#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3jzi s HIS 0 N 0.00 3.29 0.07 -1.55 5.65 -1.26 -5.06 115.29 116.44 3jzi s HIS 0 Ca 0.00 1.38 0.05 0.00 0.25 0.00 0.00 55.06 56.74 3jzi s HIS 0 Cb 0.00 -3.54 -0.03 0.00 -1.18 0.00 0.00 32.58 27.83 3jzi s HIS 0 CO 0.00 -1.53 -0.14 1.41 -0.65 0.00 0.00 174.74 173.83 3jzi s MET 1 N -0.75 0.83 0.17 2.88 1.75 -1.26 -4.82 119.30 118.10 3jzi s MET 1 Ca 0.52 -0.95 -0.32 0.00 -1.25 0.00 0.00 55.69 53.69 3jzi s MET 1 Cb -0.36 -0.84 -0.12 0.00 2.84 0.00 0.00 34.83 36.36 3jzi s MET 1 CO 0.42 0.19 1.77 1.28 -0.65 0.00 0.00 175.02 178.02 3jzi n LEU 2 N 1.29 3.99 -0.01 4.11 4.77 -1.26 -4.95 117.00 124.95 3jzi n LEU 2 Ca -0.21 1.03 -0.13 0.00 -0.03 0.00 0.00 56.01 56.67 3jzi n LEU 2 Cb 0.54 -1.56 -0.10 0.00 -2.33 0.00 0.00 43.42 39.98 3jzi n LEU 2 CO 0.21 0.17 0.65 -0.78 -1.33 0.00 0.00 177.39 176.31 3jzi h ASP 3 N 7.49 0.03 -3.74 -1.43 1.82 -1.94 -3.42 116.42 115.23 3jzi h ASP 3 Ca -0.44 -0.46 -0.15 0.00 -0.39 0.00 0.00 57.03 55.59 3jzi h ASP 3 Cb 1.21 -0.01 -0.25 0.00 0.68 0.00 0.00 39.33 40.96 3jzi h ASP 3 CO 0.95 0.48 -0.34 -0.75 -1.61 0.00 0.00 179.24 177.97 3jzi s LYS 4 N -4.37 0.37 0.11 0.28 2.20 -1.26 -0.69 119.74 116.38 3jzi s LYS 4 Ca -0.16 0.50 0.05 0.00 -0.36 0.00 0.00 55.97 56.00 3jzi s LYS 4 Cb 0.02 0.14 -0.04 0.00 -1.51 0.00 0.00 37.83 36.44 3jzi s LYS 4 CO 0.68 -0.07 -0.12 0.96 -0.36 0.00 0.00 175.35 176.44 3jzi s ILE 5 N 0.40 1.15 -0.19 5.43 -4.36 -0.63 -0.79 121.20 122.21 3jzi s ILE 5 Ca -0.02 -1.72 -0.13 0.00 -0.26 0.00 0.00 60.65 58.52 3jzi s ILE 5 Cb -0.04 -1.49 -0.05 0.00 1.25 0.00 0.00 42.46 42.14 3jzi s ILE 5 CO -0.02 -0.51 0.28 -0.69 0.24 0.00 0.00 174.94 174.24 3jzi s VAL 6 N -2.39 5.30 -0.80 8.37 1.01 -0.40 -1.14 120.40 130.36 3jzi s VAL 6 Ca 0.08 0.47 -0.19 0.00 0.00 0.00 0.00 61.98 62.34 3jzi s VAL 6 Cb -0.03 -3.61 0.12 0.00 0.00 0.00 0.00 36.38 32.85 3jzi s VAL 6 CO 0.02 0.35 0.99 -0.63 0.00 0.00 0.00 175.10 175.82 3jzi s ILE 7 N 0.81 4.71 -1.52 2.22 1.01 -0.08 -1.52 121.20 126.83 3jzi s ILE 7 Ca 0.14 -1.24 -0.10 0.00 0.00 0.00 0.00 60.65 59.45 3jzi s ILE 7 Cb -0.13 -4.68 -0.01 0.00 0.01 0.00 0.00 42.46 37.65 3jzi s ILE 7 CO 0.04 -1.39 2.61 0.00 0.00 0.00 0.00 174.94 176.20 3jzi n ALA 8 N 6.61 6.76 -3.00 9.38 0.00 0.09 -3.90 120.51 136.45 3jzi n ALA 8 Ca 0.10 -3.76 0.00 0.00 0.00 0.00 0.00 53.44 49.78 3jzi n ALA 8 Cb 0.47 -3.31 0.00 0.00 0.00 0.00 0.00 19.45 16.60 3jzi n ALA 8 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3jzi n ASN 9 N 4.06 0.00 -3.30 0.00 2.85 -1.26 -4.43 115.26 113.18 3jzi n ASN 9 Ca 0.66 -0.73 -0.13 0.00 -0.11 0.00 0.00 54.58 54.28 3jzi n ASN 9 Cb 0.29 0.00 -0.03 0.00 1.24 0.00 0.00 39.78 41.28 3jzi n ASN 9 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3jzi s ARG 10 N -1.18 1.92 5.01 1.20 1.70 -1.26 -4.83 118.95 121.50 3jzi s ARG 10 Ca 0.00 -1.63 0.00 0.00 -0.47 0.00 0.00 55.73 53.63 3jzi s ARG 10 Cb 0.00 0.48 0.00 0.00 -0.57 0.00 0.00 34.95 34.86 3jzi s ARG 10 CO 0.00 -0.82 0.00 0.41 -1.08 0.00 0.00 175.30 173.81 3jzi n GLY 11 N -0.53 2.68 0.25 3.88 0.00 -1.26 -2.88 105.19 107.32 3jzi n GLY 11 Ca -0.01 -0.36 -0.04 0.00 0.00 0.00 0.00 46.02 45.61 3jzi n GLY 11 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 3jzi h GLU 12 N 0.00 0.75 -0.18 1.61 -0.00 -1.90 -2.72 114.58 112.15 3jzi h GLU 12 Ca 0.00 -0.05 -0.11 0.00 -0.00 0.00 0.00 59.36 59.20 3jzi h GLU 12 Cb 0.00 -0.17 -0.01 0.00 -0.00 0.00 0.00 28.75 28.57 3jzi h GLU 12 CO 0.00 0.50 -0.38 0.97 -0.00 0.00 0.00 179.01 180.10 3jzi h ILE 13 N 0.78 1.30 -0.67 -1.06 6.09 -1.96 -0.05 117.51 121.93 3jzi h ILE 13 Ca 0.25 -1.49 -0.08 0.00 -1.37 0.00 0.00 64.86 62.17 3jzi h ILE 13 Cb 0.01 1.57 -0.03 0.00 0.47 0.00 0.00 36.82 38.85 3jzi h ILE 13 CO -0.10 0.46 0.09 0.00 -3.07 0.00 0.00 178.15 175.53 3jzi h ALA 14 N 1.27 0.89 -0.43 0.18 0.00 -1.38 0.16 119.26 119.95 3jzi h ALA 14 Ca 0.03 -0.28 -0.10 0.00 0.00 0.00 0.00 54.91 54.56 3jzi h ALA 14 Cb 0.81 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 3jzi h ALA 14 CO 0.07 0.68 -0.12 1.25 0.00 0.00 0.00 179.25 181.12 3jzi h LEU 15 N 1.04 0.86 -0.31 0.00 5.85 -1.24 -0.73 115.31 120.77 3jzi h LEU 15 Ca 0.20 -0.37 0.04 0.00 0.84 0.00 