28 115.64 109.85 1bwd s THR 28 Ca 0.67 0.04 -0.24 0.00 -1.21 0.00 0.00 61.69 60.95 1bwd s THR 28 Cb -0.20 -3.00 -0.08 0.00 -1.51 0.00 0.00 72.50 67.71 1bwd s THR 28 CO 0.60 -0.01 1.38 0.00 -2.21 0.00 0.00 174.62 174.38 1bwd n ALA 29 N -1.93 1.76 -3.64 11.08 0.00 -1.26 -4.97 120.51 121.54 1bwd n ALA 29 Ca 0.16 0.22 -0.05 0.00 0.00 0.00 0.00 53.44 53.77 1bwd n ALA 29 Cb 0.48 -2.36 -0.07 0.00 0.00 0.00 0.00 19.45 17.51 1bwd n ALA 29 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1bwd s ASP 30 N -0.59 -0.19 0.12 0.00 -1.08 -1.26 -5.01 116.67 108.66 1bwd s ASP 30 Ca 0.64 0.37 -0.23 0.00 -0.52 0.00 0.00 52.55 52.81 1bwd s ASP 30 Cb -0.45 0.38 -0.04 0.00 -1.46 0.00 0.00 42.92 41.35 1bwd s ASP 30 CO 0.56 -0.06 1.17 -1.14 0.52 0.00 0.00 175.17 176.21 1bwd n ARG 31 N 1.82 -0.33 -0.05 4.34 0.63 -1.26 -1.08 116.66 120.73 1bwd n ARG 31 Ca -0.11 1.15 -0.08 0.00 -0.92 0.00 0.00 57.85 57.89 1bwd n ARG 31 Cb 0.56 -1.69 -0.02 0.00 0.45 0.00 0.00 32.46 31.77 1bwd n ARG 31 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 1bwd h SER 32 N 0.00 0.05 -0.74 6.15 4.64 -1.96 0.59 113.55 122.28 1bwd h SER 32 Ca 0.13 0.03 -0.06 0.00 -0.47 0.00 0.00 61.79 61.42 1bwd h SER 32 Cb 0.32 0.03 -0.03 0.00 -0.31 0.00 0.00 62.40 62.41 1bwd h SER 32 CO -0.72 0.06 0.22 1.62 -0.87 0.00 0.00 176.83 177.14 1bwd h VAL 33 N 0.16 1.26 0.81 0.95 3.04 -1.71 0.78 116.25 121.54 1bwd h VAL 33 Ca 0.10 -0.93 -0.04 0.00 -1.01 0.00 0.00 66.70 64.82 1bwd h VAL 33 Cb 0.09 0.46 0.01 0.00 -2.01 0.00 0.00 31.29 29.84 1bwd h VAL 33 CO -0.12 0.37 -0.39 0.15 -1.01 0.00 0.00 177.57 176.56 1bwd h PHE 34 N 1.11 -1.01 -0.04 3.17 3.57 -0.85 0.82 116.94 123.70 1bwd h PHE 34 Ca 0.24 -0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.75 1bwd h PHE 34 Cb 0.33 0.33 -0.04 0.00 2.79 0.00 0.00 35.95 39.36 1bwd h PHE 34 CO 0.03 -0.62 -0.21 0.00 -2.23 0.00 0.00 178.31 175.28 1bwd h ALA 35 N -1.03 -0.23 0.00 2.41 0.00 0.40 0.24 119.26 121.05 1bwd h ALA 35 Ca -0.11 0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.69 1bwd h ALA 35 Cb 0.85 0.38 -0.02 0.00 0.00 0.00 0.00 17.79 19.00 1bwd h ALA 35 CO 0.18 -0.69 -0.75 -0.39 0.00 0.00 0.00 179.25 177.60 1bwd h VAL 36 N -0.31 0.83 0.00 0.00 -1.51 -0.90 -3.41 116.25 110.95 1bwd h VAL 36 Ca 0.07 -2.24 -0.05 0.00 -1.23 0.00 0.00 66.70 63.26 1bwd h VAL 36 Cb 0.41 2.35 -0.01 0.00 -2.13 0.00 0.00 31.29 31.91 1bwd h VAL 36 CO -0.22 0.47 -1.16 -0.62 -1.23 0.00 0.00 177.57 174.81 1bwd n GLU 37 N -3.15 0.06 -0.04 5.19 1.02 0.25 -4.92 120.64 119.06 1bwd n GLU 37 Ca -0.01 0.02 0.07 0.00 -0.02 0.00 0.00 57.16 57.23 1bwd n GLU 37 Cb 0.77 -0.74 0.08 0.00 -0.02 0.00 0.00 31.44 31.53 1bwd n GLU 37 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1bwd n TYR 38 N -2.96 0.10 -1.63 -0.32 4.01 -0.99 -4.80 117.16 110.56 1bwd n TYR 38 Ca -0.05 -0.08 -0.38 0.00 -0.16 0.00 0.00 57.90 57.22 1bwd n TYR 38 Cb 0.54 -0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.55 1bwd n TYR 38 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1bwd n ALA 39 N 0.83 7.14 -1.03 -0.72 0.00 0.04 -2.01 120.51 124.76 1bwd n ALA 39 Ca 0.10 -3.73 0.00 0.00 0.00 0.00 0.00 53.44 49.81 1bwd n ALA 39 Cb 0.38 -3.01 0.00 0.00 0.00 0.00 0.00 19.45 16.82 1bwd n ALA 39 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bwd n GLY 40 N 2.56 0.81 0.00 0.00 0.00 -1.26 -4.91 105.19 102.39 1bwd n GLY 40 Ca 0.69 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.71 1bwd n GLY 40 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1bwd n ASP 41 N 0.00 3.08 -4.74 1.61 8.00 -1.09 -5.08 116.55 118.33 1bwd n ASP 41 Ca 0.00 0.00 -0.31 0.00 0.71 0.00 0.00 54.79 55.19 1bwd n ASP 41 Cb 0.06 0.14 -0.07 0.00 -0.02 0.00 0.00 41.12 41.22 1bwd n ASP 41 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1bwd s TYR 42 N -1.70 3.12 0.23 1.24 2.02 -0.85 -5.01 117.35 116.40 1bwd s TYR 42 Ca 0.00 0.05 -0.04 0.00 -0.37 0.00 0.00 57.07 56.71 1bwd s TYR 42 Cb 0.00 -1.60 0.23 0.00 -0.40 0.00 0.00 41.96 40.19 1bwd s TYR 42 CO 0.00 0.51 1.67 0.93 -1.57 0.00 0.00 175.55 177.09 1bwd h GLU 43 N 3.41 0.78 -2.33 -0.62 5.08 -1.98 -3.44 114.58 115.49 1bwd h GLU 43 Ca -0.47 -0.28 -0.08 0.00 -1.00 0.00 0.00 59.36 57.53 1bwd h GLU 43 Cb 1.16 -0.05 -0.20 0.00 0.50 0.00 0.00 28.75 30.16 1bwd h GLU 43 CO 0.63 0.89 0.03 -1.54 -1.00 0.00 0.00 179.01 178.02 1bwd s SER 44 N -6.72 -0.52 0.57 1.42 1.04 -1.26 -5.05 113.70 103.19 1bwd s SER 44 Ca -0.09 0.62 0.37 0.00 0.48 0.00 0.00 55.95 57.32 1bwd s SER 44 Cb 0.14 0.58 1.41 0.00 0.10 0.00 0.00 66.02 68.25 1bwd s SER 44 CO 0.83 -0.50 1.60 0.06 0.98 0.00 0.00 173.24 176.21 1bwd h GLN 45 N 3.59 0.00 0.00 4.02 3.07 -1.94 0.54 115.11 124.38 1bwd h GLN 45 Ca -0.28 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.46 1bwd h GLN 45 Cb 1.15 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.71 1bwd h GLN 45 CO 0.35 0.00 0.00 0.93 0.09 0.00 0.00 178.83 180.20 1bwd h GLU 46 N 0.00 0.00 0.00 0.06 4.39 -1.96 -2.96 114.58 114.10 1bwd h GLU 46 Ca 0.61 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.31 1bwd h GLU 46 Cb 2.76 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 31.41 1bwd h GLU 46 CO -0.01 0.00 -0.55 1.04 -1.16 0.00 0.00 179.01 178.34 1bwd n GLN 47 N -2.35 0.28 -1.66 2.33 6.02 0.19 -4.92 117.38 117.28 1bwd n GLN 47 Ca 0.01 0.10 -0.45 0.00 -0.01 0.00 0.00 57.00 56.65 1bwd n GLN 47 Cb 0.21 -1.70 -0.03 0.00 1.02 0.00 0.00 30.24 29.75 1bwd n GLN 47 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 1bwd n ILE 48 N -2.11 1.03 -1.19 5.09 5.41 -1.12 -4.83 119.36 121.64 1bwd n ILE 48 Ca 0.04 -0.26 -0.35 0.00 1.00 0.00 0.00 62.75 63.18 1bwd n ILE 48 Cb 0.44 -1.38 -0.02 0.00 -0.71 0.00 0.00 39.64 37.96 1bwd n ILE 48 CO 0.00 0.00 0.00 -0.81 0.00 0.00 0.00 176.55 175.74 1bwd n PRO 49 N 1.87 2.72 -0.84 0.38 -0.04 -1.26 -4.86 135.00 132.97 1bwd n PRO 49 Ca 0.12 -1.99 -0.33 0.00 -0.04 0.00 0.00 63.50 61.25 1bwd n PRO 49 Cb 0.31 -2.80 0.12 0.00 -0.04 0.00 0.00 33.50 31.09 1bwd n PRO 49 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1bwd n SER 50 N 4.81 -1.82 0.00 3.54 7.64 -1.26 -4.73 113.62 121.81 1bwd n SER 50 Ca 0.59 0.36 0.00 0.00 1.01 0.00 0.00 58.87 60.83 1bwd n SER 50 Cb 0.25 -1.23 0.00 0.00 -1.01 0.00 0.00 64.21 62.23 1bwd n SER 50 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1bwd n GLY 51 N 1.44 2.96 3.73 0.23 0.00 -0.05 -4.86 105.19 108.64 1bwd n GLY 51 Ca 0.07 -1.98 -0.41 0.00 0.00 0.00 0.00 46.02 43.70 1bwd n GLY 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bwd s ALA 52 N -2.18 3.28 0.74 4.61 0.00 -1.26 0.42 121.76 127.37 1bwd s ALA 52 Ca 0.00 0.64 -0.15 0.00 0.00 0.00 0.00 51.96 52.44 1bwd s ALA 52 Cb 0.00 -3.30 0.02 0.00 0.00 0.00 0.00 23.12 19.83 1bwd s ALA 52 CO 0.00 -0.08 0.96 0.66 0.00 0.00 0.00 175.76 177.30 1bwd n TYR 53 N 2.73 0.61 -1.72 0.00 4.01 -0.83 -4.89 117.16 117.08 1bwd n TYR 53 Ca 0.03 0.39 -0.41 0.00 -0.16 0.00 0.00 57.90 57.74 1bwd n TYR 53 Cb 0.48 -2.07 0.00 0.00 -0.31 0.00 0.00 39.34 37.45 1bwd n TYR 53 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 1bwd n PRO 54 N -1.99 2.14 -0.32 -0.72 -0.04 -1.26 -4.84 135.00 127.97 1bwd n PRO 54 Ca 0.13 0.76 0.09 0.00 -0.04 0.00 0.00 63.50 64.43 1bwd n PRO 54 Cb 0.50 -2.43 0.26 0.00 -0.04 0.00 0.00 33.50 31.79 1bwd n PRO 54 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1bwd h ASP 55 N 2.40 0.66 -0.45 3.54 3.32 -1.99 -1.68 116.42 122.21 1bwd h ASP 55 Ca -0.48 0.09 0.09 0.00 0.02 0.00 0.00 57.03 56.75 1bwd h ASP 55 Cb 1.28 -0.03 -0.09 0.00 0.22 0.00 0.00 39.33 40.71 1bwd h ASP 55 CO 0.62 0.27 -0.14 -0.09 -1.72 0.00 0.00 179.24 178.18 1bwd h ARG 56 N 0.72 -0.03 -0.48 3.56 2.43 -1.99 0.33 114.38 118.92 1bwd h ARG 56 Ca 0.51 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.66 1bwd h ARG 56 Cb 0.72 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.26 1bwd h ARG 56 CO -0.36 -0.02 0.21 -0.39 -1.51 0.00 0.00 179.97 177.90 1bwd h VAL 57 N -0.03 1.20 -0.36 0.20 -1.51 -1.67 -0.96 116.25 113.13 1bwd h VAL 57 Ca 0.22 -0.60 -0.06 0.00 -1.23 0.00 0.00 66.70 65.03 1bwd h VAL 57 Cb 0.37 0.71 -0.01 0.00 -2.13 0.00 0.00 31.29 30.22 1bwd h VAL 57 CO -0.48 0.23 -0.02 -0.07 -1.23 0.00 0.00 177.57 176.00 1bwd h LEU 58 N 0.63 0.64 0.53 4.19 3.38 -1.26 0.12 115.31 123.54 1bwd h LEU 58 Ca 0.16 -0.32 -0.02 0.00 0.09 0.00 0.00 57.88 57.79 1bwd h LEU 58 Cb 0.16 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 1bwd h LEU 58 CO -0.02 0.80 -0.43 0.11 0.09 0.00 0.00 178.44 178.99 1bwd h LYS 59 N 0.46 -0.90 -0.32 1.13 6.56 -0.22 -0.43 116.57 122.84 1bwd h LYS 59 Ca 0.10 0.06 0.05 0.00 -1.06 0.00 0.00 60.65 59.80 1bwd h LYS 59 Cb 0.49 0.21 -0.05 0.00 -0.57 0.00 0.00 32.23 32.31 1bwd h LYS 59 CO 0.02 -0.60 0.04 0.93 -2.06 0.00 0.00 179.45 177.78 1bwd h GLU 60 N -0.94 0.14 0.00 3.15 5.08 -1.18 -1.60 114.58 119.24 1bwd h GLU 60 Ca -0.07 -0.01 -0.10 0.00 -1.00 0.00 0.00 59.36 58.18 1bwd h GLU 60 Cb 0.79 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.99 1bwd h GLU 60 CO 0.00 0.09 -0.47 1.79 -1.00 0.00 0.00 179.01 179.42 1bwd h THR 61 N 0.14 1.10 -0.27 1.13 1.35 -0.71 -2.19 112.91 113.47 1bwd h THR 61 Ca 0.15 -1.76 -0.10 0.00 -0.55 0.00 0.00 66.41 64.15 1bwd h THR 61 Cb 0.18 2.02 -0.01 0.00 -1.73 0.00 0.00 68.15 68.61 1bwd h THR 61 CO -0.22 0.46 -0.26 -0.08 -0.25 0.00 0.00 175.52 175.17 1bwd h GLU 62 N 0.00 0.52 -0.19 4.72 4.57 -0.56 0.49 114.58 124.13 1bwd h GLU 62 Ca -0.00 -0.20 -0.20 0.00 -1.18 0.00 0.00 59.36 57.77 1bwd h GLU 62 Cb 0.98 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.55 1bwd h GLU 62 CO 0.06 0.74 -0.67 1.05 -1.18 0.00 0.00 179.01 179.01 1bwd h GLU 63 N 0.46 0.74 -0.91 1.92 4.11 -0.96 -0.95 114.58 118.98 1bwd h GLU 63 Ca 0.06 -0.54 0.05 0.00 0.07 0.00 0.00 59.36 59.00 1bwd h GLU 63 Cb 0.70 0.09 -0.06 0.00 0.50 0.00 0.00 28.75 29.98 1bwd h GLU 63 CO 0.05 1.16 0.58 0.93 0.07 0.00 0.00 179.01 181.81 1bwd h GLU 64 N 0.54 1.06 -0.41 1.06 5.08 -0.95 0.66 114.58 121.61 1bwd h GLU 64 Ca -0.02 -0.06 -0.07 0.00 -1.00 0.00 0.00 59.36 58.21 1bwd h GLU 64 Cb 1.28 -0.24 -0.02 0.00 0.50 0.00 0.00 28.75 30.27 1bwd h GLU 64 CO 0.14 0.70 -0.02 -0.07 -1.00 0.00 0.00 179.01 178.76 1bwd h LEU 65 N 1.09 0.65 -0.63 1.33 4.07 0.21 -1.92 115.31 120.11 1bwd h LEU 65 Ca 0.38 -0.15 -0.05 0.00 0.08 0.00 0.00 57.88 58.14 1bwd h LEU 65 Cb 0.09 -0.17 -0.03 0.00 1.08 0.00 0.00 40.66 41.63 1bwd h LEU 65 CO -0.15 0.73 0.18 -0.74 -1.08 0.00 0.00 178.44 177.38 1bwd h HIS 66 N 0.63 1.03 -0.65 1.13 2.76 0.48 -2.57 115.15 117.97 1bwd h HIS 66 Ca 0.13 -0.11 -0.06 0.00 -2.20 0.00 0.00 60.37 58.13 1bwd h HIS 66 Cb 0.43 -0.29 -0.03 0.00 1.55 0.00 0.00 27.41 29.07 1bwd h HIS 66 CO 0.02 0.85 0.18 0.28 -1.30 0.00 0.00 177.93 177.96 1bwd h VAL 67 N 0.91 1.25 0.04 5.26 2.07 -0.61 -0.73 116.25 124.44 1bwd h VAL 67 Ca 0.20 -0.89 0.01 0.00 0.82 0.00 0.00 66.70 66.84 1bwd h VAL 67 Cb 0.32 