#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w3f h LEU 64 N 0.00 0.32 -1.23 -2.67 5.85 -2.00 -2.96 115.31 112.62 2w3f h LEU 64 Ca 0.00 -0.18 -0.04 0.00 0.84 0.00 0.00 57.88 58.50 2w3f h LEU 64 Cb 0.00 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 40.93 2w3f h LEU 64 CO 0.00 0.41 0.09 -0.33 -0.34 0.00 0.00 178.44 178.27 2w3f h GLU 65 N 0.21 0.62 -0.70 1.25 5.08 -2.02 -0.60 114.58 118.43 2w3f h GLU 65 Ca 0.07 -0.11 0.04 0.00 -1.00 0.00 0.00 59.36 58.36 2w3f h GLU 65 Cb 0.19 -0.10 -0.05 0.00 0.50 0.00 0.00 28.75 29.30 2w3f h GLU 65 CO -0.01 0.58 0.43 0.00 -1.00 0.00 0.00 179.01 179.01 2w3f h ALA 66 N 1.50 0.92 -0.24 3.43 0.00 -1.98 0.44 119.26 123.32 2w3f h ALA 66 Ca 0.14 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 2w3f h ALA 66 Cb 0.24 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2w3f h ALA 66 CO -0.00 0.18 0.12 1.15 0.00 0.00 0.00 179.25 180.70 2w3f h THR 67 N 0.83 1.14 -0.76 0.00 2.02 -1.15 -1.43 112.91 113.56 2w3f h THR 67 Ca 0.29 -0.41 -0.06 0.00 0.77 0.00 0.00 66.41 67.00 2w3f h THR 67 Cb 0.05 0.97 -0.03 0.00 -1.74 0.00 0.00 68.15 67.40 2w3f h THR 67 CO -0.12 0.14 0.26 -0.07 0.37 0.00 0.00 175.52 176.10 2w3f h LEU 68 N 0.26 1.08 -0.98 2.58 3.38 -0.94 -2.01 115.31 118.68 2w3f h LEU 68 Ca 0.08 -0.19 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 2w3f h LEU 68 Cb 0.12 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.55 2w3f h LEU 68 CO -0.01 0.99 0.39 0.03 0.09 0.00 0.00 178.44 179.93 2w3f h ARG 69 N 1.12 1.11 -0.80 1.13 3.08 -0.79 -0.40 114.38 118.83 2w3f h ARG 69 Ca 0.25 -0.15 -0.03 0.00 0.07 0.00 0.00 59.98 60.12 2w3f h ARG 69 Cb 0.28 -0.21 -0.04 0.00 0.08 0.00 0.00 29.97 30.08 2w3f h ARG 69 CO -0.01 0.84 0.37 0.00 -1.07 0.00 0.00 179.97 180.10 2w3f h ALA 70 N 1.32 1.03 -0.19 0.04 0.00 -0.79 0.15 119.26 120.83 2w3f h ALA 70 Ca 0.27 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 2w3f h ALA 70 Cb 0.09 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 2w3f h ALA 70 CO -0.04 0.61 -0.05 0.82 0.00 0.00 0.00 179.25 180.59 2w3f h ILE 71 N 1.14 1.29 -0.46 0.00 1.08 -0.96 -1.69 117.51 117.91 2w3f h ILE 71 Ca 0.27 -1.03 0.06 0.00 -0.39 0.00 0.00 64.86 63.77 2w3f h ILE 71 Cb 0.14 1.58 -0.05 0.00 -3.07 0.00 0.00 36.82 35.42 2w3f h ILE 71 CO -0.03 0.31 0.17 0.58 -0.69 0.00 0.00 178.15 178.49 2w3f h VAL 72 N 0.08 0.86 -0.72 1.67 2.07 -0.99 -0.98 116.25 118.23 2w3f h VAL 72 Ca 0.05 -0.12 0.09 0.00 0.82 0.00 0.00 66.70 67.54 2w3f h VAL 72 Cb 0.50 0.48 -0.07 0.00 -1.52 0.00 0.00 31.29 30.68 2w3f h VAL 72 CO 0.02 0.06 0.38 -0.74 0.02 0.00 0.00 177.57 177.31 2w3f h HIS 73 N 0.34 0.68 -0.51 1.57 -0.00 -0.76 -0.56 115.15 115.92 2w3f h HIS 73 Ca 0.22 0.03 -0.08 0.00 -0.00 0.00 0.00 60.37 60.53 2w3f h HIS 73 Cb 0.21 -0.20 -0.02 0.00 -0.00 0.00 0.00 27.41 27.40 2w3f h HIS 73 CO -0.15 0.27 0.00 0.77 -0.00 0.00 0.00 177.93 178.82 2w3f h SER 74 N 0.65 0.88 0.12 3.26 0.02 -0.92 -0.66 113.55 116.90 2w3f h SER 74 Ca 0.35 -0.30 -0.01 0.00 -0.84 0.00 0.00 61.79 60.99 2w3f h SER 74 Cb 0.34 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 62.64 2w3f h SER 74 CO -0.25 0.97 -0.06 0.00 -1.14 0.00 0.00 176.83 176.35 2w3f h ALA 75 N 0.94 -0.16 -0.48 3.77 0.00 -0.79 -1.02 119.26 121.51 2w3f h ALA 75 Ca 0.15 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 2w3f h ALA 75 Cb 0.52 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 2w3f h ALA 75 CO 0.03 -0.52 0.24 1.15 0.00 0.00 0.00 179.25 180.15 2w3f h THR 76 N -0.30 1.18 -0.16 0.00 2.02 -1.03 -2.23 112.91 112.39 2w3f h THR 76 Ca -0.02 -0.50 -0.15 0.00 0.77 0.00 0.00 66.41 66.51 2w3f h THR 76 Cb 0.25 0.62 0.00 0.00 -1.74 0.00 0.00 68.15 67.28 2w3f h THR 76 CO 0.03 0.20 -0.50 0.77 0.37 0.00 0.00 175.52 176.38 2w3f h SER 77 N 0.64 0.72 -0.08 4.18 4.64 -1.05 -0.63 113.55 121.97 2w3f h SER 77 Ca 0.17 -0.60 -0.19 0.00 -0.47 0.00 0.00 61.79 60.70 2w3f h SER 77 Cb 0.09 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 61.98 2w3f h SER 77 CO -0.02 1.19 -0.66 -0.07 -0.87 0.00 0.00 176.83 176.40 2w3f h LEU 78 N 0.29 0.80 -0.25 5.97 3.38 -1.18 -2.83 115.31 121.50 2w3f h LEU 78 Ca -0.02 -0.48 -0.07 0.00 0.09 0.00 0.00 57.88 57.40 2w3f h LEU 78 Cb 1.13 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.63 2w3f h LEU 78 CO 0.11 1.25 -0.35 0.58 0.09 0.00 0.00 178.44 180.11 2w3f h VAL 79 N 0.51 0.64 -3.78 1.22 2.07 -1.49 -3.48 116.25 111.93 2w3f h VAL 79 Ca -0.02 -1.76 -0.12 0.00 0.82 0.00 0.00 66.70 65.62 2w3f h VAL 79 Cb 1.25 2.20 0.08 0.00 -1.52 0.00 0.00 31.29 33.31 2w3f h VAL 79 CO 0.13 0.34 -0.34 -0.67 0.02 0.00 0.00 177.57 177.06 2w3f n ASP 80 N -3.24 -3.02 -4.92 0.57 -0.08 -0.37 -4.82 116.55 100.67 2w3f n ASP 80 Ca 0.02 -0.28 -0.28 0.00 -1.51 0.00 0.00 54.79 52.74 2w3f n ASP 80 Cb 0.63 -2.44 -0.04 0.00 2.34 0.00 0.00 41.12 41.61 2w3f n ASP 80 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2w3f s ALA 81 N -3.16 3.96 0.20 -1.67 0.00 -0.47 -0.43 121.76 120.19 2w3f s ALA 81 Ca 0.10 -0.95 -0.02 0.00 0.00 0.00 0.00 51.96 51.09 2w3f s ALA 81 Cb -0.01 -1.77 0.14 0.00 0.00 0.00 0.00 23.12 21.48 2w3f s ALA 81 CO 0.31 0.67 1.52 -0.09 0.00 0.00 0.00 175.76 178.17 2w3f h ARG 82 N 2.61 0.50 -4.78 0.00 2.43 -0.69 -3.44 114.38 111.00 2w3f h ARG 82 Ca -0.47 -0.31 -0.37 0.00 -0.81 0.00 0.00 59.98 58.02 2w3f h ARG 82 Cb 1.18 0.04 -0.26 0.00 -0.42 0.00 0.00 29.97 30.50 2w3f h ARG 82 CO 0.72 0.92 -0.77 0.71 -1.51 0.00 0.00 179.97 180.03 2w3f s TYR 83 N -3.97 0.83 0.02 2.20 2.02 -1.09 -4.36 117.35 113.01 2w3f s TYR 83 Ca -0.07 -0.26 -0.04 0.00 -0.37 0.00 0.00 57.07 56.32 2w3f s TYR 83 Cb 0.11 -0.51 -0.01 0.00 -0.40 0.00 0.00 41.96 41.15 2w3f s TYR 83 CO 0.83 -0.01 0.07 0.20 -1.57 0.00 0.00 175.55 175.07 2w3f s GLY 84 N -0.72 0.15 0.01 0.71 0.00 -0.71 -1.96 107.32 104.79 2w3f s GLY 84 Ca -0.00 -0.41 -0.22 0.00 0.00 0.00 0.00 44.72 44.09 2w3f s GLY 84 CO 0.00 -0.53 0.49 0.00 0.00 0.00 0.00 173.10 173.07 2w3f s ALA 85 N -1.78 -1.26 -0.02 3.20 0.00 -0.49 -0.65 121.76 120.76 2w3f s ALA 85 Ca -0.12 0.67 0.01 0.00 0.00 0.00 0.00 51.96 52.52 2w3f s ALA 85 Cb -0.06 0.20 0.02 0.00 0.00 0.00 0.00 23.12 23.27 2w3f s ALA 85 CO -0.01 -0.40 -0.02 1.41 0.00 0.00 0.00 175.76 176.73 2w3f s MET 86 N -1.84 0.45 -0.08 0.00 1.75 -0.24 -0.98 119.30 118.36 2w3f s MET 86 Ca -0.09 -0.04 0.00 0.00 -1.25 0.00 0.00 55.69 54.31 2w3f s MET 86 Cb -0.02 -0.53 -0.03 0.00 2.84 0.00 0.00 34.83 37.10 2w3f s MET 86 CO 0.03 -0.05 -0.06 -1.83 -0.65 0.00 0.00 175.02 172.46 2w3f s GLU 87 N 0.64 2.85 -0.05 4.11 4.04 -0.83 -1.54 118.70 127.92 2w3f s GLU 87 Ca -0.07 -0.54 0.06 0.00 0.04 0.00 0.00 54.97 54.46 2w3f s GLU 87 Cb -0.10 -2.63 -0.01 0.00 0.02 0.00 0.00 34.13 31.40 2w3f s GLU 87 CO -0.01 0.63 -0.23 0.08 -1.84 0.00 0.00 175.26 173.89 2w3f s VAL 88 N -0.71 1.90 0.22 1.83 1.01 -0.33 -1.28 120.40 123.04 2w3f s VAL 88 Ca 0.11 -0.99 0.05 0.00 0.00 0.00 0.00 61.98 61.15 2w3f s VAL 88 Cb -0.11 -1.61 -0.05 0.00 0.00 0.00 0.00 36.38 34.61 2w3f s VAL 88 CO 0.02 0.53 -0.06 -1.38 0.00 0.00 0.00 175.10 174.21 2w3f s HIS 89 N -0.19 1.62 0.64 5.22 -3.43 -0.00 -0.02 115.29 119.12 2w3f s HIS 89 Ca -0.01 -0.77 -0.05 0.00 -0.80 0.00 0.00 55.06 53.43 2w3f s HIS 89 Cb -0.13 -0.88 0.14 0.00 -1.43 0.00 0.00 32.58 30.28 2w3f s HIS 89 CO 0.03 0.14 0.87 -0.40 -2.00 0.00 0.00 174.74 173.37 2w3f n ASP 90 N -0.40 0.68 0.16 7.38 3.85 -0.32 -4.81 116.55 123.09 2w3f n ASP 90 Ca -0.07 -1.69 0.13 0.00 -0.71 0.00 0.00 54.79 52.45 2w3f n ASP 90 Cb 0.62 -0.61 0.54 0.00 -1.35 0.00 0.00 41.12 40.32 2w3f n ASP 90 CO 0.00 0.00 0.00 0.03 -1.01 0.00 0.00 177.20 176.22 2w3f h ARG 91 N 0.00 0.00 -0.15 0.11 3.08 -1.96 -0.98 114.38 114.47 2w3f h ARG 91 Ca -0.28 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.77 2w3f h ARG 91 Cb 0.93 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.98 2w3f h ARG 91 CO 0.26 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 179.16 2w3f n GLN 92 N -2.37 1.77 -1.10 0.04 0.00 -1.26 -4.94 117.38 109.52 2w3f n GLN 92 Ca 0.02 -1.15 -0.03 0.00 0.00 0.00 0.00 57.00 55.83 2w3f n GLN 92 Cb 0.23 -1.42 -0.01 0.00 0.00 0.00 0.00 30.24 29.04 2w3f n GLN 92 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.06 177.78 2w3f n HIS 93 N 0.38 0.00 -2.75 2.61 8.25 -0.37 -5.03 115.22 118.30 2w3f n HIS 93 Ca 0.17 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.22 2w3f n HIS 93 Cb 0.35 -0.98 -0.05 0.00 1.12 0.00 0.00 29.99 30.43 2w3f n HIS 93 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 2w3f s ARG 94 N -2.03 4.75 -0.07 -0.41 0.52 -1.26 -4.82 118.95 115.63 2w3f s ARG 94 Ca 0.00 1.44 -0.30 0.00 -0.52 0.00 0.00 55.73 56.36 2w3f s ARG 94 Cb 0.00 -3.33 -0.03 0.00 0.52 0.00 0.00 34.95 32.11 2w3f s ARG 94 CO 0.00 0.36 1.27 0.08 0.02 0.00 0.00 175.30 177.02 2w3f s VAL 95 N -0.53 4.14 -0.21 3.52 1.01 -1.26 -1.17 120.40 125.89 2w3f s VAL 95 Ca 0.44 1.45 0.13 0.00 0.00 0.00 0.00 61.98 64.00 2w3f s VAL 95 Cb -0.24 -3.93 -0.23 0.00 0.00 0.00 0.00 36.38 31.97 2w3f s VAL 95 CO 0.30 -0.04 0.03 0.18 0.00 0.00 0.00 175.10 175.57 2w3f n LEU 96 N 5.64 0.90 -3.73 3.92 4.77 0.96 -4.93 117.00 124.53 2w3f n LEU 96 Ca 0.12 -0.01 -0.13 0.00 -0.03 0.00 0.00 56.01 55.96 2w3f n LEU 96 Cb 0.45 0.07 -0.10 0.00 -2.33 0.00 0.00 43.42 41.51 2w3f n LEU 96 CO 0.56 0.62 0.07 -1.00 -1.33 0.00 0.00 177.39 176.31 2w3f s HIS 97 N -2.50 -0.45 -0.07 -1.77 3.76 -0.94 -4.98 115.29 108.33 2w3f s HIS 97 Ca -0.17 1.08 -0.03 0.00 -0.15 0.00 0.00 55.06 55.80 2w3f s HIS 97 Cb 0.07 0.16 0.04 0.00 1.11 0.00 0.00 32.58 33.95 2w3f s HIS 97 CO 0.77 -0.22 0.07 0.12 -0.85 0.00 0.00 174.74 174.62 2w3f s PHE 98 N 0.33 0.09 0.11 1.40 5.36 -1.26 -1.19 117.98 122.82 2w3f s PHE 98 Ca -0.01 0.13 0.08 0.00 -0.96 0.00 0.00 56.93 56.17 2w3f s PHE 98 Cb -0.03 -0.53 -0.04 0.00 -0.34 0.00 0.00 43.02 42.08 2w3f s PHE 98 CO -0.01 -0.26 -0.20 0.14 -1.46 0.00 0.00 175.22 173.43 2w3f s