0.00 57.88 58.59 3jzi h LEU 15 Cb 0.47 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.22 3jzi h LEU 15 CO 0.02 1.03 0.07 -0.09 -0.34 0.00 0.00 178.44 179.12 3jzi h ARG 16 N 0.67 0.17 -0.64 1.25 9.65 -0.71 -1.69 114.38 123.09 3jzi h ARG 16 Ca 0.11 -0.01 -0.07 0.00 -1.10 0.00 0.00 59.98 58.90 3jzi h ARG 16 Cb 0.67 -0.04 -0.03 0.00 -1.39 0.00 0.00 29.97 29.18 3jzi h ARG 16 CO 0.05 0.12 0.11 0.82 2.80 0.00 0.00 179.97 183.86 3jzi h ILE 17 N 0.18 1.26 -0.34 1.20 2.04 -0.84 -2.75 117.51 118.27 3jzi h ILE 17 Ca 0.15 -1.01 0.03 0.00 1.00 0.00 0.00 64.86 65.03 3jzi h ILE 17 Cb 0.16 0.68 -0.03 0.00 -0.74 0.00 0.00 36.82 36.89 3jzi h ILE 17 CO -0.19 0.38 0.16 0.25 0.00 0.00 0.00 178.15 178.74 3jzi h LEU 18 N 0.96 0.22 -0.57 1.44 6.46 -0.77 -1.30 115.31 121.76 3jzi h LEU 18 Ca 0.19 0.02 0.00 0.00 -0.12 0.00 0.00 57.88 57.98 3jzi h LEU 18 Cb 0.43 -0.02 -0.03 0.00 -0.73 0.00 0.00 40.66 40.31 3jzi h LEU 18 CO 0.01 0.17 0.36 0.03 -0.62 0.00 0.00 178.44 178.38 3jzi h ARG 19 N 0.33 0.76 -0.78 1.25 3.08 -1.23 -1.28 114.38 116.52 3jzi h ARG 19 Ca 0.15 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 60.11 3jzi h ARG 19 Cb 0.07 -0.16 -0.04 0.00 0.08 0.00 0.00 29.97 29.92 3jzi h ARG 19 CO -0.12 0.53 0.36 0.00 -1.07 0.00 0.00 179.97 179.67 3jzi h ALA 20 N 1.19 1.16 0.08 0.04 0.00 -1.21 -1.94 119.26 118.58 3jzi h ALA 20 Ca 0.21 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 3jzi h ALA 20 Cb -0.05 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.43 3jzi h ALA 20 CO -0.04 0.63 -0.04 0.00 0.00 0.00 0.00 179.25 179.80 3jzi h LYS 22 N -0.21 0.95 -0.36 0.00 1.57 -1.10 0.77 116.57 118.18 3jzi h LYS 22 Ca -0.01 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.68 3jzi h LYS 22 Cb 0.18 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 32.26 3jzi h LYS 22 CO 0.02 0.63 0.08 0.93 -0.57 0.00 0.00 179.45 180.54 3jzi h GLU 23 N 0.97 0.53 -0.06 3.15 5.08 -1.27 -2.62 114.58 120.37 3jzi h GLU 23 Ca 0.37 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.64 3jzi h GLU 23 Cb 0.15 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.31 3jzi h GLU 23 CO -0.17 0.49 0.00 1.28 -1.00 0.00 0.00 179.01 179.62 3jzi n LEU 24 N -4.34 1.83 -1.11 1.33 4.77 -0.60 -4.95 117.00 113.93 3jzi n LEU 24 Ca 0.02 -0.65 -0.11 0.00 -0.03 0.00 0.00 56.01 55.24 3jzi n LEU 24 Cb 0.19 -0.03 -0.02 0.00 -2.33 0.00 0.00 43.42 41.23 3jzi n LEU 24 CO 0.38 0.33 -0.13 0.61 -1.33 0.00 0.00 177.39 177.24 3jzi n GLY 25 N 1.21 0.36 3.71 -0.72 0.00 -0.41 -5.01 105.19 104.32 3jzi n GLY 25 Ca 0.18 -0.46 -0.39 0.00 0.00 0.00 0.00 46.02 45.35 3jzi n GLY 25 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3jzi s ILE 26 N -2.50 5.10 0.33 -0.61 1.01 0.13 -4.96 121.20 119.71 3jzi s ILE 26 Ca 0.00 1.17 -0.28 0.00 0.00 0.00 0.00 60.65 61.54 3jzi s ILE 26 Cb 0.00 -3.92 -0.10 0.00 0.01 0.00 0.00 42.46 38.45 3jzi s ILE 26 CO 0.00 0.25 1.23 -0.54 0.00 0.00 0.00 174.94 175.89 3jzi s LYS 27 N 0.96 4.37 -0.00 2.79 1.02 0.13 -4.16 119.74 124.86 3jzi s LYS 27 Ca 0.30 2.06 0.01 0.00 0.02 0.00 0.00 55.97 58.37 3jzi s LYS 27 Cb -0.16 -3.03 -0.04 0.00 -0.52 0.00 0.00 37.83 34.08 3jzi s LYS 27 CO 0.13 -0.12 0.00 0.95 -0.92 0.00 0.00 175.35 175.39 3jzi s THR 28 N -1.19 4.16 -0.23 2.17 -4.23 -1.26 -1.60 115.64 113.46 3jzi s THR 28 Ca 0.49 -0.59 0.01 0.00 -1.18 0.00 0.00 61.69 60.42 3jzi s THR 28 Cb -0.36 -2.85 0.06 0.00 1.34 0.00 0.00 72.50 70.68 3jzi s THR 28 CO 0.48 0.38 -0.07 -0.69 -0.54 0.00 0.00 174.62 174.18 3jzi s VAL 29 N -1.08 1.62 -0.40 2.29 1.01 -0.30 -1.45 120.40 122.09 3jzi s VAL 29 Ca 0.19 -1.22 -0.19 0.00 0.00 0.00 0.00 61.98 60.76 3jzi s VAL 29 Cb -0.11 -1.83 0.01 0.00 0.00 0.00 0.00 36.38 34.45 3jzi s VAL 29 CO 0.10 -0.04 0.56 0.00 0.00 0.00 0.00 175.10 175.72 3jzi s ALA 30 N 1.36 3.42 -0.10 5.51 0.00 -0.07 -0.91 121.76 130.97 3jzi s ALA 30 Ca -0.05 -1.17 -0.18 0.00 0.00 0.00 0.00 51.96 50.55 3jzi s ALA 30 Cb -0.18 -3.14 -0.04 0.00 0.00 0.00 0.00 23.12 19.75 3jzi s ALA 30 CO -0.06 -1.52 0.49 0.14 0.00 0.00 0.00 175.76 174.81 3jzi s VAL 31 N 2.53 5.16 0.06 0.00 -7.23 -1.25 -0.95 120.40 118.71 3jzi s VAL 31 Ca 0.19 0.98 -0.05 0.00 -1.81 0.00 0.00 61.98 61.29 3jzi s VAL 31 Cb -0.15 -3.83 -0.01 0.00 0.56 0.00 0.00 36.38 32.95 3jzi s VAL 31 CO 0.16 0.34 0.10 -1.38 -0.31 0.00 0.00 175.10 174.01 3jzi s HIS 32 N 0.47 0.26 0.74 2.82 -3.43 -0.40 -4.69 115.29 111.05 3jzi s HIS 32 Ca 0.27 -0.65 -0.11 0.00 -0.80 0.00 0.00 55.06 53.77 3jzi s HIS 32 Cb -0.15 -0.17 0.04 0.00 -1.43 0.00 0.00 32.58 30.87 3jzi s HIS 32 CO 0.11 -0.42 1.11 -1.54 -2.00 0.00 0.00 174.74 172.00 3jzi s SER 33 N -2.52 5.04 0.53 7.38 1.04 -1.26 -0.46 113.70 123.43 3jzi s SER 33 Ca 0.01 0.90 0.23 0.00 0.48 0.00 0.00 55.95 57.57 3jzi s SER 33 Cb 0.03 -1.58 1.45 0.00 0.10 0.00 0.00 66.02 66.01 3jzi s SER 33 CO -0.08 -1.56 2.13 0.77 0.98 0.00 0.00 173.24 175.48 3jzi h SER 34 N -0.77 0.00 1.02 7.02 4.64 -1.01 -1.74 113.55 122.72 3jzi h SER 34 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 3jzi h SER 34 Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 3jzi h SER 34 CO 0.64 0.07 0.00 0.00 -0.87 0.00 0.00 176.83 176.68 3jzi n ALA 35 N -2.39 2.26 -1.29 5.18 0.00 -1.26 -4.02 120.51 118.99 3jzi n ALA 35 Ca -0.03 -0.08 0.03 0.00 0.00 0.00 0.00 53.44 53.36 3jzi n ALA 35 Cb 0.16 -1.45 0.21 0.00 0.00 0.00 0.00 19.45 18.37 3jzi n ALA 35 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3jzi n ASP 36 N -1.62 2.70 0.19 0.00 10.43 -0.65 -4.70 116.55 122.90 3jzi n ASP 36 Ca 0.06 -3.48 0.03 0.00 2.57 0.00 0.00 54.79 53.97 3jzi n ASP 36 Cb 0.34 -0.56 0.37 0.00 1.84 0.00 0.00 41.12 43.10 3jzi n ASP 36 CO 0.00 0.00 0.00 0.03 -1.07 0.00 0.00 177.20 176.16 3jzi h ARG 37 N 1.03 0.00 -0.64 -1.24 3.08 -1.70 -2.96 114.38 111.96 3jzi h ARG 37 Ca 0.10 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.15 3jzi h ARG 37 Cb 1.40 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.45 3jzi h ARG 37 CO 0.22 0.37 0.00 -0.25 -1.07 0.00 0.00 179.97 179.24 3jzi n ASP 38 N -4.05 3.81 -4.76 7.04 10.43 -1.26 -4.61 116.55 123.15 3jzi n ASP 38 Ca -0.02 -2.43 -0.41 0.00 2.57 0.00 0.00 54.79 54.50 3jzi n ASP 38 Cb 0.41 -0.53 -0.03 0.00 1.84 0.00 0.00 41.12 42.81 3jzi n ASP 38 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 3jzi s LEU 39 N -1.62 4.44 0.19 0.64 1.43 -1.12 -4.89 118.68 117.76 3jzi s LEU 39 Ca 0.37 2.55 -0.14 0.00 -1.03 0.00 0.00 54.13 55.89 3jzi s LEU 39 Cb 0.26 -3.63 0.20 0.00 0.03 0.00 0.00 46.19 43.04 3jzi s LEU 39 CO 0.16 -0.48 1.65 0.50 0.23 0.00 0.00 176.35 178.41 3jzi h LYS 40 N 4.03 0.04 -0.45 1.70 1.63 -1.93 -1.42 116.57 120.17 3jzi h LYS 40 Ca -0.47 -0.00 -0.05 0.00 -0.85 0.00 0.00 60.65 59.27 3jzi h LYS 40 Cb 1.22 -0.01 -0.02 0.00 -0.60 0.00 0.00 32.23 32.82 3jzi h LYS 40 CO 0.69 0.02 0.06 1.12 -3.45 0.00 0.00 179.45 177.89 3jzi h HIS 41 N 0.04 0.72 -0.55 1.91 2.07 -1.91 -1.80 115.15 115.63 3jzi h HIS 41 Ca 0.27 -0.07 -0.02 0.00 -2.85 0.00 0.00 60.37 57.70 3jzi h HIS 41 Cb 0.41 -0.21 -0.03 0.00 2.57 0.00 0.00 27.41 30.16 3jzi h HIS 41 CO -0.41 0.65 0.28 0.28 -3.07 0.00 0.00 177.93 175.66 3jzi h VAL 42 N 0.67 1.19 0.00 6.12 2.07 -1.69 0.83 116.25 125.44 3jzi h VAL 42 Ca 0.14 -0.52 -0.03 0.00 0.82 0.00 0.00 66.70 67.11 3jzi h VAL 42 Cb 0.33 0.53 -0.00 0.00 -1.52 0.00 0.00 31.29 30.62 3jzi h VAL 42 CO 0.01 0.21 -0.15 -0.07 0.02 0.00 0.00 177.57 177.59 3jzi h LEU 43 N 0.74 0.00 0.00 2.57 3.38 -0.63 -2.94 115.31 118.43 3jzi h LEU 43 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.16 3jzi h LEU 43 Cb 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 3jzi h LEU 43 CO -0.03 0.15 -1.28 0.18 0.09 0.00 0.00 178.44 177.55 3jzi n LEU 44 N -3.62 0.72 -4.76 1.67 4.77 -0.74 -5.01 117.00 110.03 3jzi n LEU 44 Ca -0.01 -0.36 -0.35 0.00 -0.03 0.00 0.00 56.01 55.26 3jzi n LEU 44 Cb 0.28 -0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.40 3jzi n LEU 44 CO 0.31 0.18 0.81 0.00 -1.33 0.00 0.00 177.39 177.36 3jzi s ALA 45 N -3.15 2.56 0.16 -1.18 0.00 0.25 -4.97 121.76 115.44 3jzi s ALA 45 Ca 0.04 0.88 -0.10 0.00 0.00 0.00 0.00 51.96 52.78 3jzi s ALA 45 Cb 0.15 -3.41 0.02 0.00 0.00 0.00 0.00 23.12 19.89 3jzi s ALA 45 CO 0.88 -1.08 1.57 -0.44 0.00 0.00 0.00 175.76 176.69 3jzi h ASP 46 N 0.83 1.02 -4.68 0.00 3.45 -1.88 -3.45 116.42 111.72 3jzi h ASP 46 Ca -0.50 -0.37 -0.31 0.00 0.43 0.00 0.00 57.03 56.29 3jzi h ASP 46 Cb 1.28 -0.28 -0.22 0.00 -0.56 0.00 0.00 39.33 