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 1bwd h VAL 67 CO -0.00 0.34 -0.08 0.25 0.02 0.00 0.00 177.57 178.10 1bwd h LEU 68 N 0.95 -0.22 -1.08 2.57 6.46 -1.18 -0.23 115.31 122.58 1bwd h LEU 68 Ca 0.21 0.03 0.02 0.00 -0.12 0.00 0.00 57.88 58.02 1bwd h LEU 68 Cb 0.33 0.09 -0.05 0.00 -0.73 0.00 0.00 40.66 40.30 1bwd h LEU 68 CO -0.00 -0.12 0.62 0.00 -0.62 0.00 0.00 178.44 178.32 1bwd h ALA 69 N 0.79 1.36 -0.02 1.25 0.00 -1.29 -1.43 119.26 119.92 1bwd h ALA 69 Ca 0.02 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1bwd h ALA 69 Cb 0.18 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 1bwd h ALA 69 CO -0.06 0.58 0.01 0.00 0.00 0.00 0.00 179.25 179.78 1bwd h ALA 70 N 1.43 0.02 -0.32 0.00 0.00 -0.73 -1.92 119.26 117.74 1bwd h ALA 70 Ca 0.36 -0.06 -0.14 0.00 0.00 0.00 0.00 54.91 55.07 1bwd h ALA 70 Cb -0.08 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1bwd h ALA 70 CO -0.09 -0.42 -0.36 0.93 0.00 0.00 0.00 179.25 179.31 1bwd h GLU 71 N -0.09 0.74 -0.43 0.00 4.39 -0.77 -1.21 114.58 117.19 1bwd h GLU 71 Ca 0.01 -0.36 -0.11 0.00 0.34 0.00 0.00 59.36 59.23 1bwd h GLU 71 Cb 0.12 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.76 1bwd h GLU 71 CO -0.00 0.98 -0.17 -0.07 -1.16 0.00 0.00 179.01 178.59 1bwd h LEU 72 N 0.61 0.83 -0.29 1.33 3.38 -1.29 -0.76 115.31 119.12 1bwd h LEU 72 Ca 0.06 -0.28 0.02 0.00 0.09 0.00 0.00 57.88 57.76 1bwd h LEU 72 Cb 0.90 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.40 1bwd h LEU 72 CO 0.08 1.00 0.15 0.74 0.09 0.00 0.00 178.44 180.50 1bwd h THR 73 N 0.73 1.00 -1.00 0.22 2.02 -1.18 -1.10 112.91 113.59 1bwd h THR 73 Ca 0.11 -0.11 0.11 0.00 0.77 0.00 0.00 66.41 67.29 1bwd h THR 73 Cb 0.69 0.66 -0.08 0.00 -1.74 0.00 0.00 68.15 67.67 1bwd h THR 73 CO 0.05 0.06 0.64 0.11 0.37 0.00 0.00 175.52 176.74 1bwd h LYS 74 N 0.31 1.00 0.00 6.66 1.57 -0.83 0.17 116.57 125.45 1bwd h LYS 74 Ca 0.12 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1bwd h LYS 74 Cb 0.03 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.12 1bwd h LYS 74 CO -0.08 0.66 0.00 1.28 -0.57 0.00 0.00 179.45 180.74 1bwd n LEU 75 N -4.59 0.00 0.00 2.94 7.99 -0.33 -4.87 117.00 118.14 1bwd n LEU 75 Ca 0.18 0.25 0.00 0.00 -0.01 0.00 0.00 56.01 56.43 1bwd n LEU 75 Cb 0.33 -0.25 0.00 0.00 -0.11 0.00 0.00 43.42 43.38 1bwd n LEU 75 CO 0.28 -0.10 0.00 0.61 -1.51 0.00 0.00 177.39 176.68 1bwd n GLY 76 N 0.28 0.79 3.83 -0.72 0.00 0.59 -5.07 105.19 104.89 1bwd n GLY 76 Ca 0.09 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 1bwd n GLY 76 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bwd s VAL 77 N -2.09 4.53 -0.32 1.61 1.01 -0.51 -4.95 120.40 119.68 1bwd s VAL 77 Ca 0.00 1.22 -0.18 0.00 0.00 0.00 0.00 61.98 63.02 1bwd s VAL 77 Cb 0.00 -3.62 -0.01 0.00 0.00 0.00 0.00 36.38 32.75 1bwd s VAL 77 CO 0.00 -0.24 0.53 -0.89 0.00 0.00 0.00 175.10 174.51 1bwd s THR 78 N -2.06 5.01 -0.20 3.92 2.01 0.16 -4.10 115.64 120.38 1bwd s THR 78 Ca 0.58 0.55 -0.09 0.00 0.31 0.00 0.00 61.69 63.03 1bwd s THR 78 Cb -0.10 -3.94 -0.05 0.00 0.01 0.00 0.00 72.50 68.43 1bwd s THR 78 CO 0.15 -0.14 0.12 -0.69 -0.69 0.00 0.00 174.62 173.37 1bwd s VAL 79 N 2.42 5.25 0.07 3.82 1.01 -1.26 -1.62 120.40 130.08 1bwd s VAL 79 Ca 0.20 0.13 0.09 0.00 0.00 0.00 0.00 61.98 62.40 1bwd s VAL 79 Cb -0.15 -3.39 -0.03 0.00 0.00 0.00 0.00 36.38 32.80 1bwd s VAL 79 CO 0.12 0.44 -0.22 -0.13 0.00 0.00 0.00 175.10 175.31 1bwd s ARG 80 N 0.43 1.83 0.19 2.72 1.81 -0.41 -5.01 118.95 120.52 1bwd s ARG 80 Ca 0.07 -1.11 0.11 0.00 -1.72 0.00 0.00 55.73 53.08 1bwd s ARG 80 Cb -0.12 -2.06 -0.04 0.00 -0.45 0.00 0.00 34.95 32.28 1bwd s ARG 80 CO -0.01 0.51 -0.24 1.03 -0.68 0.00 0.00 175.30 175.91 1bwd s ARG 81 N -1.57 1.51 1.13 3.54 0.52 -1.26 -1.08 118.95 121.74 1bwd s ARG 81 Ca 0.14 -1.53 -0.15 0.00 -0.52 0.00 0.00 55.73 53.68 1bwd s ARG 81 Cb -0.10 -1.83 0.21 0.00 0.52 0.00 0.00 34.95 33.74 1bwd s ARG 81 CO 0.05 0.39 0.65 -2.30 0.02 0.00 0.00 175.30 174.12 1bwd n PRO 82 N 0.26 -1.93 -2.51 3.54 -0.02 -1.26 -4.96 135.00 128.12 1bwd n PRO 82 Ca -0.12 -0.53 -0.23 0.00 -2.02 0.00 0.00 63.50 60.59 1bwd n PRO 82 Cb 0.56 -2.01 0.08 0.00 -0.02 0.00 0.00 33.50 32.11 1bwd n PRO 82 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1bwd s GLY 83 N -2.21 1.77 0.29 -1.23 0.00 0.99 -5.02 107.32 101.92 1bwd s GLY 83 Ca 0.64 -1.41 -0.28 0.00 0.00 0.00 0.00 44.72 43.66 1bwd s GLY 83 CO 0.65 -0.97 1.04 2.56 0.00 0.00 0.00 173.10 176.38 1bwd s PRO 84 N -5.05 4.62 -0.20 2.90 0.04 -1.26 -4.87 135.00 131.18 1bwd s PRO 84 Ca 0.62 1.64 -0.19 0.00 0.04 0.00 0.00 61.00 63.11 1bwd s PRO 84 Cb -0.08 -3.08 0.05 0.00 0.04 0.00 0.00 34.50 31.43 1bwd s PRO 84 CO 0.43 0.25 0.54 0.50 0.04 0.00 0.00 177.00 178.75 1bwd s ARG 85 N -1.58 0.64 -0.16 4.56 3.52 -1.26 -4.86 118.95 119.80 1bwd s ARG 85 Ca 0.46 0.73 -0.24 0.00 -0.13 0.00 0.00 55.73 56.55 1bwd s ARG 85 Cb -0.28 0.31 -0.02 0.00 -1.56 0.00 0.00 34.95 33.40 1bwd s ARG 85 CO 0.35 -0.08 0.76 0.34 -0.81 0.00 0.00 175.30 175.86 1bwd s ASP 86 N 0.24 6.88 0.00 -2.12 -1.08 -1.26 -4.90 116.67 114.43 1bwd s ASP 86 Ca -0.00 1.08 0.26 0.00 -0.52 0.00 0.00 52.55 53.37 1bwd s ASP 86 Cb -0.04 -2.42 0.69 0.00 -1.46 0.00 0.00 42.92 39.69 1bwd s ASP 86 CO 0.01 -0.32 1.53 1.41 0.52 0.00 0.00 175.17 178.31 1bwd n HIS 87 N 4.98 0.00 0.91 -5.34 8.25 -1.26 -3.62 115.22 119.14 1bwd n HIS 87 Ca 0.02 0.00 0.10 0.00 -0.26 0.00 0.00 57.72 57.58 1bwd n HIS 87 Cb 0.49 -0.05 -0.12 0.00 1.12 0.00 0.00 29.99 31.43 1bwd n HIS 87 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 1bwd n SER 88 N -0.10 0.92 -4.74 0.41 3.41 -1.26 0.60 113.62 112.85 1bwd n SER 88 Ca 0.14 -0.93 -0.41 0.00 -0.26 0.00 0.00 58.87 57.40 1bwd n SER 88 Cb 0.39 1.04 -0.02 0.00 -0.26 0.00 0.00 64.21 65.36 1bwd n SER 88 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1bwd s ALA 89 N -2.93 3.68 0.40 7.33 0.00 -1.24 -4.82 121.76 124.19 1bwd s ALA 89 Ca 0.07 1.41 -0.25 0.00 0.00 0.00 0.00 51.96 53.19 1bwd s ALA 89 Cb 0.15 -3.59 -0.08 0.00 0.00 0.00 0.00 23.12 19.59 1bwd s ALA 89 CO 0.83 -0.82 1.12 -0.51 0.00 0.00 0.00 175.76 176.38 1bwd s LEU 90 N -0.22 4.16 -0.09 0.00 1.43 -1.26 -4.10 118.68 118.60 1bwd s LEU 90 Ca 0.62 2.22 0.05 0.00 -1.03 0.00 0.00 54.13 55.99 1bwd s LEU 90 Cb -0.44 -4.10 -0.00 0.00 0.03 0.00 0.00 46.19 41.68 1bwd s LEU 90 CO 0.43 -0.63 -0.24 0.27 0.23 0.00 0.00 176.35 176.42 1bwd s ILE 91 N -1.51 2.11 -0.07 -0.59 -4.36 0.15 -4.98 121.20 111.95 1bwd s ILE 91 Ca 0.58 -1.02 -0.03 0.00 -0.26 0.00 0.00 60.65 59.92 1bwd s ILE 91 Cb -0.27 -1.79 0.04 0.00 1.25 0.00 0.00 42.46 41.69 1bwd s ILE 91 CO 0.34 0.56 0.13 -0.75 0.24 0.00 0.00 174.94 175.46 1bwd s LYS 92 N 0.15 0.02 0.42 0.37 2.36 -1.26 -1.10 119.74 120.70 1bwd s LYS 92 Ca -0.13 0.46 0.07 0.00 -2.55 0.00 0.00 55.97 53.83 1bwd s LYS 92 Cb -0.16 -0.30 -0.03 0.00 -1.05 0.00 0.00 37.83 36.29 1bwd s LYS 92 CO 0.07 -0.27 0.31 0.95 1.55 0.00 0.00 175.35 177.96 1bwd s THR 93 N 1.95 2.47 0.26 3.43 -4.23 -0.50 -5.01 115.64 114.01 1bwd s THR 93 Ca 0.00 -1.47 -0.03 0.00 -1.18 0.00 0.00 61.69 59.01 1bwd s THR 93 Cb -0.12 -2.94 0.25 0.00 1.34 0.00 0.00 72.50 71.03 1bwd s THR 93 CO -0.05 0.00 1.87 -0.65 -0.54 0.00 0.00 174.62 175.25 1bwd h PRO 94 N 1.14 1.07 -0.04 3.99 0.11 -2.01 -2.91 132.00 133.35 1bwd h PRO 94 Ca -0.42 -0.06 -0.15 0.00 0.11 0.00 0.00 66.00 65.48 1bwd h PRO 94 Cb 1.26 -0.24 0.01 0.00 0.11 0.00 0.00 31.00 32.14 1bwd h PRO 94 CO 0.62 0.71 -0.58 -0.44 -0.21 0.00 0.00 178.00 178.10 1bwd h ASP 95 N 1.10 0.58 -3.50 -2.05 3.32 -1.96 -3.49 116.42 110.43 1bwd h ASP 95 Ca 0.42 -0.71 -0.24 0.00 0.02 0.00 0.00 57.03 56.52 1bwd h ASP 95 Cb 0.19 -0.18 -0.06 0.00 0.22 0.00 0.00 39.33 39.50 1bwd h ASP 95 CO -0.18 1.21 -0.18 -2.67 -1.72 0.00 0.00 179.24 175.69 1bwd n TRP 96 N -4.21 -0.91 -3.80 4.55 4.27 -1.10 -5.08 117.44 111.15 1bwd n TRP 96 Ca -0.09 -1.72 -0.12 0.00 -3.89 0.00 0.00 57.50 51.67 1bwd n TRP 96 Cb 0.65 0.31 -0.11 0.00 -1.36 0.00 0.00 31.31 30.80 1bwd n TRP 96 CO 0.00 0.00 0.00 -2.00 -2.29 0.00 0.00 177.69 173.40 1bwd s GLU 97 N -2.69 0.38 0.24 -2.67 2.12 -1.26 -1.40 118.70 113.41 1bwd s GLU 97 Ca 0.23 0.09 -0.21 0.00 0.36 0.00 0.00 54.97 55.44 1bwd s GLU 97 Cb 0.00 0.17 0.07 0.00 0.26 0.00 0.00 34.13 34.63 1bwd s GLU 97 CO 0.16 -0.07 0.96 0.95 -0.54 0.00 0.00 175.26 176.72 1bwd s THR 98 N -0.41 0.00 0.42 -1.70 -4.23 -0.26 -5.01 115.64 104.45 1bwd s THR 98 Ca -0.05 -0.71 0.07 0.00 -1.18 0.00 0.00 61.69 59.82 1bwd s THR 98 Cb -0.03 -2.77 -0.04 0.00 1.34 0.00 0.00 72.50 71.00 1bwd s THR 98 CO 0.01 0.00 0.25 1.51 -0.54 0.00 0.00 174.62 175.85 1bwd s ASP 99 N -3.26 4.61 0.75 3.99 -4.77 -1.26 0.35 116.67 117.08 1bwd s ASP 99 Ca 0.19 -1.00 -0.04 0.00 -3.30 0.00 0.00 52.55 48.40 1bwd s ASP 99 Cb -0.03 -0.43 0.12 0.00 -1.09 0.00 0.00 42.92 41.48 1bwd s ASP 99 CO 0.07 -0.62 0.76 0.61 0.70 0.00 0.00 175.17 176.69 1bwd n GLY 100 N -1.36 0.01 0.00 2.12 0.00 0.20 -4.42 105.19 101.74 1bwd n GLY 100 Ca -0.00 -1.91 0.00 0.00 0.00 0.00 0.00 46.02 44.11 1bwd n GLY 100 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1bwd n PHE 101 N -2.68 0.00 -3.66 1.61 7.35 -1.25 -4.40 117.46 114.43 1bwd n PHE 101 Ca 0.11 0.00 -0.03 0.00 -0.76 0.00 0.00 57.45 56.77 1bwd n PHE 101 Cb 0.40 0.00 -0.01 0.00 0.35 0.00 0.00 39.48 40.22 1bwd n PHE 101 CO 0.00 0.00 0.00 -3.38 -0.76 0.00 0.00 176.76 172.62 1bwd s HIS 102 N 0.29 -0.16 -0.39 -5.13 -3.43 -1.26 -1.27 115.29 103.94 1bwd s HIS 102 Ca 0.00 -0.05 0.05 0.00 -0.80 0.00 0.00 55.06 54.26 1bwd s HIS 102 Cb 0.00 0.59 0.44 0.00 -1.43 0.00 0.00 32.58 32.18 1bwd s HIS 102 CO 0.00 -0.60 1.30 -0.25 -2.00 0.00 0.00 174.74 173.19 1bwd n ASP 103 N -0.40 5.30 0.02 7.38 8.00 -1.26 -4.70 116.55 130.89 1bwd n ASP 103 Ca -0.07 -3.75 0.11 0.00 0.71 0.00 0.00 54.79 51.79 1bwd n ASP 103 Cb 0.61 -0.47 -0.03 0.00 -0.02 0.00 0.00 41.12 41.21 1bwd n ASP 103 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1bwd n TYR 104 N -0.67 0.20 -3.53 1.24 9.36 -1.08 -2.24 117.16 120.44 1bwd n TYR 104 Ca 0.45 0.06 -0.27 0.00 3.32 0.00 0.00 57.90 61.46 1bwd n TYR 104 Cb 0.82 -0.39 -0.10 0.00 -0.63 0.00 0.00 39.34 39.04 1bwd n TYR 104 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1bwd h PRO 106 N 5.15 0.00 -0.98 0.00 0.11 -1.82 -3.02 132.00 131.44 1bwd h PRO 106 Ca 0.19 0.00 0.03 0.00 0.11 0.00 0.00 66.00 66.33 1bwd h PRO 106 Cb 0.83 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 31.88 1bwd h PRO 106 CO 0.55 0.00 0.64 -0.09 -0.21 0.00 0.00 178.00 178.89 1bwd h ARG 107 N 0.00 1.23 -0.73 1.05 9.65 -1.57 -3.35 114.38 120.66 1bwd h ARG 107 Ca 0.13 -0.07 0.10 0.00 -1.10 0.00 0.00 59.98 59.03 1bwd h ARG 107 Cb 0.83 -0.28 -0.05 0.00 -1.39 0.00 0.00 29.97 29.08 1bwd h ARG 107 CO -0.00 0.81 0.48 -0.44 2.80 0.00 0.00 179.97 183.62 1bwd h ASP 108 N 1.26 0.55 0.00 -3.80 5.19 -1.80 -3.22 116.42 114.61 1bwd h ASP 108 Ca 0.38 0.01 -0.06 