VAL 99 N 2.16 1.68 0.16 3.12 -7.23 -0.59 -4.99 120.40 114.72 2w3f s VAL 99 Ca 0.04 -1.61 -0.23 0.00 -1.81 0.00 0.00 61.98 58.37 2w3f s VAL 99 Cb -0.13 -1.59 0.07 0.00 0.56 0.00 0.00 36.38 35.29 2w3f s VAL 99 CO -0.04 -0.14 0.61 -0.72 -0.31 0.00 0.00 175.10 174.50 2w3f s TYR 100 N -1.39 -0.53 0.01 2.82 1.13 -1.26 -1.08 117.35 117.05 2w3f s TYR 100 Ca 0.08 0.31 -0.09 0.00 -1.41 0.00 0.00 57.07 55.97 2w3f s TYR 100 Cb -0.09 0.56 0.00 0.00 -1.10 0.00 0.00 41.96 41.34 2w3f s TYR 100 CO 0.05 -0.85 0.17 -1.83 -2.51 0.00 0.00 175.55 170.58 2w3f s GLU 101 N -3.73 0.56 0.00 -3.49 -1.05 0.18 -4.95 118.70 106.22 2w3f s GLU 101 Ca 0.01 -0.43 0.00 0.00 -0.15 0.00 0.00 54.97 54.40 2w3f s GLU 101 Cb -0.01 0.23 0.00 0.00 -0.44 0.00 0.00 34.13 33.91 2w3f s GLU 101 CO -0.12 -0.14 0.00 0.41 0.95 0.00 0.00 175.26 176.35 2w3f n GLY 102 N 1.24 1.76 3.16 -3.83 0.00 -1.26 -1.74 105.19 104.52 2w3f n GLY 102 Ca -0.22 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.48 2w3f n GLY 102 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2w3f s ILE 103 N -2.04 2.06 0.63 -0.61 1.01 -1.26 -4.91 121.20 116.08 2w3f s ILE 103 Ca 0.00 -0.97 -0.18 0.00 0.00 0.00 0.00 60.65 59.50 2w3f s ILE 103 Cb 0.00 -1.83 -0.02 0.00 0.01 0.00 0.00 42.46 40.63 2w3f s ILE 103 CO 0.00 0.55 1.21 1.51 0.00 0.00 0.00 174.94 178.21 2w3f s ASP 104 N 0.89 4.94 0.57 3.58 1.47 -1.26 -4.80 116.67 122.06 2w3f s ASP 104 Ca -0.05 2.37 0.31 0.00 1.18 0.00 0.00 52.55 56.36 2w3f s ASP 104 Cb -0.15 -2.59 1.71 0.00 -0.34 0.00 0.00 42.92 41.54 2w3f s ASP 104 CO -0.04 -1.76 2.17 -0.33 0.68 0.00 0.00 175.17 175.89 2w3f h GLU 105 N 0.56 0.00 -0.38 2.11 5.08 -1.99 -0.99 114.58 118.97 2w3f h GLU 105 Ca -0.50 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 57.77 2w3f h GLU 105 Cb 1.30 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.54 2w3f h GLU 105 CO 0.54 0.06 -0.11 0.93 -1.00 0.00 0.00 179.01 179.42 2w3f h GLU 106 N 0.00 0.74 -0.49 2.33 5.08 -1.99 -0.11 114.58 120.14 2w3f h GLU 106 Ca -0.00 -0.29 -0.07 0.00 -1.00 0.00 0.00 59.36 57.99 2w3f h GLU 106 Cb 0.18 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.38 2w3f h GLU 106 CO 0.01 0.90 0.02 1.15 -1.00 0.00 0.00 179.01 180.08 2w3f h THR 107 N 0.54 1.26 -0.81 1.13 2.02 -1.77 -2.40 112.91 112.88 2w3f h THR 107 Ca 0.09 -1.03 0.08 0.00 0.77 0.00 0.00 66.41 66.32 2w3f h THR 107 Cb 0.63 0.97 -0.07 0.00 -1.74 0.00 0.00 68.15 67.95 2w3f h THR 107 CO 0.04 0.36 0.48 0.58 0.37 0.00 0.00 175.52 177.35 2w3f h VAL 108 N 0.70 0.95 -0.42 3.16 2.07 -1.01 -0.91 116.25 120.80 2w3f h VAL 108 Ca 0.14 -0.28 -0.08 0.00 0.82 0.00 0.00 66.70 67.29 2w3f h VAL 108 Cb 0.48 0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 30.29 2w3f h VAL 108 CO 0.02 0.15 -0.08 -0.09 0.02 0.00 0.00 177.57 177.59 2w3f h ARG 109 N 0.83 0.72 -0.44 1.57 2.43 -0.78 -1.80 114.38 116.92 2w3f h ARG 109 Ca 0.38 -0.22 -0.07 0.00 -0.81 0.00 0.00 59.98 59.26 2w3f h ARG 109 Cb 0.28 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.75 2w3f h ARG 109 CO -0.22 0.79 0.01 0.00 -1.51 0.00 0.00 179.97 179.04 2w3f h ARG 110 N 0.66 0.76 -0.84 0.20 3.08 -0.84 -3.13 114.38 114.28 2w3f h ARG 110 Ca 0.12 -0.24 -0.03 0.00 0.07 0.00 0.00 59.98 59.90 2w3f h ARG 110 Cb 0.53 -0.07 -0.04 0.00 0.08 0.00 0.00 29.97 30.47 2w3f h ARG 110 CO 0.03 0.83 0.41 0.82 -1.07 0.00 0.00 179.97 180.99 2w3f h ILE 111 N 0.61 1.26 0.00 2.04 2.04 -0.92 -3.47 117.51 119.07 2w3f h ILE 111 Ca 0.13 -0.71 0.00 0.00 1.00 0.00 0.00 64.86 65.28 2w3f h ILE 111 Cb 0.47 0.17 0.00 0.00 -0.74 0.00 0.00 36.82 36.73 2w3f h ILE 111 CO 0.02 0.31 0.00 0.61 0.00 0.00 0.00 178.15 179.09 2w3f n GLY 112 N -1.04 1.12 3.77 5.37 0.00 -0.70 -4.92 105.19 108.78 2w3f n GLY 112 Ca 0.08 -1.00 -0.39 0.00 0.00 0.00 0.00 46.02 44.72 2w3f n GLY 112 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2w3f s HIS 113 N 0.00 2.99 0.87 1.61 -3.43 -1.26 -4.85 115.29 111.22 2w3f s HIS 113 Ca 0.00 1.48 -0.11 0.00 -0.80 0.00 0.00 55.06 55.63 2w3f s HIS 113 Cb 0.00 -3.55 0.12 0.00 -1.43 0.00 0.00 32.58 27.71 2w3f s HIS 113 CO 0.00 -1.69 1.10 -0.51 -2.00 0.00 0.00 174.74 171.64 2w3f s LEU 114 N -2.28 2.64 0.52 5.38 1.43 -1.26 -4.95 118.68 120.16 2w3f s LEU 114 Ca 0.55 1.85 -0.22 0.00 -1.03 0.00 0.00 54.13 55.28 2w3f s LEU 114 Cb -0.35 -4.33 -0.07 0.00 0.03 0.00 0.00 46.19 41.47 2w3f s LEU 114 CO 0.46 -2.68 1.22 -2.65 0.23 0.00 0.00 176.35 172.93 2w3f n PRO 115 N -3.94 1.55 0.00 1.29 -0.02 -1.26 -4.92 135.00 127.70 2w3f n PRO 115 Ca 0.09 0.57 0.12 0.00 -2.02 0.00 0.00 63.50 62.25 2w3f n PRO 115 Cb 0.53 -2.39 0.09 0.00 -0.02 0.00 0.00 33.50 31.71 2w3f n PRO 115 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2w3f n LYS 116 N -0.64 1.46 -1.70 -0.52 5.02 -1.26 -4.97 118.16 115.55 2w3f n LYS 116 Ca 0.10 -1.16 0.00 0.00 -2.02 0.00 0.00 58.31 55.23 2w3f n LYS 116 Cb 0.43 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 33.97 2w3f n LYS 116 