#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bbd s ILE 2 N 0.00 3.57 -0.34 0.53 1.01 -1.26 -5.01 121.20 119.69 1bbd s ILE 2 Ca 0.00 0.99 0.01 0.00 0.00 0.00 0.00 60.65 61.65 1bbd s ILE 2 Cb 0.00 -3.41 0.09 0.00 0.01 0.00 0.00 42.46 39.15 1bbd s ILE 2 CO 0.00 -0.20 0.07 -0.69 0.00 0.00 0.00 174.94 174.12 1bbd s VAL 3 N -1.89 2.71 0.15 2.92 1.01 -1.26 -4.87 120.40 119.17 1bbd s VAL 3 Ca 0.69 -1.98 -0.30 0.00 0.00 0.00 0.00 61.98 60.39 1bbd s VAL 3 Cb -0.19 -2.82 -0.07 0.00 0.00 0.00 0.00 36.38 33.31 1bbd s VAL 3 CO 0.23 -0.46 1.03 -0.04 0.00 0.00 0.00 175.10 175.86 1bbd s MET 4 N 1.07 4.65 -0.06 2.72 1.00 -1.26 -2.73 119.30 124.69 1bbd s MET 4 Ca 0.04 1.59 -0.01 0.00 0.00 0.00 0.00 55.69 57.31 1bbd s MET 4 Cb -0.20 -3.32 0.03 0.00 0.00 0.00 0.00 34.83 31.33 1bbd s MET 4 CO -0.05 0.15 -0.01 0.99 0.00 0.00 0.00 175.02 176.10 1bbd s THR 5 N -0.15 0.40 0.23 2.05 2.01 -0.72 -4.50 115.64 114.95 1bbd s THR 5 Ca 0.48 0.06 0.09 0.00 0.31 0.00 0.00 61.69 62.63 1bbd s THR 5 Cb -0.26 -0.52 -0.04 0.00 0.01 0.00 0.00 72.50 71.68 1bbd s THR 5 CO 0.32 0.24 -0.03 -1.10 -0.69 0.00 0.00 174.62 173.36 1bbd s GLN 6 N 1.65 2.23 -0.25 4.92 -0.21 -1.26 -1.29 119.66 125.45 1bbd s GLN 6 Ca 0.00 -1.33 -0.27 0.00 0.02 0.00 0.00 55.36 53.78 1bbd s GLN 6 Cb -0.13 -2.19 0.16 0.00 1.00 0.00 0.00 33.01 31.85 1bbd s GLN 6 CO -0.04 0.40 1.19 -1.54 -2.12 0.00 0.00 175.29 173.19 1bbd s SER 7 N -3.30 -0.24 0.98 5.90 1.04 -0.96 -4.78 113.70 112.35 1bbd s SER 7 Ca 0.29 0.38 -0.14 0.00 0.48 0.00 0.00 55.95 56.95 1bbd s SER 7 Cb -0.08 0.35 0.18 0.00 0.10 0.00 0.00 66.02 66.58 1bbd s SER 7 CO 0.18 -0.15 1.17 -2.16 0.98 0.00 0.00 173.24 173.26 1bbd s PRO 8 N -0.44 0.54 0.21 4.02 0.04 -1.26 -2.24 135.00 135.86 1bbd s PRO 8 Ca 0.04 0.08 0.01 0.00 0.04 0.00 0.00 61.00 61.17 1bbd s PRO 8 Cb -0.03 -1.79 0.16 0.00 0.04 0.00 0.00 34.50 32.88 1bbd s PRO 8 CO -0.07 -2.56 1.51 0.77 0.04 0.00 0.00 177.00 176.69 1bbd h SER 9 N -1.76 0.41 -5.08 6.66 0.02 -1.86 -3.39 113.55 108.55 1bbd h SER 9 Ca -0.48 -0.24 -0.06 0.00 -0.84 0.00 0.00 61.79 60.17 1bbd h SER 9 Cb 1.30 -0.12 -0.14 0.00 0.14 0.00 0.00 62.40 63.59 1bbd h SER 9 CO 0.51 0.93 -0.11 -0.94 -1.14 0.00 0.00 176.83 176.08 1bbd s SER 10 N -6.92 -0.20 -0.17 3.07 1.04 -1.25 -0.57 113.70 108.69 1bbd s SER 10 Ca -0.05 -0.30 -0.09 0.00 0.48 0.00 0.00 55.95 55.99 1bbd s SER 10 Cb 0.11 0.45 0.06 0.00 0.10 0.00 0.00 66.02 66.74 1bbd s SER 10 CO 0.82 -0.80 0.40 -0.22 0.98 0.00 0.00 173.24 174.42 1bbd s LEU 11 N -2.66 -0.14 -0.26 2.42 2.96 0.45 -4.85 118.68 116.59 1bbd s LEU 11 Ca 0.02 0.88 -0.11 0.00 -0.22 0.00 0.00 54.13 54.70 1bbd s LEU 11 Cb 0.02 1.31 -0.05 0.00 0.50 0.00 0.00 46.19 47.97 1bbd s LEU 11 CO -0.10 -0.20 0.20 -0.89 -1.32 0.00 0.00 176.35 174.04 1bbd s THR 12 N 1.55 5.32 0.32 3.68 2.01 -1.26 -2.18 115.64 125.08 1bbd s THR 12 Ca -0.08 0.23 0.03 0.00 0.31 0.00 0.00 61.69 62.17 1bbd s THR 12 Cb -0.09 -3.54 -0.05 0.00 0.01 0.00 0.00 72.50 68.83 1bbd s THR 12 CO -0.13 0.28 0.09 -0.69 -0.69 0.00 0.00 174.62 173.49 1bbd s VAL 13 N 1.47 0.85 0.07 3.82 1.01 -1.21 -4.99 120.40 121.42 1bbd s VAL 13 Ca 0.08 -2.00 0.05 0.00 0.00 0.00 0.00 61.98 60.12 1bbd s VAL 13 Cb -0.15 -2.65 -0.04 0.00 0.00 0.00 0.00 36.38 33.55 1bbd s VAL 13 CO 0.08 0.00 -0.07 0.28 0.00 0.00 0.00 175.10 175.39 1bbd s THR 14 N -3.42 3.56 0.28 3.92 -1.32 -1.26 -1.88 115.64 115.52 1bbd s THR 14 Ca 0.34 -1.06 -0.30 0.00 -1.21 0.00 0.00 61.69 59.46 1bbd s THR 14 Cb 0.07 -2.63 -0.13 0.00 -1.51 0.00 0.00 72.50 68.30 1bbd s THR 14 CO 0.15 0.21 1.34 1.07 -2.21 0.00 0.00 174.62 175.18 1bbd n THR 15 N 0.96 1.41 0.00 5.08 5.66 -1.26 -0.83 114.28 125.30 1bbd n THR 15 Ca -0.14 -0.35 0.00 0.00 -3.05 0.00 0.00 64.05 60.51 1bbd n THR 15 Cb 0.52 -1.49 0.00 0.00 -1.55 0.00 0.00 70.33 67.81 1bbd n THR 15 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1bbd n GLY 16 N 1.58 3.10 0.01 1.09 0.00 -0.91 -4.95 105.19 105.11 1bbd n GLY 16 Ca 0.09 -0.87 -0.00 0.00 0.00 0.00 0.00 46.02 45.23 1bbd n GLY 16 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1bbd n GLU 17 N 0.00 1.67 -3.31 1.61 4.07 -0.01 -2.67 120.64 122.00 1bbd n GLU 17 Ca 0.00 -0.00 -0.01 0.00 -0.06 0.00 0.00 57.16 57.09 1bbd n GLU 17 Cb 0.00 -0.00 -0.04 0.00 -0.06 0.00 0.00 31.44 31.34 1bbd n GLU 17 CO 0.00 0.00 0.00 -1.59 -0.06 0.00 0.00 177.13 175.48 1bbd s LYS 18 N -0.25 0.49 0.21 5.31 0.00 -1.26 0.48 119.74 124.71 1bbd s LYS 18 Ca 0.00 0.93 0.05 0.00 0.00 0.00 0.00 55.97 56.94 1bbd s LYS 18 Cb -0.00 0.28 -0.03 0.00 0.00 0.00 0.00 37.83 38.07 1bbd s LYS 18 CO 0.00 -0.54 0.29 0.08 0.00 0.00 0.00 175.35 175.18 1bbd s VAL 19 N 2.75 5.07 -0.05 1.79 1.01 0.38 -4.93 120.40 126.42 1bbd s VAL 19 Ca 0.13 -0.98 -0.02 0.00 0.00 0.00 0.00 61.98 61.12 1bbd s VAL 19 Cb -0.15 -3.70 0.03 0.00 0.00 0.00 0.00 36.38 32.57 1bbd s VAL 19 CO -0.19 -0.24 0.08 -0.89 0.00 0.00 0.00 175.10 173.86 1bbd s THR 20 N -1.91 -0.12 0.21 3.92 2.01 -1.26 -0.68 115.64 117.81 1bbd s THR 20 Ca 0.34 0.33 0.09 0.00 0.31 0.00 0.00 61.69 62.75 1bbd s THR 20 Cb -0.09 -0.17 -0.05 0.00 0.01 0.00 0.00 72.50 72.20 1bbd s THR 20 CO 0.28 0.14 -0.16 0.00 -0.69 0.00 0.00 174.62 174.18 1bbd s MET 21 N 1.79 1.36 0.08 4.92 0.23 0.24 -4.90 119.30 123.02 1bbd s MET 21 Ca -0.01 -1.57 0.06 0.00 -1.03 0.00 0.00 55.69 53.14 1bbd s MET 21 Cb -0.12 -1.26 -0.04 0.00 -1.53 0.00 0.00 34.83 31.88 1bbd s MET 21 CO -0.04 0.22 -0.09 0.99 -2.03 0.00 0.00 175.02 174.07 1bbd s THR 22 N -2.69 3.43 -0.22 3.16 2.01 -0.95 -0.15 115.64 120.23 1bbd s THR 22 Ca 0.22 -1.16 -0.04 0.00 0.31 0.00 0.00 61.69 61.02 1bbd s THR 22 Cb -0.02 -2.58 0.11 0.00 0.01 0.00 0.00 72.50 70.02 1bbd s THR 22 CO 0.08 0.17 0.38 0.00 -0.69 0.00 0.00 174.62 174.56 1bbd s LYS 24 N 2.55 3.48 0.15 0.00 1.02 -0.41 -0.73 119.74 125.80 1bbd s LYS 24 Ca 0.07 -0.61 -0.09 0.00 0.02 0.00 0.00 55.97 55.36 1bbd s LYS 24 Cb -0.14 -2.85 -0.06 0.00 -0.52 0.00 0.00 37.83 34.26 1bbd s LYS 24 CO -0.14 0.09 0.46 0.45 -0.92 0.00 0.00 175.35 175.29 1bbd s SER 25 N 0.72 6.63 0.00 2.83 0.15 -0.44 -1.76 113.70 121.83 1bbd s SER 25 Ca -0.03 0.83 0.17 0.00 0.70 0.00 0.00 55.95 57.62 1bbd s SER 25 Cb -0.15 -2.19 0.51 0.00 -1.71 0.00 0.00 66.02 62.48 1bbd s SER 25 CO 0.02 0.06 1.41 -1.54 1.20 0.00 0.00 173.24 174.39 1bbd n SER 26 N 0.38 2.45 -3.66 5.45 3.41 -1.10 -4.82 113.62 115.72 1bbd n SER 26 Ca -0.04 -1.93 -0.07 0.00 -0.26 0.00 0.00 58.87 56.58 1bbd n SER 26 Cb 0.52 -0.26 -0.02 0.00 -0.26 0.00 0.00 64.21 64.20 1bbd n SER 26 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 1bbd s GLN 27 N -1.49 1.26 0.20 4.33 0.74 -1.26 -4.82 119.66 118.62 1bbd s GLN 27 Ca 0.33 -0.62 -0.30 0.00 0.05 0.00 0.00 55.36 54.82 1bbd s GLN 27 Cb 0.18 0.48 -0.08 0.00 1.10 0.00 0.00 33.01 34.68 1bbd s GLN 27 CO 0.24 -0.57 0.95 0.45 -0.55 0.00 0.00 175.29 175.81 1bbd s SER 28 N -2.80 7.60 0.00 6.67 0.15 -1.26 -4.79 113.70 119.27 1bbd s SER 28 Ca 0.08 1.90 0.19 0.00 0.70 0.00 0.00 55.95 58.83 1bbd s SER 28 Cb -0.02 -2.60 -0.19 0.00 -1.71 0.00 0.00 66.02 61.49 1bbd s SER 28 CO -0.02 0.09 0.82 0.18 1.20 0.00 0.00 173.24 175.51 1bbd n LEU 29 N 1.89 0.95 -4.68 3.45 4.77 -1.22 -4.94 117.00 117.22 1bbd n LEU 29 Ca -0.01 -0.52 -0.42 0.00 -0.03 0.00 0.00 56.01 55.03 1bbd n LEU 29 Cb 0.48 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.54 