39.56 3jzi h ASP 46 CO 0.55 1.15 -0.74 -1.61 -1.57 0.00 0.00 179.24 177.02 3jzi s GLU 47 N -4.78 0.59 0.04 3.56 2.02 -0.53 -5.01 118.70 114.59 3jzi s GLU 47 Ca -0.12 -0.78 0.05 0.00 0.02 0.00 0.00 54.97 54.14 3jzi s GLU 47 Cb 0.12 -0.42 -0.02 0.00 0.10 0.00 0.00 34.13 33.92 3jzi s GLU 47 CO 0.86 0.08 -0.14 0.95 0.02 0.00 0.00 175.26 177.04 3jzi s THR 48 N -1.31 1.12 -0.06 3.63 -4.23 -1.26 -0.89 115.64 112.63 3jzi s THR 48 Ca -0.08 -0.98 -0.02 0.00 -1.18 0.00 0.00 61.69 59.43 3jzi s THR 48 Cb -0.10 -1.01 0.03 0.00 1.34 0.00 0.00 72.50 72.77 3jzi s THR 48 CO 0.01 0.02 0.06 -0.69 -0.54 0.00 0.00 174.62 173.48 3jzi s VAL 49 N -0.82 -0.07 -0.30 2.29 1.01 -0.12 -4.93 120.40 117.45 3jzi s VAL 49 Ca 0.02 0.32 -0.28 0.00 0.00 0.00 0.00 61.98 62.03 3jzi s VAL 49 Cb -0.08 -0.24 0.01 0.00 0.00 0.00 0.00 36.38 36.07 3jzi s VAL 49 CO 0.01 0.12 1.04 0.00 0.00 0.00 0.00 175.10 176.27 3jzi n ILE 51 N 5.74 0.00 -0.08 0.00 -5.35 0.39 -4.91 119.36 115.15 3jzi n ILE 51 Ca 0.11 -0.41 0.00 0.00 -0.27 0.00 0.00 62.75 62.18 3jzi n ILE 51 Cb 0.47 1.32 0.00 0.00 -1.74 0.00 0.00 39.64 39.69 3jzi n ILE 51 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3jzi n GLY 52 N 1.35 -1.53 3.69 3.28 0.00 -1.26 -4.58 105.19 106.15 3jzi n GLY 52 Ca 0.13 -1.55 -0.30 0.00 0.00 0.00 0.00 46.02 44.31 3jzi n GLY 52 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3jzi s PRO 53 N -1.66 -0.36 0.21 1.61 0.04 -1.26 -0.52 135.00 133.06 3jzi s PRO 53 Ca 0.00 -0.02 -0.11 0.00 0.04 0.00 0.00 61.00 60.91 3jzi s PRO 53 Cb 0.00 -1.69 0.29 0.00 0.04 0.00 0.00 34.50 33.13 3jzi s PRO 53 CO 0.00 -3.15 1.65 0.00 0.04 0.00 0.00 177.00 175.54 3jzi h ALA 54 N -2.18 0.55 -2.59 8.56 0.00 -1.93 -3.37 119.26 118.30 3jzi h ALA 54 Ca -0.47 0.22 -0.54 0.00 0.00 0.00 0.00 54.91 54.12 3jzi h ALA 54 Cb 1.29 0.39 0.07 0.00 0.00 0.00 0.00 17.79 19.54 3jzi h ALA 54 CO 0.41 -0.41 0.90 -2.30 0.00 0.00 0.00 179.25 177.85 3jzi n PRO 55 N -5.34 2.58 -0.18 0.00 -0.02 -1.26 -4.86 135.00 125.92 3jzi n PRO 55 Ca 0.09 0.92 0.19 0.00 -2.02 0.00 0.00 63.50 62.68 3jzi n PRO 55 Cb 0.36 -2.72 0.55 0.00 -0.02 0.00 0.00 33.50 31.67 3jzi n PRO 55 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 3jzi h SER 56 N 5.78 0.31 -0.75 2.55 0.02 -1.88 -2.10 113.55 117.48 3jzi h SER 56 Ca -0.45 0.02 0.10 0.00 -0.84 0.00 0.00 61.79 60.62 3jzi h SER 56 Cb 1.22 -0.03 -0.05 0.00 0.14 0.00 0.00 62.40 63.68 3jzi h SER 56 CO 0.88 0.14 0.49 1.62 -1.14 0.00 0.00 176.83 178.82 3jzi h VAL 57 N 0.32 0.94 -0.02 2.27 3.04 -1.92 0.28 116.25 121.15 3jzi h VAL 57 Ca 0.40 -0.22 0.00 0.00 -1.01 0.00 0.00 66.70 65.86 3jzi h VAL 57 Cb 1.08 0.23 0.00 0.00 -2.01 0.00 0.00 31.29 30.59 3jzi h VAL 57 CO -0.11 0.12 -0.38 0.29 -1.01 0.00 0.00 177.57 176.47 3jzi n LYS 58 N -4.50 1.44 0.00 4.17 4.76 -0.80 -3.63 118.16 119.59 3jzi n LYS 58 Ca 0.12 -1.19 0.00 0.00 -2.87 0.00 0.00 58.31 54.37 3jzi n LYS 58 Cb 0.34 -1.48 0.00 0.00 -1.84 0.00 0.00 35.03 32.05 3jzi n LYS 58 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 3jzi n SER 59 N 0.26 0.00 0.19 4.39 3.41 -0.87 -4.18 113.62 116.82 3jzi n SER 59 Ca 0.10 0.00 0.14 0.00 -0.26 0.00 0.00 58.87 58.85 3jzi n SER 59 Cb 0.50 0.00 0.66 0.00 -0.26 0.00 0.00 64.21 65.11 3jzi n SER 59 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 175.04 176.76 3jzi h TYR 60 N 0.00 0.00 -0.01 7.33 0.05 -1.65 -2.04 116.97 120.65 3jzi h TYR 60 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 3jzi h TYR 60 Cb 0.00 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.74 3jzi h TYR 60 CO 0.00 0.00 -0.02 1.28 -1.05 0.00 0.00 178.16 178.37 3jzi n LEU 61 N -2.48 1.97 -4.56 3.88 4.77 0.93 -4.51 117.00 117.01 3jzi n LEU 61 Ca -0.00 -0.98 -0.38 0.00 -0.03 0.00 0.00 56.01 54.61 3jzi n LEU 61 Cb 0.14 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.19 3jzi n LEU 61 CO 0.17 0.37 1.47 0.21 -1.33 0.00 0.00 177.39 178.28 3jzi s ASN 62 N -1.06 6.26 0.12 -1.43 3.84 -0.77 -4.91 114.94 117.00 3jzi s ASN 62 Ca 0.14 -1.35 -0.26 0.00 0.21 0.00 0.00 52.86 51.60 3jzi s ASN 62 Cb 0.10 -2.57 -0.05 0.00 -0.55 0.00 0.00 41.25 38.18 3jzi s ASN 62 CO 0.16 -1.73 1.62 0.40 -2.79 0.00 0.00 177.10 174.77 3jzi h ILE 63 N 6.84 0.35 -0.71 -5.21 