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2w3f n GLY 117 N 1.38 0.76 1.70 0.72 0.00 -1.26 -4.74 105.19 103.76 2w3f n GLY 117 Ca 0.11 -0.44 -0.10 0.00 0.00 0.00 0.00 46.02 45.59 2w3f n GLY 117 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2w3f n LEU 118 N -0.52 0.00 0.00 0.99 4.77 -1.26 -2.57 117.00 118.41 2w3f n LEU 118 Ca 0.00 -1.18 0.00 0.00 -0.03 0.00 0.00 56.01 54.80 2w3f n LEU 118 Cb 0.37 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 2w3f n LEU 118 CO 0.00 -0.51 0.00 0.61 -1.33 0.00 0.00 177.39 176.16 2w3f n GLY 119 N 1.97 2.73 0.37 -0.72 0.00 -1.26 -2.16 105.19 106.11 2w3f n GLY 119 Ca 0.04 -0.40 0.10 0.00 0.00 0.00 0.00 46.02 45.75 2w3f n GLY 119 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2w3f h VAL 120 N 0.00 0.87 -0.63 1.61 2.07 -1.92 -1.51 116.25 116.75 2w3f h VAL 120 Ca 0.00 -0.29 -0.07 0.00 0.82 0.00 0.00 66.70 67.16 2w3f h VAL 120 Cb 0.00 -0.04 -0.03 0.00 -1.52 0.00 0.00 31.29 29.71 2w3f h VAL 120 CO 0.00 0.15 0.13 0.40 0.02 0.00 0.00 177.57 178.27 2w3f h ILE 121 N 0.84 1.26 -0.70 4.57 1.08 -1.80 -2.54 117.51 120.21 2w3f h ILE 121 Ca 0.47 -0.97 0.12 0.00 -0.39 0.00 0.00 64.86 64.10 2w3f h ILE 121 Cb 0.61 0.67 -0.09 0.00 -3.07 0.00 0.00 36.82 34.95 2w3f h ILE 121 CO -0.24 0.36 0.27 1.23 -0.69 0.00 0.00 178.15 179.09 2w3f h GLY 122 N 0.94 1.03 0.49 5.37 0.00 -0.78 0.35 103.07 110.46 2w3f h GLY 122 Ca 0.19 -0.14 0.05 0.00 0.00 0.00 0.00 47.33 47.44 2w3f h GLY 122 CO 0.01 -0.06 -0.06 -2.00 0.00 0.00 0.00 176.54 174.42 2w3f h LEU 123 N 0.44 -0.23 -1.06 3.11 6.46 -1.09 -1.02 115.31 121.92 2w3f h LEU 123 Ca 0.37 0.08 -0.10 0.00 -0.12 0.00 0.00 57.88 58.11 2w3f h LEU 123 Cb 0.52 0.16 -0.01 0.00 -0.73 0.00 0.00 40.66 40.59 2w3f h LEU 123 CO -0.36 -0.08 -0.40 -0.07 -0.62 0.00 0.00 178.44 176.90 2w3f h LEU 124 N 0.00 0.13 -0.36 2.25 3.38 -0.92 0.17 115.31 119.97 2w3f h LEU 124 Ca 0.12 -0.05 -0.08 0.00 0.09 0.00 0.00 57.88 57.96 2w3f h LEU 124 Cb 0.19 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 2w3f h LEU 124 CO -0.26 0.53 -0.10 0.40 0.09 0.00 0.00 178.44 179.10 2w3f h ILE 125 N 0.11 1.28 -0.38 1.22 2.04 -0.65 -2.40 117.51 118.73 2w3f h ILE 125 Ca 0.01 -1.18 -0.16 0.00 1.00 0.00 0.00 64.86 64.54 2w3f h ILE 125 Cb 0.76 1.30 -0.01 0.00 -0.74 0.00 0.00 36.82 38.14 2w3f h ILE 125 CO 0.06 0.39 -0.37 -0.33 0.00 0.00 0.00 178.15 177.89 2w3f h GLU 126 N 0.49 0.92 -2.67 2.37 5.08 -0.77 -3.39 114.58 116.61 2w3f h GLU 126 Ca 0.09 -0.49 -0.60 0.00 -1.00 0.00 0.00 59.36 57.36 2w3f h GLU 126 Cb 0.61 0.02 -0.39 0.00 0.50 0.00 0.00 28.75 29.49 2w3f h GLU 126 CO 0.04 1.14 -0.82 0.34 -1.00 0.00 0.00 179.01 178.71 2w3f s ASP 127 N -6.81 2.81 -0.26 1.42 2.15 0.57 -5.10 116.67 111.45 2w3f s ASP 127 Ca -0.11 -3.16 -0.29 0.00 0.43 0.00 0.00 52.55 49.43 2w3f s ASP 127 Cb 0.11 -0.86 -0.02 0.00 -0.30 0.00 0.00 42.92 41.85 2w3f s ASP 127 CO 0.88 -0.17 1.69 -2.16 -0.17 0.00 0.00 175.17 175.23 2w3f s PRO 128 N -0.24 3.62 0.07 4.34 0.04 -0.90 -4.47 135.00 137.44 2w3f s PRO 128 Ca 0.27 1.56 -0.26 0.00 0.04 0.00 0.00 61.00 62.61 2w3f s PRO 128 Cb -0.05 -4.10 0.09 0.00 0.04 0.00 0.00 34.50 30.48 2w3f s PRO 128 CO -0.14 -1.52 0.82 -1.59 0.04 0.00 0.00 177.00 174.61 2w3f s LYS 129 N 5.06 1.03 0.46 4.56 -2.85 -1.26 -4.93 119.74 121.81 2w3f s LYS 129 Ca 0.75 -0.42 -0.23 0.00 -1.00 0.00 0.00 55.97 55.07 2w3f s LYS 129 Cb -0.24 0.45 -0.07 0.00 -2.06 0.00 0.00 37.83 35.91 2w3f s LYS 129 CO 0.31 -0.45 1.21 -2.14 0.10 0.00 0.00 175.35 174.38 2w3f s PRO 130 N -3.34 3.70 -0.05 1.78 0.02 -1.26 -4.53 135.00 131.31 2w3f s PRO 130 Ca 0.05 1.90 -0.02 0.00 0.02 0.00 0.00 61.00 62.95 2w3f s PRO 130 Cb -0.01 -2.44 0.04 0.00 0.02 0.00 0.00 34.50 32.10 2w3f s PRO 130 CO -0.08 -0.64 0.11 -1.17 -0.33 0.00 0.00 177.00 174.89 2w3f s LEU 131 N -3.00 0.63 -0.04 -5.54 2.96 -0.12 -5.01 118.68 108.55 2w3f s LEU 131 Ca 0.64 0.22 0.06 0.00 -0.22 0.00 0.00 54.13 54.82 2w3f s LEU 131 Cb -0.32 0.19 -0.02 0.00 0.50 0.00 0.00 46.19 46.54 2w3f s LEU 131 CO 0.39 -0.17 -0.21 -0.13 -1.32 0.00 0.00 176.35 174.91 2w3f s ARG 132 N 1.43 2.34 -0.02 1.98 0.52 -1.26 -1.31 118.95 122.63 2w3f s ARG 132 Ca -0.06 -0.83 0.03 0.00 -0.52 0.00 0.00 55.73 54.36 2w3f s ARG 132 Cb -0.12 -2.20 -0.00 0.00 0.52 0.00 0.00 34.95 33.15 2w3f s ARG 132 CO -0.05 0.56 -0.11 -0.51 0.02 0.00 0.00 175.30 175.21 2w3f s LEU 133 N -0.60 1.92 0.29 2.53 1.43 -0.33 -5.00 118.68 118.93 2w3f s LEU 133 Ca 0.09 -0.21 0.04 0.00 -1.03 0.00 0.00 54.13 53.01 2w3f s LEU 133 Cb -0.11 -0.60 0.45 0.00 0.03 0.00 0.00 46.19 45.96 2w3f s LEU 133 CO 0.00 0.11 1.74 0.44 0.23 0.00 0.00 176.35 178.87 2w3f h ASP 134 N 6.10 0.43 -1.98 2.29 3.45 -1.86 -0.12 116.42 124.73 2w3f h ASP 134 Ca -0.33 -0.14 -0.25 0.00 0.43 0.00 0.00 57.03 56.74 2w3f h ASP 134 Cb 1.17 -0.12 -0.31 0.00 -0.56 0.00 0.00 39.33 39.51 2w3f h ASP 134 CO 0.49 0.68 -0.58 -0.62 -1.57 0.00 0.00 179.24 177.65 2w3f s ASP 135 N -6.82 0.98 0.36 6.45 