1bbd n LEU 29 CO 0.50 0.23 1.14 -0.22 -1.33 0.00 0.00 177.39 177.72 1bbd s LEU 30 N -2.86 4.29 -0.36 2.23 2.96 -1.26 -2.02 118.68 121.67 1bbd s LEU 30 Ca 0.08 2.05 -0.17 0.00 -0.22 0.00 0.00 54.13 55.87 1bbd s LEU 30 Cb 0.14 -3.55 -0.00 0.00 0.50 0.00 0.00 46.19 43.28 1bbd s LEU 30 CO 0.76 -0.75 0.42 0.21 -1.32 0.00 0.00 176.35 175.68 1bbd s ASN 31 N 2.10 6.22 0.09 3.68 3.04 0.47 -4.94 114.94 125.60 1bbd s ASN 31 Ca 0.63 -0.26 -0.25 0.00 0.04 0.00 0.00 52.86 53.03 1bbd s ASN 31 Cb -0.30 -2.22 -0.15 0.00 -1.54 0.00 0.00 41.25 37.04 1bbd s ASN 31 CO 0.25 -0.43 1.71 0.28 -3.04 0.00 0.00 177.10 175.87 1bbd h SER 32 N 8.52 -0.18 0.00 -4.21 0.02 -1.96 2.88 113.55 118.62 1bbd h SER 32 Ca -0.28 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.67 1bbd h SER 32 Cb 1.13 0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.72 1bbd h SER 32 CO 0.74 -0.12 0.00 0.54 -1.14 0.00 0.00 176.83 176.85 1bbd n ARG 33 N -5.18 0.00 0.17 3.45 1.74 -1.26 -3.11 116.66 112.47 1bbd n ARG 33 Ca -0.08 0.03 0.02 0.00 -0.77 0.00 0.00 57.85 57.05 1bbd n ARG 33 Cb 0.11 -0.36 0.29 0.00 -1.02 0.00 0.00 32.46 31.48 1bbd n ARG 33 CO 0.00 0.00 0.00 1.79 -1.52 0.00 0.00 177.63 177.90 1bbd h THR 34 N 0.00 1.23 -4.22 0.55 1.35 -1.99 -3.47 112.91 106.36 1bbd h THR 34 Ca 0.00 -1.64 -0.26 0.00 -0.55 0.00 0.00 66.41 63.97 1bbd h THR 34 Cb 0.00 1.91 0.09 0.00 -1.73 0.00 0.00 68.15 68.42 1bbd h THR 34 CO 0.00 0.45 -0.45 1.67 -0.25 0.00 0.00 175.52 176.94 1bbd n GLN 35 N -3.85 -5.15 -4.89 4.72 -0.06 0.96 -5.02 117.38 104.09 1bbd n GLN 35 Ca -0.01 0.55 -0.32 0.00 -2.00 0.00 0.00 57.00 55.22 1bbd n GLN 35 Cb 0.50 -4.73 -0.14 0.00 -4.06 0.00 0.00 30.24 21.82 1bbd n GLN 35 CO 0.00 0.00 0.00 0.15 -0.20 0.00 0.00 177.06 177.01 1bbd s LYS 36 N -5.74 2.24 -0.45 3.69 -0.14 -1.19 -4.91 119.74 113.24 1bbd s LYS 36 Ca 0.34 -0.86 -0.10 0.00 -1.36 0.00 0.00 55.97 53.98 1bbd s LYS 36 Cb -0.15 -2.23 0.09 0.00 -1.68 0.00 0.00 37.83 33.87 1bbd s LYS 36 CO 0.48 0.58 0.31 -0.80 -0.76 0.00 0.00 175.35 175.16 1bbd s ASN 37 N -0.99 5.75 -0.98 2.83 0.01 -1.26 0.18 114.94 120.47 1bbd s ASN 37 Ca 0.12 -1.62 -0.21 0.00 -0.71 0.00 0.00 52.86 50.44 1bbd s ASN 37 Cb -0.10 -2.03 -0.11 0.00 0.41 0.00 0.00 41.25 39.42 1bbd s ASN 37 CO 0.02 -0.61 1.94 -1.22 -1.51 0.00 0.00 177.10 175.72 1bbd n TYR 38 N 4.97 2.45 -4.60 2.20 4.01 -0.85 -2.93 117.16 122.39 1bbd n TYR 38 Ca -0.10 -1.88 -0.28 0.00 -0.16 0.00 0.00 57.90 55.48 1bbd n TYR 38 Cb 0.42 -2.10 -0.17 0.00 -0.31 0.00 0.00 39.34 37.18 1bbd n TYR 38 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 1bbd s LEU 39 N 4.24 1.75 0.15 7.72 1.98 -1.26 -1.37 118.68 131.89 1bbd s LEU 39 Ca 0.59 -0.41 0.11 0.00 -2.89 0.00 0.00 54.13 51.53 1bbd s LEU 39 Cb 0.09 -1.06 -0.04 0.00 0.66 0.00 0.00 46.19 45.84 1bbd s LEU 39 CO 0.10 0.04 -0.25 -0.89 -1.89 0.00 0.00 176.35 173.47 1bbd s THR 40 N 0.80 2.20 -0.14 3.68 2.01 -0.78 -0.89 115.64 122.52 1bbd s THR 40 Ca -0.11 -1.83 0.02 0.00 0.31 0.00 0.00 61.69 60.08 1bbd s THR 40 Cb -0.16 -1.98 0.01 0.00 0.01 0.00 0.00 72.50 70.38 1bbd s THR 40 CO 0.01 -0.02 -0.20 0.26 -0.69 0.00 0.00 174.62 173.99 1bbd s TRP 41 N -1.32 2.70 0.26 4.92 0.52 -1.08 -0.66 118.94 124.27 1bbd s TRP 41 Ca 0.15 -1.26 0.09 0.00 0.02 0.00 0.00 56.10 55.10 1bbd s TRP 41 Cb -0.09 -1.83 -0.04 0.00 -1.15 0.00 0.00 33.47 30.35 1bbd s TRP 41 CO 0.07 -0.58 0.04 0.71 0.02 0.00 0.00 176.95 177.21 1bbd s TYR 42 N 0.81 2.79 -0.07 -1.98 1.51 0.43 -0.89 117.35 119.95 1bbd s TYR 42 Ca -0.07 -0.19 0.04 0.00 -1.01 0.00 0.00 57.07 55.84 1bbd s TYR 42 Cb -0.15 -1.24 -0.00 0.00 -0.11 0.00 0.00 41.96 40.45 1bbd s TYR 42 CO -0.01 0.60 -0.21 1.14 -1.11 0.00 0.00 175.55 175.95 1bbd s GLN 43 N -3.67 2.50 -0.21 -0.62 -2.07 0.81 -1.77 119.66 114.62 1bbd s GLN 43 Ca 0.31 -0.77 0.01 0.00 -1.82 0.00 0.00 55.36 53.10 1bbd s GLN 43 Cb -0.07 -2.00 0.04 0.00 -1.09 0.00 0.00 33.01 29.90 1bbd s GLN 43 CO 0.21 0.22 -0.11 -1.14 -1.32 0.00 0.00 175.29 173.15 1bbd s GLN 44 N 0.20 2.12 0.46 9.60 0.74 0.44 -0.79 119.66 132.42 1bbd s GLN 44 Ca -0.12 -0.94 -0.10 0.00 0.05 0.00 0.00 55.36 54.26 1bbd s GLN 44 Cb -0.15 -2.53 -0.06 0.00 1.10 0.00 0.00 33.01 31.37 1bbd s GLN 44 CO 0.06 -0.45 0.82 0.15 -0.55 0.00 0.00 175.29 175.32 1bbd s LYS 45 N 1.34 3.71 -0.22 1.67 1.02 -1.26 0.10 119.74 126.10 1bbd s LYS 45 Ca -0.02 0.48 -0.42 0.00 0.02 0.00 0.00 55.97 56.02 1bbd s LYS 45 Cb -0.17 -2.33 -0.18 0.00 -0.52 0.00 0.00 37.83 34.63 1bbd s LYS 45 CO -0.08 -0.16 1.46 -2.30 -0.92 0.00 0.00 175.35 173.35 1bbd n PRO 46 N -1.73 0.49 -1.10 -1.68 -0.02 -1.26 -1.62 135.00 128.08 1bbd n PRO 46 Ca 0.03 0.18 -0.04 0.00 -2.02 0.00 0.00 63.50 61.65 1bbd n PRO 46 Cb 0.54 -1.75 -0.02 0.00 -0.02 0.00 0.00 33.50 32.26 1bbd n PRO 46 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1bbd n GLY 47 N 3.17 0.51 3.34 -1.23 0.00 -1.26 -4.98 105.19 104.74 1bbd n GLY 47 Ca 0.25 -0.10 -0.20 0.00 0.00 0.00 0.00 46.02 45.97 1bbd n GLY 47 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1bbd s GLN 48 N -1.78 1.32 0.59 1.61 -0.21 -0.64 -5.14 119.66 115.41 1bbd s GLN 48 Ca 0.00 -1.54 -0.14 0.00 0.02 0.00 0.00 55.36 53.70 1bbd s GLN 48 Cb 0.00 -1.20 -0.04 0.00 1.00 0.00 0.00 33.01 32.77 1bbd s GLN 48 CO 0.00 0.21 1.03 -1.54 -2.12 0.00 0.00 175.29 172.88 1bbd s SER 49 N -3.12 6.01 0.67 5.90 1.04 -1.26 -4.53 113.70 118.41 1bbd s SER 49 Ca 0.21 1.66 -0.17 0.00 0.48 0.00 0.00 55.95 58.12 1bbd s SER 49 Cb -0.02 -2.51 -0.02 0.00 0.10 0.00 0.00 66.02 63.57 1bbd s SER 49 CO 0.07 -1.01 0.99 -2.65 0.98 0.00 0.00 173.24 171.62 1bbd n PRO 50 N -2.19 0.70 -5.00 4.02 -0.02 -1.26 -4.65 135.00 126.59 1bbd n PRO 50 Ca 0.08 0.29 -0.29 0.00 -2.02 0.00 0.00 63.50 61.56 1bbd n PRO 50 Cb 0.53 -2.22 -0.16 0.00 -0.02 0.00 0.00 33.50 31.63 1bbd n PRO 50 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1bbd s LYS 51 N -3.12 2.21 0.37 -0.52 2.36 0.03 -4.94 119.74 116.14 1bbd s LYS 51 Ca 0.75 -0.72 -0.26 0.00 -2.55 0.00 0.00 55.97 53.20 1bbd s LYS 51 Cb -0.37 -1.84 -0.09 0.00 -1.05 0.00 0.00 37.83 34.47 1bbd s LYS 51 CO 0.48 0.25 1.07 -1.17 1.55 0.00 0.00 175.35 177.53 1bbd s LEU 52 N 0.09 4.25 0.00 5.43 0.20 -1.26 -0.13 118.68 127.26 1bbd s LEU 52 Ca -0.07 2.12 0.00 0.00 0.69 0.00 0.00 54.13 56.86 1bbd s LEU 52 Cb -0.14 -4.02 0.00 0.00 -0.43 0.00 0.00 46.19 41.60 1bbd s LEU 52 CO 0.04 -0.41 0.00 0.18 -0.29 0.00 0.00 176.35 175.87 1bbd n LEU 53 N 0.28 0.92 -3.66 -0.68 4.32 -0.06 -4.82 117.00 113.28 1bbd n LEU 53 Ca 0.03 0.00 -0.14 0.00 -0.02 0.00 0.00 56.01 55.88 1bbd n LEU 53 Cb 0.48 0.00 -0.14 0.00 -1.62 0.00 0.00 43.42 42.14 1bbd n LEU 53 CO 0.48 0.14 -0.16 -0.63 -1.22 0.00 0.00 177.39 176.00 1bbd s ILE 54 N -1.99 -0.38 0.42 -0.08 1.01 -1.17 -2.51 121.20 116.50 1bbd s ILE 54 Ca 0.00 0.30 0.03 0.00 0.00 0.00 0.00 60.65 60.98 1bbd s ILE 54 Cb 0.00 -0.41 0.00 0.00 0.01 0.00 0.00 42.46 42.06 1bbd s ILE 54 CO 0.00 0.12 0.60 -0.72 0.00 0.00 0.00 174.94 174.95 1bbd s TYR 55 N 2.39 3.09 -1.30 3.97 1.13 -0.62 -2.64 117.35 123.36 1bbd s TYR 55 Ca 0.02 -0.03 -0.17 0.00 -1.41 0.00 0.00 57.07 55.47 1bbd s TYR 55 Cb -0.12 -2.26 0.01 0.00 -1.10 0.00 0.00 41.96 38.49 1bbd s TYR 55 CO -0.08 -0.31 0.52 0.91 -2.51 0.00 0.00 175.55 174.08 1bbd n TRP 56 N -1.93 -1.54 0.00 -3.49 8.01 -1.20 -0.48 117.44 116.81 1bbd n TRP 56 Ca 0.02 0.41 0.00 0.00 -1.31 0.00 0.00 57.50 56.62 1bbd n TRP 56 Cb 0.58 -3.15 0.00 0.00 -2.01 0.00 0.00 31.31 26.73 1bbd n TRP 56 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1bbd n ALA 57 N -4.62 0.00 -1.16 6.99 0.00 -0.06 -3.76 120.51 117.91 1bbd n ALA 57 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.25 1bbd n ALA 57 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.07 1bbd n ALA 57 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1bbd n SER 58 N 0.00 0.00 -4.78 0.00 7.64 -0.95 -3.81 113.62 111.72 1bbd n SER 58 Ca 0.00 -0.32 -0.35 0.00 1.01 0.00 0.00 58.87 59.21 1bbd n SER 58 Cb 0.00 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.19 1bbd n SER 58 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1bbd s THR 59 N 0.00 3.37 -0.14 0.44 2.01 0.37 -4.65 115.64 117.03 1bbd s THR 59 Ca 0.00 0.89 -0.02 0.00 0.31 0.00 0.00 61.69 62.86 1bbd s THR 59 Cb 0.00 -3.37 -0.02 0.00 0.01 0.00 0.00 72.50 69.11 1bbd s THR 59 CO 0.00 -0.15 -0.07 -0.13 -0.69 0.00 0.00 174.62 173.58 1bbd s ARG 60 N -3.15 3.55 0.84 4.92 0.52 -1.26 -1.60 118.95 122.77 1bbd s ARG 60 Ca 0.69 -0.57 -0.12 0.00 -0.52 0.00 0.00 55.73 55.21 1bbd s ARG 60 Cb -0.22 -2.82 0.10 0.00 0.52 0.00 0.00 34.95 32.53 1bbd s ARG 60 CO 0.26 0.25 1.12 -1.83 0.02 0.00 0.00 175.30 175.12 1bbd s GLU 61 N 0.31 1.74 -0.31 3.54 -1.05 -1.04 -4.86 118.70 117.02 1bbd s GLU 61 Ca -0.06 0.42 -0.44 0.00 -0.15 0.00 0.00 54.97 54.75 1bbd s GLU 61 Cb -0.15 -1.90 -0.20 0.00 -0.44 0.00 0.00 34.13 31.45 1bbd s GLU 61 CO 0.04 -1.81 1.37 0.45 0.95 0.00 0.00 175.26 176.26 1bbd n SER 62 N -3.53 0.74 0.00 0.83 2.88 -1.26 -1.03 113.62 112.25 1bbd n SER 62 Ca 0.07 1.15 0.00 0.00 -1.33 0.00 0.00 58.87 58.76 1bbd n SER 62 Cb 0.58 -0.88 0.00 0.00 -0.75 0.00 0.00 64.21 63.16 1bbd n SER 62 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1bbd n GLY 63 N 3.01 2.74 3.66 0.46 0.00 -1.26 -5.02 105.19 108.79 1bbd n GLY 63 Ca 0.26 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.82 1bbd n GLY 63 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1bbd n VAL 64 N -0.59 0.12 -0.72 1.61 0.31 -0.20 -4.93 118.33 113.94 1bbd n VAL 64 Ca 0.00 -0.03 -0.29 0.00 -0.01 0.00 0.00 64.34 64.01 1bbd n VAL 64 Cb 0.00 -1.47 0.21 0.00 -0.91 0.00 0.00 33.84 31.67 1bbd n VAL 64 CO 0.00 0.00 0.00 -2.84 -1.32 0.00 0.00 176.83 172.67 1bbd s PRO 65 N 0.70 -0.05 -0.36 5.55 0.02 -1.26 -4.84 135.00 134.76 1bbd s PRO 65 Ca 0.78 0.99 0.08 0.00 0.02 0.00 0.00 61.00 62.87 1bbd s PRO 65 Cb -0.70 -1.64 0.71 0.00 0.02 0.00 0.00 34.50 32.88 1bbd s PRO 65 CO 0.40 -3.18 1.81 -0.40 -0.33 0.00 0.00 177.00 175.30 1bbd n ASP 66 N -4.56 4.34 0.13 2.53 5.68 -1.26 -3.54 116.55 119.87 1bbd n ASP 66 Ca 0.06 -3.37 0.12 0.00 -0.50 0.00 0.00 54.79 51.09 1bbd n ASP 66 Cb 0.54 -0.76 0.06 0.00 -1.14 0.00 0.00 41.12 39.81 1bbd n ASP 66 CO 0.00 0.00 0.00 0.08 -1.33 0.00 0.00 177.20 175.95 1bbd h ARG 67 N 2.04 0.00 -6.73 0.11 0.11 -1.92 -3.44 114.38 104.56 1bbd h ARG 67 Ca 0.37 0.00 -0.49 0.00 0.10 0.00 0.00 59.98 59.95 1bbd h ARG 67 Cb 2.43 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 33.49 1bbd h ARG 67 CO 0.81 0.00 0.23 -0.06 0.10 0.00 0.00 179.97 181.05 1bbd s PHE 68 N -3.31 3.68 -0.26 4.08 0.08 -1.23 -3.16 117.98 117.85 1bbd s PHE 68 Ca 0.02 1.60 -0.15 0.00 0.12 0.00 0.00 56.93 58.52 1bbd s PHE 68 Cb 0.09 -2.78 0.08 0.00 -0.57 0.00 0.00 43.02 39.84 1bbd s PHE 68 CO 0.76 0.28 0.65 0.99 -0.10 0.00 0.00 175.22 177.79 1bbd s THR 69 N -1.56 -0.04 -0.15 0.64 2.01 -0.91 -4.98 115.64 110.65 1bbd s THR 69 Ca 0.46 0.02 0.00 0.00 0.31 0.00 0.00 61.69 62.48 1bbd s THR 69 Cb -0.18 -0.94 0.03 0.00 0.01 0.00 0.00 72.50 71.42 1bbd s THR 69 CO 0.23 0.01 -0.12 -0.83 -0.69 0.00 0.00 174.62 173.21 1bbd s GLY 70 N 1.65 1.10 0.49 4.40 0.00 -1.26 -2.50 107.32 111.21 1bbd s GLY 70 Ca -0.10 -0.90 0.04 0.00 0.00 0.00 0.00 44.72 43.76 1bbd s GLY 70 CO -0.19 0.61 0.31 -1.14 0.00 0.00 0.00 173.10 172.69 1bbd n SER 71 N 4.79 2.72 0.00 1.64 3.41 -1.22 -3.69 113.62 121.27 1bbd n SER 71 Ca -0.16 -2.77 0.00 0.00 -0.26 0.00 0.00 58.87 55.68 1bbd n SER 71 Cb 0.49 0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.47 1bbd n SER 71 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1bbd n GLY 72 N -0.94 2.79 3.38 5.00 0.00 -1.26 -3.31 105.19 110.85 1bbd n GLY 72 Ca -0.05 -1.93 -0.10 0.00 0.00 0.00 0.00 46.02 43.94 1bbd n GLY 72 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1bbd s SER 73 N 0.00 -0.25 1.34 1.61 0.15 -1.13 -4.94 113.70 110.49 1bbd s SER 73 Ca 0.00 -0.38 0.00 0.00 0.70 0.00 0.00 55.95 56.27 1bbd s SER 73 Cb 0.00 0.51 0.00 0.00 -1.71 0.00 0.00 66.02 64.82 1bbd s SER 73 CO 0.00 -0.92 0.00 0.61 1.20 0.00 0.00 173.24 174.13 1bbd n GLY 74 N -0.27 2.37 0.23 9.45 0.00 -1.26 -3.50 105.19 112.20 1bbd n GLY 74 Ca -0.14 -0.16 0.02 0.00 0.00 0.00 0.00 46.02 45.74 1bbd n GLY 74 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1bbd n THR 75 N 0.00 0.35 -4.03 2.61 -2.24 -1.26 -3.39 114.28 106.32 1bbd n THR 75 Ca 0.00 -0.68 -0.24 0.00 -2.27 0.00 0.00 64.05 60.86 1bbd n THR 75 Cb 0.00 0.89 -0.17 0.00 -2.10 0.00 0.00 70.33 68.95 1bbd n THR 75 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1bbd s ASP 76 N -0.62 1.72 0.11 3.42 1.01 -1.23 -1.33 116.67 119.75 1bbd s ASP 76 Ca 0.07 -0.21 0.07 0.00 0.71 0.00 0.00 52.55 53.19 1bbd s ASP 76 Cb 0.04 -0.66 -0.04 0.00 1.01 0.00 0.00 42.92 43.28 1bbd s ASP 76 CO 0.06 -0.10 -0.17 -0.36 0.21 0.00 0.00 175.17 174.82 1bbd s PHE 77 N 1.45 1.54 0.02 4.23 0.08 0.09 -2.84 117.98 122.55 1bbd s PHE 77 Ca -0.01 -0.48 -0.06 0.00 0.12 0.00 0.00 56.93 56.50 1bbd s PHE 77 Cb -0.13 -0.82 -0.01 0.00 -0.57 0.00 0.00 43.02 41.49 1bbd s PHE 77 CO -0.04 0.17 0.10 0.95 -0.10 0.00 0.00 175.22 176.31 1bbd s THR 78 N -1.64 0.10 0.13 0.64 -4.23 -1.21 -1.12 115.64 108.31 1bbd s THR 78 Ca 0.07 -0.85 0.11 0.00 -1.18 0.00 0.00 61.69 59.83 1bbd s THR 78 Cb -0.08 -0.56 -0.04 0.00 1.34 0.00 0.00 72.50 73.16 1bbd s THR 78 CO 0.04 -0.47 -0.26 -0.22 -0.54 0.00 0.00 174.62 173.17 1bbd s LEU 79 N -1.65 2.32 -0.01 4.79 2.96 0.79 -3.40 118.68 124.49 1bbd s LEU 79 Ca -0.12 -0.74 -0.02 0.00 -0.22 0.00 0.00 54.13 53.03 1bbd s LEU 79 Cb -0.06 -1.17 -0.00 0.00 0.50 0.00 0.00 46.19 45.46 1bbd s LEU 79 CO -0.01 0.16 0.04 -0.44 -1.32 0.00 0.00 176.35 174.78 1bbd s SER 80 N -2.03 0.04 0.00 3.68 0.01 -1.04 0.80 113.70 115.16 1bbd s SER 80 Ca 0.13 -0.10 0.06 0.00 1.31 0.00 0.00 55.95 57.35 1bbd s SER 80 Cb -0.10 0.12 -0.02 0.00 0.21 0.00 0.00 66.02 66.23 1bbd s SER 80 CO 0.06 -0.14 -0.19 -0.63 0.41 0.00 0.00 173.24 172.74 1bbd s ILE 81 N -0.56 1.55 -0.21 1.44 1.01 0.15 -2.14 121.20 122.43 1bbd s ILE 81 Ca -0.06 -0.94 0.01 0.00 0.00 0.00 0.00 60.65 59.66 1bbd s ILE 81 Cb -0.04 -1.31 0.05 0.00 0.01 0.00 0.00 42.46 41.17 1bbd s ILE 81 CO -0.00 0.35 -0.09 -0.94 0.00 0.00 0.00 174.94 174.26 1bbd s SER 82 N -0.69 3.62 -0.28 3.58 1.04 -1.19 -0.47 113.70 119.31 1bbd s SER 82 Ca 0.07 -1.02 -0.02 0.00 0.48 0.00 0.00 55.95 55.47 1bbd s SER 82 Cb -0.08 -1.24 -0.02 0.00 0.10 0.00 0.00 66.02 64.78 1bbd s SER 82 CO 0.00 -0.18 0.25 0.61 0.98 0.00 0.00 173.24 174.90 1bbd n GLY 83 N 4.66 0.30 3.54 7.32 0.00 1.75 -4.93 105.19 117.84 1bbd n GLY 83 Ca -0.14 -0.04 -0.39 0.00 0.00 0.00 0.00 46.02 45.45 1bbd n GLY 83 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1bbd n