2.04 -1.90 -2.24 117.51 116.68 3jzi h ILE 63 Ca 0.19 0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.08 3jzi h ILE 63 Cb 1.00 0.35 -0.05 0.00 -0.74 0.00 0.00 36.82 37.39 3jzi h ILE 63 CO 1.39 0.00 0.44 -0.65 0.00 0.00 0.00 178.15 179.33 3jzi h PRO 64 N -0.44 0.82 -0.63 2.37 0.11 -1.99 -1.75 132.00 130.50 3jzi h PRO 64 Ca 0.06 -0.05 -0.08 0.00 0.11 0.00 0.00 66.00 66.05 3jzi h PRO 64 Cb 0.53 -0.19 -0.03 0.00 0.11 0.00 0.00 31.00 31.42 3jzi h PRO 64 CO -0.25 0.54 0.09 0.00 -0.21 0.00 0.00 178.00 178.18 3jzi h ALA 65 N 1.31 0.98 -0.07 -0.75 0.00 -1.88 0.10 119.26 118.96 3jzi h ALA 65 Ca 0.29 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 3jzi h ALA 65 Cb 0.04 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 3jzi h ALA 65 CO -0.12 0.64 -0.01 0.82 0.00 0.00 0.00 179.25 180.58 3jzi h ILE 66 N 0.96 1.27 -0.77 0.00 2.04 -1.20 -0.78 117.51 119.03 3jzi h ILE 66 Ca 0.19 -0.85 -0.03 0.00 1.00 0.00 0.00 64.86 65.18 3jzi h ILE 66 Cb 0.43 1.71 -0.04 0.00 -0.74 0.00 0.00 36.82 38.18 3jzi h ILE 66 CO 0.01 0.23 0.38 0.40 0.00 0.00 0.00 178.15 179.17 3jzi h ILE 67 N -0.19 1.24 -0.60 -0.67 2.04 -1.27 -2.54 117.51 115.52 3jzi h ILE 67 Ca 0.02 -0.68 -0.02 0.00 1.00 0.00 0.00 64.86 65.18 3jzi h ILE 67 Cb 0.37 0.26 -0.03 0.00 -0.74 0.00 0.00 36.82 36.69 3jzi h ILE 67 CO 0.00 0.29 0.29 -1.28 0.00 0.00 0.00 178.15 177.45 3jzi h SER 68 N 1.09 0.77 0.26 1.72 0.87 -0.70 -2.02 113.55 115.54 3jzi h SER 68 Ca 0.27 -0.08 -0.12 0.00 -1.23 0.00 0.00 61.79 60.63 3jzi h SER 68 Cb 0.11 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 61.86 3jzi h SER 68 CO -0.03 0.65 -0.46 0.00 -0.53 0.00 0.00 176.83 176.46 3jzi h ALA 69 N 1.47 1.04 -0.45 6.23 0.00 -0.75 -0.96 119.26 125.84 3jzi h ALA 69 Ca 0.21 -0.45 -0.12 0.00 0.00 0.00 0.00 54.91 54.55 3jzi h ALA 69 Cb 0.09 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3jzi h ALA 69 CO -0.03 0.63 -0.19 0.00 0.00 0.00 0.00 179.25 179.66 3jzi h ALA 70 N 1.32 0.63 0.03 0.00 0.00 -1.02 -2.37 119.26 117.86 3jzi h ALA 70 Ca 0.01 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.55 3jzi h ALA 70 Cb 0.89 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.53 3jzi h ALA 70 CO 0.07 0.59 -0.02 1.49 0.00 0.00 0.00 179.25 181.39 3jzi h GLU 71 N 0.76 -0.04 -0.78 0.00 4.81 -1.25 0.86 114.58 118.94 3jzi h GLU 71 Ca 0.10 0.00 0.05 0.00 -0.13 0.00 0.00 59.36 59.39 3jzi h GLU 71 Cb 0.76 0.01 -0.05 0.00 0.63 0.00 0.00 28.75 30.09 3jzi h GLU 71 CO 0.06 0.26 0.48 0.82 -0.73 0.00 0.00 179.01 179.90 3jzi h ILE 72 N -0.35 1.06 0.00 2.32 5.03 -1.21 -2.80 117.51 121.56 3jzi h ILE 72 Ca -0.00 -0.31 0.00 0.00 -0.12 0.00 0.00 64.86 64.42 3jzi h ILE 72 Cb 0.32 0.07 0.00 0.00 -3.03 0.00 0.00 36.82 34.18 3jzi h ILE 72 CO 0.01 0.17 -0.30 0.35 -0.68 0.00 0.00 178.15 177.69 3jzi n THR 73 N -4.65 0.15 -2.17 -0.27 -2.24 -0.89 -4.93 114.28 99.27 3jzi n THR 73 Ca 0.10 -0.09 -0.07 0.00 -2.27 0.00 0.00 64.05 61.72 3jzi n THR 73 Cb 0.14 -0.17 -0.00 0.00 -2.10 0.00 0.00 70.33 68.19 3jzi n THR 73 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3jzi n GLY 74 N 1.44 0.11 3.78 3.38 0.00 -0.76 -5.03 105.19 108.11 3jzi n GLY 74 Ca 0.06 -0.59 -0.33 0.00 0.00 0.00 0.00 46.02 45.15 3jzi n GLY 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3jzi s ALA 75 N -2.38 2.62 -0.18 4.61 0.00 0.23 -4.83 121.76 121.82 3jzi s ALA 75 Ca 0.01 0.51 0.13 0.00 0.00 0.00 0.00 51.96 52.62 3jzi s ALA 75 Cb -0.00 -3.28 -0.19 0.00 0.00 0.00 0.00 23.12 19.64 3jzi s ALA 75 CO 0.01 -1.00 0.36 1.33 0.00 0.00 0.00 175.76 176.47 3jzi n VAL 76 N -2.09 0.00 -3.80 0.00 0.24 0.03 -4.76 118.33 107.96 3jzi n VAL 76 Ca 0.10 -0.27 -0.10 0.00 -2.04 0.00 0.00 64.34 62.03 3jzi n VAL 76 Cb 0.52 0.42 -0.07 0.00 -1.47 0.00 0.00 33.84 33.24 3jzi n VAL 76 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3jzi s ALA 77 N -2.73 -0.44 -0.10 2.33 0.00 -1.23 -1.21 121.76 118.38 3jzi s ALA 77 Ca -0.02 -0.37 0.01 0.00 0.00 0.00 0.00 51.96 51.57 3jzi s ALA 77 Cb 0.09 0.47 0.02 0.00 0.00 0.00 0.00 23.12 23.70 3jzi s ALA 77 CO 0.54 -0.50 -0.12 0.42 0.00 0.00 0.00 175.76 176.11 3jzi s ILE 78 N -3.49 1.23 -0.37 0.00 1.01 0.40 -1.27 121.20 118.71 3jzi s ILE 78 Ca 0.02 -0.47 -0.14 0.00 0.00 