0.00 -0.62 0.00 0.00 57.03 56.74 1bwd h ASP 108 Cb -0.05 -0.10 -0.14 0.00 0.18 0.00 0.00 39.33 39.22 1bwd h ASP 108 CO -0.11 0.33 -0.69 0.61 -3.12 0.00 0.00 179.24 176.27 1bwd n GLY 109 N -1.47 0.68 2.74 2.75 0.00 -1.26 0.28 105.19 108.91 1bwd n GLY 109 Ca 0.12 -0.30 -0.24 0.00 0.00 0.00 0.00 46.02 45.60 1bwd n GLY 109 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1bwd s LEU 110 N 0.00 0.70 -0.17 0.99 1.02 -1.26 -2.65 118.68 117.31 1bwd s LEU 110 Ca 0.12 -0.33 -0.01 0.00 0.02 0.00 0.00 54.13 53.93 1bwd s LEU 110 Cb 0.14 -0.45 -0.00 0.00 0.02 0.00 0.00 46.19 45.90 1bwd s LEU 110 CO -0.06 -0.24 -0.12 -0.22 0.02 0.00 0.00 176.35 175.72 1bwd s LEU 111 N 1.97 2.61 -0.37 1.79 2.96 -0.60 -4.80 118.68 122.24 1bwd s LEU 111 Ca 0.03 -0.44 -0.05 0.00 -0.22 0.00 0.00 54.13 53.45 1bwd s LEU 111 Cb -0.14 -1.62 0.07 0.00 0.50 0.00 0.00 46.19 45.01 1bwd s LEU 111 CO -0.06 0.06 0.15 -0.94 -1.32 0.00 0.00 176.35 174.24 1bwd s SER 112 N 0.96 5.29 -0.08 3.68 1.04 -1.26 -0.14 113.70 123.19 1bwd s SER 112 Ca -0.02 -1.50 0.21 0.00 0.48 0.00 0.00 55.95 55.11 1bwd s SER 112 Cb -0.15 -1.86 -0.31 0.00 0.10 0.00 0.00 66.02 63.81 1bwd s SER 112 CO -0.01 -0.43 0.36 0.52 0.98 0.00 0.00 173.24 174.66 1bwd n VAL 113 N 4.74 0.38 0.00 5.02 0.31 -1.02 -4.86 118.33 122.90 1bwd n VAL 113 Ca -0.09 -0.59 0.00 0.00 -0.01 0.00 0.00 64.34 63.65 1bwd n VAL 113 Cb 0.43 -0.12 0.00 0.00 -0.91 0.00 0.00 33.84 33.24 1bwd n VAL 113 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1bwd n GLY 114 N 1.42 -1.32 0.36 2.92 0.00 -1.24 -4.57 105.19 102.75 1bwd n GLY 114 Ca -0.12 0.54 0.04 0.00 0.00 0.00 0.00 46.02 46.48 1bwd n GLY 114 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1bwd n GLN 115 N -0.26 1.11 -4.09 1.61 3.00 -1.25 -1.90 117.38 115.60 1bwd n GLN 115 Ca 0.00 -1.30 -0.33 0.00 -0.01 0.00 0.00 57.00 55.36 1bwd n GLN 115 Cb 0.00 -1.16 -0.07 0.00 0.00 0.00 0.00 30.24 29.01 1bwd n GLN 115 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.06 178.05 1bwd s THR 116 N -0.77 4.80 -0.13 5.09 2.01 -1.26 -0.06 115.64 125.32 1bwd s THR 116 Ca 0.12 -0.34 0.00 0.00 0.31 0.00 0.00 61.69 61.78 1bwd s THR 116 Cb 0.07 -3.18 -0.01 0.00 0.01 0.00 0.00 72.50 69.39 1bwd s THR 116 CO 0.10 0.39 -0.14 -0.63 -0.69 0.00 0.00 174.62 173.64 1bwd s ILE 117 N -1.17 2.94 -0.22 1.82 1.01 0.02 -2.43 121.20 123.18 1bwd s ILE 117 Ca 0.22 -0.70 -0.02 0.00 0.00 0.00 0.00 60.65 60.15 1bwd s ILE 117 Cb -0.12 -2.23 0.01 0.00 0.01 0.00 0.00 42.46 40.13 1bwd s ILE 117 CO 0.13 0.53 -0.08 -0.63 0.00 0.00 0.00 174.94 174.88 1bwd s ILE 118 N 0.35 2.98 -0.42 2.92 1.01 0.80 -0.45 121.20 128.39 1bwd s ILE 118 Ca -0.12 -0.71 -0.29 0.00 0.00 0.00 0.00 60.65 59.54 1bwd s ILE 118 Cb -0.16 -2.37 0.02 0.00 0.01 0.00 0.00 42.46 39.96 1bwd s ILE 118 CO 0.06 0.40 1.14 -1.61 0.00 0.00 0.00 174.94 174.93 1bwd s GLU 119 N 1.41 3.83 0.72 2.79 2.02 0.69 -1.56 118.70 128.59 1bwd s GLU 119 Ca 0.04 0.75 -0.11 0.00 0.02 0.00 0.00 54.97 55.68 1bwd s GLU 119 Cb -0.14 -3.86 0.02 0.00 0.10 0.00 0.00 34.13 30.25 1bwd s GLU 119 CO -0.06 -1.24 1.07 0.95 0.02 0.00 0.00 175.26 176.01 1bwd s THR 120 N 4.26 3.72 -1.23 3.63 -4.23 -1.08 -0.82 115.64 119.89 1bwd s THR 120 Ca 0.48 0.56 -0.13 0.00 -1.18 0.00 0.00 61.69 61.42 1bwd s THR 120 Cb -0.09 -3.39 0.17 0.00 1.34 0.00 0.00 72.50 70.53 1bwd s THR 120 CO 0.27 -0.73 1.52 -0.81 -0.54 0.00 0.00 174.62 174.33 1bwd n PRO 121 N -3.15 3.40 -1.53 3.99 -0.04 -1.23 -4.79 135.00 131.67 1bwd n PRO 121 Ca 0.07 -3.78 -0.51 0.00 -0.04 0.00 0.00 63.50 59.24 1bwd n PRO 121 Cb 0.55 -3.03 -0.05 0.00 -0.04 0.00 0.00 33.50 30.93 1bwd n PRO 121 CO 0.00 0.00 0.00 -0.12 -0.04 0.00 0.00 175.50 175.34 1bwd n MET 122 N 5.42 0.69 0.26 0.54 1.56 -1.25 -1.64 117.12 122.71 1bwd n MET 122 Ca 0.38 0.25 0.15 0.00 -0.27 0.00 0.00 57.70 58.20 1bwd n MET 122 Cb 0.42 -1.64 0.65 0.00 2.15 0.00 0.00 33.22 34.80 1bwd n MET 122 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1bwd h ALA 123 N 2.76 1.04 -2.88 -5.12 0.00 -1.88 -3.44 119.26 109.75 1bwd h ALA 123 Ca -0.42 -0.07 -0.62 0.00 0.00 0.00 0.00 54.91 53.80 1bwd h ALA 123 Cb 1.38 -0.01 -0.14 0.00 0.00 0.00 0.00 17.79 19.02 1bwd h ALA 123 CO 0.66 0.10 -0.34 -1.17 0.00 0.00 0.00 179.25 178.50 1bwd s LEU 124 N -6.48 4.08 0.46 0.00 2.96 -1.26 -4.92 118.68 113.52 1bwd s LEU 124 Ca 0.00 0.25 0.19 0.00 -0.22 0.00 0.00 54.13 54.35 1bwd s LEU 124 Cb 0.10 -2.32 1.17 0.00 0.50 0.00 0.00 46.19 45.65 1bwd s LEU 124 CO 0.57 -0.07 1.94 0.03 -1.32 0.00 0.00 176.35 177.49 1bwd h ARG 125 N 7.85 0.27 0.00 1.98 3.08 -1.93 0.67 114.38 126.29 1bwd h ARG 125 Ca -0.35 -0.02 -0.00 0.00 0.07 0.00 0.00 59.98 59.69 1bwd h ARG 125 Cb 1.17 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 31.16 1bwd h ARG 125 CO 0.65 0.18 -0.00 0.66 -1.07 0.00 0.00 179.97 180.39 1bwd h SER 126 N 0.28 0.00 -0.40 7.04 4.64 -1.95 -0.81 113.55 122.34 1bwd h SER 126 Ca 0.34 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.61 1bwd h SER 126 Cb 0.94 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.00 1bwd h SER 126 CO -0.08 0.00 0.03 0.54 -0.87 0.00 0.00 176.83 176.45 1bwd n ARG 127 N -3.08 3.32 -0.18 4.77 1.74 0.22 -3.82 116.66 119.63 1bwd n ARG 127 Ca -0.02 -2.98 0.09 0.00 -0.77 0.00 0.00 57.85 54.17 1bwd n ARG 127 Cb 0.11 -1.98 0.39 0.00 -1.02 0.00 0.00 32.46 29.96 1bwd n ARG 127 CO 0.00 0.00 0.00 0.35 -1.52 0.00 0.00 177.63 176.46 1bwd h PHE 128 N 2.27 0.71 -0.89 -1.55 3.57 -1.17 -2.58 116.94 117.30 1bwd h PHE 128 Ca 0.06 0.02 -0.51 0.00 3.53 0.00 0.00 57.97 61.07 1bwd h PHE 128 Cb 1.70 -0.23 -0.42 0.00 2.79 0.00 0.00 35.95 39.78 1bwd h PHE 128 CO 0.77 0.34 -0.86 1.28 -2.23 0.00 0.00 178.31 177.62 1bwd n LEU 129 N -4.49 4.29 -0.31 0.59 4.77 -1.26 -4.89 117.00 115.69 1bwd n LEU 129 Ca 0.12 -4.59 0.14 0.00 -0.03 0.00 0.00 56.01 51.65 1bwd n LEU 129 Cb 0.31 -0.23 0.32 0.00 -2.33 0.00 0.00 43.42 41.50 1bwd n LEU 129 CO 0.33 1.98 1.06 -0.08 -1.33 0.00 0.00 177.39 179.35 1bwd h GLU 130 N 2.36 0.41 0.00 3.23 4.57 -1.77 -0.89 114.58 122.49 1bwd h GLU 130 Ca 0.27 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.42 1bwd h GLU 130 Cb 1.35 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 29.85 1bwd h GLU 130 CO 0.69 0.27 0.00 -1.13 -1.18 0.00 0.00 179.01 177.66 1bwd n SER 131 N -5.03 0.00 -0.34 1.04 3.41 -1.26 -3.99 113.62 107.46 1bwd n SER 131 Ca 0.23 -0.67 -0.03 0.00 -0.26 0.00 0.00 58.87 58.14 1bwd n SER 131 Cb 0.68 -0.09 0.09 0.00 -0.26 0.00 0.00 64.21 64.63 1bwd n SER 131 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1bwd h LEU 132 N 0.00 1.08 -1.63 1.04 5.85 -1.57 -1.01 115.31 119.07 1bwd h LEU 132 Ca 0.00 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.66 1bwd h LEU 132 Cb 0.08 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 40.84 1bwd h LEU 132 CO 0.00 0.82 0.00 0.00 -0.34 0.00 0.00 178.44 178.92 1bwd h ALA 133 N 1.31 1.00 -0.30 1.25 0.00 -1.79 -2.72 119.26 118.01 1bwd h ALA 133 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1bwd h ALA 133 Cb -0.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1bwd h ALA 133 CO -0.06 0.00 0.00 0.66 0.00 0.00 0.00 179.25 179.85 1bwd n TYR 134 N -2.63 0.92 -0.01 0.00 4.02 -0.39 -0.01 117.16 119.06 1bwd n TYR 134 Ca -0.00 -0.80 -0.10 0.00 -0.01 0.00 0.00 57.90 56.98 1bwd n TYR 134 Cb 0.15 -0.27 -0.04 0.00 -0.02 0.00 0.00 39.34 39.16 1bwd n TYR 134 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 176.86 175.63 1bwd h LYS 135 N 1.98 0.08 -0.55 -0.72 1.63 -1.35 -1.56 116.57 116.08 1bwd h LYS 135 Ca 0.00 -0.00 -0.05 0.00 -0.85 0.00 0.00 60.65 59.74 1bwd h LYS 135 Cb 1.34 -0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 32.93 1bwd h LYS 135 CO 0.20 0.05 0.14 -0.44 -3.45 0.00 0.00 179.45 175.95 1bwd h ASP 136 N 0.08 0.84 0.45 4.20 3.32 -1.86 -0.39 116.42 123.06 1bwd h ASP 136 Ca 0.05 -0.23 -0.01 0.00 0.02 0.00 0.00 57.03 56.86 1bwd h ASP 136 Cb 0.04 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.36 1bwd h ASP 136 CO -0.07 0.85 -0.30 -0.07 -1.72 0.00 0.00 179.24 177.94 1bwd h LEU 137 N 0.78 -0.75 -0.96 1.55 4.07 -1.86 -2.46 115.31 115.68 1bwd h LEU 137 Ca 0.17 0.05 0.13 0.00 0.08 0.00 0.00 57.88 58.31 1bwd h LEU 137 Cb 0.34 0.23 -0.09 0.00 1.08 0.00 0.00 40.66 42.22 1bwd h LEU 137 CO 0.00 -0.46 0.58 -0.07 -1.08 0.00 0.00 178.44 177.41 1bwd h LEU 138 N -0.72 0.83 -0.72 1.67 4.07 -1.10 0.37 115.31 119.70 1bwd h LEU 138 Ca -0.05 0.06 0.06 0.00 0.08 0.00 0.00 57.88 58.04 1bwd h LEU 138 Cb 0.60 -0.10 -0.06 0.00 1.08 0.00 0.00 40.66 42.18 1bwd h LEU 138 CO 0.04 0.41 0.41 0.25 -1.08 0.00 0.00 178.44 178.47 1bwd h LEU 139 N 0.89 0.62 0.20 1.67 5.85 -0.77 0.77 115.31 124.54 1bwd h LEU 139 Ca 0.49 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 59.23 1bwd h LEU 139 Cb 0.55 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.49 1bwd h LEU 139 CO -0.29 0.39 -0.10 -0.08 -0.34 0.00 0.00 178.44 178.02 1bwd h GLU 140 N 0.75 -0.26 -0.44 1.25 4.81 -0.56 -0.22 114.58 119.92 1bwd h GLU 140 Ca 0.32 0.02 0.09 0.00 -0.13 0.00 0.00 59.36 59.66 1bwd h GLU 140 Cb 0.20 0.06 -0.09 0.00 0.63 0.00 0.00 28.75 29.55 1bwd h GLU 140 CO -0.19 0.11 -0.23 1.88 -0.73 0.00 0.00 179.01 179.85 1bwd h TYR 141 N -0.69 -0.58 -0.07 0.92 0.05 -0.61 -1.79 116.97 114.20 1bwd h TYR 141 Ca -0.03 0.05 0.02 0.00 0.05 0.00 0.00 58.73 58.82 1bwd h TYR 141 Cb 0.49 0.32 -0.04 0.00 1.01 0.00 0.00 36.73 38.50 1bwd h TYR 141 CO 0.05 -0.31 -0.37 0.35 -1.05 0.00 0.00 178.16 176.83 1bwd h PHE 142 N -0.14 -1.10 0.00 4.88 3.57 0.66 -2.78 116.94 122.03 1bwd h PHE 142 Ca 0.21 0.04 -0.59 0.00 3.53 0.00 0.00 57.97 61.16 1bwd h PHE 142 Cb 0.46 0.49 0.08 0.00 2.79 0.00 0.00 35.95 39.77 1bwd h PHE 142 CO -0.48 -0.38 1.98 0.00 -2.23 0.00 0.00 178.31 177.20 1bwd n ALA 143 N -2.86 2.54 -0.02 2.41 0.00 -0.10 -1.59 120.51 120.89 1bwd n ALA 143 Ca -0.04 -2.89 0.00 0.00 0.00 0.00 0.00 53.44 50.51 1bwd n ALA 143 Cb 0.26 -3.58 0.00 0.00 0.00 0.00 0.00 19.45 16.13 1bwd n ALA 143 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1bwd n SER 144 N 7.62 0.00 0.00 0.00 3.41 -1.07 -4.85 113.62 118.74 1bwd n SER 144 Ca 0.46 -0.01 0.00 0.00 -0.26 0.00 0.00 58.87 59.07 1bwd n SER 144 Cb 0.37 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.32 1bwd n SER 144 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1bwd n GLY 145 N 0.00 0.76 3.75 5.00 0.00 -0.62 -2.05 105.19 112.03 1bwd n GLY 145 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1bwd n GLY 145 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1bwd s SER 146 N -2.48 7.12 0.05 1.61 0.01 -1.12 -4.76 113.70 114.13 1bwd s SER 146 Ca 0.00 2.30 -0.30 0.00 1.31 0.00 0.00 55.95 59.26 1bwd s SER 146 Cb 0.00 -2.62 -0.05 0.00 0.21 0.00 0.00 66.02 63.57 1bwd s SER 146 CO 0.00 -0.30 1.07 -0.60 0.41 0.00 0.00 173.24 173.82 1bwd s ARG 147 N -0.87 4.52 -0.34 12.44 3.52 0.92 -4.49 118.95 134.65 1bwd s ARG 147 Ca 0.49 1.58 