3.68 -1.24 -3.52 116.67 116.56 2w3f s ASP 135 Ca -0.06 -0.43 0.05 0.00 2.13 0.00 0.00 52.55 54.23 2w3f s ASP 135 Cb 0.14 0.80 0.71 0.00 -1.45 0.00 0.00 42.92 43.12 2w3f s ASP 135 CO 0.78 -0.36 1.98 1.62 0.13 0.00 0.00 175.17 179.32 2w3f h VAL 136 N 6.22 1.07 0.00 1.11 3.04 -0.89 -1.74 116.25 125.06 2w3f h VAL 136 Ca -0.13 -0.27 0.00 0.00 -1.01 0.00 0.00 66.70 65.29 2w3f h VAL 136 Cb 1.11 0.21 0.00 0.00 -2.01 0.00 0.00 31.29 30.60 2w3f h VAL 136 CO 0.30 0.14 0.00 -1.54 -1.01 0.00 0.00 177.57 175.46 2w3f n SER 137 N -4.47 0.68 0.15 3.17 3.41 -1.26 -2.57 113.62 112.73 2w3f n SER 137 Ca 0.09 0.66 0.12 0.00 -0.26 0.00 0.00 58.87 59.48 2w3f n SER 137 Cb 0.16 -0.80 0.14 0.00 -0.26 0.00 0.00 64.21 63.45 2w3f n SER 137 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2w3f h ALA 138 N 2.29 0.79 -2.91 7.33 0.00 -1.72 -3.46 119.26 121.59 2w3f h ALA 138 Ca 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.38 2w3f h ALA 138 Cb 0.40 0.00 0.08 0.00 0.00 0.00 0.00 17.79 18.27 2w3f h ALA 138 CO 0.00 0.00 0.69 -1.58 0.00 0.00 0.00 179.25 178.36 2w3f s HIS 139 N -3.24 2.84 0.55 0.00 2.46 -1.06 -4.92 115.29 111.92 2w3f s HIS 139 Ca 0.05 1.32 0.26 0.00 0.47 0.00 0.00 55.06 57.17 2w3f s HIS 139 Cb 0.08 -3.81 1.47 0.00 -0.13 0.00 0.00 32.58 30.19 2w3f s HIS 139 CO 0.71 -2.31 2.01 -1.35 -2.47 0.00 0.00 174.74 171.33 2w3f h PRO 140 N 3.14 0.00 -0.00 2.88 0.11 -1.91 -1.54 132.00 134.68 2w3f h PRO 140 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2w3f h PRO 140 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 2w3f h PRO 140 CO 0.64 0.00 -0.28 0.00 -0.21 0.00 0.00 178.00 178.16 2w3f n ALA 141 N -2.51 3.05 -1.68 -0.75 0.00 -1.26 -4.94 120.51 112.41 2w3f n ALA 141 Ca 0.07 -0.28 -0.46 0.00 0.00 0.00 0.00 53.44 52.77 2w3f n ALA 141 Cb 0.52 -1.25 -0.04 0.00 0.00 0.00 0.00 19.45 18.68 2w3f n ALA 141 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2w3f n SER 142 N -1.30 3.28 0.01 0.00 2.88 -0.58 -3.62 113.62 114.28 2w3f n SER 142 Ca 0.08 1.05 0.06 0.00 -1.33 0.00 0.00 58.87 58.74 2w3f n SER 142 Cb 0.33 -1.43 -0.12 0.00 -0.75 0.00 0.00 64.21 62.23 2w3f n SER 142 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2w3f n ILE 143 N 3.87 0.55 0.00 2.46 3.06 -1.26 -4.93 119.36 123.11 2w3f n ILE 143 Ca 0.18 -0.60 0.00 0.00 -2.50 0.00 0.00 62.75 59.83 2w3f n ILE 143 Cb 0.30 -0.27 0.00 0.00 0.54 0.00 0.00 39.64 40.21 2w3f n ILE 143 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 2w3f n GLY 144 N 1.35 1.49 3.84 4.50 0.00 -1.26 -5.02 105.19 110.09 2w3f n GLY 144 Ca -0.09 -1.72 -0.32 0.00 0.00 0.00 0.00 46.02 43.89 2w3f n GLY 144 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2w3f s PHE 145 N -2.49 3.40 0.79 1.61 0.08 -1.26 -5.05 117.98 115.06 2w3f s PHE 145 Ca 0.00 1.41 -0.11 0.00 0.12 0.00 0.00 56.93 58.35 2w3f s PHE 145 Cb 0.00 -2.71 0.07 0.00 -0.57 0.00 0.00 43.02 39.80 2w3f s PHE 145 CO 0.00 -0.18 1.09 -1.25 -0.10 0.00 0.00 175.22 174.78 2w3f s PRO 146 N -3.60 2.12 0.50 0.24 0.04 -1.26 -4.98 135.00 128.06 2w3f s PRO 146 Ca 0.58 0.94 -0.21 0.00 0.04 0.00 0.00 61.00 62.35 2w3f s PRO 146 Cb -0.10 -1.90 -0.09 0.00 0.04 0.00 0.00 34.50 32.46 2w3f s PRO 146 CO 0.24 -1.67 0.81 -2.30 0.04 0.00 0.00 177.00 174.11 2w3f n PRO 147 N -3.51 0.92 0.00 0.56 -0.02 -1.26 -2.64 135.00 129.04 2w3f n PRO 147 Ca 0.08 0.34 0.00 0.00 -2.02 0.00 0.00 63.50 61.90 2w3f n PRO 147 Cb 0.54 -1.91 0.00 0.00 -0.02 0.00 0.00 33.50 32.11 2w3f n PRO 147 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2w3f n TYR 148 N -1.15 0.00 -2.02 6.00 4.02 -1.26 -4.54 117.16 118.21 2w3f n TYR 148 Ca 0.11 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.59 2w3f n TYR 148 Cb 0.43 -0.23 -0.02 0.00 -0.02 0.00 0.00 39.34 39.50 2w3f n TYR 148 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 176.86 174.27 2w3f s HIS 149 N -2.13 2.98 0.56 -0.72 2.46 -1.08 -4.74 115.29 112.62 2w3f s HIS 149 Ca 0.00 1.16 -0.21 0.00 0.47 0.00 0.00 55.06 56.48 2w3f s HIS 149 Cb 0.00 -3.80 -0.05 0.00 -0.13 0.00 0.00 32.58 28.60 2w3f s HIS 149 CO 0.00 -2.46 1.25 -2.30 -2.47 0.00 0.00 174.74 168.76 2w3f n PRO 150 N 1.66 1.45 -1.79 2.88 -0.02 -1.26 -4.95 135.00 132.98 2w3f n PRO 150 Ca 0.04 0.54 -0.40 0.00 -2.02 0.00 0.00 63.50 61.66 2w3f n PRO 150 Cb 0.41 -2.45 0.01 0.00 -0.02 0.00 0.00 33.50 31.44 2w3f n PRO 150 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 2w3f s PRO 151 N -2.84 3.88 -0.05 0.52 0.02 -1.26 -5.02 135.00 130.24 2w3f s PRO 151 Ca 0.73 2.51 -0.04 0.00 0.02 0.00 0.00 61.00 64.21 2w3f s PRO 151 Cb -0.43 -2.80 0.01 0.00 0.02 0.00 0.00 34.50 31.31 2w3f s PRO 151 CO 0.48 -0.70 0.13 -1.64 -0.33 0.00 0.00 177.00 174.94 2w3f s MET 152 N -2.29 0.14 0.01 5.54 -1.94 -1.26 -5.05 119.30 114.44 2w3f s MET 152 Ca 0.57 0.19 -0.00 0.00 -1.71 0.00 0.00 55.69 54.74 2w3f s MET 152 Cb -0.45 0.04 -0.00 0.00 2.01 0.00 0.00 34.83 36.43 2w3f s MET 152 CO 0.60 -0.03 -0.00 -2.13 -0.01 0.00 0.00 