0.00 0.00 60.65 60.06 3jzi s ILE 78 Cb 0.03 -1.17 -0.00 0.00 0.01 0.00 0.00 42.46 41.33 3jzi s ILE 78 CO -0.09 0.39 0.26 -2.28 0.00 0.00 0.00 174.94 173.22 3jzi s HIS 79 N 1.18 3.23 -1.12 3.97 2.46 -0.58 -0.82 115.29 123.62 3jzi s HIS 79 Ca -0.04 -0.37 0.29 0.00 0.47 0.00 0.00 55.06 55.40 3jzi s HIS 79 Cb -0.14 -2.52 1.23 0.00 -0.13 0.00 0.00 32.58 31.02 3jzi s HIS 79 CO -0.03 -0.46 1.91 -0.35 -2.47 0.00 0.00 174.74 173.34 3jzi n PRO 80 N 5.12 0.12 0.00 2.88 -0.04 -1.26 -0.73 135.00 141.10 3jzi n PRO 80 Ca -0.12 -0.01 0.00 0.00 -0.04 0.00 0.00 63.50 63.33 3jzi n PRO 80 Cb 0.49 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.45 3jzi n PRO 80 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3jzi n GLY 81 N 1.45 2.77 3.39 0.55 0.00 -1.26 -4.40 105.19 107.68 3jzi n GLY 81 Ca 0.09 -0.31 -0.21 0.00 0.00 0.00 0.00 46.02 45.59 3jzi n GLY 81 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3jzi s TYR 82 N 0.00 1.93 0.00 1.61 -0.85 -1.26 -4.32 117.35 114.46 3jzi s TYR 82 Ca 0.00 -0.48 0.00 0.00 -0.52 0.00 0.00 57.07 56.07 3jzi s TYR 82 Cb 0.00 -0.88 0.00 0.00 0.38 0.00 0.00 41.96 41.46 3jzi s TYR 82 CO 0.00 0.48 0.00 0.41 -1.52 0.00 0.00 175.55 174.92 3jzi n GLY 83 N -0.38 0.13 7.00 5.49 0.00 -1.26 -4.84 105.19 111.32 3jzi n GLY 83 Ca -0.08 -0.95 0.00 0.00 0.00 0.00 0.00 46.02 44.99 3jzi n GLY 83 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3jzi n PHE 84 N 0.00 0.00 -0.25 1.61 3.01 -1.26 -1.55 117.46 119.02 3jzi n PHE 84 Ca 0.00 0.00 0.10 0.00 1.01 0.00 0.00 57.45 58.56 3jzi n PHE 84 Cb 0.00 0.00 0.26 0.00 -0.01 0.00 0.00 39.48 39.73 3jzi n PHE 84 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 3jzi n LEU 85 N 0.00 3.60 0.22 4.37 4.77 -1.26 -4.67 117.00 124.03 3jzi n LEU 85 Ca 0.00 -1.95 0.07 0.00 -0.03 0.00 0.00 56.01 54.11 3jzi n LEU 85 Cb 0.00 -0.39 0.60 0.00 -2.33 0.00 0.00 43.42 41.30 3jzi n LEU 85 CO 0.00 0.89 1.07 0.77 -1.33 0.00 0.00 177.39 178.79 3jzi h SER 86 N 3.64 0.08 -0.21 -1.43 4.64 -1.49 -2.50 113.55 116.28 3jzi h SER 86 Ca 0.00 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3jzi h SER 86 Cb 0.91 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.98 3jzi h SER 86 CO 0.00 0.07 0.00 -1.84 -0.87 0.00 0.00 176.83 174.19 3jzi n GLU 87 N -4.52 2.70 -2.74 4.77 0.28 -1.26 -4.77 120.64 115.10 3jzi n GLU 87 Ca -0.02 -2.23 -0.42 0.00 -0.16 0.00 0.00 57.16 54.33 3jzi n GLU 87 Cb 0.09 -1.40 -0.04 0.00 1.43 0.00 0.00 31.44 31.53 3jzi n GLU 87 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 177.13 178.18 3jzi s ASN 88 N -1.51 6.25 0.41 -1.84 3.84 -0.94 -4.91 114.94 116.25 3jzi s ASN 88 Ca 0.25 -0.53 0.10 0.00 0.21 0.00 0.00 52.86 52.89 3jzi s ASN 88 Cb 0.18 -2.47 0.88 0.00 -0.55 0.00 0.00 41.25 39.29 3jzi s ASN 88 CO 0.09 -1.48 1.98 0.00 -2.79 0.00 0.00 177.10 174.90 3jzi h ALA 89 N 9.60 1.63 -0.51 1.71 0.00 -1.87 -2.65 119.26 127.17 3jzi h ALA 89 Ca -0.27 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.41 3jzi h ALA 89 Cb 1.06 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 3jzi h ALA 89 CO 1.18 0.28 -0.01 -0.91 0.00 0.00 0.00 179.25 179.79 3jzi h ASN 90 N 0.24 0.88 0.06 0.00 2.35 -1.93 -1.55 115.58 115.63 3jzi h ASN 90 Ca 0.06 -0.31 -0.00 0.00 -0.55 0.00 0.00 56.30 55.49 3jzi h ASN 90 Cb 0.23 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.37 3jzi h ASN 90 CO 0.01 0.98 -0.03 0.15 -1.65 0.00 0.00 177.43 176.89 3jzi h PHE 91 N 0.76 -0.07 -0.74 1.19 3.04 -1.84 -0.11 116.94 119.17 3jzi h PHE 91 Ca 0.14 -0.00 0.01 0.00 3.98 0.00 0.00 57.97 62.11 3jzi h PHE 91 Cb 0.53 0.02 -0.04 0.00 2.56 0.00 0.00 35.95 39.02 3jzi h PHE 91 CO 0.04 0.05 0.49 0.00 -2.02 0.00 0.00 178.31 176.88 3jzi h ALA 92 N 0.76 1.50 -0.12 2.41 0.00 -1.45 0.89 119.26 123.24 3jzi h ALA 92 Ca -0.01 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 3jzi h ALA 92 Cb 0.16 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 3jzi h ALA 92 CO 0.01 0.46 -0.00 0.93 0.00 0.00 0.00 179.25 180.65 3jzi h GLU 93 N 0.98 0.22 -0.58 0.00 5.08 -1.13 -2.08 114.58 117.07 3jzi h GLU 93 Ca 0.28 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.55 3jzi h GLU 93 Cb -0.07 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.13 3jzi h GLU 93 CO -0.07 0.46 0.27 1.96 -1.00 0.00 0.00 179.01 180.63 3jzi h GLN 94 N -0.05 0.81 0.21 2.33 4.20 -0.38 -0.50 115.11 121.73 3jzi h GLN 94 Ca 0.03 -0.11 -0.01 0.00 0.06 0.00 0.00 58.65 58.63 3jzi h GLN 94 Cb 0.36 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 27.99 3jzi h GLN 94 CO 0.01 0.64 -0.10 0.28 -0.67 0.00 0.00 178.83 178.98 3jzi h VAL 95 N 0.81 0.85 -0.07 -0.54 2.07 -0.75 -0.97 116.25 117.65 3jzi h VAL 95 Ca 0.20 -0.35 0.02 0.00 0.82 0.00 0.00 66.70 67.39 3jzi h VAL 95 Cb 0.10 1.