0.03 0.00 -0.13 0.00 0.00 55.73 57.71 1bwd s ARG 147 Cb -0.33 -3.40 0.10 0.00 -1.56 0.00 0.00 34.95 29.76 1bwd s ARG 147 CO 0.40 -0.10 0.05 -0.46 -0.81 0.00 0.00 175.30 174.38 1bwd s TRP 148 N 0.86 3.55 0.35 5.12 -0.00 -1.26 -0.80 118.94 126.76 1bwd s TRP 148 Ca 0.54 -2.87 0.08 0.00 -0.00 0.00 0.00 56.10 53.85 1bwd s TRP 148 Cb -0.25 -2.80 -0.05 0.00 -0.00 0.00 0.00 33.47 30.37 1bwd s TRP 148 CO 0.29 -0.94 0.12 -0.51 -0.00 0.00 0.00 176.95 175.91 1bwd s LEU 149 N 0.98 3.18 0.03 5.86 1.02 0.41 -4.98 118.68 125.18 1bwd s LEU 149 Ca 0.11 -0.86 0.02 0.00 0.02 0.00 0.00 54.13 53.41 1bwd s LEU 149 Cb -0.19 -1.62 -0.02 0.00 0.02 0.00 0.00 46.19 44.39 1bwd s LEU 149 CO -0.10 -0.32 -0.06 -0.55 0.02 0.00 0.00 176.35 175.34 1bwd s SER 150 N -3.83 0.70 0.55 2.29 0.15 -1.26 -0.22 113.70 112.07 1bwd s SER 150 Ca 0.38 -0.46 -0.14 0.00 0.70 0.00 0.00 55.95 56.43 1bwd s SER 150 Cb -0.01 0.03 -0.06 0.00 -1.71 0.00 0.00 66.02 64.26 1bwd s SER 150 CO 0.22 -0.17 0.99 0.00 1.20 0.00 0.00 173.24 175.47 1bwd s ALA 151 N -1.16 3.10 0.29 5.45 0.00 0.00 -4.89 121.76 124.55 1bwd s ALA 151 Ca -0.09 0.06 -0.29 0.00 0.00 0.00 0.00 51.96 51.64 1bwd s ALA 151 Cb -0.08 -3.08 -0.13 0.00 0.00 0.00 0.00 23.12 19.82 1bwd s ALA 151 CO 0.00 -0.38 1.20 -2.30 0.00 0.00 0.00 175.76 174.28 1bwd n PRO 152 N -1.98 1.74 -2.27 0.00 -0.02 -1.26 -4.80 135.00 126.41 1bwd n PRO 152 Ca 0.06 0.61 -0.42 0.00 -2.02 0.00 0.00 63.50 61.73 1bwd n PRO 152 Cb 0.54 -2.13 -0.03 0.00 -0.02 0.00 0.00 33.50 31.87 1bwd n PRO 152 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1bwd s LYS 153 N -1.31 4.27 0.68 -0.52 -0.14 -1.26 -4.78 119.74 116.68 1bwd s LYS 153 Ca 0.61 1.89 -0.16 0.00 -1.36 0.00 0.00 55.97 56.95 1bwd s LYS 153 Cb -0.66 -3.67 0.01 0.00 -1.68 0.00 0.00 37.83 31.83 1bwd s LYS 153 CO 0.58 -0.62 1.16 -1.25 -0.76 0.00 0.00 175.35 174.45 1bwd s PRO 154 N 2.84 2.56 0.01 -1.68 0.04 -1.26 -4.98 135.00 132.52 1bwd s PRO 154 Ca 0.62 1.59 -0.21 0.00 0.04 0.00 0.00 61.00 63.04 1bwd s PRO 154 Cb -0.29 -1.90 -0.18 0.00 0.04 0.00 0.00 34.50 32.18 1bwd s PRO 154 CO 0.24 -1.48 1.24 -0.09 0.04 0.00 0.00 177.00 176.95 1bwd h ARG 155 N 0.02 0.30 -5.75 4.56 2.43 -1.96 -3.47 114.38 110.50 1bwd h ARG 155 Ca -0.48 -0.20 -0.36 0.00 -0.81 0.00 0.00 59.98 58.13 1bwd h ARG 155 Cb 1.27 0.03 0.15 0.00 -0.42 0.00 0.00 29.97 31.00 1bwd h ARG 155 CO 0.52 0.81 -0.74 -0.11 -1.51 0.00 0.00 179.97 178.94 1bwd n LEU 156 N -4.52 -3.75 -4.82 3.80 7.94 -1.26 -4.95 117.00 109.44 1bwd n LEU 156 Ca -0.07 -0.61 -0.30 0.00 -1.11 0.00 0.00 56.01 53.92 1bwd n LEU 156 Cb 0.42 -3.06 0.19 0.00 0.53 0.00 0.00 43.42 41.50 1bwd n LEU 156 CO 0.40 0.48 0.78 0.42 -1.11 0.00 0.00 177.39 178.36 1bwd s THR 157 N -3.36 1.88 0.50 1.96 -4.23 -1.26 -4.92 115.64 106.22 1bwd s THR 157 Ca 0.22 0.00 0.20 0.00 -1.18 0.00 0.00 61.69 60.93 1bwd s THR 157 Cb -0.10 -2.83 0.35 0.00 1.34 0.00 0.00 72.50 71.26 1bwd s THR 157 CO 0.74 0.00 2.03 0.44 -0.54 0.00 0.00 174.62 177.28 1bwd h ASP 158 N -1.87 0.10 -0.01 3.99 5.19 -1.97 -2.56 116.42 119.30 1bwd h ASP 158 Ca -0.45 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.96 1bwd h ASP 158 Cb 1.27 -0.02 -0.00 0.00 0.18 0.00 0.00 39.33 40.76 1bwd h ASP 158 CO 0.41 0.06 0.08 -2.24 -3.12 0.00 0.00 179.24 174.43 1bwd h ASP 159 N 0.12 0.00 0.44 6.45 2.03 -2.03 -2.91 116.42 120.52 1bwd h ASP 159 Ca 0.20 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.50 1bwd h ASP 159 Cb 0.66 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.16 1bwd h ASP 159 CO -0.02 0.00 -0.10 -1.20 -1.03 0.00 0.00 179.24 176.89 1bwd n SER 160 N -3.10 0.35 -4.47 4.15 7.64 -0.96 -4.67 113.62 112.56 1bwd n SER 160 Ca -0.03 -0.42 -0.26 0.00 1.01 0.00 0.00 58.87 59.18 1bwd n SER 160 Cb 0.15 -0.12 -0.11 0.00 -1.01 0.00 0.00 64.21 63.12 1bwd n SER 160 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 1bwd s TYR 161 N -2.55 2.36 -0.44 1.43 2.02 -1.10 -0.45 117.35 118.63 1bwd s TYR 161 Ca 0.27 -0.32 0.08 0.00 -0.37 0.00 0.00 57.07 56.72 1bwd s TYR 161 Cb 0.20 -1.11 0.28 0.00 -0.40 0.00 0.00 41.96 40.93 1bwd s TYR 161 CO 0.49 0.59 0.83 0.00 -1.57 0.00 0.00 175.55 175.88 1bwd n ALA 162 N -0.15 0.28 -0.33 3.71 0.00 0.12 -4.77 120.51 119.38 1bwd n ALA 162 Ca -0.09 -2.26 0.04 0.00 0.00 0.00 0.00 53.44 51.13 1bwd n ALA 162 Cb 0.58 -1.09 0.10 0.00 0.00 0.00 0.00 19.45 19.03 1bwd n ALA 162 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1bwd n PRO 163 N 1.02 -0.12 0.24 0.00 -0.02 -1.26 -0.67 135.00 134.19 1bwd n PRO 163 Ca 0.14 1.40 0.16 0.00 -2.02 0.00 0.00 63.50 63.18 1bwd n PRO 163 Cb 0.63 -2.08 0.65 0.00 -0.02 0.00 0.00 33.50 32.67 1bwd n PRO 163 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 1bwd h GLN 164 N 0.00 0.00 -7.32 -0.52 7.50 -1.96 -3.46 115.11 109.36 1bwd h GLN 164 Ca 0.40 0.00 -0.45 0.00 0.50 0.00 0.00 58.65 59.09 1bwd h GLN 164 Cb 0.62 0.00 0.17 0.00 0.05 0.00 0.00 27.48 28.32 1bwd h GLN 164 CO -0.92 0.00 0.17 0.00 -1.50 0.00 0.00 178.83 176.58 1bwd s ALA 165 N -3.59 0.79 0.86 3.87 0.00 0.16 -5.01 121.76 118.84 1bwd s ALA 165 Ca 0.02 -0.28 -0.10 0.00 0.00 0.00 0.00 51.96 51.60 1bwd s ALA 165 Cb 0.09 -3.15 0.11 0.00 0.00 0.00 0.00 23.12 20.17 1bwd s ALA 165 CO 0.50 -2.95 1.12 -2.14 0.00 0.00 0.00 175.76 172.29 1bwd s PRO 166 N -4.88 1.47 0.42 0.00 0.02 -1.26 -4.80 135.00 125.97 1bwd s PRO 166 Ca 0.66 1.37 -0.26 0.00 0.02 0.00 0.00 61.00 62.78 1bwd s PRO 166 Cb -0.20 -1.79 -0.09 0.00 0.02 0.00 0.00 34.50 32.45 1bwd s PRO 166 CO 0.59 -2.26 1.34 0.00 -0.33 0.00 0.00 177.00 176.34 1bwd s ALA 167 N -2.75 3.26 0.00 -1.55 0.00 -1.26 -2.43 121.76 117.03 1bwd s ALA 167 Ca 0.64 1.31 0.00 0.00 0.00 0.00 0.00 51.96 53.91 1bwd s ALA 167 Cb -0.20 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.40 1bwd s ALA 167 CO 0.57 -0.94 0.00 0.41 0.00 0.00 0.00 175.76 175.80 1bwd n GLY 168 N 0.63 0.43 0.39 0.00 0.00 -1.26 -4.87 105.19 100.52 1bwd n GLY 168 Ca 0.04 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.29 1bwd n GLY 168 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1bwd n GLU 169 N -2.97 0.00 -0.30 1.61 1.02 -1.02 -4.34 120.64 114.64 1bwd n GLU 169 Ca 0.00 -0.56 0.12 0.00 -0.02 0.00 0.00 57.16 56.70 1bwd n GLU 169 Cb 0.00 -0.31 0.28 0.00 -0.02 0.00 0.00 31.44 31.39 1bwd n GLU 169 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1bwd n ARG 170 N 0.00 2.65 -4.06 3.49 1.74 -1.25 -4.72 116.66 114.51 1bwd n ARG 170 Ca 0.00 -2.52 -0.32 0.00 -0.77 0.00 0.00 57.85 54.24 1bwd n ARG 170 Cb 0.60 -1.54 -0.15 0.00 -1.02 0.00 0.00 32.46 30.35 1bwd n ARG 170 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1bwd s LEU 171 N -1.17 3.57 1.14 0.55 2.96 -1.26 0.13 118.68 124.60 1bwd s LEU 171 Ca 0.45 -1.45 -0.19 0.00 -0.22 0.00 0.00 54.13 52.72 1bwd s LEU 171 Cb 0.24 -1.56 0.27 0.00 0.50 0.00 0.00 46.19 45.64 1bwd s LEU 171 CO 0.32 -0.21 1.20 0.42 -1.32 0.00 0.00 176.35 176.76 1bwd s THR 172 N 1.09 1.71 -0.74 3.68 -4.23 0.41 -4.89 115.64 112.67 1bwd s THR 172 Ca -0.07 0.00 0.03 0.00 -1.18 0.00 0.00 61.69 60.47 1bwd s THR 172 Cb -0.20 -2.68 0.29 0.00 1.34 0.00 0.00 72.50 71.25 1bwd s THR 172 CO -0.05 0.00 1.02 -0.67 -0.54 0.00 0.00 174.62 174.38 1bwd n ASP 173 N -4.47 4.74 -0.04 3.99 2.03 -1.26 -4.79 116.55 116.75 1bwd n ASP 173 Ca 0.15 -3.52 0.04 0.00 0.52 0.00 0.00 54.79 51.97 1bwd n ASP 173 Cb 0.60 -0.79 -0.16 0.00 -0.72 0.00 0.00 41.12 40.04 1bwd n ASP 173 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1bwd n GLU 174 N 0.57 0.67 -3.49 -0.67 -0.58 -1.26 -4.94 120.64 110.95 1bwd n GLU 174 Ca 0.31 -0.12 -0.15 0.00 -0.42 0.00 0.00 57.16 56.78 1bwd n GLU 174 Cb 0.38 -1.53 -0.04 0.00 -0.57 0.00 0.00 31.44 29.68 1bwd n GLU 174 CO 0.00 0.00 0.00 -1.83 -0.48 0.00 0.00 177.13 174.82 1bwd s GLU 175 N -3.15 1.09 -0.38 3.49 -1.05 -1.26 -5.10 118.70 112.34 1bwd s GLU 175 Ca -0.09 -0.03 -0.32 0.00 -0.15 0.00 0.00 54.97 54.39 1bwd s GLU 175 Cb 0.11 0.51 -0.10 0.00 -0.44 0.00 0.00 34.13 34.21 1bwd s GLU 175 CO 0.88 -0.40 2.27 -2.30 0.95 0.00 0.00 175.26 176.66 1bwd n PRO 176 N 0.39 1.23 -4.37 -4.83 -0.02 -1.26 -4.62 135.00 121.52 1bwd n PRO 176 Ca -0.17 0.29 -0.19 0.00 -2.02 0.00 0.00 63.50 61.41 1bwd n PRO 176 Cb 0.60 -2.76 -0.14 0.00 -0.02 0.00 0.00 33.50 31.18 1bwd n PRO 176 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1bwd s VAL 177 N 8.49 0.88 0.00 -1.45 -7.23 -1.26 -4.80 120.40 115.02 1bwd s VAL 177 Ca 1.07 -0.68 0.00 0.00 -1.81 0.00 0.00 61.98 60.56 1bwd s VAL 177 Cb -0.64 -0.78 0.00 0.00 0.56 0.00 0.00 36.38 35.53 1bwd s VAL 177 CO 0.42 0.10 0.00 2.22 -0.31 0.00 0.00 175.10 177.52 1bwd n PHE 178 N 2.39 0.00 -2.95 2.82 -1.74 -0.65 -1.53 117.46 115.80 1bwd n PHE 178 Ca -0.16 0.00 -0.34 0.00 -0.56 0.00 0.00 57.45 56.39 1bwd n PHE 178 Cb 0.56 0.00 -0.07 0.00 1.52 0.00 0.00 39.48 41.49 1bwd n PHE 178 CO 0.00 0.00 0.00 -0.51 -0.56 0.00 0.00 176.76 175.69 1bwd s ASP 179 N 0.00 6.98 0.34 5.98 1.11 -0.82 -3.49 116.67 126.77 1bwd s ASP 179 Ca 0.00 1.55 0.04 0.00 0.18 0.00 0.00 52.55 54.32 1bwd s ASP 179 Cb 0.00 -2.48 0.67 0.00 1.07 0.00 0.00 42.92 42.18 1bwd s ASP 179 CO 0.00 -0.20 1.95 0.00 1.18 0.00 0.00 175.17 178.09 1bwd h ALA 180 N 2.46 1.64 0.00 5.23 0.00 -0.40 -2.54 119.26 125.64 1bwd h ALA 180 Ca -0.48 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1bwd h ALA 180 Cb 1.18 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1bwd h ALA 180 CO 0.64 0.24 0.00 0.00 0.00 0.00 0.00 179.25 180.13 1bwd n ALA 181 N -2.43 1.56 0.84 0.00 0.00 -1.22 -0.18 120.51 119.08 1bwd n ALA 181 Ca 0.11 -0.01 0.09 0.00 0.00 0.00 0.00 53.44 53.64 1bwd n ALA 181 Cb 0.21 -1.02 -0.00 0.00 0.00 0.00 0.00 19.45 18.64 1bwd n ALA 181 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1bwd n ASN 182 N -0.74 1.82 -4.53 0.00 4.13 -0.96 -2.52 115.26 112.46 1bwd n ASN 182 Ca 0.01 -1.41 -0.32 0.00 1.68 0.00 0.00 54.58 54.54 1bwd n ASN 182 Cb 0.00 0.46 -0.12 0.00 -1.54 0.00 0.00 39.78 38.59 1bwd n ASN 182 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1bwd s VAL 183 N -2.14 3.30 0.01 2.41 1.01 0.74 -0.31 120.40 125.43 1bwd s VAL 183 Ca 0.16 -0.86 0.04 0.00 0.00 0.00 0.00 61.98 61.32 1bwd s VAL 183 Cb 0.15 -2.40 -0.01 0.00 0.00 0.00 0.00 36.38 34.12 1bwd s VAL 183 CO 0.47 0.43 -0.13 -0.22 0.00 0.00 0.00 175.10 175.65 1bwd s LEU 184 N -1.26 2.08 -0.24 3.92 2.96 -0.63 -4.95 118.68 120.56 1bwd s LEU 184 Ca 0.15 -0.31 0.02 0.00 -0.22 0.00 0.00 54.13 53.78 1bwd s LEU 184 Cb -0.11 -0.63 0.05 0.00 0.50 0.00 0.00 46.19 46.00 1bwd s LEU 184 CO 0.05 0.11 -0.13 0.00 -1.32 0.00 0.00 176.35 175.06 1bwd s ARG 185 N -0.59 2.39 -0.82 1.98 1.70 -1.26 -1.22 118.95 121.14 1bwd s ARG 185 Ca 0.04 -1.18 0.02 0.00 -0.47 0.00 0.00 55.73 54.13 1bwd s ARG 185 Cb -0.06 -2.78 0.29 0.00 -0.57 0.00 0.00 34.95 31.84 1bwd s ARG 185 CO 0.00 -0.47 1.17 1.19 -1.08 0.00 0.00 175.30 176.11 1bwd n PHE 186 N 4.50 3.16 -0.37 5.89 3.01 -0.79 -2.77 117.46 