175.02 173.45 2w3f n ARG 153 N 3.14 0.00 -2.61 2.03 0.63 -1.26 -4.65 116.66 113.94 2w3f n ARG 153 Ca -0.14 0.00 -0.35 0.00 -0.92 0.00 0.00 57.85 56.45 2w3f n ARG 153 Cb 0.58 -0.05 -0.04 0.00 0.45 0.00 0.00 32.46 33.39 2w3f n ARG 153 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 2w3f s THR 154 N -1.06 3.91 -0.06 5.15 -4.23 -1.23 -0.26 115.64 117.86 2w3f s THR 154 Ca -0.00 1.28 -0.05 0.00 -1.18 0.00 0.00 61.69 61.73 2w3f s THR 154 Cb 0.00 -3.57 0.02 0.00 1.34 0.00 0.00 72.50 70.29 2w3f s THR 154 CO 0.00 -0.17 0.15 0.12 -0.54 0.00 0.00 174.62 174.18 2w3f s PHE 155 N -1.91 -0.17 -0.03 3.99 2.19 -0.06 -2.04 117.98 119.94 2w3f s PHE 155 Ca 0.63 0.42 -0.01 0.00 0.33 0.00 0.00 56.93 58.30 2w3f s PHE 155 Cb -0.17 0.05 0.03 0.00 -1.31 0.00 0.00 43.02 41.62 2w3f s PHE 155 CO 0.21 -0.09 0.03 -1.17 1.83 0.00 0.00 175.22 176.03 2w3f s LEU 156 N 0.15 0.70 -0.01 6.12 2.96 -0.17 -1.18 118.68 127.25 2w3f s LEU 156 Ca -0.01 0.03 0.02 0.00 -0.22 0.00 0.00 54.13 53.95 2w3f s LEU 156 Cb -0.02 -0.17 -0.00 0.00 0.50 0.00 0.00 46.19 46.50 2w3f s LEU 156 CO -0.00 -0.17 -0.06 -0.83 -1.32 0.00 0.00 176.35 173.96 2w3f s GLY 157 N 1.56 0.31 0.02 7.98 0.00 -0.42 0.19 107.32 116.95 2w3f s GLY 157 Ca -0.03 -0.25 0.01 0.00 0.00 0.00 0.00 44.72 44.45 2w3f s GLY 157 CO -0.03 -0.17 -0.04 -1.34 0.00 0.00 0.00 173.10 171.52 2w3f s VAL 158 N -0.07 0.21 0.47 1.40 -7.23 -0.31 -0.95 120.40 113.94 2w3f s VAL 158 Ca 0.01 -0.78 -0.23 0.00 -1.81 0.00 0.00 61.98 59.18 2w3f s VAL 158 Cb -0.03 -0.31 -0.07 0.00 0.56 0.00 0.00 36.38 36.52 2w3f s VAL 158 CO -0.00 -0.36 1.16 -2.16 -0.31 0.00 0.00 175.10 173.43 2w3f s PRO 159 N -1.20 3.72 -0.40 4.82 0.04 -1.26 -0.75 135.00 139.96 2w3f s PRO 159 Ca -0.11 1.76 -0.12 0.00 0.04 0.00 0.00 61.00 62.57 2w3f s PRO 159 Cb -0.08 -2.37 0.04 0.00 0.04 0.00 0.00 34.50 32.13 2w3f s PRO 159 CO -0.00 -0.58 0.26 0.08 0.04 0.00 0.00 177.00 176.79 2w3f s VAL 160 N -1.56 4.70 0.18 -0.36 1.01 0.25 -4.77 120.40 119.85 2w3f s VAL 160 Ca 0.64 -0.97 -0.16 0.00 0.00 0.00 0.00 61.98 61.50 2w3f s VAL 160 Cb -0.28 -3.70 0.02 0.00 0.00 0.00 0.00 36.38 32.42 2w3f s VAL 160 CO 0.34 -0.35 0.46 0.00 0.00 0.00 0.00 175.10 175.54 2w3f s ARG 161 N 1.56 1.28 0.47 2.72 1.70 -1.26 -0.62 118.95 124.80 2w3f s ARG 161 Ca 0.03 -0.89 0.03 0.00 -0.47 0.00 0.00 55.73 54.42 2w3f s ARG 161 Cb -0.21 0.48 -0.03 0.00 -0.57 0.00 0.00 34.95 34.63 2w3f s ARG 161 CO 0.06 -0.52 0.03 0.14 -1.08 0.00 0.00 175.30 173.93 2w3f s VAL 162 N -3.88 1.14 0.25 4.99 -7.23 -0.44 -4.34 120.40 110.89 2w3f s VAL 162 Ca 0.09 -2.00 -0.03 0.00 -1.81 0.00 0.00 61.98 58.23 2w3f s VAL 162 Cb 0.00 -2.33 0.22 0.00 0.56 0.00 0.00 36.38 34.83 2w3f s VAL 162 CO -0.04 0.00 1.74 -0.09 -0.31 0.00 0.00 175.10 176.40 2w3f h ARG 163 N 1.53 0.49 0.00 4.82 2.43 -2.01 -2.76 114.38 118.88 2w3f h ARG 163 Ca -0.42 -0.03 -0.09 0.00 -0.81 0.00 0.00 59.98 58.63 2w3f h ARG 163 Cb 1.29 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.72 2w3f h ARG 163 CO 0.71 0.32 -0.42 -0.44 -1.51 0.00 0.00 179.97 178.63 2w3f h ASP 164 N 0.51 0.00 -3.61 -3.80 3.32 -2.04 -3.47 116.42 107.33 2w3f h ASP 164 Ca 0.42 0.00 0.08 0.00 0.02 0.00 0.00 57.03 57.55 2w3f h ASP 164 Cb 0.61 0.00 -0.25 0.00 0.22 0.00 0.00 39.33 39.91 2w3f h ASP 164 CO -0.38 0.42 0.53 -0.70 -1.72 0.00 0.00 179.24 177.40 2w3f s GLU 165 N -3.58 0.52 -0.12 3.56 2.12 -1.04 -5.16 118.70 115.00 2w3f s GLU 165 Ca 0.00 0.33 -0.04 0.00 0.36 0.00 0.00 54.97 55.62 2w3f s GLU 165 Cb 0.11 0.25 -0.04 0.00 0.26 0.00 0.00 34.13 34.71 2w3f s GLU 165 CO 0.70 -0.12 0.03 0.45 -0.54 0.00 0.00 175.26 175.78 2w3f s SER 166 N -0.49 5.45 -0.00 -1.70 0.15 -1.26 -1.33 113.70 114.52 2w3f s SER 166 Ca 0.01 0.15 0.04 0.00 0.70 0.00 0.00 55.95 56.84 2w3f s SER 166 Cb -0.03 -1.71 -0.05 0.00 -1.71 0.00 0.00 66.02 62.52 2w3f s SER 166 CO -0.03 0.31 0.11 0.49 1.20 0.00 0.00 173.24 175.32 2w3f n PHE 167 N 2.61 0.00 -3.79 3.44 3.72 0.21 -4.99 117.46 118.66 2w3f n PHE 167 Ca -0.18 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.22 2w3f n PHE 167 Cb 0.53 -0.05 0.01 0.00 -0.94 0.00 0.00 39.48 39.03 2w3f n PHE 167 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2w3f n GLY 168 N 1.78 0.69 2.99 1.37 0.00 -1.03 -0.82 105.19 110.17 2w3f n GLY 168 Ca -0.00 -0.94 -0.13 0.00 0.00 0.00 0.00 46.02 44.95 2w3f n GLY 168 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2w3f s THR 169 N -2.21 -0.04 -0.21 2.61 2.01 -0.40 -0.58 115.64 116.81 2w3f s THR 169 Ca 0.10 0.15 -0.07 0.00 0.31 0.00 0.00 61.69 62.17 2w3f s THR 169 Cb -0.01 -0.31 -0.04 0.00 0.01 0.00 0.00 72.50 72.16 2w3f s THR 169 CO 0.01 0.06 0.06 -0.22 -0.69 0.00 0.00 174.62 173.84 2w3f s LEU 170 N 1.12 3.63 0.03 4.42 2.96 0.07 -1.97 118.68 128.93 2w3f s LEU 170 Ca -0.08 -0.06 -0.04 0.00 -0.22 0.00 0.00 54.13 53.73 2w3f s LEU 170 Cb -0.10 -1.94 -0.02 0.00 0.50 0.00 0.00 46.19 44.63 2w3f s LEU 170 CO -0.07 0.08 0.05 -0.72 -1.32 0.00 0.00 