VAL 84 N -1.93 2.71 -4.30 1.61 3.14 -1.04 -4.64 118.33 113.88 1bbd n VAL 84 Ca -0.02 -0.50 -0.17 0.00 -2.96 0.00 0.00 64.34 60.69 1bbd n VAL 84 Cb 0.53 -0.90 -0.10 0.00 -1.06 0.00 0.00 33.84 32.30 1bbd n VAL 84 CO 0.00 0.00 0.00 -1.10 -6.46 0.00 0.00 176.83 169.27 1bbd s GLN 85 N -2.24 1.19 0.22 1.45 -0.21 -1.26 -2.13 119.66 116.68 1bbd s GLN 85 Ca 0.69 -1.48 -0.12 0.00 0.02 0.00 0.00 55.36 54.48 1bbd s GLN 85 Cb -0.47 -0.94 0.29 0.00 1.00 0.00 0.00 33.01 32.89 1bbd s GLN 85 CO 0.53 0.15 1.37 0.00 -2.12 0.00 0.00 175.29 175.22 1bbd n ALA 86 N -0.13 0.02 1.02 6.09 0.00 -1.26 0.25 120.51 126.50 1bbd n ALA 86 Ca -0.10 0.91 0.00 0.00 0.00 0.00 0.00 53.44 54.25 1bbd n ALA 86 Cb 0.60 -0.47 0.00 0.00 0.00 0.00 0.00 19.45 19.58 1bbd n ALA 86 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1bbd n GLU 87 N -5.35 0.51 -0.46 0.00 0.28 -1.09 -2.63 120.64 111.91 1bbd n GLU 87 Ca 0.11 0.00 0.08 0.00 -0.16 0.00 0.00 57.16 57.19 1bbd n GLU 87 Cb 0.39 -1.00 0.28 0.00 1.43 0.00 0.00 31.44 32.53 1bbd n GLU 87 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1bbd n ASP 88 N -0.50 4.06 -4.67 -1.84 8.00 0.71 -4.92 116.55 117.39 1bbd n ASP 88 Ca 0.00 -2.48 -0.43 0.00 0.71 0.00 0.00 54.79 52.59 1bbd n ASP 88 Cb 0.00 -0.48 -0.02 0.00 -0.02 0.00 0.00 41.12 40.60 1bbd n ASP 88 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1bbd s LEU 89 N -1.88 4.18 0.00 0.64 2.96 -1.08 -4.90 118.68 118.61 1bbd s LEU 89 Ca 0.41 1.55 0.00 0.00 -0.22 0.00 0.00 54.13 55.87 1bbd s LEU 89 Cb 0.28 -3.55 0.00 0.00 0.50 0.00 0.00 46.19 43.42 1bbd s LEU 89 CO 0.18 -0.61 0.00 0.00 -1.32 0.00 0.00 176.35 174.60 1bbd n ALA 90 N 5.85 0.00 -2.81 5.97 0.00 -1.21 -4.65 120.51 123.66 1bbd n ALA 90 Ca 0.11 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.21 1bbd n ALA 90 Cb 0.47 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.82 1bbd n ALA 90 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1bbd s VAL 91 N -2.30 4.54 -0.19 0.00 1.01 0.12 -2.14 120.40 121.44 1bbd s VAL 91 Ca 0.00 -0.14 -0.05 0.00 0.00 0.00 0.00 61.98 61.79 1bbd s VAL 91 Cb 0.00 -2.99 -0.03 0.00 0.00 0.00 0.00 36.38 33.36 1bbd s VAL 91 CO 0.00 0.52 0.00 -0.31 0.00 0.00 0.00 175.10 175.31 1bbd s TYR 92 N -0.10 3.07 0.22 5.22 1.51 -0.86 0.17 117.35 126.58 1bbd s TYR 92 Ca 0.05 -0.33 0.10 0.00 -1.01 0.00 0.00 57.07 55.88 1bbd s TYR 92 Cb -0.12 -2.06 -0.04 0.00 -0.11 0.00 0.00 41.96 39.62 1bbd s TYR 92 CO 0.02 -0.13 -0.13 0.71 -1.11 0.00 0.00 175.55 174.90 1bbd s TYR 93 N 0.77 2.50 0.05 2.71 1.51 -0.73 -1.94 117.35 122.23 1bbd s TYR 93 Ca 0.00 -0.27 0.04 0.00 -1.01 0.00 0.00 57.07 55.83 1bbd s TYR 93 Cb -0.14 -1.18 -0.02 0.00 -0.11 0.00 0.00 41.96 40.51 1bbd s TYR 93 CO 0.02 0.57 -0.12 0.00 -1.11 0.00 0.00 175.55 174.91 1bbd s GLN 95 N -1.38 0.49 -0.24 0.00 0.74 0.16 -0.52 119.66 118.91 1bbd s GLN 95 Ca -0.02 -0.93 -0.19 0.00 0.05 0.00 0.00 55.36 54.27 1bbd s GLN 95 Cb -0.09 0.17 -0.02 0.00 1.10 0.00 0.00 33.01 34.17 1bbd s GLN 95 CO 0.01 -0.09 0.57 1.21 -0.55 0.00 0.00 175.29 176.44 1bbd s ASN 96 N -2.26 6.53 0.00 6.67 2.47 -0.83 -1.87 114.94 125.65 1bbd s ASN 96 Ca -0.03 0.64 0.10 0.00 0.42 0.00 0.00 52.86 53.99 1bbd s ASN 96 Cb -0.00 -2.31 0.09 0.00 -1.45 0.00 0.00 41.25 37.58 1bbd s ASN 96 CO -0.06 -0.30 0.83 0.59 -3.72 0.00 0.00 177.10 174.45 1bbd n ASN 97 N 5.44 1.88 0.00 -4.21 4.13 -0.47 -3.97 115.26 118.06 1bbd n ASN 97 Ca -0.03 -1.44 0.00 0.00 1.68 0.00 0.00 54.58 54.79 1bbd n ASN 97 Cb 0.50 -0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.73 1bbd n ASN 97 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1bbd n TYR 98 N 0.58 0.00 -4.22 3.10 9.36 -1.17 -4.91 117.16 119.89 1bbd n TYR 98 Ca 0.06 0.00 -0.24 0.00 3.32 0.00 0.00 57.90 61.05 1bbd n TYR 98 Cb 0.26 0.00 -0.07 0.00 -0.63 0.00 0.00 39.34 38.91 1bbd n TYR 98 CO 0.00 0.00 0.00 -0.80 0.22 0.00 0.00 176.86 176.28 1bbd s ASN 99 N -1.68 4.88 0.33 2.98 0.01 -1.26 -5.09 114.94 115.11 1bbd s ASN 99 Ca 0.00 -0.47 -0.26 0.00 -0.71 0.00 0.00 52.86 51.42 1bbd s ASN 99 Cb 0.00 -1.05 -0.10 0.00 0.41 0.00 0.00 41.25 40.52 1bbd s ASN 99 CO 0.00 0.01 0.99 -0.31 -1.51 0.00 0.00 177.10 176.28 1bbd s TYR 100 N -2.12 3.60 0.51 2.20 1.51 -1.26 -4.07 117.35 117.72 1bbd s TYR 100 Ca 0.31 1.75 -0.20 0.00 -1.01 0.00 0.00 57.07 57.92 1bbd s TYR 100 Cb -0.08 -3.01 -0.07 0.00 -0.11 0.00 0.00 41.96 38.69 1bbd s TYR 100 CO 0.21 -0.05 1.07 -1.25 -1.11 0.00 0.00 175.55 174.42 1bbd s PRO 101 N -2.04 3.63 -1.05 -1.71 0.04 -1.26 -4.86 135.00 127.75 1bbd s PRO 101 Ca 0.51 1.44 -0.22 0.00 0.04 0.00 0.00 61.00 62.76 1bbd s PRO 101 Cb -0.21 -2.06 0.04 0.00 0.04 0.00 0.00 34.50 32.31 1bbd s PRO 101 CO 0.27 -0.58 1.54 -0.51 0.04 0.00 0.00 177.00 177.75 1bbd s LEU 102 N -3.63 3.51 0.28 -3.56 1.43 -1.26 -4.74 118.68 110.72 1bbd s LEU 102 Ca 0.69 -1.53 -0.29 0.00 -1.03 0.00 0.00 54.13 51.97 1bbd s LEU 102 Cb -0.19 -2.57 -0.09 0.00 0.03 0.00 0.00 46.19 43.37 1bbd s LEU 102 CO 0.23 -1.58 1.03 0.42 0.23 0.00 0.00 176.35 176.68 1bbd s THR 103 N 5.36 3.74 -0.08 5.49 -4.23 -1.25 -4.74 115.64 119.92 1bbd s THR 103 Ca 0.49 1.69 -0.05 0.00 -1.18 0.00 0.00 61.69 62.64 1bbd s THR 103 Cb 0.00 -4.05 -0.04 0.00 1.34 0.00 0.00 72.50 69.75 1bbd s THR 103 CO -0.06 0.35 0.13 -0.36 -0.54 0.00 0.00 174.62 174.14 1bbd s PHE 104 N -1.25 3.51 1.28 3.99 0.40 -1.26 -1.97 117.98 122.68 1bbd s PHE 104 Ca 0.45 0.42 -0.20 0.00 -0.60 0.00 0.00 56.93 57.00 1bbd s PHE 104 Cb -0.28 -1.88 0.31 0.00 0.51 0.00 0.00 43.02 41.68 1bbd s PHE 104 CO 0.36 0.67 1.04 0.20 0.70 0.00 0.00 175.22 178.19 1bbd s GLY 105 N -1.28 1.52 0.00 4.36 0.00 0.32 -4.82 107.32 107.42 1bbd s GLY 105 Ca 0.18 -0.87 0.27 0.00 0.00 0.00 0.00 44.72 44.30 1bbd s GLY 105 CO 0.08 0.05 1.58 0.00 0.00 0.00 0.00 173.10 174.81 1bbd n ALA 106 N -5.08 2.75 0.00 3.20 0.00 -1.26 -4.67 120.51 115.46 1bbd n ALA 106 Ca 0.13 -0.48 0.00 0.00 0.00 0.00 0.00 53.44 53.08 1bbd n ALA 106 Cb 0.59 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 18.97 1bbd n ALA 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bbd n GLY 107 N 1.26 2.76 2.56 0.00 0.00 -1.26 -5.06 105.19 105.45 1bbd n GLY 107 Ca 0.16 -1.92 -0.28 0.00 0.00 0.00 0.00 46.02 43.98 1bbd n GLY 107 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1bbd s THR 108 N -2.87 -0.05 -0.03 2.61 2.01 -0.82 -4.60 115.64 111.90 1bbd s THR 108 Ca 0.00 -0.65 -0.29 0.00 0.31 0.00 0.00 61.69 61.06 1bbd s THR 108 Cb 0.00 -0.91 -0.03 0.00 0.01 0.00 0.00 72.50 71.57 1bbd s THR 108 CO 0.00 -0.63 0.95 -0.75 -0.69 0.00 0.00 174.62 173.50 1bbd s LYS 109 N 2.10 4.52 -0.46 4.92 2.47 0.26 -2.03 119.74 131.52 1bbd s LYS 109 Ca 0.07 1.34 -0.02 0.00 -1.56 0.00 0.00 55.97 55.81 1bbd s LYS 109 Cb -0.16 -3.48 0.12 0.00 -1.46 0.00 0.00 37.83 32.86 1bbd s LYS 109 CO -0.31 -0.09 0.25 -1.17 0.16 0.00 0.00 175.35 174.19 1bbd s LEU 110 N 1.18 5.16 0.23 5.43 2.96 -0.91 -0.42 118.68 132.32 1bbd s LEU 110 Ca 0.49 -2.29 -0.02 0.00 -0.22 0.00 0.00 54.13 52.09 1bbd s LEU 110 Cb -0.20 -1.81 -0.05 0.00 0.50 0.00 0.00 46.19 44.64 1bbd s LEU 110 CO 0.25 -0.47 0.45 -1.61 -1.32 0.00 0.00 176.35 173.65 1bbd s GLU 111 N 0.75 3.57 0.14 1.98 2.02 -0.93 -3.31 118.70 122.92 1bbd s GLU 111 Ca 0.11 -0.20 0.07 0.00 0.02 0.00 0.00 54.97 54.97 1bbd s GLU 111 Cb -0.22 -2.77 -0.04 0.00 0.10 0.00 0.00 34.13 31.20 1bbd s GLU 111 