130.09 1bwd n PHE 186 Ca -0.16 -3.41 0.00 0.00 1.01 0.00 0.00 57.45 54.90 1bwd n PHE 186 Cb 0.44 -0.85 0.00 0.00 -0.01 0.00 0.00 39.48 39.06 1bwd n PHE 186 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1bwd n GLY 187 N 0.66 3.44 0.30 1.37 0.00 0.37 -2.22 105.19 109.12 1bwd n GLY 187 Ca 0.31 -0.11 0.09 0.00 0.00 0.00 0.00 46.02 46.32 1bwd n GLY 187 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1bwd h THR 188 N 0.00 0.25 -3.50 2.61 2.02 -1.72 -3.40 112.91 109.17 1bwd h THR 188 Ca 0.00 -0.04 -0.53 0.00 0.77 0.00 0.00 66.41 66.62 1bwd h THR 188 Cb 0.00 0.14 -0.02 0.00 -1.74 0.00 0.00 68.15 66.52 1bwd h THR 188 CO 0.00 0.02 0.36 -1.81 0.37 0.00 0.00 175.52 174.46 1bwd s ASP 189 N -5.12 7.44 -0.14 4.18 1.01 -0.94 -1.90 116.67 121.20 1bwd s ASP 189 Ca -0.13 1.73 0.01 0.00 0.71 0.00 0.00 52.55 54.87 1bwd s ASP 189 Cb 0.25 -2.58 0.02 0.00 1.01 0.00 0.00 42.92 41.62 1bwd s ASP 189 CO 0.76 -0.14 -0.15 -0.76 0.21 0.00 0.00 175.17 175.09 1bwd s LEU 190 N 0.40 1.74 -0.19 1.23 1.43 -0.40 -1.88 118.68 121.02 1bwd s LEU 190 Ca 0.49 -0.48 -0.17 0.00 -1.03 0.00 0.00 54.13 52.93 1bwd s LEU 190 Cb -0.22 -1.18 -0.04 0.00 0.03 0.00 0.00 46.19 44.78 1bwd s LEU 190 CO 0.29 -0.02 0.46 -0.22 0.23 0.00 0.00 176.35 177.09 1bwd s LEU 191 N 1.28 4.17 -0.23 1.79 2.96 -0.35 0.16 118.68 128.46 1bwd s LEU 191 Ca 0.01 0.64 0.02 0.00 -0.22 0.00 0.00 54.13 54.57 1bwd s LEU 191 Cb -0.14 -2.63 0.05 0.00 0.50 0.00 0.00 46.19 43.97 1bwd s LEU 191 CO -0.07 -0.11 -0.12 -0.47 -1.32 0.00 0.00 176.35 174.26 1bwd s TYR 192 N 1.33 2.85 -0.46 5.38 6.14 0.15 -1.60 117.35 131.14 1bwd s TYR 192 Ca 0.22 -1.94 -0.29 0.00 0.64 0.00 0.00 57.07 55.70 1bwd s TYR 192 Cb -0.15 -1.81 0.02 0.00 0.42 0.00 0.00 41.96 40.44 1bwd s TYR 192 CO 0.09 -0.82 1.23 -1.17 0.64 0.00 0.00 175.55 175.52 1bwd s LEU 193 N 1.25 3.62 -0.29 6.97 2.96 0.58 -0.76 118.68 133.00 1bwd s LEU 193 Ca -0.04 0.57 -0.28 0.00 -0.22 0.00 0.00 54.13 54.16 1bwd s LEU 193 Cb -0.18 -3.55 0.01 0.00 0.50 0.00 0.00 46.19 42.98 1bwd s LEU 193 CO -0.07 -1.32 1.03 0.54 -1.32 0.00 0.00 176.35 175.21 1bwd s VAL 194 N 4.77 4.60 0.00 1.68 0.11 0.03 -4.79 120.40 126.80 1bwd s VAL 194 Ca 0.52 1.75 0.00 0.00 -2.93 0.00 0.00 61.98 61.32 1bwd s VAL 194 Cb -0.09 -4.35 0.00 0.00 -1.53 0.00 0.00 36.38 30.41 1bwd s VAL 194 CO 0.32 -0.36 0.00 -1.54 -3.33 0.00 0.00 175.10 170.19 1bwd n SER 195 N 6.62 0.00 0.01 3.54 3.41 -0.62 -4.59 113.62 121.98 1bwd n SER 195 Ca 0.11 0.00 0.04 0.00 -0.26 0.00 0.00 58.87 58.76 1bwd n SER 195 Cb 0.47 0.00 0.18 0.00 -0.26 0.00 0.00 64.21 64.60 1bwd n SER 195 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1bwd n ASP 196 N 0.00 0.03 -2.44 4.04 8.00 -0.08 -2.93 116.55 123.16 1bwd n ASP 196 Ca 0.00 0.51 -0.18 0.00 0.71 0.00 0.00 54.79 55.83 1bwd n ASP 196 Cb 0.00 -0.51 0.02 0.00 -0.02 0.00 0.00 41.12 40.61 1bwd n ASP 196 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1bwd n SER 197 N -1.53 3.55 0.00 -2.24 3.41 -1.26 -4.58 113.62 110.97 1bwd n SER 197 Ca 0.02 -3.22 0.00 0.00 -0.26 0.00 0.00 58.87 55.41 1bwd n SER 197 Cb 0.09 -0.44 0.00 0.00 -0.26 0.00 0.00 64.21 63.60 1bwd n SER 197 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1bwd n GLY 198 N -0.49 1.89 4.02 5.00 0.00 -1.15 -1.94 105.19 112.52 1bwd n GLY 198 Ca 0.29 0.39 -0.22 0.00 0.00 0.00 0.00 46.02 46.48 1bwd n GLY 198 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bwd s ASN 199 N 0.00 4.67 0.20 1.61 4.22 -0.58 -1.59 114.94 123.47 1bwd s ASN 199 Ca 0.00 -0.67 -0.11 0.00 -2.14 0.00 0.00 52.86 49.94 1bwd s ASN 199 Cb 0.00 0.25 0.14 0.00 1.28 0.00 0.00 41.25 42.92 1bwd s ASN 199 CO 0.00 -1.65 1.86 -0.33 -2.04 0.00 0.00 177.10 174.93 1bwd h GLU 200 N -0.20 0.96 -0.43 3.55 4.39 -1.93 -1.81 114.58 119.10 1bwd h GLU 200 Ca -0.32 -0.07 -0.05 0.00 0.34 0.00 0.00 59.36 59.26 1bwd h GLU 200 Cb 1.28 -0.21 -0.02 0.00 -0.10 0.00 0.00 28.75 29.70 1bwd h GLU 200 CO 0.39 0.66 0.06 -0.07 -1.16 0.00 0.00 179.01 178.89 1bwd h LEU 201 N 0.97 0.62 -0.43 1.33 3.38 -1.91 0.25 115.31 119.52 1bwd h LEU 201 Ca 0.26 -0.11 0.04 0.00 0.09 0.00 0.00 57.88 58.15 1bwd h LEU 201 Cb -0.07 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.48 1bwd h LEU 201 CO -0.05 0.66 0.20 1.23 0.09 0.00 0.00 178.44 180.57 1bwd h GLY 202 N 0.89 0.58 1.80 0.83 0.00 -1.51 0.28 103.07 105.94 1bwd h GLY 202 Ca 0.14 -0.14 -0.17 0.00 0.00 0.00 0.00 47.33 47.16 1bwd h GLY 202 CO 0.00 0.09 -0.74 0.00 0.00 0.00 0.00 176.54 175.89 1bwd h ALA 203 N 1.24 0.69 0.25 3.60 0.00 -0.97 0.65 119.26 124.73 1bwd h ALA 203 Ca 0.19 -0.64 0.01 0.00 0.00 0.00 0.00 54.91 54.47 1bwd h ALA 203 Cb 0.11 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 1bwd h ALA 203 CO -0.14 0.83 -0.37 -0.22 0.00 0.00 0.00 179.25 179.35 1bwd h LYS 204 N 0.12 -0.66 -0.21 0.00 3.64 -0.03 -0.79 116.57 118.64 1bwd h LYS 204 Ca -0.02 0.04 0.03 0.00 -1.27 0.00 0.00 60.65 59.43 1bwd h LYS 204 Cb 1.31 0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 33.25 1bwd h LYS 204 CO 0.11 -0.44 0.01 2.35 -2.27 0.00 0.00 179.45 179.21 1bwd h TRP 205 N -0.68 0.01 -0.57 1.91 7.01 -0.18 -2.58 115.95 120.86 1bwd h TRP 205 Ca -0.00 0.02 0.11 0.00 2.11 0.00 0.00 58.89 61.13 1bwd h TRP 205 Cb 0.65 0.03 -0.09 0.00 -2.10 0.00 0.00 29.16 27.65 1bwd h TRP 205 CO -0.26 -0.02 0.06 1.25 -2.79 0.00 0.00 178.44 176.68 1bwd h LEU 206 N 0.08 -0.13 -0.53 0.65 5.85 0.74 -2.04 115.31 119.93 1bwd h LEU 206 Ca 0.10 0.12 0.08 0.00 0.84 0.00 0.00 57.88 59.03 1bwd h LEU 206 Cb 0.12 0.20 -0.07 0.00 0.37 0.00 0.00 40.66 41.28 1bwd h LEU 206 CO -0.16 -0.05 0.15 1.56 -0.34 0.00 0.00 178.44 179.61 1bwd h GLN 207 N 0.18 0.30 -0.57 1.25 1.08 -0.75 -2.54 115.11 114.06 1bwd h GLN 207 Ca 0.30 -0.02 -0.04 0.00 -1.45 0.00 0.00 58.65 57.44 1bwd h GLN 207 Cb 0.46 -0.07 -0.03 0.00 -0.05 0.00 0.00 27.48 27.79 1bwd h GLN 207 CO -0.44 0.20 0.21 1.03 -0.95 0.00 0.00 178.83 178.88 1bwd h SER 208 N 0.31 0.77 0.14 1.46 0.87 -1.23 -1.21 113.55 114.66 1bwd h SER 208 Ca 0.26 -0.11 -0.14 0.00 -1.23 0.00 0.00 61.79 60.58 1bwd h SER 208 Cb 0.33 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 62.08 1bwd h SER 208 CO -0.30 0.71 -0.50 0.00 -0.53 0.00 0.00 176.83 176.21 1bwd h ALA 209 N 1.40 0.86 0.00 6.23 0.00 -1.08 -3.27 119.26 123.41 1bwd h ALA 209 Ca 0.19 -0.48 -0.05 0.00 0.00 0.00 0.00 54.91 54.57 1bwd h ALA 209 Cb 0.20 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1bwd h ALA 209 CO -0.01 0.67 -1.70 1.33 0.00 0.00 0.00 179.25 179.53 1bwd n VAL 210 N -3.97 0.41 0.00 0.00 0.24 -0.99 -5.11 118.33 108.92 1bwd n VAL 210 Ca -0.02 -0.56 0.00 0.00 -2.04 0.00 0.00 64.34 61.71 1bwd n VAL 210 Cb 0.56 -0.20 0.00 0.00 -1.47 0.00 0.00 33.84 32.72 1bwd n VAL 210 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1bwd n GLY 211 N 1.29 -1.12 0.38 7.63 0.00 -0.46 -4.66 105.19 108.25 1bwd n GLY 211 Ca -0.06 -1.63 0.19 0.00 0.00 0.00 0.00 46.02 44.52 1bwd n GLY 211 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1bwd h ASP 212 N 0.00 0.00 -0.15 1.61 2.03 -1.94 -2.68 116.42 115.30 1bwd h ASP 212 Ca 0.00 0.00 0.01 0.00 -0.73 0.00 0.00 57.03 56.31 1bwd h ASP 212 Cb 0.00 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 38.48 1bwd h ASP 212 CO 0.00 0.00 0.05 0.74 -1.03 0.00 0.00 179.24 179.00 1bwd h THR 213 N 0.00 0.96 -3.38 1.15 2.02 -1.97 -3.43 112.91 108.26 1bwd h THR 213 Ca 0.15 -0.04 -0.49 0.00 0.77 0.00 0.00 66.41 66.80 1bwd h THR 213 Cb 1.05 0.83 0.02 0.00 -1.74 0.00 0.00 68.15 68.31 1bwd h THR 213 CO -0.00 0.02 0.02 -0.31 0.37 0.00 0.00 175.52 175.62 1bwd s TYR 214 N -6.18 3.53 -0.14 3.16 1.51 -1.01 -4.89 117.35 113.32 1bwd s TYR 214 Ca -0.13 0.73 -0.00 0.00 -1.01 0.00 0.00 57.07 56.65 1bwd s TYR 214 Cb 0.08 -2.21 0.03 0.00 -0.11 0.00 0.00 41.96 39.76 1bwd s TYR 214 CO 0.68 -0.11 -0.06 -0.08 -1.11 0.00 0.00 175.55 174.87 1bwd s THR 215 N -2.51 1.09 -0.10 -0.71 -1.32 -0.80 -4.88 115.64 106.42 1bwd s THR 215 Ca 0.46 -0.49 -0.26 0.00 -1.21 0.00 0.00 61.69 60.18 1bwd s THR 215 Cb -0.10 -1.19 -0.02 0.00 -1.51 0.00 0.00 72.50 69.67 1bwd s THR 215 CO 0.39 0.23 0.85 -0.69 -2.21 0.00 0.00 174.62 173.19 1bwd s VAL 216 N 1.66 4.91 -0.47 5.08 1.01 -1.26 -1.27 120.40 130.06 1bwd s VAL 216 Ca 0.02 1.73 -0.08 0.00 0.00 0.00 0.00 61.98 63.66 1bwd s VAL 216 Cb -0.14 -4.17 0.12 0.00 0.00 0.00 0.00 36.38 32.19 1bwd s VAL 216 CO -0.08 0.11 0.32 -1.00 0.00 0.00 0.00 175.10 174.46 1bwd s HIS 217 N 1.52 3.47 0.22 5.22 3.76 0.43 -4.95 115.29 124.97 1bwd s HIS 217 Ca 0.42 -2.04 -0.30 0.00 -0.15 0.00 0.00 55.06 53.00 1bwd s HIS 217 Cb -0.18 -3.43 -0.08 0.00 1.11 0.00 0.00 32.58 29.99 1bwd s HIS 217 CO 0.18 -0.99 1.03 -1.25 -0.85 0.00 0.00 174.74 172.86 1bwd s PRO 218 N 1.23 4.72 -0.11 8.40 0.04 -1.25 0.31 135.00 148.34 1bwd s PRO 218 Ca 0.07 1.63 0.01 0.00 0.04 0.00 0.00 61.00 62.75 1bwd s PRO 218 Cb -0.25 -3.26 0.02 0.00 0.04 0.00 0.00 34.50 31.05 1bwd s PRO 218 CO -0.02 0.30 -0.12 0.00 0.04 0.00 0.00 177.00 177.20 1bwd n ARG 220 N 4.51 1.70 -0.01 0.00 0.00 -1.26 -0.79 116.66 120.82 1bwd n ARG 220 Ca -0.17 -1.27 0.09 0.00 -0.00 0.00 0.00 57.85 56.50 1bwd n ARG 220 Cb 0.51 -1.05 -0.13 0.00 -0.00 0.00 0.00 32.46 31.79 1bwd n ARG 220 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80 1bwd n LYS 221 N -0.16 0.76 -0.97 2.89 3.00 -1.26 -4.93 118.16 117.50 1bwd n LYS 221 Ca 0.02 -0.11 -0.31 0.00 -0.00 0.00 0.00 58.31 57.91 1bwd n LYS 221 Cb 0.20 -1.40 0.13 0.00 0.00 0.00 0.00 35.03 33.97 1bwd n LYS 221 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 1bwd s LEU 222 N -3.76 2.94 -0.15 3.14 1.43 -1.26 -4.93 118.68 116.09 1bwd s LEU 222 Ca -0.02 2.02 0.17 0.00 -1.03 0.00 0.00 54.13 55.27 1bwd s LEU 222 Cb 0.12 -4.55 0.72 0.00 0.03 0.00 0.00 46.19 42.51 1bwd s LEU 222 CO 0.75 -2.60 1.63 -1.22 0.23 0.00 0.00 176.35 175.14 1bwd n TYR 223 N -3.88 1.56 -1.80 0.29 4.01 -1.26 -4.95 117.16 111.13 1bwd n TYR 223 Ca 0.11 -0.67 -0.42 0.00 -0.16 0.00 0.00 57.90 56.76 1bwd n TYR 223 Cb 0.52 -0.32 -0.03 0.00 -0.31 0.00 0.00 39.34 39.21 1bwd n TYR 223 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1bwd s ALA 224 N -2.18 3.84 -0.45 -0.72 0.00 -1.26 -4.88 121.76 116.11 1bwd s ALA 224 Ca 0.50 1.52 0.23 0.00 0.00 0.00 0.00 51.96 54.21 1bwd s ALA 224 Cb 0.35 -3.66 0.17 0.00 0.00 0.00 0.00 23.12 19.98 1bwd s ALA 224 CO 0.20 -0.89 1.18 0.77 0.00 0.00 0.00 175.76 177.02 1bwd h SER 225 N 6.24 0.00 0.00 0.00 0.02 -1.94 -3.44 113.55 114.43 1bwd h SER 225 Ca -0.44 -0.12 0.00 0.00 -0.84 0.00 0.00 61.79 60.39 1bwd h SER 225 Cb 1.