176.35 174.37 2w3f s TYR 171 N 0.94 0.23 0.07 5.38 1.13 -0.15 -1.16 117.35 123.79 2w3f s TYR 171 Ca 0.04 -0.52 0.04 0.00 -1.41 0.00 0.00 57.07 55.22 2w3f s TYR 171 Cb -0.14 -0.17 -0.03 0.00 -1.10 0.00 0.00 41.96 40.52 2w3f s TYR 171 CO 0.03 -0.30 -0.12 -0.51 -2.51 0.00 0.00 175.55 172.14 2w3f s LEU 172 N -1.91 2.30 0.10 -3.49 1.43 0.13 -1.40 118.68 115.84 2w3f s LEU 172 Ca -0.08 -0.64 0.03 0.00 -1.03 0.00 0.00 54.13 52.40 2w3f s LEU 172 Cb -0.04 -0.38 -0.04 0.00 0.03 0.00 0.00 46.19 45.77 2w3f s LEU 172 CO -0.03 -0.15 -0.08 0.42 0.23 0.00 0.00 176.35 176.74 2w3f s THR 173 N -1.57 0.78 -0.88 5.49 -4.23 -0.83 -1.00 115.64 113.41 2w3f s THR 173 Ca -0.02 -1.76 -0.04 0.00 -1.18 0.00 0.00 61.69 58.69 2w3f s THR 173 Cb -0.08 -1.48 -0.02 0.00 1.34 0.00 0.00 72.50 72.26 2w3f s THR 173 CO 0.01 -0.72 0.77 0.47 -0.54 0.00 0.00 174.62 174.62 2w3f n ASP 174 N 0.29 -7.03 -4.67 3.99 9.92 -0.87 -2.56 116.55 115.62 2w3f n ASP 174 Ca -0.14 -0.42 -0.44 0.00 -0.53 0.00 0.00 54.79 53.26 2w3f n ASP 174 Cb 0.59 -4.88 -0.02 0.00 -0.64 0.00 0.00 41.12 36.17 2w3f n ASP 174 CO 0.00 0.00 0.00 1.17 0.13 0.00 0.00 177.20 178.50 2w3f n LYS 175 N -2.51 1.98 -1.52 -1.24 4.81 -1.26 -0.81 118.16 117.61 2w3f n LYS 175 Ca -0.05 0.70 -0.43 0.00 -0.87 0.00 0.00 58.31 57.66 2w3f n LYS 175 Cb 0.56 -2.30 0.00 0.00 0.02 0.00 0.00 35.03 33.31 2w3f n LYS 175 CO 0.00 0.00 0.00 2.41 1.17 0.00 0.00 177.40 180.98 2w3f n THR 176 N 1.15 2.03 -0.80 3.15 -1.04 0.43 -1.80 114.28 117.39 2w3f n THR 176 Ca 0.09 -0.50 0.00 0.00 -2.04 0.00 0.00 64.05 61.60 2w3f n THR 176 Cb 0.33 -0.76 0.00 0.00 -1.82 0.00 0.00 70.33 68.08 2w3f n THR 176 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 2w3f n ASN 177 N 1.11 -2.03 0.00 8.00 5.03 -1.26 -3.85 115.26 122.26 2w3f n ASN 177 Ca 0.11 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.56 2w3f n ASN 177 Cb 0.37 -1.99 0.00 0.00 -1.02 0.00 0.00 39.78 37.14 2w3f n ASN 177 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2w3f n GLY 178 N -1.33 0.69 3.90 7.41 0.00 -0.74 -5.07 105.19 110.04 2w3f n GLY 178 Ca 0.00 -0.17 -0.28 0.00 0.00 0.00 0.00 46.02 45.57 2w3f n GLY 178 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2w3f s GLN 179 N -0.62 3.58 0.63 1.61 1.11 -1.25 -4.99 119.66 119.74 2w3f s GLN 179 Ca 0.00 0.25 -0.14 0.00 0.01 0.00 0.00 55.36 55.48 2w3f s GLN 179 Cb 0.00 -2.38 -0.02 0.00 -1.01 0.00 0.00 33.01 29.60 2w3f s GLN 179 CO 0.00 -0.18 1.06 -2.14 0.01 0.00 0.00 175.29 174.03 2w3f s PRO 180 N -4.59 3.18 0.38 2.91 0.02 -1.26 -4.41 135.00 131.23 2w3f s PRO 180 Ca 0.48 1.09 -0.27 0.00 0.02 0.00 0.00 61.00 62.32 2w3f s PRO 180 Cb -0.10 -2.02 -0.09 0.00 0.02 0.00 0.00 34.50 32.30 2w3f s PRO 180 CO 0.43 -0.91 1.31 -0.06 -0.33 0.00 0.00 177.00 177.44 2w3f s PHE 181 N -2.71 2.90 0.50 6.54 0.08 -1.26 -5.02 117.98 119.01 2w3f s PHE 181 Ca 0.61 1.40 0.03 0.00 0.12 0.00 0.00 56.93 59.10 2w3f s PHE 181 Cb -0.15 -3.68 0.02 0.00 -0.57 0.00 0.00 43.02 38.64 2w3f s PHE 181 CO 0.44 -2.02 0.70 -1.54 -0.10 0.00 0.00 175.22 172.70 2w3f s SER 182 N -0.63 5.44 0.25 1.36 1.04 -1.26 -4.96 113.70 114.94 2w3f s SER 182 Ca 0.54 -0.12 -0.06 0.00 0.48 0.00 0.00 55.95 56.79 2w3f s SER 182 Cb -0.39 -0.87 0.27 0.00 0.10 0.00 0.00 66.02 65.13 2w3f s SER 182 CO 0.51 -0.98 1.92 -0.78 0.98 0.00 0.00 173.24 174.89 2w3f h ASP 183 N 0.28 1.12 -0.68 7.02 3.58 -2.00 -1.73 116.42 124.01 2w3f h ASP 183 Ca -0.42 -0.02 -0.05 0.00 0.42 0.00 0.00 57.03 56.96 2w3f h ASP 183 Cb 1.29 -0.27 -0.03 0.00 1.72 0.00 0.00 39.33 42.03 2w3f h ASP 183 CO 0.50 0.80 0.26 0.44 -2.88 0.00 0.00 179.24 178.36 2w3f h ASP 184 N 1.32 0.98 -0.48 2.28 3.45 -1.99 -1.30 116.42 120.67 2w3f h ASP 184 Ca 0.37 -0.16 -0.00 0.00 0.43 0.00 0.00 57.03 57.67 2w3f h ASP 184 Cb -0.12 -0.25 -0.02 0.00 -0.56 0.00 0.00 39.33 38.37 2w3f h ASP 184 CO -0.09 0.89 0.30 0.44 -1.57 0.00 0.00 179.24 179.21 2w3f h ASP 185 N 1.03 0.57 -0.30 6.45 3.32 -1.82 -1.27 116.42 124.40 2w3f h ASP 185 Ca 0.23 -0.04 -0.00 0.00 0.02 0.00 0.00 57.03 57.24 2w3f h ASP 185 Cb 0.23 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 2w3f h ASP 185 CO -0.02 0.44 0.18 -0.08 -1.72 0.00 0.00 179.24 178.05 2w3f h GLU 186 N 0.64 0.41 -0.23 3.56 4.81 -0.97 -0.65 114.58 122.15 2w3f h GLU 186 Ca 0.17 -0.04 0.04 0.00 -0.13 0.00 0.00 59.36 59.40 2w3f h GLU 186 Cb -0.03 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.23 2w3f h GLU 186 CO -0.03 0.32 0.01 0.28 -0.73 0.00 0.00 179.01 178.86 2w3f h VAL 187 N 0.38 0.85 -0.16 0.32 2.07 -1.10 -0.13 116.25 118.48 2w3f h VAL 187 Ca 0.11 -0.03 0.03 0.00 0.82 0.00 0.00 66.70 67.63 2w3f h VAL 187 Cb 0.02 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 30.52 2w3f h VAL 187 CO -0.02 0.02 -0.05 0.25 0.02 0.00 0.00 177.57 177.78 2w3f h LEU 188 N 0.09 -0.19 -0.88 2.57 5.85 -1.08 -1.66 115.31 120.00 2w3f h LEU 188 Ca 0.11 0.05 -0.06 0.00 0.84 0.00 0.00 57.88 58.82 2w3f h LEU 188 Cb 0.13 