CO -0.04 0.34 -0.04 -0.51 0.02 0.00 0.00 175.26 175.02 1bbd s LEU 112 N -3.37 3.23 0.02 1.80 2.01 -1.26 -3.32 118.68 117.78 1bbd s LEU 112 Ca 0.41 -0.37 0.02 0.00 0.01 0.00 0.00 54.13 54.20 1bbd s LEU 112 Cb -0.11 -1.94 -0.04 0.00 0.01 0.00 0.00 46.19 44.11 1bbd s LEU 112 CO 0.29 0.13 0.00 -0.75 1.01 0.00 0.00 176.35 177.04 1bbd s LYS 113 N -2.58 2.76 0.24 1.70 2.20 -0.79 -4.94 119.74 118.33 1bbd s LYS 113 Ca 0.25 -0.65 -0.21 0.00 -0.36 0.00 0.00 55.97 55.00 1bbd s LYS 113 Cb -0.10 -2.65 0.06 0.00 -1.51 0.00 0.00 37.83 33.62 1bbd s LYS 113 CO 0.17 0.61 0.92 -0.98 -0.36 0.00 0.00 175.35 175.70 1bbd s ARG 114 N -1.70 1.58 0.30 4.03 1.70 -1.26 -4.29 118.95 119.30 1bbd s ARG 114 Ca 0.21 -0.97 -0.30 0.00 -0.47 0.00 0.00 55.73 54.20 1bbd s ARG 114 Cb -0.12 0.47 -0.12 0.00 -0.57 0.00 0.00 34.95 34.62 1bbd s ARG 114 CO 0.12 -0.73 1.54 0.00 -1.08 0.00 0.00 175.30 175.15 1bbd n ALA 115 N -0.57 2.29 -1.34 7.88 0.00 -1.26 -4.91 120.51 122.59 1bbd n ALA 115 Ca -0.05 0.37 -0.35 0.00 0.00 0.00 0.00 53.44 53.40 1bbd n ALA 115 Cb 0.60 -2.42 0.09 0.00 0.00 0.00 0.00 19.45 17.71 1bbd n ALA 115 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1bbd n ASP 116 N 1.87 0.59 -3.58 0.00 8.00 -1.26 -4.84 116.55 117.33 1bbd n ASP 116 Ca 0.08 0.66 -0.15 0.00 0.71 0.00 0.00 54.79 56.09 1bbd n ASP 116 Cb 0.36 -1.42 -0.06 0.00 -0.02 0.00 0.00 41.12 39.98 1bbd n ASP 116 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1bbd s ALA 117 N -1.83 -1.80 0.17 2.24 0.00 0.32 -4.93 121.76 115.93 1bbd s ALA 117 Ca 0.74 1.67 -0.11 0.00 0.00 0.00 0.00 51.96 54.25 1bbd s ALA 117 Cb -0.34 -0.63 -0.07 0.00 0.00 0.00 0.00 23.12 22.08 1bbd s ALA 117 CO 0.50 -0.34 0.52 0.00 0.00 0.00 0.00 175.76 176.43 1bbd s ALA 118 N -0.44 3.61 1.09 0.00 0.00 -1.26 -2.58 121.76 122.17 1bbd s ALA 118 Ca -0.05 -0.25 -0.13 0.00 0.00 0.00 0.00 51.96 51.54 1bbd s ALA 118 Cb -0.02 -2.43 0.21 0.00 0.00 0.00 0.00 23.12 20.88 1bbd s ALA 118 CO 0.05 0.50 0.87 -2.30 0.00 0.00 0.00 175.76 174.88 1bbd n PRO 119 N 0.40 -1.71 -4.74 0.00 -0.01 -1.26 -4.54 135.00 123.14 1bbd n PRO 119 Ca -0.03 -0.46 -0.28 0.00 -0.01 0.00 0.00 63.50 62.71 1bbd n PRO 119 Cb 0.52 -2.13 -0.17 0.00 -0.01 0.00 0.00 33.50 31.71 1bbd n PRO 119 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 175.50 176.48 1bbd s THR 120 N -2.44 1.57 0.03 3.45 2.01 -0.80 -4.89 115.64 114.57 1bbd s THR 120 Ca 0.66 -0.72 0.08 0.00 0.31 0.00 0.00 61.69 62.01 1bbd s THR 120 Cb -0.23 -1.40 -0.03 0.00 0.01 0.00 0.00 72.50 70.85 1bbd s THR 120 CO 0.64 0.45 -0.21 -0.69 -0.69 0.00 0.00 174.62 174.12 1bbd s VAL 121 N 0.68 2.58 0.03 3.82 1.01 -1.26 -0.13 120.40 127.13 1bbd s VAL 121 Ca -0.13 -1.21 -0.13 0.00 0.00 0.00 0.00 61.98 60.50 1bbd s VAL 121 Cb -0.16 -2.05 0.02 0.00 0.00 0.00 0.00 36.38 34.19 1bbd s VAL 121 CO 0.03 0.38 0.29 -0.94 0.00 0.00 0.00 175.10 174.86 1bbd s SER 122 N -1.29 -0.11 0.02 3.32 1.04 -0.58 -4.96 113.70 111.13 1bbd s SER 122 Ca 0.13 -0.17 0.03 0.00 0.48 0.00 0.00 55.95 56.42 1bbd s SER 122 Cb -0.10 0.34 -0.01 0.00 0.10 0.00 0.00 66.02 66.34 1bbd s SER 122 CO 0.04 -0.58 -0.08 -0.51 0.98 0.00 0.00 173.24 173.08 1bbd s ILE 123 N -2.35 0.63 -0.08 -1.02 2.07 -1.26 -2.06 121.20 117.13 1bbd s ILE 123 Ca -0.06 -0.68 0.02 0.00 -1.41 0.00 0.00 60.65 58.51 1bbd s ILE 123 Cb -0.02 -0.60 0.02 0.00 0.13 0.00 0.00 42.46 41.99 1bbd s ILE 123 CO -0.02 -0.06 -0.12 -0.36 -1.91 0.00 0.00 174.94 172.47 1bbd s PHE 124 N -0.69 1.52 1.14 3.50 0.40 0.33 -4.98 117.98 119.21 1bbd s PHE 124 Ca -0.02 -0.63 -0.12 0.00 -0.60 0.00 0.00 56.93 55.56 1bbd s PHE 124 Cb -0.06 -1.15 0.27 0.00 0.51 0.00 0.00 43.02 42.60 1bbd s PHE 124 CO 0.00 -0.35 1.04 -1.25 0.70 0.00 0.00 175.22 175.36 1bbd s PRO 125 N 0.93 -0.78 0.14 0.24 0.04 -1.26 -3.02 135.00 131.29 1bbd s PRO 125 Ca -0.09 0.95 -0.02 0.00 0.04 0.00 0.00 61.00 61.88 1bbd s PRO 125 Cb -0.15 -1.56 0.03 0.00 0.04 0.00 0.00 34.50 32.86 1bbd s PRO 125 CO 0.00 -3.66 0.07 -2.30 0.04 0.00 0.00 177.00 171.15 1bbd n PRO 126 N -4.89 -0.91 -4.00 0.56 -0.02 -1.25 -4.83 135.00 119.67 1bbd n PRO 126 Ca 0.04 -0.12 -0.10 0.00 -2.02 0.00 0.00 63.50 61.30 1bbd n PRO 126 Cb 0.54 -0.20 -0.11 0.00 -0.02 0.00 0.00 33.50 33.71 1bbd n PRO 126 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1bbd s SER 127 N -1.76 0.36 0.12 2.55 1.04 -1.26 -5.02 113.70 109.73 1bbd s SER 127 Ca 0.06 -0.49 -0.28 0.00 0.48 0.00 0.00 55.95 55.72 1bbd s SER 127 Cb -0.01 0.08 -0.06 0.00 0.10 0.00 0.00 66.02 66.13 1bbd s SER 127 CO 0.05 -0.27 1.62 0.28 0.98 0.00 0.00 173.24 175.89 1bbd h SER 128 N 4.67 -0.94 -1.00 7.02 0.02 -1.99 0.12 113.55 121.45 1bbd h SER 128 Ca -0.33 0.12 0.23 0.00 -0.84 0.00 0.00 61.79 60.98 1bbd h SER 128 Cb 1.21 0.37 -0.10 0.00 0.14 0.00 0.00 62.40 64.02 1bbd h SER 128 CO 0.41 -0.39 0.63 1.05 -1.14 0.00 0.00 176.83 177.40 1bbd h GLU 129 N -0.49 0.49 -0.14 3.45 9.09 -2.00 -1.38 114.58 123.61 1bbd h GLU 129 Ca 0.05 -0.03 -0.20 0.00 0.05 0.00 0.00 59.36 59.24 1bbd h GLU 129 Cb 0.56 -0.11 0.01 0.00 -1.65 0.00 0.00 28.75 27.56 1bbd h GLU 129 CO -0.24 0.33 -0.68 0.37 0.05 0.00 0.00 179.01 178.84 1bbd h GLN 130 N 0.51 0.70 -0.85 1.06 4.15 -1.17 -3.08 115.11 116.42 1bbd h GLN 130 Ca 0.58 -0.57 0.09 0.00 0.77 0.00 0.00 58.65 59.51 1bbd h GLN 130 Cb 1.27 0.12 -0.07 0.00 0.21 0.00 0.00 27.48 29.01 1bbd h GLN 130 CO -0.32 1.19 0.51 -0.07 -1.93 0.00 0.00 178.83 178.21 1bbd h LEU 131 N 0.39 0.75 -0.28 -2.39 3.38 0.20 -0.69 115.31 116.67 1bbd h LEU 131 Ca -0.05 0.04 0.06 0.00 0.09 0.00 0.00 57.88 58.03 1bbd h LEU 131 Cb 1.31 -0.11 -0.08 0.00 0.09 0.00 0.00 40.66 41.88 1bbd h LEU 131 CO 0.14 0.44 -0.32 0.74 0.09 0.00 0.00 178.44 179.54 1bbd h THR 132 N 0.87 0.27 0.00 0.22 2.02 -1.56 1.33 112.91 116.06 1bbd h THR 132 Ca 0.40 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.58 1bbd h THR 132 Cb 0.32 0.27 0.00 0.00 -1.74 0.00 0.00 68.15 66.99 1bbd h THR 132 CO -0.23 0.00 0.12 0.77 0.37 0.00 0.00 175.52 176.55 1bbd h SER 133 N -0.31 0.00 -3.10 4.18 4.64 -1.07 -3.45 113.55 114.45 1bbd h SER 133 Ca 0.14 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.32 1bbd h SER 133 Cb 0.53 0.00 0.06 0.00 -0.31 0.00 0.00 62.40 62.68 1bbd h SER 133 CO -0.45 0.00 -0.27 0.61 -0.87 0.00 0.00 176.83 175.85 1bbd n GLY 134 N -1.27 0.26 3.07 -0.77 0.00 0.46 -5.07 105.19 101.87 1bbd n GLY 134 Ca -0.01 -0.30 -0.08 0.00 0.00 0.00 0.00 46.02 45.63 1bbd n GLY 134 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1bbd s GLY 135 N -3.33 0.32 -0.09 -0.02 0.00 -1.00 -3.56 107.32 99.65 1bbd s GLY 135 Ca 0.10 -0.86 -0.04 0.00 0.00 0.00 0.00 44.72 43.92 1bbd s GLY 135 CO 0.27 -0.97 0.18 0.00 0.00 0.00 0.00 173.10 172.58 1bbd s ALA 136 N -2.92 -0.28 -0.13 3.20 0.00 -1.00 -3.02 121.76 117.61 1bbd s ALA 136 Ca -0.02 0.69 0.01 0.00 0.00 0.00 0.00 51.96 52.64 1bbd s ALA 136 Cb 0.01 -0.71 0.02 0.00 0.00 0.00 0.00 23.12 22.44 1bbd s ALA 136 CO -0.06 -0.41 -0.16 -1.12 0.00 0.00 0.00 175.76 174.01 1bbd s SER 137 N 1.85 2.64 -0.21 0.00 0.01 -1.26 0.18 113.70 116.92 1bbd s SER 137 Ca -0.02 -0.48 -0.06 0.00 1.31 0.00 0.00 55.95 56.70 1bbd s SER 137 Cb -0.12 -1.19 -0.03 0.00 0.21 0.00 0.00 66.02 64.90 1bbd s SER 137 CO -0.06 0.00 0.02 -0.69 0.41 0.00 0.00 173.24 172.91 1bbd s VAL 138 N 1.13 4.04 -0.03 3.43 1.01 0.20 -3.76 120.40 126.42 1bbd s VAL 138 Ca -0.02 -0.28 0.02 0.00 0.00 0.00 0.00 61.98 61.70 1bbd s VAL 138 Cb -0.14 -2.84 -0.03 0.00 0.00 0.00 0.00 36.38 33.37 1bbd s VAL 138 CO -0.05 0.41 -0.08 -0.69 0.00 0.00 0.00 175.10 174.69 1bbd s VAL 139 N 1.12 3.56 -0.05 2.92 1.01 -1.17 -0.80 120.40 126.99 1bbd s VAL 139 Ca 0.03 -0.66 0.02 0.00 0.00 0.00 0.00 61.98 61.36 1bbd s VAL 139 Cb -0.14 -2.49 0.02 0.00 0.00 0.00 0.00 36.38 33.76 1bbd s VAL 139 CO 0.02 0.50 -0.08 0.00 0.00 0.00 0.00 175.10 175.54 1bbd s PHE 141 N 0.75 2.86 -0.54 0.00 0.08 -0.88 0.10 117.98 120.36 1bbd s PHE 141 Ca -0.13 -0.69 -0.03 0.00 0.12 0.00 0.00 56.93 56.20 1bbd s PHE 141 Cb -0.15 -1.90 0.14 0.00 -0.57 0.00 0.00 43.02 40.54 1bbd s PHE 141 CO 0.02 -0.27 0.35 -0.51 -0.10 0.00 0.00 175.22 174.71 1bbd s LEU 142 N 0.56 5.28 -0.02 -0.37 1.02 -0.43 -1.53 118.68 123.19 1bbd s LEU 142 Ca -0.07 -2.50 0.02 0.00 0.02 0.00 0.00 54.13 51.60 1bbd s LEU 142 Cb -0.15 -1.85 -0.03 0.00 0.02 0.00 0.00 46.19 44.17 1bbd s LEU 142 CO 0.03 -0.45 -0.05 0.20 0.02 0.00 0.00 176.35 176.10 1bbd s ASN 143 N 1.22 4.75 -0.56 2.29 0.02 0.82 -1.14 114.94 122.34 1bbd s ASN 143 Ca 0.13 -0.07 -0.01 0.00 -1.02 0.00 0.00 52.86 51.89 1bbd s ASN 143 Cb -0.21 -1.17 -0.01 0.00 0.02 0.00 0.00 41.25 39.87 1bbd s ASN 143 CO -0.04 0.31 0.47 0.59 0.02 0.00 0.00 177.10 178.46 1bbd n ASN 144 N 1.74 -2.96 -2.91 -1.22 4.13 0.17 -1.91 115.26 112.30 1bbd n ASN 144 Ca -0.16 -0.32 -0.06 0.00 1.68 0.00 0.00 54.58 55.71 1bbd n ASN 144 Cb 0.53 -2.79 0.02 0.00 -1.54 0.00 0.00 39.78 36.00 1bbd n ASN 144 CO 0.00 0.00 0.00 2.22 0.28 0.00 0.00 177.26 179.76 1bbd n PHE 145 N -2.46 -2.57 0.00 3.10 -1.74 -0.88 -4.42 117.46 108.50 1bbd n PHE 145 Ca -0.10 -0.67 0.00 0.00 -0.56 0.00 0.00 57.45 56.13 1bbd n PHE 145 Cb 0.57 -0.17 0.00 0.00 1.52 0.00 0.00 39.48 41.41 1bbd n PHE 145 CO 0.00 0.00 0.00 0.98 -0.56 0.00 0.00 176.76 177.18 1bbd n TYR 146 N -1.33 0.00 -1.31 2.97 9.36 -1.06 -0.30 117.16 125.49 1bbd n TYR 146 Ca 0.04 0.00 -0.30 0.00 3.32 0.00 0.00 57.90 60.97 1bbd n TYR 146 Cb 0.19 0.00 0.22 0.00 -0.63 0.00 0.00 39.34 39.11 1bbd n TYR 146 CO 0.00 0.00 0.00 -1.25 0.22 0.00 0.00 176.86 175.83 1bbd s PRO 147 N 0.00 -0.57 0.28 2.98 0.04 -1.26 0.12 135.00 136.59 1bbd s PRO 147 Ca 0.00 -0.09 0.25 0.00 0.04 0.00 0.00 61.00 61.20 1bbd s PRO 147 Cb 0.00 -1.67 0.73 0.00 0.04 0.00 0.00 34.50 33.59 1bbd s PRO 147 CO 0.00 -3.27 1.74 1.57 0.04 0.00 0.00 177.00 177.08 1bbd h LYS 148 N -2.27 0.00 -6.23 4.56 2.10 -1.99 -3.44 116.57 109.30 1bbd h LYS 148 Ca -0.46 0.00 -0.57 0.00 -2.00 0.00 0.00 60.65 57.63 1bbd h LYS 148 Cb 1.29 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 32.58 1bbd h LYS 148 CO 0.38 0.00 0.97 -0.51 -2.00 0.00 0.00 179.45 178.29 1bbd s ASP 149 N -4.95 6.78 0.02 7.07 1.01 -1.26 -5.02 116.67 120.31 1bbd s ASP 149 Ca 0.09 1.64 -0.07 0.00 0.71 0.00 0.00 52.55 54.92 1bbd s ASP 149 Cb 0.10 -2.54 -0.00 0.00 1.01 0.00 0.00 42.92 41.49 1bbd s ASP 149 CO 0.60 -0.92 0.13 -0.51 0.21 0.00 0.00 175.17 174.68 1bbd s ILE 150 N 3.98 0.10 -0.14 0.77 2.07 -1.26 -4.75 121.20 121.97 1bbd s ILE 150 Ca 0.59 -0.81 0.01 0.00 -1.41 0.00 0.00 60.65 59.03 1bbd s ILE 150 Cb -0.22 -0.59 0.02 0.00 0.13 0.00 0.00 42.46 41.79 1bbd s ILE 150 CO 0.20 -0.45 -0.16 0.21 -1.91 0.00 0.00 174.94 172.83 1bbd s ASN 151 N -1.64 2.69 -0.10 4.50 3.04 -0.87 -4.96 114.94 117.60 1bbd s ASN 151 Ca -0.11 -0.50 0.01 0.00 0.04 0.00 0.00 52.86 52.30 1bbd s ASN 151 Cb -0.05 -1.21 -0.02 0.00 -1.54 0.00 0.00 41.25 38.43 1bbd s ASN 151 CO -0.00 -0.01 -0.13 -0.69 -3.04 0.00 0.00 177.10 173.23 1bbd s VAL 152 N 1.20 3.08 -0.01 -5.21 1.01 -1.26 -0.14 120.40 119.07 1bbd s VAL 152 Ca -0.01 -0.68 0.06 0.00 0.00 0.00 0.00 61.98 61.35 1bbd s VAL 152 Cb -0.14 -2.26 -0.02 0.00 0.00 0.00 0.00 36.38 33.96 1bbd s VAL 152 CO -0.06 0.55 -0.19 -0.54 0.00 0.00 0.00 175.10 174.85 1bbd s LYS 153 N -0.09 1.52 -0.08 2.72 3.01 0.15 -4.96 119.74 122.02 1bbd s LYS 153 Ca -0.02 -0.72 0.00 0.00 -1.01 0.00 0.00 55.97 54.22 1bbd s LYS 153 Cb -0.14 -1.49 -0.03 0.00 -1.01 0.00 0.00 37.83 35.16 1bbd s LYS 153 CO 0.04 0.41 -0.06 -1.58 0.51 0.00 0.00 175.35 174.67 1bbd s TRP 154 N -0.50 2.98 -0.03 3.18 0.52 -1.26 0.75 118.94 124.58 1bbd s TRP 154 Ca 0.07 0.02 0.05 0.00 0.02 0.00 0.00 56.10 56.27 1bbd s TRP 154 Cb -0.08 -1.74 -0.01 0.00 -1.15 0.00 0.00 33.47 30.49 1bbd s TRP 154 CO -0.00 0.33 -0.18 0.15 0.02 0.00 0.00 176.95 177.26 1bbd s LYS 155 N -0.73 1.65 -0.26 4.98 -0.14 0.04 -1.54 119.74 123.74 1bbd s LYS 155 Ca 0.11 -0.63 -0.07 0.00 -1.36 0.00 0.00 55.97 54.02 1bbd s LYS 155 Cb -0.11 -1.50 -0.01 0.00 -1.68 0.00 0.00 37.83 34.52 1bbd s LYS 155 CO 0.02 0.31 0.06 0.42 -0.76 0.00 0.00 175.35 175.40 1bbd s ILE 156 N -0.18 4.09 -1.67 2.17 1.01 0.54 -1.32 121.20 125.85 1bbd s ILE 156 Ca 0.01 -0.38 -0.16 0.00 0.00 0.00 0.00 60.65 60.12 1bbd s ILE 156 Cb -0.09 -2.97 0.14 0.00 0.01 0.00 0.00 42.46 39.54 1bbd s ILE 156 CO 0.01 0.26 0.75 0.47 0.00 0.00 0.00 174.94 176.43 1bbd n ASP 157 N 4.89 -2.98 0.00 3.58 8.00 0.39 -1.18 116.55 129.25 1bbd n ASP 157 Ca -0.16 -1.01 0.00 0.00 0.71 0.00 0.00 54.79 54.33 1bbd n ASP 157 Cb 0.50 -2.81 0.00 0.00 -0.02 0.00 0.00 41.12 38.79 1bbd n ASP 157 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1bbd n GLY 158 N -1.49 2.57 3.91 0.44 0.00 -1.26 -5.03 105.19 104.33 1bbd n GLY 158 Ca 0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 1bbd n GLY 158 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1bbd s SER 159 N -1.53 6.38 0.30 1.61 0.01 -0.32 -4.97 113.70 115.18 1bbd s SER 159 Ca 0.00 0.33 -0.24 0.00 1.31 0.00 0.00 55.95 57.34 1bbd s SER 159 Cb 0.00 -1.99 -0.09 0.00 0.21 0.00 0.00 66.02 64.15 1bbd s SER 159 CO 0.00 0.20 0.89 -0.70 0.41 0.00 0.00 173.24 174.03 1bbd s GLU 160 N -2.29 4.50 -0.03 12.44 2.12 -1.26 0.20 118.70 134.38 1bbd s GLU 160 Ca 0.32 1.21 0.05 0.00 0.36 0.00 0.00 54.97 56.91 1bbd s GLU 160 Cb -0.13 -2.82 -0.01 0.00 0.26 0.00 0.00 34.13 31.43 1bbd s GLU 160 CO 0.24 0.31 -0.18 0.50 -0.54 0.00 0.00 175.26 175.59 1bbd s ARG 161 N -2.03 1.69 0.00 4.30 3.52 -0.59 -4.86 118.95 120.98 1bbd s ARG 161 Ca 0.48 -0.64 0.00 0.00 -0.13 0.00 0.00 55.73 55.44 1bbd s ARG 161 Cb -0.18 -1.53 0.00 0.00 -1.56 0.00 0.00 34.95 31.68 1bbd s ARG 161 CO 0.23 0.32 0.00 0.94 -0.81 0.00 0.00 175.30 175.98 1bbd n GLN 162 N 2.90 2.45 -2.21 5.12 -0.06 -1.26 -4.29 117.38 120.03 1bbd n GLN 162 Ca -0.17 0.00 -0.41 0.00 -2.00 0.00 0.00 57.00 54.42 1bbd n GLN 162 Cb 0.53 -0.92 -0.03 0.00 -4.06 0.00 0.00 30.24 25.77 1bbd n GLN 162 CO 0.00 0.00 0.00 -0.80 -0.20 0.00 0.00 177.06 176.06 1bbd s ASN 163 N -2.98 6.90 0.00 1.69 -0.87 -1.26 -3.11 114.94 115.30 1bbd s ASN 163 Ca 0.00 2.49 0.00 0.00 -1.57 0.00 0.00 52.86 53.78 1bbd s ASN 163 Cb 0.00 -2.63 0.00 0.00 -0.02 0.00 0.00 41.25 38.60 1bbd s ASN 163 CO 0.00 -0.48 0.00 0.61 -2.57 0.00 0.00 177.10 174.66 1bbd n GLY 164 N 1.68 0.49 3.39 0.66 0.00 -1.26 -4.85 105.19 105.29 1bbd n GLY 164 Ca 0.03 -0.84 -0.39 0.00 0.00 0.00 0.00 46.02 44.83 1bbd n GLY 164 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bbd s VAL 165 N -2.00 4.38 -0.29 1.61 1.01 -1.18 -0.50 120.40 123.43 1bbd s VAL 165 Ca 0.00 -0.65 -0.10 0.00 0.00 0.00 0.00 61.98 61.22 1bbd s VAL 165 Cb 0.00 -3.31 -0.03 0.00 0.00 0.00 0.00 36.38 33.03 1bbd s VAL 165 CO 0.00 -0.03 0.17 -0.76 0.00 0.00 0.00 175.10 