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.75 1bwd h SER 225 CO 0.90 0.06 0.00 1.07 -1.14 0.00 0.00 176.83 177.72 1bwd n THR 226 N -2.39 0.00 -4.39 -2.27 5.66 -1.26 -0.90 114.28 108.74 1bwd n THR 226 Ca 0.02 0.00 -0.30 0.00 -3.05 0.00 0.00 64.05 60.72 1bwd n THR 226 Cb 0.49 -0.02 -0.11 0.00 -1.55 0.00 0.00 70.33 69.14 1bwd n THR 226 CO 0.00 0.00 0.00 -1.00 -3.05 0.00 0.00 175.07 171.02 1bwd s HIS 227 N -0.74 2.58 -0.68 1.09 3.76 -1.26 -4.17 115.29 115.87 1bwd s HIS 227 Ca 0.00 -0.24 0.25 0.00 -0.15 0.00 0.00 55.06 54.92 1bwd s HIS 227 Cb 0.00 -1.40 0.64 0.00 1.11 0.00 0.00 32.58 32.94 1bwd s HIS 227 CO 0.00 0.36 1.63 -0.24 -0.85 0.00 0.00 174.74 175.64 1bwd h VAL 228 N 3.61 0.00 -0.57 -0.90 3.04 -1.77 -3.38 116.25 116.27 1bwd h VAL 228 Ca -0.49 -0.53 0.18 0.00 -1.01 0.00 0.00 66.70 64.85 1bwd h VAL 228 Cb 1.16 1.41 -0.11 0.00 -2.01 0.00 0.00 31.29 31.74 1bwd h VAL 228 CO 0.47 0.00 0.08 0.47 -1.01 0.00 0.00 177.57 177.58 1bwd n ASP 229 N -2.29 -0.01 -0.64 3.17 8.00 -1.25 -1.57 116.55 121.96 1bwd n ASP 229 Ca 0.05 0.97 0.05 0.00 0.71 0.00 0.00 54.79 56.57 1bwd n ASP 229 Cb 0.44 -0.38 0.20 0.00 -0.02 0.00 0.00 41.12 41.36 1bwd n ASP 229 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1bwd n SER 230 N -4.62 2.05 0.00 -2.24 7.64 -1.26 -4.63 113.62 110.55 1bwd n SER 230 Ca 0.15 -3.72 0.00 0.00 1.01 0.00 0.00 58.87 56.32 1bwd n SER 230 Cb 0.51 -0.54 0.00 0.00 -1.01 0.00 0.00 64.21 63.17 1bwd n SER 230 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1bwd n THR 231 N -1.15 0.00 -4.04 0.44 -1.04 -0.61 -4.76 114.28 103.13 1bwd n THR 231 Ca 0.21 0.00 -0.31 0.00 -2.04 0.00 0.00 64.05 61.91 1bwd n THR 231 Cb 0.76 -1.14 -0.16 0.00 -1.82 0.00 0.00 70.33 67.97 1bwd n THR 231 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1bwd s ILE 232 N -1.97 1.84 -0.51 12.58 1.09 -0.96 -1.31 121.20 131.96 1bwd s ILE 232 Ca 0.00 -1.14 0.02 0.00 -1.10 0.00 0.00 60.65 58.43 1bwd s ILE 232 Cb 0.00 -1.87 0.13 0.00 -1.06 0.00 0.00 42.46 39.66 1bwd s ILE 232 CO 0.00 0.19 0.26 -0.69 -0.10 0.00 0.00 174.94 174.60 1bwd s VAL 233 N 1.31 2.78 0.48 2.92 1.01 0.31 -4.74 120.40 124.47 1bwd s VAL 233 Ca -0.02 -3.06 -0.24 0.00 0.00 0.00 0.00 61.98 58.66 1bwd s VAL 233 Cb -0.16 -2.92 -0.08 0.00 0.00 0.00 0.00 36.38 33.22 1bwd s VAL 233 CO -0.08 -0.78 1.31 -0.81 0.00 0.00 0.00 175.10 174.73 1bwd n PRO 234 N 3.40 1.84 0.00 2.72 -0.04 -1.26 -1.66 135.00 140.00 1bwd n PRO 234 Ca 0.05 0.66 0.00 0.00 -0.04 0.00 0.00 63.50 64.17 1bwd n PRO 234 Cb 0.35 -2.48 0.00 0.00 -0.04 0.00 0.00 33.50 31.33 1bwd n PRO 234 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1bwd n LEU 235 N -0.33 0.27 -3.56 1.53 4.77 -0.59 -4.89 117.00 114.20 1bwd n LEU 235 Ca 0.08 0.00 -0.06 0.00 -0.03 0.00 0.00 56.01 56.00 1bwd n LEU 235 Cb 0.42 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.49 1bwd n LEU 235 CO 0.57 0.04 0.89 0.00 -1.33 0.00 0.00 177.39 177.56 1bwd s ARG 236 N -1.95 0.49 -0.06 3.23 1.70 -1.23 -4.60 118.95 116.52 1bwd s ARG 236 Ca 0.00 -0.18 -0.34 0.00 -0.47 0.00 0.00 55.73 54.74 1bwd s ARG 236 Cb 0.00 0.23 -0.12 0.00 -0.57 0.00 0.00 34.95 34.49 1bwd s ARG 236 CO 0.00 -0.21 1.84 -0.35 -1.08 0.00 0.00 175.30 175.50 1bwd n PRO 237 N -0.14 2.16 -0.30 3.89 -0.04 -1.26 -1.66 135.00 137.65 1bwd n PRO 237 Ca -0.03 0.79 0.00 0.00 -0.04 0.00 0.00 63.50 64.22 1bwd n PRO 237 Cb 0.59 -2.63 0.00 0.00 -0.04 0.00 0.00 33.50 31.43 1bwd n PRO 237 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1bwd n GLY 238 N 4.29 0.70 2.73 0.55 0.00 -1.26 -5.05 105.19 107.14 1bwd n GLY 238 Ca 0.22 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.04 1bwd n GLY 238 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1bwd s LEU 239 N 0.00 0.08 -0.01 0.99 2.96 -0.67 -1.11 118.68 120.93 1bwd s LEU 239 Ca 0.00 -0.03 0.04 0.00 -0.22 0.00 0.00 54.13 53.92 1bwd s LEU 239 Cb 0.00 0.05 -0.01 0.00 0.50 0.00 0.00 46.19 46.73 1bwd s LEU 239 CO 0.00 -0.28 -0.14 0.54 -1.32 0.00 0.00 176.35 175.15 1bwd s VAL 240 N 2.23 1.11 -0.20 1.68 0.11 -0.65 -1.55 120.40 123.13 1bwd s VAL 240 Ca 0.04 -0.62 -0.18 0.00 -2.93 0.00 0.00 61.98 58.29 1bwd s VAL 240 Cb -0.13 -0.93 -0.03 0.00 -1.53 0.00 0.00 36.38 33.75 1bwd s VAL 240 CO -0.07 0.29 0.49 -0.22 -3.33 0.00 0.00 175.10 172.27 1bwd s LEU 241 N -0.38 4.15 0.26 2.54 2.96 -0.67 -0.84 118.68 126.71 1bwd s LEU 241 Ca 0.05 0.65 0.11 0.00 -0.22 0.00 0.00 54.13 54.72 1bwd s LEU 241 Cb -0.06 -2.67 -0.05 0.00 0.50 0.00 0.00 46.19 43.92 1bwd s LEU 241 CO -0.00 -0.15 -0.16 0.42 -1.32 0.00 0.00 176.35 175.14 1bwd s THR 242 N 1.52 2.70 -0.42 3.68 -4.23 -0.76 -0.53 115.64 117.60 1bwd s THR 242 Ca 0.23 -2.20 -0.20 0.00 -1.18 0.00 0.00 61.69 58.34 1bwd s THR 242 Cb -0.15 -2.40 0.02 0.00 1.34 0.00 0.00 72.50 71.31 1bwd s THR 242 CO 0.09 -0.33 0.58 0.21 -0.54 0.00 0.00 174.62 174.63 1bwd s ASN 243 N -3.37 6.30 0.64 3.99 3.04 -0.43 -2.40 114.94 122.72 1bwd s ASN 243 Ca 0.29 -0.33 0.42 0.00 0.04 0.00 0.00 52.86 53.28 1bwd s ASN 243 Cb -0.06 -2.29 2.22 0.00 -1.54 0.00 0.00 41.25 39.58 1bwd s ASN 243 CO 0.15 -0.68 2.30 1.55 -3.04 0.00 0.00 177.10 177.38 1bwd h PRO 244 N 8.76 0.00 0.00 0.43 0.13 -1.85 0.16 132.00 139.62 1bwd h PRO 244 Ca -0.26 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.84 1bwd h PRO 244 Cb 1.10 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.23 1bwd h PRO 244 CO 0.85 0.00 -0.45 0.66 -0.23 0.00 0.00 178.00 178.84 1bwd h SER 245 N 0.00 0.00 0.00 1.44 4.64 -1.96 -3.41 113.55 114.25 1bwd h SER 245 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1bwd h SER 245 Cb 0.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.19 1bwd h SER 245 CO 0.00 0.14 -0.57 0.54 -0.87 0.00 0.00 176.83 176.07 1bwd n ARG 246 N -3.00 0.30 -3.60 4.77 1.74 -0.20 -4.98 116.66 111.69 1bwd n ARG 246 Ca 0.02 0.12 -0.33 0.00 -0.77 0.00 0.00 57.85 56.89 1bwd n ARG 246 Cb 0.60 -1.00 -0.05 0.00 -1.02 0.00 0.00 32.46 30.99 1bwd n ARG 246 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1bwd s VAL 247 N -2.31 5.11 0.00 1.55 -7.23 0.39 -4.32 120.40 113.59 1bwd s VAL 247 Ca -0.16 0.25 0.00 0.00 -1.81 0.00 0.00 61.98 60.26 1bwd s VAL 247 Cb 0.02 -3.63 0.00 0.00 0.56 0.00 0.00 36.38 33.33 1bwd s VAL 247 CO 0.24 0.12 0.00 -0.46 -0.31 0.00 0.00 175.10 174.69 1bwd n ASN 248 N 0.37 0.00 0.09 4.85 0.23 -1.26 -4.42 115.26 115.12 1bwd n ASN 248 Ca -0.04 0.00 0.01 0.00 -0.53 0.00 0.00 54.58 54.02 1bwd n ASN 248 Cb 0.52 0.00 -0.03 0.00 -2.08 0.00 0.00 39.78 38.19 1bwd n ASN 248 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 1bwd h ASP 249 N 0.00 0.00 -0.11 0.53 5.19 -1.98 -2.80 116.42 117.26 1bwd h ASP 249 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1bwd h ASP 249 Cb 0.00 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.51 1bwd h ASP 249 CO 0.00 0.55 0.00 1.21 -3.12 0.00 0.00 179.24 177.88 1bwd n GLU 250 N -3.09 1.87 -0.06 3.56 2.13 -1.26 -4.31 120.64 119.48 1bwd n GLU 250 Ca -0.03 -1.29 -0.06 0.00 0.66 0.00 0.00 57.16 56.44 1bwd n GLU 250 Cb 0.79 -1.45 -0.02 0.00 0.27 0.00 0.00 31.44 31.02 1bwd n GLU 250 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1bwd n ASN 251 N 0.54 1.33 -1.84 4.31 5.03 -1.22 -5.05 115.26 118.37 1bwd n ASN 251 Ca 0.17 0.24 -0.25 0.00 0.87 0.00 0.00 54.58 55.62 1bwd n ASN 251 Cb 0.41 -0.67 -0.03 0.00 -1.02 0.00 0.00 39.78 38.46 1bwd n ASN 251 CO 0.00 0.00 0.00 0.80 -1.83 0.00 0.00 177.26 176.23 1bwd n MET 252 N -3.85 0.00 -1.26 3.52 1.56 -1.06 -4.86 117.12 111.17 1bwd n MET 252 Ca -0.09 0.00 -0.36 0.00 -0.27 0.00 0.00 57.70 56.98 1bwd n MET 252 Cb 0.35 -0.60 0.08 0.00 2.15 0.00 0.00 33.22 35.19 1bwd n MET 252 CO 0.00 0.00 0.00 -2.30 -0.73 0.00 0.00 175.97 172.94 1bwd n PRO 253 N 0.92 0.32 -0.08 2.12 -0.02 -1.26 -4.85 135.00 132.16 1bwd n PRO 253 Ca 0.09 0.15 -0.13 0.00 -2.02 0.00 0.00 63.50 61.60 1bwd n PRO 253 Cb 0.01 -1.92 -0.05 0.00 -0.02 0.00 0.00 33.50 31.51 1bwd n PRO 253 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1bwd h ASP 254 N -0.39 0.59 0.21 2.55 5.19 -2.01 -2.96 116.42 119.60 1bwd h ASP 254 Ca -0.46 -0.48 0.00 0.00 -0.62 0.00 0.00 57.03 55.48 1bwd h ASP 254 Cb 1.34 -0.17 0.00 0.00 0.18 0.00 0.00 39.33 40.69 1bwd h ASP 254 CO 0.43 0.95 0.00 2.22 -3.12 0.00 0.00 179.24 179.72 1bwd n PHE 255 N -4.39 0.00 0.33 4.55 -1.74 -1.26 -1.98 117.46 112.98 1bwd n PHE 255 Ca -0.05 0.00 0.10 0.00 -0.56 0.00 0.00 57.45 56.94 1bwd n PHE 255 Cb 0.43 -0.18 -0.14 0.00 1.52 0.00 0.00 39.48 41.11 1bwd n PHE 255 CO 0.00 0.00 0.00 1.28 -0.56 0.00 0.00 176.76 177.48 1bwd n LEU 256 N -1.18 0.34 0.25 5.98 4.32 -1.15 -4.58 117.00 120.97 1bwd n LEU 256 Ca 0.10 -0.19 0.13 0.00 -0.02 0.00 0.00 56.01 56.04 1bwd n LEU 256 Cb 0.11 0.00 0.70 0.00 -1.62 0.00 0.00 43.42 42.62 1bwd n LEU 256 CO 0.12 0.09 0.98 0.03 -1.22 0.00 0.00 177.39 177.39 1bwd h ARG 257 N 0.00 0.00 0.04 3.23 3.08 -1.24 -1.45 114.38 118.04 1bwd h ARG 257 Ca 0.00 0.00 -0.32 0.00 0.07 0.00 0.00 59.98 59.73 1bwd h ARG 257 Cb 0.73 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.73 1bwd h ARG 257 CO 0.00 0.00 -1.87 0.45 -1.07 0.00 0.00 179.97 177.48 1bwd n SER 258 N -2.54 1.19 -4.74 7.04 2.88 -1.26 -4.92 113.62 111.27 1bwd n SER 258 Ca -0.02 0.31 -0.39 0.00 -1.33 0.00 0.00 58.87 57.44 1bwd n SER 258 Cb 0.24 -0.21 0.03 0.00 -0.75 0.00 0.00 64.21 63.52 1bwd n SER 258 CO 0.00 0.00 0.00 0.79 -1.23 0.00 0.00 175.04 174.60 1bwd n TRP 259 N -3.15 2.39 -2.44 0.66 7.02 -0.55 -4.90 117.44 116.47 1bwd n TRP 259 Ca -0.23 0.44 -0.41 0.00 -1.02 0.00 0.00 57.50 56.27 1bwd n TRP 259 Cb 1.06 -2.39 -0.04 0.00 -2.42 0.00 0.00 31.31 27.52 1bwd n TRP 259 CO 0.00 0.00 0.00 -2.00 -2.02 0.00 0.00 177.69 173.67 1bwd s GLU 260 N -2.68 4.52 -0.18 -0.99 2.12 -0.26 -4.90 118.70 116.33 1bwd s GLU 260 Ca 0.67 1.79 -0.04 0.00 0.36 0.00 0.00 54.97 57.76 1bwd s GLU 260 Cb -0.43 -3.28 -0.02 0.00 0.26 0.00 0.00 34.13 30.66 1bwd s GLU 260 CO 0.53 -0.05 -0.04 1.21 -0.54 0.00 0.00 175.26 176.36 1bwd s ASN 261 N 0.21 4.60 -0.18 -1.70 3.84 -1.26 -1.64 114.94 118.81 1bwd s ASN 261 Ca 0.52 -0.23 -0.04 0.00 0.21 0.00 0.00 52.86 53.33 1bwd s ASN 261 Cb -0.31 -1.76 -0.02 0.00 -0.55 0.00 0.00 41.25 38.61 1bwd s ASN 261 CO 0.34 0.10 -0.02 0.27 -2.79 0.00 0.00 177.10 175.01 1bwd s ILE 262 N 0.74 3.84 0.12 -5.21 -4.36 -0.02 -4.98 121.20 111.34 1bwd s ILE 262 Ca -0.02 -0.36 -0.30 0.00 -0.26 0.00 0.00 60.65 59.71 1bwd s ILE 262 Cb -0.15 -2.71 -0.06 0.00 1.25 0.00 0.00 42.46 40.79 1bwd s ILE 262 CO 0.02 0.46 1.09 -0.89 0.24 0.00 0.00 174.94 175.85 1bwd s THR 263 N 0.77 4.11 0.26 8.37 2.01 -1.26 -1.83 115.64 128.07 1bwd s THR 263 Ca -0.01 1.70 -0.30 0.00 0.31 0.00 0.00 61.69 63.40 1bwd s THR 263 Cb -0.14 -4.09 -0.09 0.00 0.01 0.00 0.00 72.50 68.19 1bwd s THR 263 CO 0.02 0.23 1.28 0.00 -0.69 0.00 0.00 174.62 175.46 1bwd s PRO 265 N -0.93 0.58 0.11 0.00 0.04 -1.26 -4.74 135.00 128.80 1bwd s PRO 265 Ca 0.52 0.68 -0.30 0.00 0.04 0.00 0.00 61.00 61.94 1bwd s PRO 265 Cb -0.37 -1.74 -0.06 0.00 0.04 0.00 0.00 34.50 32.37 1bwd s PRO 265 CO 0.44 -2.67 1.00 -1.83 0.04 0.00 0.00 177.00 173.98 1bwd s GLU 266 N -4.89 4.66 0.87 4.56 -1.05 -1.26 -4.96 118.70 116.62 1bwd s GLU 266 Ca 0.65 1.51 -0.13 0.00 -0.15 0.00 0.00 54.97 56.85 1bwd s GLU 266 Cb -0.19 -3.36 0.12 0.00 -0.44 0.00 0.00 34.13 