0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.25 2w3f h LEU 188 CO -0.17 -0.07 0.12 0.58 -0.34 0.00 0.00 178.44 178.56 2w3f h VAL 189 N -0.02 1.25 -0.77 1.05 2.07 -0.94 -0.96 116.25 117.91 2w3f h VAL 189 Ca 0.08 -0.92 0.03 0.00 0.82 0.00 0.00 66.70 66.71 2w3f h VAL 189 Cb 0.15 0.65 -0.05 0.00 -1.52 0.00 0.00 31.29 30.52 2w3f h VAL 189 CO -0.18 0.34 0.49 1.56 0.02 0.00 0.00 177.57 179.81 2w3f h GLN 190 N 0.91 0.94 -0.52 1.57 4.20 -0.84 -0.18 115.11 121.18 2w3f h GLN 190 Ca 0.19 -0.06 -0.04 0.00 0.06 0.00 0.00 58.65 58.80 2w3f h GLN 190 Cb 0.36 -0.21 -0.02 0.00 0.30 0.00 0.00 27.48 27.90 2w3f h GLN 190 CO 0.00 0.62 0.16 0.00 -0.67 0.00 0.00 178.83 178.94 2w3f h ALA 191 N 1.32 0.69 -0.49 3.87 0.00 -0.43 -2.32 119.26 121.91 2w3f h ALA 191 Ca 0.31 -0.19 -0.12 0.00 0.00 0.00 0.00 54.91 54.91 2w3f h ALA 191 Cb 0.00 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 2w3f h ALA 191 CO -0.11 0.35 -0.17 -0.07 0.00 0.00 0.00 179.25 179.25 2w3f h LEU 192 N 0.72 0.97 -1.66 0.00 3.38 -1.03 -3.00 115.31 114.69 2w3f h LEU 192 Ca 0.17 -0.34 -0.02 0.00 0.09 0.00 0.00 57.88 57.78 2w3f h LEU 192 Cb 0.28 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 2w3f h LEU 192 CO -0.00 1.12 0.04 0.00 0.09 0.00 0.00 178.44 179.69 2w3f h ALA 193 N 0.96 1.74 -0.28 1.53 0.00 -0.87 -2.32 119.26 120.01 2w3f h ALA 193 Ca 0.12 -0.08 -0.12 0.00 0.00 0.00 0.00 54.91 54.83 2w3f h ALA 193 Cb 0.73 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 2w3f h ALA 193 CO 0.06 0.21 -0.33 0.00 0.00 0.00 0.00 179.25 179.19 2w3f h ALA 194 N 1.80 0.91 -0.60 0.00 0.00 -1.27 0.19 119.26 120.28 2w3f h ALA 194 Ca 0.06 -0.40 -0.10 0.00 0.00 0.00 0.00 54.91 54.48 2w3f h ALA 194 Cb 0.11 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 2w3f h ALA 194 CO -0.00 0.62 -0.00 0.00 0.00 0.00 0.00 179.25 179.87 2w3f h ALA 195 N 1.13 0.86 -0.66 0.00 0.00 -1.42 -1.92 119.26 117.26 2w3f h ALA 195 Ca 0.06 -0.31 -0.06 0.00 0.00 0.00 0.00 54.91 54.59 2w3f h ALA 195 Cb 0.81 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 2w3f h ALA 195 CO 0.07 0.66 0.16 0.00 0.00 0.00 0.00 179.25 180.14 2w3f h ALA 196 N 1.03 1.03 -0.56 0.00 0.00 -1.09 -2.12 119.26 117.55 2w3f h ALA 196 Ca 0.17 -0.24 0.10 0.00 0.00 0.00 0.00 54.91 54.94 2w3f h ALA 196 Cb 0.55 -0.26 -0.08 0.00 0.00 0.00 0.00 17.79 18.01 2w3f h ALA 196 CO 0.03 0.63 0.14 0.78 0.00 0.00 0.00 179.25 180.83 2w3f h GLY 197 N 1.06 0.72 0.99 0.00 0.00 -0.22 0.53 103.07 106.15 2w3f h GLY 197 Ca 0.21 -0.05 -0.04 0.00 0.00 0.00 0.00 47.33 47.46 2w3f h GLY 197 CO 0.00 -0.07 0.21 -2.22 0.00 0.00 0.00 176.54 174.46 2w3f h ILE 198 N 0.28 1.23 -0.46 2.60 2.04 -1.17 -0.42 117.51 121.61 2w3f h ILE 198 Ca 0.29 -0.73 0.04 0.00 1.00 0.00 0.00 64.86 65.46 2w3f h ILE 198 Cb 0.39 0.65 -0.04 0.00 -0.74 0.00 0.00 36.82 37.08 2w3f h ILE 198 CO -0.35 0.28 0.23 0.00 0.00 0.00 0.00 178.15 178.31 2w3f h ALA 199 N 1.06 0.59 -0.14 1.87 0.00 -0.73 -0.84 119.26 121.07 2w3f h ALA 199 Ca 0.19 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 2w3f h ALA 199 Cb 0.22 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2w3f h ALA 199 CO -0.01 -0.12 0.00 0.28 0.00 0.00 0.00 179.25 179.40 2w3f h VAL 200 N 0.46 1.25 -0.83 0.00 2.07 -0.73 -2.09 116.25 116.38 2w3f h VAL 200 Ca 0.20 -0.81 0.09 0.00 0.82 0.00 0.00 66.70 67.00 2w3f h VAL 200 Cb 0.11 1.52 -0.06 0.00 -1.52 0.00 0.00 31.29 31.34 2w3f h VAL 200 CO -0.14 0.24 0.54 0.00 0.02 0.00 0.00 177.57 178.22 2w3f h ALA 201 N 0.76 1.68 -0.41 1.67 0.00 -0.89 -1.92 119.26 120.17 2w3f h ALA 201 Ca 0.04 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.82 2w3f h ALA 201 Cb 0.36 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2w3f h ALA 201 CO 0.01 0.16 -0.21 -0.97 0.00 0.00 0.00 179.25 178.24 2w3f h ASN 202 N 0.82 0.88 0.10 0.00 -1.24 -1.02 -2.95 115.58 112.17 2w3f h ASN 202 Ca 0.37 -0.41 -0.07 0.00 0.71 0.00 0.00 56.30 56.91 2w3f h ASN 202 Cb 0.37 -0.24 -0.01 0.00 0.73 0.00 0.00 38.32 39.16 2w3f h ASN 202 CO -0.14 1.10 -0.22 0.00 -1.29 0.00 0.00 177.43 176.87 2w3f h ALA 203 N 0.81 1.39 0.00 1.57 0.00 -0.86 0.17 119.26 122.36 2w3f h ALA 203 Ca 0.09 -0.27 -0.07 0.00 0.00 0.00 0.00 54.91 54.66 2w3f h ALA 203 Cb 0.77 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 2w3f h ALA 203 CO 0.06 0.42 -0.35 0.00 0.00 0.00 0.00 179.25 179.39 2w3f h ARG 204 N 0.21 0.00 0.00 0.00 3.08 -1.24 -3.21 114.38 113.22 2w3f h ARG 204 Ca 0.04 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.06 2w3f h ARG 204 Cb 0.51 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.56 2w3f h ARG 204 CO 0.03 0.35 -0.25 -0.07 -1.07 0.00 0.00 179.97 178.96 2w3f h LEU 205 N 0.00 0.00 0.00 3.04 3.38 -1.30 -3.52 115.31 116.92 2w3f h LEU 205 Ca -0.00 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.74 2w3f h LEU 205 Cb 0.76 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.51 2w3f h LEU 205 CO 0.04 0.75 0.00 -1.22 0.09 0.00 0.00 178.44 178.10