174.48 1bbd s LEU 166 N 1.55 4.01 0.34 3.92 1.43 -0.10 -4.95 118.68 124.88 1bbd s LEU 166 Ca 0.03 -0.20 0.07 0.00 -1.03 0.00 0.00 54.13 53.00 1bbd s LEU 166 Cb -0.18 -2.07 -0.02 0.00 0.03 0.00 0.00 46.19 43.96 1bbd s LEU 166 CO 0.05 -0.10 0.40 0.20 0.23 0.00 0.00 176.35 177.13 1bbd s ASN 167 N 1.70 5.72 -0.29 2.29 0.01 -1.26 -2.11 114.94 121.01 1bbd s ASN 167 Ca 0.06 -0.30 -0.19 0.00 -0.71 0.00 0.00 52.86 51.72 1bbd s ASN 167 Cb -0.16 -1.13 0.13 0.00 0.41 0.00 0.00 41.25 40.50 1bbd s ASN 167 CO 0.09 -0.40 0.98 -0.55 -1.51 0.00 0.00 177.10 175.70 1bbd s SER 168 N -4.11 -0.51 0.20 -1.22 0.15 -1.12 -4.99 113.70 102.10 1bbd s SER 168 Ca 0.43 0.87 0.07 0.00 0.70 0.00 0.00 55.95 58.03 1bbd s SER 168 Cb -0.08 1.10 -0.04 0.00 -1.71 0.00 0.00 66.02 65.29 1bbd s SER 168 CO 0.29 -0.14 0.08 0.26 1.20 0.00 0.00 173.24 174.93 1bbd s TRP 169 N 0.97 2.97 0.72 3.44 0.51 -1.26 -1.77 118.94 124.51 1bbd s TRP 169 Ca -0.05 -0.11 0.02 0.00 -2.12 0.00 0.00 56.10 53.84 1bbd s TRP 169 Cb -0.04 -1.40 0.14 0.00 -0.81 0.00 0.00 33.47 31.36 1bbd s TRP 169 CO -0.12 0.53 0.99 0.95 -0.51 0.00 0.00 176.95 178.79 1bbd s THR 170 N -1.89 2.00 0.58 2.01 -4.23 0.12 -4.98 115.64 109.25 1bbd s THR 170 Ca 0.30 -0.70 0.04 0.00 -1.18 0.00 0.00 61.69 60.16 1bbd s THR 170 Cb -0.09 -2.31 0.07 0.00 1.34 0.00 0.00 72.50 71.52 1bbd s THR 170 CO 0.21 0.00 0.80 -1.81 -0.54 0.00 0.00 174.62 173.28 1bbd s ASP 171 N -4.79 5.04 0.28 3.99 1.11 -1.26 -4.55 116.67 116.49 1bbd s ASP 171 Ca 0.67 -0.43 -0.30 0.00 0.18 0.00 0.00 52.55 52.67 1bbd s ASP 171 Cb -0.04 -0.25 -0.13 0.00 1.07 0.00 0.00 42.92 43.57 1bbd s ASP 171 CO 0.44 -1.33 1.46 0.00 1.18 0.00 0.00 175.17 176.93 1bbd n GLN 172 N -2.35 2.31 -1.70 8.23 6.02 -1.26 -4.72 117.38 123.90 1bbd n GLN 172 Ca 0.12 0.82 -0.43 0.00 -0.01 0.00 0.00 57.00 57.50 1bbd n GLN 172 Cb 0.60 -2.51 -0.02 0.00 1.02 0.00 0.00 30.24 29.33 1bbd n GLN 172 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 1bbd n ASP 173 N 1.93 2.97 0.07 1.08 2.03 0.28 -4.82 116.55 120.09 1bbd n ASP 173 Ca 0.09 1.17 0.12 0.00 0.52 0.00 0.00 54.79 56.69 1bbd n ASP 173 Cb 0.34 -1.48 0.45 0.00 -0.72 0.00 0.00 41.12 39.71 1bbd n ASP 173 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 1bbd n SER 174 N 1.60 0.43 -0.08 1.67 7.64 -1.26 -1.63 113.62 121.99 1bbd n SER 174 Ca 0.08 0.57 -0.09 0.00 1.01 0.00 0.00 58.87 60.44 1bbd n SER 174 Cb 0.34 -0.68 -0.11 0.00 -1.01 0.00 0.00 64.21 62.76 1bbd n SER 174 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32 1bbd n LYS 175 N -1.94 1.22 -0.24 1.43 2.85 -1.26 -2.66 118.16 117.56 1bbd n LYS 175 Ca 0.04 0.03 0.04 0.00 -1.05 0.00 0.00 58.31 57.37 1bbd n LYS 175 Cb 0.29 -1.38 0.05 0.00 -0.65 0.00 0.00 35.03 33.34 1bbd n LYS 175 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 177.40 176.95 1bbd n ASP 176 N -2.71 1.08 0.00 -5.58 5.68 -1.24 -4.92 116.55 108.87 1bbd n ASP 176 Ca -0.27 -2.32 0.00 0.00 -0.50 0.00 0.00 54.79 51.70 1bbd n ASP 176 Cb 0.95 -0.25 0.00 0.00 -1.14 0.00 0.00 41.12 40.68 1bbd n ASP 176 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1bbd n SER 177 N -0.60 -2.14 -4.84 -1.12 7.64 -0.64 -4.88 113.62 107.04 1bbd n SER 177 Ca 0.06 0.00 -0.30 0.00 1.01 0.00 0.00 58.87 59.64 1bbd n SER 177 Cb 0.62 -2.83 0.08 0.00 -1.01 0.00 0.00 64.21 61.06 1bbd n SER 177 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1bbd s THR 178 N -1.02 3.07 0.42 0.44 2.01 -1.26 -4.43 115.64 114.87 1bbd s THR 178 Ca 0.00 0.35 0.07 0.00 0.31 0.00 0.00 61.69 62.41 1bbd s THR 178 Cb 0.00 -3.21 -0.06 0.00 0.01 0.00 0.00 72.50 69.25 1bbd s THR 178 CO 0.00 -0.45 0.13 -0.31 -0.69 0.00 0.00 174.62 173.29 1bbd s TYR 179 N -3.27 2.51 0.02 4.92 1.51 0.58 -0.56 117.35 123.06 1bbd s TYR 179 Ca 0.60 -0.64 0.00 0.00 -1.01 0.00 0.00 57.07 56.02 1bbd s TYR 179 Cb -0.13 -1.89 -0.02 0.00 -0.11 0.00 0.00 41.96 39.82 1bbd s TYR 179 CO 0.53 0.25 -0.03 -1.12 -1.11 0.00 0.00 175.55 174.07 1bbd s SER 180 N -3.86 0.22 0.04 2.29 0.01 -1.26 -0.66 113.70 110.48 1bbd s SER 180 Ca 0.37 -0.40 -0.03 0.00 1.31 0.00 0.00 55.95 57.21 1bbd s SER 180 Cb 0.05 0.08 -0.02 0.00 0.21 0.00 0.00 66.02 66.34 1bbd s SER 180 CO 0.20 -0.23 0.03 -0.32 0.41 0.00 0.00 173.24 173.33 1bbd s MET 181 N -1.16 0.53 -0.05 12.44 0.00 -0.29 -0.71 119.30 130.06 1bbd s MET 181 Ca -0.12 -0.85 -0.00 0.00 0.00 0.00 0.00 55.69 54.71 1bbd s MET 181 Cb -0.08 0.20 0.03 0.00 0.00 0.00 0.00 34.83 34.97 1bbd s MET 181 CO -0.01 -0.11 -0.01 0.45 0.00 0.00 0.00 175.02 175.33 1bbd s SER 182 N -2.20 1.05 -0.13 1.11 0.15 -0.73 -1.31 113.70 111.64 1bbd s SER 182 Ca -0.04 -0.08 0.00 0.00 0.70 0.00 0.00 55.95 56.53 1bbd s SER 182 Cb -0.01 -0.38 -0.01 0.00 -1.71 0.00 0.00 66.02 63.91 1bbd s SER 182 CO -0.05 -0.12 -0.14 -0.55 1.20 0.00 0.00 173.24 173.58 1bbd s SER 183 N 1.34 3.89 -0.05 5.45 0.15 0.11 -2.79 113.70 121.80 1bbd s SER 183 Ca -0.05 -0.36 0.03 0.00 0.70 0.00 0.00 55.95 56.27 1bbd s SER 183 Cb -0.13 -1.59 0.01 0.00 -1.71 0.00 0.00 66.02 62.60 1bbd s SER 183 CO -0.02 0.16 -0.14 0.28 1.20 0.00 0.00 173.24 174.72 1bbd s THR 184 N 0.40 1.21 -0.10 6.45 -1.32 -0.89 -0.95 115.64 120.42 1bbd s THR 184 Ca -0.11 -0.55 0.03 0.00 -1.21 0.00 0.00 61.69 59.84 1bbd s THR 184 Cb -0.16 -1.07 -0.01 0.00 -1.51 0.00 0.00 72.50 69.75 1bbd s THR 184 CO 0.05 0.36 -0.20 -0.22 -2.21 0.00 0.00 174.62 172.41 1bbd s LEU 185 N 0.40 2.33 -0.17 9.08 2.96 0.02 -0.92 118.68 132.36 1bbd s LEU 185 Ca -0.10 -0.46 -0.04 0.00 -0.22 0.00 0.00 54.13 53.31 1bbd s LEU 185 Cb -0.14 -1.48 -0.02 0.00 0.50 0.00 0.00 46.19 45.05 1bbd s LEU 185 CO 0.03 0.18 -0.03 -0.89 -1.32 0.00 0.00 176.35 174.32 1bbd s THR 186 N 0.22 3.85 0.35 3.68 2.01 0.34 -0.63 115.64 125.46 1bbd s THR 186 Ca -0.13 -0.36 0.05 0.00 0.31 0.00 0.00 61.69 61.56 1bbd s THR 186 Cb -0.16 -2.71 -0.07 0.00 0.01 0.00 0.00 72.50 69.57 1bbd s THR 186 CO 0.07 0.47 0.04 -0.76 -0.69 0.00 0.00 174.62 173.75 1bbd s LEU 187 N 0.66 2.39 0.76 4.42 1.43 0.13 -4.74 118.68 123.72 1bbd s LEU 187 Ca -0.02 -1.38 -0.10 0.00 -1.03 0.00 0.00 54.13 51.61 1bbd s LEU 187 Cb -0.14 -0.54 0.07 0.00 0.03 0.00 0.00 46.19 45.61 1bbd s LEU 187 CO 0.02 -0.56 1.11 0.42 0.23 0.00 0.00 176.35 177.57 1bbd s THR 188 N -3.12 2.18 0.37 5.49 -4.23 -1.26 -2.37 115.64 112.70 1bbd s THR 188 Ca 0.36 -0.09 0.24 0.00 -1.18 0.00 0.00 61.69 61.01 1bbd s THR 188 Cb 0.09 -3.02 0.25 0.00 1.34 0.00 0.00 72.50 71.16 1bbd s THR 188 CO 0.16 -0.03 1.99 0.50 -0.54 0.00 0.00 174.62 176.71 1bbd h LYS 189 N -0.85 0.00 0.00 3.99 3.64 -1.85 -1.91 116.57 119.59 1bbd h LYS 189 Ca -0.45 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.93 1bbd h LYS 189 Cb 1.32 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.14 1bbd h LYS 189 CO 0.64 0.18 0.00 -0.25 -2.27 0.00 0.00 179.45 177.74 1bbd n ASP 190 N -3.73 0.00 0.00 4.20 8.00 -1.26 -2.59 116.55 121.17 1bbd n ASP 190 Ca -0.02 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.48 1bbd n ASP 190 Cb 0.29 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.39 1bbd n ASP 190 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1bbd n GLU 191 N 0.00 0.00 0.00 -1.24 1.02 -1.25 0.23 120.64 119.39 1bbd n GLU 191 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1bbd n GLU 191 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 1bbd n GLU 191 CO 0.00 0.00 0.00 0.98 1.18 