30.25 1bwd s GLU 266 CO 0.58 0.15 1.19 -0.51 0.95 0.00 0.00 175.26 177.63 1bwd s LEU 267 N 0.05 2.39 0.18 1.83 1.02 -1.26 -4.93 118.68 117.96 1bwd s LEU 267 Ca 0.48 0.73 -0.25 0.00 0.02 0.00 0.00 54.13 55.11 1bwd s LEU 267 Cb -0.24 -3.09 -0.08 0.00 0.02 0.00 0.00 46.19 42.79 1bwd s LEU 267 CO 0.31 -2.23 0.79 -0.69 0.02 0.00 0.00 176.35 174.54 1bwd s VAL 268 N -3.55 4.35 -0.93 -1.59 1.01 -1.26 -5.01 120.40 113.42 1bwd s VAL 268 Ca 0.65 1.71 -0.22 0.00 0.00 0.00 0.00 61.98 64.12 1bwd s VAL 268 Cb -0.11 -4.13 0.08 0.00 0.00 0.00 0.00 36.38 32.22 1bwd s VAL 268 CO 0.51 0.50 1.26 -0.62 0.00 0.00 0.00 175.10 176.74 1bwd s ASP 269 N -1.19 6.49 0.81 3.32 -1.08 -1.26 -4.95 116.67 118.81 1bwd s ASP 269 Ca 0.37 -1.56 -0.13 0.00 -0.52 0.00 0.00 52.55 50.70 1bwd s ASP 269 Cb -0.23 -2.49 0.08 0.00 -1.46 0.00 0.00 42.92 38.83 1bwd s ASP 269 CO 0.26 -1.35 1.21 0.27 0.52 0.00 0.00 175.17 176.08 1bwd s ILE 270 N 4.03 2.04 0.00 4.11 -4.36 -1.26 -4.97 121.20 120.79 1bwd s ILE 270 Ca 0.37 0.02 -0.00 0.00 -0.26 0.00 0.00 60.65 60.78 1bwd s ILE 270 Cb -0.04 -2.42 0.00 0.00 1.25 0.00 0.00 42.46 41.25 1bwd s ILE 270 CO -0.06 -0.01 0.00 0.61 0.24 0.00 0.00 174.94 175.72 1bwd n GLY 271 N 0.49 -1.82 3.05 6.27 0.00 -1.26 -4.95 105.19 106.96 1bwd n GLY 271 Ca 0.13 -1.55 -0.12 0.00 0.00 0.00 0.00 46.02 44.48 1bwd n GLY 271 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1bwd s PHE 272 N -1.01 -0.07 -0.32 1.61 -0.12 -1.26 -4.42 117.98 112.38 1bwd s PHE 272 Ca 0.00 0.17 -0.07 0.00 -0.05 0.00 0.00 56.93 56.98 1bwd s PHE 272 Cb -0.00 0.01 0.02 0.00 -0.63 0.00 0.00 43.02 42.42 1bwd s PHE 272 CO 0.00 -0.15 0.11 0.99 -0.05 0.00 0.00 175.22 176.12 1bwd s THR 273 N -0.47 3.98 0.00 -4.49 2.01 -1.26 -4.96 115.64 110.44 1bwd s THR 273 Ca -0.06 -0.88 0.00 0.00 0.31 0.00 0.00 61.69 61.06 1bwd s THR 273 Cb -0.04 -3.15 0.00 0.00 0.01 0.00 0.00 72.50 69.33 1bwd s THR 273 CO 0.01 -0.06 0.00 0.61 -0.69 0.00 0.00 174.62 174.49 1bwd n GLY 274 N 4.86 -0.49 0.52 4.40 0.00 -1.26 -4.91 105.19 108.32 1bwd n GLY 274 Ca -0.13 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1bwd n GLY 274 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1bwd n ASP 275 N 0.00 0.46 -3.79 1.61 -0.08 -1.26 -5.05 116.55 108.44 1bwd n ASP 275 Ca 0.00 0.00 -0.13 0.00 -1.51 0.00 0.00 54.79 53.15 1bwd n ASP 275 Cb 0.00 0.00 -0.14 0.00 2.34 0.00 0.00 41.12 43.32 1bwd n ASP 275 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 1bwd s LYS 276 N -1.40 0.07 0.63 -0.67 3.01 -1.26 -5.15 119.74 114.97 1bwd s LYS 276 Ca 0.00 0.25 -0.18 0.00 -1.01 0.00 0.00 55.97 55.03 1bwd s LYS 276 Cb 0.00 -0.11 -0.02 0.00 -1.01 0.00 0.00 37.83 36.69 1bwd s LYS 276 CO 0.00 -0.11 1.19 -1.25 0.51 0.00 0.00 175.35 175.69 1bwd s PRO 277 N 0.75 2.78 0.04 -1.68 0.04 -1.26 -4.97 135.00 130.70 1bwd s PRO 277 Ca -0.06 1.76 0.18 0.00 0.04 0.00 0.00 61.00 62.92 1bwd s PRO 277 Cb -0.08 -1.91 -0.15 0.00 0.04 0.00 0.00 34.50 32.39 1bwd s PRO 277 CO -0.03 -1.34 0.73 1.58 0.04 0.00 0.00 177.00 177.98 1bwd n HIS 278 N -1.93 0.77 -4.17 0.56 -0.00 -0.61 -4.93 115.22 104.91 1bwd n HIS 278 Ca 0.13 0.25 -0.17 0.00 0.46 0.00 0.00 57.72 58.39 1bwd n HIS 278 Cb 0.50 -1.00 -0.12 0.00 -0.12 0.00 0.00 29.99 29.25 1bwd n HIS 278 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1bwd s SER 280 N -1.62 3.66 0.66 0.00 1.04 -1.26 -4.84 113.70 111.33 1bwd s SER 280 Ca -0.03 2.10 0.39 0.00 0.48 0.00 0.00 55.95 58.89 1bwd s SER 280 Cb -0.10 -2.56 2.15 0.00 0.10 0.00 0.00 66.02 65.62 1bwd s SER 280 CO 0.02 -2.61 2.24 -0.37 0.98 0.00 0.00 173.24 173.50 1bwd h VAL 281 N -1.34 0.08 0.00 5.02 -1.51 -1.97 -2.22 116.25 114.31 1bwd h VAL 281 Ca -0.44 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.03 1bwd h VAL 281 Cb 1.26 0.91 0.00 0.00 -2.13 0.00 0.00 31.29 31.33 1bwd h VAL 281 CO 0.46 0.00 0.00 0.79 -1.23 0.00 0.00 177.57 177.59 1bwd n TRP 282 N -3.16 0.00 0.43 5.19 7.02 -1.26 -1.89 117.44 123.76 1bwd n TRP 282 Ca -0.02 0.00 0.13 0.00 -1.02 0.00 0.00 57.50 56.59 1bwd n TRP 282 Cb 0.16 0.00 0.44 0.00 -2.42 0.00 0.00 31.31 29.49 1bwd n TRP 282 CO 0.00 0.00 0.00 -0.84 -2.02 0.00 0.00 177.69 174.83 1bwd h ILE 283 N 0.00 0.00 -1.03 -0.99 -2.65 -1.75 -2.19 117.51 108.90 1bwd h ILE 283 Ca 0.00 -0.49 0.27 0.00 1.03 0.00 0.00 64.86 65.68 1bwd h ILE 283 Cb 0.00 1.40 -0.07 0.00 -2.05 0.00 0.00 36.82 36.10 1bwd h ILE 283 CO 0.00 0.00 0.69 1.23 0.03 0.00 0.00 178.15 180.10 1bwd h GLY 284 N 3.29 0.72 1.95 0.16 0.00 -1.65 0.75 103.07 108.28 1bwd h GLY 284 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.20 1bwd h GLY 284 CO 0.00 -0.07 -0.01 1.03 0.00 0.00 0.00 176.54 177.49 1bwd n MET 285 N -4.46 0.02 -0.56 4.80 2.81 -0.82 -4.56 117.12 114.35 1bwd n MET 285 Ca 0.23 -0.00 -0.14 0.00 -1.81 0.00 0.00 57.70 55.98 1bwd n MET 285 Cb 0.94 -1.50 -0.03 0.00 -0.71 0.00 0.00 33.22 31.91 1bwd n MET 285 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 1bwd n ASN 286 N -1.49 3.51 -4.89 7.83 4.05 0.26 -4.85 115.26 119.68 1bwd n ASN 286 Ca 0.07 -2.16 -0.29 0.00 0.45 0.00 0.00 54.58 52.65 1bwd n ASN 286 Cb 0.33 -0.88 0.02 0.00 1.23 0.00 0.00 39.78 40.48 1bwd n ASN 286 CO 0.00 0.00 0.00 -1.48 -3.05 0.00 0.00 177.26 172.73 1bwd s LEU 287 N 0.05 3.29 -0.20 1.20 0.05 -1.26 -0.85 118.68 120.96 1bwd s LEU 287 Ca 0.32 1.12 0.01 0.00 0.05 0.00 0.00 54.13 55.63 1bwd s LEU 287 Cb 0.10 -4.07 0.04 0.00 -2.05 0.00 0.00 46.19 40.21 1bwd s LEU 287 CO -0.02 -0.89 -0.10 -0.22 -0.55 0.00 0.00 176.35 174.57 1bwd s LEU 288 N -5.05 2.30 -0.21 1.48 2.96 -1.08 -3.93 118.68 115.14 1bwd s LEU 288 Ca 0.53 -0.90 -0.28 0.00 -0.22 0.00 0.00 54.13 53.26 1bwd s LEU 288 Cb -0.11 -1.23 0.00 0.00 0.50 0.00 0.00 46.19 45.36 1bwd s LEU 288 CO 0.50 -0.15 0.99 -0.69 -1.32 0.00 0.00 176.35 175.68 1bwd s VAL 289 N 1.40 4.73 -0.05 1.68 1.01 -1.26 -0.05 120.40 127.85 1bwd s VAL 289 Ca -0.02 1.94 -0.04 0.00 0.00 0.00 0.00 61.98 63.87 1bwd s VAL 289 Cb -0.16 -4.27 -0.28 0.00 0.00 0.00 0.00 36.38 31.67 1bwd s VAL 289 CO -0.08 -0.13 0.66 0.58 0.00 0.00 0.00 175.10 176.13 1bwd h VAL 290 N 5.39 0.92 -3.31 2.92 2.07 -0.46 -3.43 116.25 120.34 1bwd h VAL 290 Ca -0.22 -2.59 -0.02 0.00 0.82 0.00 0.00 66.70 64.69 1bwd h VAL 290 Cb 1.08 2.66 -0.10 0.00 -1.52 0.00 0.00 31.29 33.40 1bwd h VAL 290 CO 0.94 0.81 0.03 0.00 0.02 0.00 0.00 177.57 179.37 1bwd s ARG 291 N -2.59 1.38 0.66 1.57 1.70 -0.91 -0.14 118.95 120.62 1bwd s ARG 291 Ca -0.14 -0.87 0.18 0.00 -0.47 0.00 0.00 55.73 54.43 1bwd s ARG 291 Cb 0.06 0.52 0.97 0.00 -0.57 0.00 0.00 34.95 35.94 1bwd s ARG 291 CO 0.83 -0.59 1.54 -1.35 -1.08 0.00 0.00 175.30 174.66 1bwd h PRO 292 N 2.20 0.00 0.00 3.89 0.11 -1.73 -0.27 132.00 136.20 1bwd h PRO 292 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1bwd h PRO 292 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1bwd h PRO 292 CO 0.37 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.76 1bwd n ASP 293 N -2.75 1.44 -3.88 -2.05 5.75 -1.26 -4.72 116.55 109.07 1bwd n ASP 293 Ca -0.01 -1.46 -0.22 0.00 -0.01 0.00 0.00 54.79 53.09 1bwd n ASP 293 Cb 0.65 0.00 -0.17 0.00 -1.03 0.00 0.00 41.12 40.57 1bwd n ASP 293 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 1bwd s LEU 294 N -0.46 1.16 0.02 -2.12 2.96 -0.11 0.12 118.68 120.24 1bwd s LEU 294 Ca 0.00 -0.17 0.01 0.00 -0.22 0.00 0.00 54.13 53.75 1bwd s LEU 294 Cb 0.00 -0.56 -0.02 0.00 0.50 0.00 0.00 46.19 46.11 1bwd s LEU 294 CO 0.00 -0.09 -0.05 0.00 -1.32 0.00 0.00 176.35 174.89 1bwd s ALA 295 N 1.29 0.33 -0.22 5.97 0.00 -0.71 0.27 121.76 128.68 1bwd s ALA 295 Ca -0.05 -0.50 -0.09 0.00 0.00 0.00 0.00 51.96 51.33 1bwd s ALA 295 Cb -0.14 0.04 -0.04 0.00 0.00 0.00 0.00 23.12 22.98 1bwd s ALA 295 CO -0.02 -0.03 0.10 0.54 0.00 0.00 0.00 175.76 176.35 1bwd s VAL 296 N -0.97 4.87 0.03 0.00 0.11 0.92 -2.07 120.40 123.30 1bwd s VAL 296 Ca -0.08 0.01 0.07 0.00 -2.93 0.00 0.00 61.98 59.05 1bwd s VAL 296 Cb -0.07 -3.25 -0.02 0.00 -1.53 0.00 0.00 36.38 31.51 1bwd s VAL 296 CO -0.00 0.38 -0.21 -0.69 -3.33 0.00 0.00 175.10 171.24 1bwd s VAL 297 N 1.00 1.71 0.22 2.04 1.01 -1.20 -2.64 120.40 122.53 1bwd s VAL 297 Ca 0.05 -1.16 -0.31 0.00 0.00 0.00 0.00 61.98 60.55 1bwd s VAL 297 Cb -0.14 -1.47 -0.11 0.00 0.00 0.00 0.00 36.38 34.66 1bwd s VAL 297 CO 0.03 0.26 1.65 -0.62 0.00 0.00 0.00 175.10 176.43 1bwd s ASP 298 N -1.07 6.43 0.00 3.32 -1.08 -1.26 -2.69 116.67 120.33 1bwd s ASP 298 Ca 0.08 2.83 0.06 0.00 -0.52 0.00 0.00 52.55 54.99 1bwd s ASP 298 Cb -0.09 -2.61 0.35 0.00 -1.46 0.00 0.00 42.92 39.11 1bwd s ASP 298 CO 0.01 -0.92 0.74 -2.11 0.52 0.00 0.00 175.17 173.41 1bwd n ARG 299 N 3.51 0.30 -0.00 4.34 1.85 0.32 -1.40 116.66 125.59 1bwd n ARG 299 Ca 0.13 0.00 0.10 0.00 -1.00 0.00 0.00 57.85 57.08 1bwd n ARG 299 Cb 0.37 -1.30 -0.12 0.00 -1.05 0.00 0.00 32.46 30.35 1bwd n ARG 299 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 1bwd n ARG 300 N -0.80 0.17 -1.96 2.89 1.74 -1.26 -4.51 116.66 112.93 1bwd n ARG 300 Ca 0.04 -0.03 -0.41 0.00 -0.77 0.00 0.00 57.85 56.69 1bwd n ARG 300 Cb 0.02 -1.49 -0.01 0.00 -1.02 0.00 0.00 32.46 29.96 1bwd n ARG 300 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1bwd n GLN 301 N -1.59 4.15 -0.14 5.56 1.13 -0.49 -4.73 117.38 121.27 1bwd n GLN 301 Ca 0.03 -3.25 -0.02 0.00 -1.94 0.00 0.00 57.00 51.82 1bwd n GLN 301 Cb 0.36 -2.76 0.20 0.00 0.11 0.00 0.00 30.24 28.15 1bwd n GLN 301 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1bwd h THR 302 N 3.00 1.22 0.25 5.09 1.03 -1.83 0.27 112.91 121.94 1bwd h THR 302 Ca 0.65 -0.76 0.00 0.00 -0.01 0.00 0.00 66.41 66.29 1bwd h THR 302 Cb 0.39 0.61 -0.02 0.00 -1.07 0.00 0.00 68.15 68.07 1bwd h THR 302 CO 1.58 0.29 -0.25 0.00 -0.01 0.00 0.00 175.52 177.13 1bwd h ALA 303 N 1.37 -0.51 -0.70 0.00 0.00 -1.93 -1.71 119.26 115.78 1bwd h ALA 303 Ca 0.18 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 55.04 1bwd h ALA 303 Cb 0.25 0.35 -0.04 0.00 0.00 0.00 0.00 17.79 18.35 1bwd h ALA 303 CO -0.01 -0.82 0.44 1.25 0.00 0.00 0.00 179.25 180.11 1bwd h LEU 304 N -0.53 0.72 -0.20 0.00 5.85 -1.79 -1.68 115.31 117.68 1bwd h LEU 304 Ca -0.01 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 1bwd h LEU 304 Cb 0.49 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.35 1bwd h LEU 304 CO -0.05 0.50 0.09 0.40 -0.34 0.00 0.00 178.44 179.04 1bwd h ILE 305 N 0.86 1.15 -0.03 4.05 2.04 -0.38 -1.83 117.51 123.37 1bwd h ILE 305 Ca 0.28 -0.45 0.01 0.00 1.00 0.00 0.00 64.86 65.69 1bwd h ILE 305 Cb 0.01 1.08 -0.02 0.00 -0.74 0.00 0.00 36.82 37.15 1bwd h ILE 305 CO -0.10 0.15 -0.19 0.03 0.00 0.00 0.00 178.15 178.04 1bwd h ARG 306 N 0.18 -0.20 -0.75 2.37 3.08 -1.01 -0.79 114.38 117.26 1bwd h ARG 306 Ca 0.07 0.01 0.13 0.00 0.07 0.00 0.00 59.98 60.26 1bwd h ARG 306 Cb 0.15 0.05 -0.13 0.00 0.08 0.00 0.00 29.97 30.12 1bwd h ARG 306 CO -0.01 -0.13 -0.34 1.25 -1.07 0.00 0.00 179.97 179.67 1bwd h LEU 307 N -0.21 -1.21 -0.63 3.04 5.85 -1.30 0.18 115.31 121.04 1bwd h LEU 307 Ca 0.01 0.26 0.10 0.00 0.84 0.00 0.00 57.88 59.09 1bwd h LEU 307 Cb 0.24 0.63 -0.08 0.00 0.37 0.00 0.00 40.66 41.82 1bwd h LEU 307 CO -0.14 -0.30 0.23 -0.07 -0.34 0.00 0.00 178.44 177.82 1bwd h LEU 308 N -0.09 0.22 -0.93 2.25 3.38 -0.96 0.12 115.31 119.30 1bwd h LEU 308 Ca 0.29 0.08 -0.04 0.00 0.09 0.00 0.00 57.88 58.31 1bwd h LEU 308 Cb 0.57 0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.35 1bwd h LEU 308 CO -0.80 0.13 0.33 -0.33 0.09 0.00 0.00 178.44 177.85 1bwd h GLU 309 N 0.41 1.10 -0.89 1.13 5.08 0.76 -2.13 114.58 120.03 1bwd h GLU 309 Ca 0.32 -0.17 0.19 0.00 -1.00 0.00 0.00 59.36 58.70 1bwd h GLU 309 Cb 0.41 -0.19 -0.07 0.00 0.50 0.00 0.00 28.75 29.40 1bwd h GLU 309 CO -0.32 0.87 0.59 -0.22 -1.00 0.00 0.00 179.01 178.92 1bwd h LYS 310 N 1.08 0.46 -0.96 2.33 3.64 0.11 0.27 116.57 123.49 1bwd h LYS 310 Ca 0.26 -0.03 -0.38 0.00 -1.27 0.00 0.00 60.65 59.23 1bwd h LYS 310 Cb 0.16 -0.10 -0.22 0.00 -0.41 0.00 0.00 32.23 31.65 1bwd h LYS 310 CO -0.03 0.30 0.48 0.72 -2.27 0.00 0.00 179.45 178.65 1bwd n HIS 311 N -4.53 2.41 -3.61 1.91 8.25 -0.83 -4.93 115.22 113.89 1bwd n HIS 311 Ca 0.19 -1.48 -0.21 0.00 -0.26 0.00 0.00 57.72 55.95 1bwd n HIS 311 Cb 0.64 -0.78 0.05 0.00 1.12 0.00 0.00 29.99 31.02 1bwd n HIS 311 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1bwd n GLY 312 N -0.69 -0.51 2.94 -1.41 0.00 0.95 -5.00 105.19 101.46 1bwd n GLY 312 Ca 0.46 0.23 -0.30 0.00 0.00 0.00 0.00 46.02 46.41 1bwd n GLY 312 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1bwd s MET 313 N -5.70 1.58 0.07 1.61 0.00 -1.01 -4.81 119.30 111.04 1bwd s MET 313 Ca 0.13 -1.04 -0.28 0.00 0.00 0.00 0.00 55.69 54.50 1bwd s MET 313 Cb -0.03 -2.60 -0.05 0.00 0.00 0.00 0.00 34.83 32.15 1bwd s MET 313 CO 0.80 -0.63 0.88 -0.80 0.00 0.00 0.00 175.02 175.27 1bwd s ASN 314 N 1.38 7.37 0.17 1.11 0.02 0.32 -3.37 114.94 121.95 1bwd s ASN 314 Ca -0.04 1.64 0.06 0.00 -1.02 0.00 0.00 52.86 53.50 1bwd s ASN 314 Cb -0.19 -2.54 -0.04 0.00 0.02 0.00 0.00 41.25 38.50 1bwd s ASN 314 CO -0.07 -0.05 0.07 0.68 0.02 0.00 0.00 177.10 177.74 1bwd s VAL 315 N 0.07 4.08 -0.35 1.60 -7.23 -1.26 -1.75 120.40 115.56 1bwd s VAL 315 Ca 0.44 -1.27 0.01 0.00 -1.81 0.00 0.00 61.98 59.35 1bwd s VAL 315 Cb -0.22 -3.07 0.11 0.00 0.56 0.00 0.00 36.38 33.76 1bwd s VAL 315 CO 0.27 -0.12 0.12 -0.22 -0.31 0.00 0.00 175.10 174.84 1bwd s LEU 316 N -3.04 3.07 -0.62 1.32 2.96 -0.88 -4.93 118.68 116.56 1bwd s LEU 316 Ca 0.29 -2.01 -0.23 0.00 -0.22 0.00 0.00 54.13 51.96 1bwd s LEU 316 Cb -0.10 -1.13 0.06 0.00 0.50 0.00 0.00 46.19 45.52 1bwd s LEU 316 CO 0.21 -0.37 0.94 -2.16 -1.32 0.00 0.00 176.35 173.65 1bwd s PRO 317 N 1.12 3.18 0.23 0.98 0.04 -1.26 -3.24 135.00 136.05 1bwd s PRO 317 Ca 0.12 -0.65 0.03 0.00 0.04 0.00 0.00 61.00 60.54 1bwd s PRO 317 Cb -0.19 -4.16 0.03 0.00 0.04 0.00 0.00 34.50 30.21 1bwd s PRO 317 CO -0.15 -1.68 0.27 1.28 0.04 0.00 0.00 177.00 176.76 1bwd n LEU 318 N 7.56 0.00 -3.79 -3.56 4.77 -1.10 -4.50 117.00 116.38 1bwd n LEU 318 Ca -0.02 -1.03 -0.14 0.00 -0.03 0.00 0.00 56.01 54.79 1bwd n LEU 318 Cb 0.46 -0.12 -0.15 0.00 -2.33 0.00 0.00 43.42 41.28 1bwd n LEU 318 CO 0.63 -0.52 -0.30 -1.58 -1.33 0.00 0.00 177.39 174.29 1bwd s GLN 319 N -3.00 0.03 -0.38 3.23 0.74 -1.26 -0.52 119.66 118.50 1bwd s GLN 319 Ca 0.21 0.20 0.02 0.00 0.05 0.00 0.00 55.36 55.83 1bwd s GLN 319 Cb -0.02 -0.13 0.11 0.00 1.10 0.00 0.00 33.01 34.07 1bwd s GLN 319 CO 0.13 -0.11 0.11 -0.51 -0.55 0.00 0.00 175.29 174.36 1bwd s LEU 320 N 0.72 4.86 0.08 3.68 1.43 -1.26 -4.87 118.68 123.32 1bwd s LEU 320 Ca -0.06 -2.22 -0.33 0.00 -1.03 0.00 0.00 54.13 50.50 1bwd s LEU 320 Cb -0.08 -1.68 -0.17 0.00 0.03 0.00 0.00 46.19 44.29 1bwd s LEU 320 CO -0.03 -0.41 1.61 0.74 0.23 0.00 0.00 176.35 178.50 1bwd h THR 321 N 6.43 0.27 -0.31 5.49 2.02 -1.97 -3.28 112.91 121.56 1bwd h THR 321 Ca -0.06 0.00 -0.19 0.00 0.77 0.00 0.00 66.41 66.92 1bwd h THR 321 Cb 1.01 0.27 -0.09 0.00 -1.74 0.00 0.00 68.15 67.60 1bwd h THR 321 CO 0.58 0.00 0.25 1.41 0.37 0.00 0.00 175.52 178.13 1bwd n HIS 322 N -5.49 0.97 -0.24 3.16 8.25 -1.26 -4.54 115.22 116.06 1bwd n HIS 322 Ca -0.12 -1.40 -0.07 0.00 -0.26 0.00 0.00 57.72 55.87 1bwd n HIS 322 Cb 0.39 -0.69 0.04 0.00 1.12 0.00 0.00 29.99 30.85 1bwd n HIS 322 CO 0.00 0.00 0.00 0.77 0.64 0.00 0.00 176.34 177.75 1bwd h SER 323 N 0.99 1.00 1.11 0.41 0.02 -1.78 -0.86 113.55 114.44 1bwd h SER 323 Ca 0.19 -0.22 0.00 0.00 -0.84 0.00 0.00 61.79 60.92 1bwd h SER 323 Cb 1.14 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 63.42 1bwd h SER 323 CO 0.44 0.96 0.00 0.54 -1.14 0.00 0.00 176.83 177.63 1bwd n ARG 324 N -4.31 0.20 -0.09 3.45 1.74 -1.26 -0.43 116.66 115.95 1bwd n ARG 324 Ca 0.05 0.27 -0.19 0.00 -0.77 0.00 0.00 57.85 57.20 1bwd n ARG 324 Cb 0.23 -1.78 -0.12 0.00 -1.02 0.00 0.00 32.46 29.78 1bwd n ARG 324 CO 0.00 0.00 0.00 1.15 -1.52 0.00 0.00 177.63 177.26 1bwd h THR 325 N 0.00 1.14 0.00 0.55 2.02 -1.48 -1.49 112.91 113.65 1bwd h THR 325 Ca 0.00 -2.18 0.00 0.00 0.77 0.00 0.00 66.41 65.00 1bwd h THR 325 Cb 0.55 2.48 0.00 0.00 -1.74 0.00 0.00 68.15 69.45 1bwd h THR 325 CO 0.00 0.39 -0.52 -0.07 0.37 0.00 0.00 175.52 175.69 1bwd h LEU 326 N -1.00 0.00 -2.76 2.58 3.38 -1.32 -3.41 115.31 112.78 1bwd h LEU 326 Ca -0.23 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.63 1bwd h LEU 326 Cb 1.18 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.93 1bwd h LEU 326 CO -0.14 0.05 -0.03 0.61 0.09 0.00 0.00 178.44 179.02 1bwd n GLY 327 N 1.26 -0.60 3.64 0.83 0.00 0.42 -5.03 105.19 105.71 1bwd n GLY 327 Ca 0.03 0.06 -0.04 0.00 0.00 0.00 0.00 46.02 46.06 1bwd n GLY 327 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1bwd s GLY 328 N -2.44 -0.11 0.00 -0.02 0.00 -1.06 -4.98 107.32 98.71 1bwd s GLY 328 Ca 0.01 2.95 0.00 0.00 0.00 0.00 0.00 44.72 47.69 1bwd s GLY 328 CO 0.29 2.40 0.00 0.61 0.00 0.00 0.00 173.10 176.40 1bwd n GLY 329 N 3.45 3.73 0.32 0.20 0.00 -1.26 -4.46 105.19 107.16 1bwd n GLY 329 Ca -0.17 -2.10 -0.04 0.00 0.00 0.00 0.00 46.02 43.70 1bwd n GLY 329 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1bwd h PHE 330 N 0.24 1.06 0.06 1.61 0.04 -1.32 -1.35 116.94 117.29 1bwd h PHE 330 Ca 0.00 -0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.77 1bwd h PHE 330 Cb 0.00 -0.35 0.00 0.00 2.20 0.00 0.00 35.95 37.80 1bwd h PHE 330 CO 0.00 0.71 -0.03 1.25 -0.60 0.00 0.00 178.31 179.64 1bwd h HIS 331 N 1.11 -0.08 -0.63 -0.55 2.76 -1.24 -3.03 115.15 113.49 1bwd h HIS 331 Ca 0.29 -0.00 0.09 0.00 -2.20 0.00 0.00 60.37 58.55 1bwd h HIS 331 Cb -0.05 0.03 -0.07 0.00 1.55 0.00 0.00 27.41 28.87 1bwd h HIS 331 CO -0.01 0.25 0.27 0.00 -1.30 0.00 0.00 177.93 177.14 1bwd n ALA 333 N -2.44 2.45 -2.44 0.00 0.00 -0.52 -3.39 120.51 114.17 1bwd n ALA 333 Ca 0.09 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.44 1bwd n ALA 333 Cb 0.26 -1.00 -0.08 0.00 0.00 0.00 0.00 19.45 18.63 1bwd n ALA 333 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1bwd s THR 334 N -1.12 0.13 -0.21 0.00 -4.23 -1.06 -4.51 115.64 104.65 1bwd s THR 334 Ca 0.00 -1.45 -0.04 0.00 -1.18 0.00 0.00 61.69 59.02 1bwd s THR 334 Cb 0.00 -1.59 0.08 0.00 1.34 0.00 0.00 72.50 72.34 1bwd s THR 334 CO 0.00 -0.61 0.17 -0.22 -0.54 0.00 0.00 174.62 173.41 1bwd s LEU 335 N -2.92 0.12 -0.27 4.79 1.98 -0.25 -3.38 118.68 118.75 1bwd s LEU 335 Ca 0.11 -0.52 -0.27 0.00 -2.89 0.00 0.00 54.13 50.56 1bwd s LEU 335 Cb 0.05 0.08 0.01 0.00 0.66 0.00 0.00 46.19 46.99 1bwd s LEU 335 CO -0.07 -0.35 0.96 1.51 -1.89 0.00 0.00 176.35 176.52 1bwd s ASP 336 N 2.23 6.92 0.00 3.68 -4.77 -1.26 -0.89 116.67 122.59 1bwd s ASP 336 Ca 0.05 1.10 0.22 0.00 -3.30 0.00 0.00 52.55 50.62 1bwd s ASP 336 Cb -0.16 -2.50 -0.15 0.00 -1.09 0.00 0.00 42.92 39.02 1bwd s ASP 336 CO -0.15 -0.69 0.91 1.33 0.70 0.00 0.00 175.17 177.28 1bwd n VAL 337 N 5.49 0.01 -3.60 2.11 0.24 -0.64 -4.86 118.33 117.08 1bwd n VAL 337 Ca 0.09 -0.07 -0.02 0.00 -2.04 0.00 0.00 64.34 62.30 1bwd n VAL 337 Cb 0.47 0.76 -0.05 0.00 -1.47 0.00 0.00 33.84 33.54 1bwd n VAL 337 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 1bwd s ARG 338 N -3.07 0.53 -0.03 7.34 3.52 -1.08 -1.82 118.95 124.34 1bwd s ARG 338 Ca 0.06 1.15 0.07 0.00 -0.13 0.00 0.00 55.73 56.88 1bwd s ARG 338 Cb 0.16 0.50 -0.01 0.00 -1.56 0.00 0.00 34.95 34.03 1bwd s ARG 338 CO 0.85 -0.15 -0.23 1.03 -0.81 0.00 0.00 175.30 175.99 1bwd s ARG 339 N 2.28 2.06 0.26 5.12 0.52 -0.70 -0.27 118.95 128.21 1bwd s ARG 339 Ca -0.07 -0.84 -0.30 0.00 -0.52 0.00 0.00 55.73 54.00 1bwd s ARG 339 Cb -0.08 -1.90 -0.11 0.00 0.52 0.00 0.00 34.95 33.38 1bwd s ARG 339 CO -0.18 0.45 1.53 0.95 0.02 0.00 0.00 175.30 178.07 1bwd s THR 340 N -0.41 2.36 -5.00 0.02 -4.23 -0.44 -4.62 115.64 103.32 1bwd s THR 340 Ca 0.05 0.30 0.00 0.00 -1.18 0.00 0.00 61.69 60.86 1bwd s THR 340 Cb -0.10 -3.19 0.00 0.00 1.34 0.00 0.00 72.50 70.55 1bwd s THR 340 CO 0.00 0.05 0.00 0.61 -0.54 0.00 0.00 174.62 174.74 1bwd n GLY 341 N 2.37 0.00 3.44 3.99 0.00 -1.26 -3.90 105.19 109.83 1bwd n GLY 341 Ca 0.08 -1.73 -0.22 0.00 0.00 0.00 0.00 46.02 44.15 1bwd n GLY 341 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bwd s ALA 342 N -1.17 2.41 -0.23 4.61 0.00 -1.26 -4.96 121.76 121.16 1bwd s ALA 342 Ca 0.00 -1.79 -0.24 0.00 0.00 0.00 0.00 51.96 49.93 1bwd s ALA 342 Cb 0.00 0.76 -0.01 0.00 0.00 0.00 0.00 23.12 23.87 1bwd s ALA 342 CO 0.00 -0.34 0.79 -1.17 0.00 0.00 0.00 175.76 175.04 1bwd s LEU 343 N -3.49 4.10 0.00 0.00 2.96 -1.26 -4.84 118.68 116.16 1bwd s LEU 343 Ca 0.33 1.01 0.05 0.00 -0.22 0.00 0.00 54.13 55.30 1bwd s LEU 343 Cb 0.07 -3.13 -0.02 0.00 0.50 0.00 0.00 46.19 43.61 1bwd s LEU 343 CO 0.15 -0.46 0.21 -0.62 -1.32 0.00 0.00 176.35 174.31 1bwd n GLU 344 N 5.74 0.30 -3.90 1.98 1.02 -1.26 -4.98 120.64 119.53 1bwd n GLU 344 Ca 0.04 -2.24 -0.30 0.00 -0.02 0.00 0.00 57.16 54.64 1bwd n GLU 344 Cb 0.48 1.86 -0.16 0.00 -0.02 0.00 0.00 31.44 33.61 1bwd n GLU 344 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1bwd s THR 345 N -2.90 1.40 -0.37 2.62 2.01 -1.26 -2.14 115.64 115.00 1bwd s THR 345 Ca 0.27 -1.23 -0.05 0.00 0.31 0.00 0.00 61.69 60.99 1bwd s THR 345 Cb 0.01 -1.75 -0.06 0.00 0.01 0.00 0.00 72.50 70.72 1bwd s THR 345 CO 0.19 -0.19 3.06 -1.22 -0.69 0.00 0.00 174.62 175.76 1bwd n TYR 346 N 4.70 1.11 -3.46 4.92 4.01 -1.26 -4.94 117.16 122.24 1bwd n TYR 346 Ca -0.10 -1.86 -0.41 0.00 -0.16 0.00 0.00 57.90 55.37 1bwd n TYR 346 Cb 0.44 -1.51 -0.10 0.00 -0.31 0.00 0.00 39.34 37.86 1bwd n TYR 346 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 1bwd s GLN 347 N -0.63 3.46 0.00 -0.72 -0.21 -1.26 -4.89 119.66 115.41 1bwd s GLN 347 Ca 0.62 -0.59 0.20 0.00 0.02 0.00 0.00 55.36 55.61 1bwd s GLN 347 Cb 0.35 -3.83 0.16 0.00 1.00 0.00 0.00 33.01 30.69 1bwd s GLN 347 CO -0.14 -0.52 1.14 1.19 -2.12 0.00 0.00 175.29 174.85