0.00 0.00 177.13 179.29 1bbd n TYR 192 N -2.31 0.00 0.31 -0.32 9.36 -0.72 -2.24 117.16 121.25 1bbd n TYR 192 Ca 0.00 0.00 0.19 0.00 3.32 0.00 0.00 57.90 61.41 1bbd n TYR 192 Cb 0.00 -0.47 1.04 0.00 -0.63 0.00 0.00 39.34 39.28 1bbd n TYR 192 CO 0.00 0.00 0.00 0.93 0.22 0.00 0.00 176.86 178.01 1bbd h GLU 193 N 0.00 0.00 -0.59 2.98 5.08 0.31 -2.23 114.58 120.12 1bbd h GLU 193 Ca 0.00 0.00 0.10 0.00 -1.00 0.00 0.00 59.36 58.46 1bbd h GLU 193 Cb 0.00 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.21 1bbd h GLU 193 CO 0.00 0.00 0.40 0.00 -1.00 0.00 0.00 179.01 178.41 1bbd h ARG 194 N 0.00 0.40 -5.54 2.33 3.08 -1.34 -3.44 114.38 109.88 1bbd h ARG 194 Ca 0.01 -0.02 -0.64 0.00 0.07 0.00 0.00 59.98 59.41 1bbd h ARG 194 Cb 0.19 -0.09 -0.09 0.00 0.08 0.00 0.00 29.97 30.06 1bbd h ARG 194 CO -0.00 0.26 -0.42 -1.01 -1.07 0.00 0.00 179.97 177.74 1bbd s HIS 195 N -5.39 1.75 0.00 3.04 3.76 -0.84 -5.06 115.29 112.54 1bbd s HIS 195 Ca -0.08 -0.90 0.00 0.00 -0.15 0.00 0.00 55.06 53.93 1bbd s HIS 195 Cb 0.20 -1.75 0.00 0.00 1.11 0.00 0.00 32.58 32.13 1bbd s HIS 195 CO 0.75 -0.10 0.00 0.09 -0.85 0.00 0.00 174.74 174.63 1bbd n ASN 196 N -1.50 0.00 -4.26 1.40 3.02 -1.26 -4.83 115.26 107.83 1bbd n ASN 196 Ca -0.11 0.00 -0.36 0.00 -0.03 0.00 0.00 54.58 54.08 1bbd n ASN 196 Cb 0.66 0.00 -0.13 0.00 -0.61 0.00 0.00 39.78 39.69 1bbd n ASN 196 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1bbd s SER 197 N -0.82 4.75 -0.13 6.41 1.04 -1.26 -0.67 113.70 123.03 1bbd s SER 197 Ca 0.00 -0.87 -0.04 0.00 0.48 0.00 0.00 55.95 55.51 1bbd s SER 197 Cb 0.00 -1.76 -0.04 0.00 0.10 0.00 0.00 66.02 64.32 1bbd s SER 197 CO 0.00 -0.18 0.03 -0.31 0.98 0.00 0.00 173.24 173.76 1bbd s TYR 198 N 1.39 3.23 -0.02 5.02 1.51 -1.00 -0.46 117.35 127.02 1bbd s TYR 198 Ca 0.00 0.14 0.04 0.00 -1.01 0.00 0.00 57.07 56.24 1bbd s TYR 198 Cb -0.17 -1.91 -0.01 0.00 -0.11 0.00 0.00 41.96 39.76 1bbd s TYR 198 CO -0.01 0.35 -0.12 0.99 -1.11 0.00 0.00 175.55 175.65 1bbd s THR 199 N -0.39 0.98 -0.22 -0.71 2.01 -0.43 -2.18 115.64 114.69 1bbd s THR 199 Ca 0.08 -0.51 -0.04 0.00 0.31 0.00 0.00 61.69 61.53 1bbd s THR 199 Cb -0.12 -0.84 -0.01 0.00 0.01 0.00 0.00 72.50 71.54 1bbd s THR 199 CO 0.02 0.28 -0.03 0.00 -0.69 0.00 0.00 174.62 174.20 1bbd s GLU 201 N 1.47 3.03 -0.01 0.00 2.02 0.23 -1.56 118.70 123.88 1bbd s GLU 201 Ca 0.06 -0.84 0.03 0.00 0.02 0.00 0.00 54.97 54.23 1bbd s GLU 201 Cb -0.14 -2.48 -0.03 0.00 0.10 0.00 0.00 34.13 31.57 1bbd s GLU 201 CO -0.03 -0.05 -0.07 0.00 0.02 0.00 0.00 175.26 175.14 1bbd s ALA 202 N 0.91 3.01 -0.10 5.21 0.00 0.51 0.32 121.76 131.61 1bbd s ALA 202 Ca -0.05 -1.00 0.04 0.00 0.00 0.00 0.00 51.96 50.96 1bbd s ALA 202 Cb -0.15 -1.15 -0.00 0.00 0.00 0.00 0.00 23.12 21.82 1bbd s ALA 202 CO -0.04 0.61 -0.24 0.99 0.00 0.00 0.00 175.76 177.08 1bbd s THR 203 N -0.96 2.10 -0.28 0.00 2.01 0.80 -0.21 115.64 119.09 1bbd s THR 203 Ca 0.16 -1.01 -0.19 0.00 0.31 0.00 0.00 61.69 60.96 1bbd s THR 203 Cb -0.11 -1.80 0.09 0.00 0.01 0.00 0.00 72.50 70.69 1bbd s THR 203 CO 0.06 0.56 0.75 -2.28 -0.69 0.00 0.00 174.62 173.02 1bbd s HIS 204 N 0.32 -0.91 0.13 4.92 5.04 -1.26 -2.05 115.29 121.47 1bbd s HIS 204 Ca -0.18 1.93 0.09 0.00 -1.54 0.00 0.00 55.06 55.36 1bbd s HIS 204 Cb -0.18 0.49 0.44 0.00 0.04 0.00 0.00 32.58 33.37 1bbd s HIS 204 CO 0.09 -0.45 0.48 1.17 -2.34 0.00 0.00 174.74 173.69 1bbd n LYS 205 N 3.67 -0.01 -0.13 2.88 4.81 -1.26 0.87 118.16 128.99 1bbd n LYS 205 Ca -0.18 0.39 0.21 0.00 -0.87 0.00 0.00 58.31 57.86 1bbd n LYS 205 Cb 0.58 -0.75 0.62 0.00 0.02 0.00 0.00 35.03 35.49 1bbd n LYS 205 CO 0.00 0.00 0.00 1.15 1.17 0.00 0.00 177.40 179.72 1bbd h THR 206 N 0.00 0.69 -1.70 3.15 2.02 -1.93 -3.43 112.91 111.71 1bbd h THR 206 Ca 0.27 -0.06 -0.60 0.00 0.77 0.00 0.00 66.41 66.79 1bbd h THR 206 Cb 0.81 0.50 -0.13 0.00 -1.74 0.00 0.00 68.15 67.59 1bbd h THR 206 CO -0.17 0.03 -0.54 -0.55 0.37 0.00 0.00 175.52 174.66 1bbd s SER 207 N -5.89 3.37 -0.02 4.18 0.15 0.25 -4.93 113.70 110.81 1bbd s SER 207 Ca -0.06 -1.58 0.08 0.00 0.70 0.00 0.00 55.95 55.09 1bbd s SER 207 Cb 0.21 0.29 -0.12 0.00 -1.71 0.00 0.00 66.02 64.69 1bbd s SER 207 CO 0.76 -0.78 0.16 1.07 1.20 0.00 0.00 173.24 175.65 1bbd n THR 208 N -1.01 0.06 -5.03 6.45 5.66 -1.26 -4.73 114.28 114.43 1bbd n THR 208 Ca -0.10 -0.20 -0.28 0.00 -3.05 0.00 0.00 64.05 60.42 1bbd n THR 208 Cb 0.66 0.18 -0.16 0.00 -1.55 0.00 0.00 70.33 69.46 1bbd n THR 208 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 1bbd s SER 209 N -3.06 2.53 0.45 1.09 1.04 -1.26 -5.08 113.70 109.41 1bbd s SER 209 Ca -0.03 -0.40 -0.23 0.00 0.48 0.00 0.00 55.95 55.77 1bbd s SER 209 Cb 0.05 -0.28 -0.10 0.00 0.10 0.00 0.00 66.02 65.79 1bbd s SER 209 CO 0.34 0.26 0.87 -2.65 0.98 0.00 0.00 173.24 173.03 1bbd n PRO 210 N 2.48 1.06 -3.30 4.02 -0.02 -1.26 -4.90 135.00 133.08 1bbd n PRO 210 Ca -0.15 0.39 -0.38 0.00 -2.02 0.00 0.00 63.50 61.33 1bbd n PRO 210 Cb 0.53 -1.91 -0.06 0.00 -0.02 0.00 0.00 33.50 32.04 1bbd n PRO 210 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1bbd s ILE 211 N -1.37 4.86 -0.02 4.25 1.01 0.70 -4.94 121.20 125.70 1bbd s ILE 211 Ca 0.65 1.14 0.03 0.00 0.00 0.00 0.00 60.65 62.47 1bbd s ILE 211 Cb -0.55 -3.87 -0.00 0.00 0.01 0.00 0.00 42.46 38.05 1bbd s ILE 211 CO 0.56 0.51 -0.11 -0.69 0.00 0.00 0.00 174.94 175.21 1bbd s VAL 212 N -0.75 0.89 -0.01 2.92 1.01 -1.26 -0.37 120.40 122.83 1bbd s VAL 212 Ca 0.28 -0.46 0.03 0.00 0.00 0.00 0.00 61.98 61.83 1bbd s VAL 212 Cb -0.18 -0.76 -0.01 0.00 0.00 0.00 0.00 36.38 35.43 1bbd s VAL 212 CO 0.17 0.26 -0.09 -0.54 0.00 0.00 0.00 175.10 174.90 1bbd s LYS 213 N -0.10 0.75 0.24 2.72 3.01 -0.60 -5.00 119.74 120.75 1bbd s LYS 213 Ca 0.02 -0.31 -0.03 0.00 -1.01 0.00 0.00 55.97 54.63 1bbd s LYS 213 Cb -0.06 -0.72 -0.03 0.00 -1.01 0.00 0.00 37.83 36.01 1bbd s LYS 213 CO -0.00 0.18 0.27 -1.12 0.51 0.00 0.00 175.35 175.19 1bbd s SER 214 N -0.15 0.38 0.17 2.83 0.01 -1.26 -0.11 113.70 115.57 1bbd s SER 214 Ca 0.03 -1.34 -0.19 0.00 1.31 0.00 0.00 55.95 55.75 1bbd s SER 214 Cb -0.04 0.48 0.04 0.00 0.21 0.00 0.00 66.02 66.72 1bbd s SER 214 CO -0.00 -0.99 0.53 0.72 0.41 0.00 0.00 173.24 173.91 1bbd s PHE 215 N -3.91 -0.29 -0.17 2.43 -0.12 -0.93 -5.01 117.98 110.00 1bbd s PHE 215 Ca 0.34 -0.01 0.00 0.00 -0.05 0.00 0.00 56.93 57.21 1bbd s PHE 215 Cb 0.04 0.44 0.01 0.00 -0.63 0.00 0.00 43.02 42.87 1bbd s PHE 215 CO 0.14 -0.86 -0.16 1.21 -0.05 0.00 0.00 175.22 175.49 1bbd s ASN 216 N -2.82 3.49 0.25 1.98 3.84 -1.26 -2.37 114.94 118.06 1bbd s ASN 216 Ca 0.05 -0.53 -0.09 0.00 0.21 0.00 0.00 52.86 52.49 1bbd s ASN 216 Cb -0.01 -1.54 0.39 0.00 -0.55 0.00 0.00 41.25 39.54 1bbd s ASN 216 CO -0.08 0.05 1.59 -0.09 -2.79 0.00 0.00 177.10 175.79 1bbd h ARG 217 N 7.57 0.01 -6.58 0.43 2.43 -1.22 -3.36 114.38 113.67 1bbd h ARG 217 Ca -0.37 -0.00 -0.52 0.00 -0.81 0.00 0.00 59.98 58.28 1bbd h ARG 217 Cb 1.17 -0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.69 1bbd h ARG 217 CO 0.59 0.01 0.07 -0.80 -1.51 0.00 0.00 179.97 178.32 1bbd s ASN 218 N -5.23 6.92 0.00 -3.80 -0.87 -1.26 -5.13 114.94 105.58 1bbd s ASN 218 Ca -0.14 1.31 0.00 0.00 -1.57 0.00 0.00 52.86 52.45 1bbd s ASN 218 Cb 0.24 -2.38 0.00 0.00 -0.02 0.00 0.00 41.25 39.09 1bbd s ASN 218 CO 0.76 -0.03 0.00 -0.62 -2.57 0.00 0.00 177.10 174.64