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 3jzi h VAL 95 CO -0.02 0.08 -0.06 -0.33 0.02 0.00 0.00 177.57 177.25 3jzi h GLU 96 N -0.46 -0.08 -0.93 1.57 5.08 -1.18 -1.79 114.58 116.79 3jzi h GLU 96 Ca -0.03 0.01 0.14 0.00 -1.00 0.00 0.00 59.36 58.48 3jzi h GLU 96 Cb 0.35 0.02 -0.09 0.00 0.50 0.00 0.00 28.75 29.52 3jzi h GLU 96 CO 0.05 -0.05 0.54 -0.09 -1.00 0.00 0.00 179.01 178.46 3jzi h ARG 97 N -0.08 0.78 0.00 2.33 2.43 -1.07 -0.17 114.38 118.59 3jzi h ARG 97 Ca 0.05 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3jzi h ARG 97 Cb 0.15 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 29.53 3jzi h ARG 97 CO -0.12 0.51 0.00 0.43 -1.51 0.00 0.00 179.97 179.29 3jzi n SER 98 N -4.75 0.00 0.00 -3.80 7.64 -0.37 -4.89 113.62 107.45 3jzi n SER 98 Ca 0.18 -0.78 0.00 0.00 1.01 0.00 0.00 58.87 59.28 3jzi n SER 98 Cb 0.41 -0.04 0.00 0.00 -1.01 0.00 0.00 64.21 63.57 3jzi n SER 98 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3jzi n GLY 99 N 0.80 0.61 3.85 0.23 0.00 -0.08 -5.07 105.19 105.54 3jzi n GLY 99 Ca 0.20 -0.16 -0.26 0.00 0.00 0.00 0.00 46.02 45.79 3jzi n GLY 99 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3jzi s PHE 100 N -2.00 3.28 0.02 1.61 0.08 -0.71 -5.01 117.98 115.25 3jzi s PHE 100 Ca 0.00 0.04 -0.26 0.00 0.12 0.00 0.00 56.93 56.83 3jzi s PHE 100 Cb 0.00 -1.58 -0.05 0.00 -0.57 0.00 0.00 43.02 40.82 3jzi s PHE 100 CO 0.00 0.52 0.80 0.42 -0.10 0.00 0.00 175.22 176.86 3jzi s ILE 101 N -1.72 4.80 -0.38 0.64 1.01 -0.35 -3.55 121.20 121.65 3jzi s ILE 101 Ca 0.32 1.69 -0.17 0.00 0.00 0.00 0.00 60.65 62.50 3jzi s ILE 101 Cb -0.11 -4.15 0.00 0.00 0.01 0.00 0.00 42.46 38.22 3jzi s ILE 101 CO 0.25 0.30 0.43 0.12 0.00 0.00 0.00 174.94 176.05 3jzi s PHE 102 N 0.31 3.18 -1.12 3.97 2.19 -1.26 -0.45 117.98 124.79 3jzi s PHE 102 Ca 0.41 -0.10 -0.22 0.00 0.33 0.00 0.00 56.93 57.35 3jzi s PHE 102 Cb -0.20 -2.84 -0.03 0.00 -1.31 0.00 0.00 43.02 38.64 3jzi s PHE 102 CO 0.23 -0.57 1.84 0.42 1.83 0.00 0.00 175.22 178.97 3jzi s ILE 103 N 2.18 3.69 -1.34 3.12 1.01 0.00 -4.71 121.20 125.15 3jzi s ILE 103 Ca 0.14 -0.98 0.00 0.00 0.00 0.00 0.00 60.65 59.80 3jzi s ILE 103 Cb -0.16 -4.63 0.00 0.00 0.01 0.00 0.00 42.46 37.67 3jzi s ILE 103 CO 0.13 -1.32 0.00 0.61 0.00 0.00 0.00 174.94 174.36 3jzi n GLY 104 N 6.10 -0.91 3.93 6.18 0.00 -1.26 -4.49 105.19 114.74 3jzi n GLY 104 Ca 0.43 -0.82 -0.29 0.00 0.00 0.00 0.00 46.02 45.34 3jzi n GLY 104 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3jzi s PRO 105 N -0.54 1.02 0.70 1.61 0.04 -1.14 -4.63 135.00 132.06 3jzi s PRO 105 Ca 0.00 -0.31 -0.16 0.00 0.04 0.00 0.00 61.00 60.57 3jzi s PRO 105 Cb 0.00 -1.89 0.02 0.00 0.04 0.00 0.00 34.50 32.66 3jzi s PRO 105 CO 0.00 -2.17 1.25 0.15 0.04 0.00 0.00 177.00 176.27 3jzi s LYS 106 N -5.78 2.30 0.19 4.56 1.02 -1.26 -4.85 119.74 115.92 3jzi s LYS 106 Ca 0.71 1.91 -0.12 0.00 0.02 0.00 0.00 55.97 58.48 3jzi s LYS 106 Cb -0.06 -1.84 0.18 0.00 -0.52 0.00 0.00 37.83 35.60 3jzi s LYS 106 CO 0.52 -1.75 1.76 0.00 -0.92 0.00 0.00 175.35 174.96 3jzi h ALA 107 N 0.08 0.67 -0.09 5.17 0.00 -1.88 -2.09 119.26 121.12 3jzi h ALA 107 Ca -0.49 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.47 3jzi h ALA 107 Cb 1.32 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.09 3jzi h ALA 107 CO 0.51 -0.15 0.04 1.05 0.00 0.00 0.00 179.25 180.70 3jzi h GLU 108 N 0.43 0.12 -0.26 0.00 4.11 -1.91 -0.12 114.58 116.96 3jzi h GLU 108 Ca 0.25 -0.01 -0.15 0.00 0.07 0.00 0.00 59.36 59.52 3jzi h GLU 108 Cb 0.23 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.46 3jzi h GLU 108 CO -0.22 0.10 -0.42 1.15 0.07 0.00 0.00 179.01 179.69 3jzi h THR 109 N 0.12 1.30 -0.30 -1.06 2.02 -1.76 -0.63 112.91 112.61 3jzi h THR 109 Ca 0.03 -1.62 -0.01 0.00 0.77 0.00 0.00 66.41 65.59 3jzi h THR 109 Cb 0.02 1.70 -0.01 0.00 -1.74 0.00 0.00 68.15 68.11 3jzi h THR 109 CO -0.00 0.52 0.15 0.40 0.37 0.00 0.00 175.52 176.95 3jzi h ILE 110 N 0.48 1.15 -0.34 3.11 2.04 -0.78 -1.28 117.51 121.89 3jzi h ILE 110 Ca 0.02 -0.42 0.03 0.00 1.00 0.00 0.00 64.86 65.49 3jzi h ILE 110 Cb 1.02 0.88 -0.03 0.00 -0.74 0.00 0.00 36.82 37.94 3jzi h ILE 110 CO 0.10 0.15 0.15 0.03 0.00 0.00 0.00 178.15 178.58 3jzi h ARG 111 N 0.35 0.31 0.01 2.37 3.08 -1.01 0.17 114.38 119.66 3jzi h ARG 111 Ca 0.10 -0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.13 3jzi h ARG 111 Cb 0.11 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.09 3jzi h ARG 111 CO -0.01 0.20 -0.00 1.25 -1.07 0.00 0.00 179.97 180.33 3jzi h LEU 112 N 0.31 -0.01 -0.51 3.04 5.85 -0.93 -2.60 115.31 120.46 3jzi h LEU 112 Ca 0.15 -0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.77 3jzi h LEU 112 Cb 0.08 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.11 3jzi h LEU 112 CO -0.12 0.07 -0.10 0.24 -0.34 0.00 0.00 178.44 178.18 3jzi h MET 113 N -0.08 0.00 0.00 1.25 2.86 -1.15 -2.99 114.93 114.82 3jzi h MET 113 Ca -0.00 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.61 3jzi h MET 113 Cb 0.08 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.74 3jzi h MET 113 CO 0.00 0.10 -0.14 0.78 1.06 0.00 0.00 176.91 178.71 3jzi h GLY 114 N 3.18 0.00 -7.19 8.32 0.00 -0.56 -3.39 103.07 103.43 3jzi h GLY 114 Ca -0.00 0.00 -0.72 0.00 0.00 0.00 0.00 47.33 46.61 3jzi h GLY 114 CO 0.01 0.00 -0.05 -0.35 0.00 0.00 0.00 176.54 176.16 3jzi s ASP 115 N -6.13 6.19 0.40 0.19 2.15 -0.99 -4.68 116.67 113.80 3jzi s ASP 115 Ca 0.04 -1.37 0.09 0.00 0.43 0.00 0.00 52.55 51.75 3jzi s ASP 115 Cb 0.08 -2.26 0.88 0.00 -0.30 0.00 0.00 42.92 41.31 3jzi s ASP 115 CO 0.65 -0.93 1.97 0.11 -0.17 0.00 0.00 175.17 176.80 3jzi h LYS 116 N 9.01 0.57 -0.01 4.34 1.79 -1.44 0.42 116.57 131.25 3jzi h LYS 116 Ca -0.29 -0.03 -0.00 0.00 -2.18 0.00 0.00 60.65 58.15 3jzi h LYS 116 Cb 1.10 -0.13 -0.00 0.00 -1.58 0.00 0.00 32.23 31.62 3jzi h LYS 116 CO 1.02 0.38 -0.00 0.28 -1.08 0.00 0.00 179.45 180.04 3jzi h VAL 117 N 0.59 1.33 -0.61 0.50 2.07 -1.93 -2.09 116.25 116.11 3jzi h VAL 117 Ca 0.29 -0.97 -0.07 0.00 0.82 0.00 0.00 66.70 66.77 3jzi h VAL 117 Cb 0.36 1.97 -0.03 0.00 -1.52 0.00 0.00 31.29 32.08 3jzi h VAL 117 CO -0.09 0.25 0.10 0.28 0.02 0.00 0.00 177.57 178.13 3jzi h SER 118 N -0.40 0.93 -0.58 0.57 0.02 -1.78 -2.28 113.55 110.04 3jzi h SER 118 Ca 0.00 -0.21 -0.04 0.00 -0.84 0.00 0.00 61.79 60.71 3jzi h SER 118 Cb 0.41 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 62.68 3jzi h SER 118 CO 0.00 0.93 0.22 0.00 -1.14 0.00 0.00 176.83 176.84 3jzi h ALA 119 N 1.18 0.76 -0.37 3.77 0.00 -0.93 -1.19 119.26 122.48 3jzi h ALA 119 Ca 0.19 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 3jzi h ALA 119 Cb 0.40 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3jzi h ALA 119 CO 0.01 0.39 0.05 0.82 0.00 0.00 0.00 179.25 180.51 3jzi h ILE 120 N 0.81 1.24 -0.92 0.00 2.04 -1.22 -1.54 117.51 117.92 3jzi h ILE 120 Ca 0.19 -0.88 0.00 0.00 1.00 0.00 0.00 64.86 65.17 3jzi h ILE 120 Cb 0.23 1.10 -0.05 0.00 -0.74 0.00 0.00 36.82 37.37 3jzi h ILE 120 CO -0.01 0.30 0.58 0.00 0.00 0.00 0.00 178.15 179.02 3jzi h ALA 121 N 0.90 1.30 -0.50 1.87 0.00 -1.22 0.45 119.26 122.06 3jzi h ALA 121 Ca 0.11 -0.08 -0.12 0.00 0.00 0.00 0.00 54.91 54.82 3jzi h ALA 121 Cb 0.38 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 3jzi h ALA 121 CO 0.01 0.63 -0.15 0.00 0.00 0.00 0.00 179.25 179.74 3jzi h ALA 122 N 1.39 0.79 -0.21 0.00 0.00 -1.07 -2.27 119.26 117.88 3jzi h ALA 122 Ca 0.33 -0.36 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 3jzi h ALA 122 Cb -0.10 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.50 3jzi h ALA 122 CO -0.07 0.66 -0.15 0.52 0.00 0.00 0.00 179.25 180.22 3jzi h MET 123 N 0.85 0.47 -0.67 0.00 2.07 -0.64 -2.24 114.93 114.77 3jzi h MET 123 Ca 0.13 -0.23 0.02 0.00 -2.07 0.00 0.00 59.70 57.55 3jzi h MET 123 Cb 0.71 -0.00 -0.04 0.00 -1.87 0.00 0.00 31.60 30.40 3jzi h MET 123 CO 0.05 0.78 0.43 -0.22 1.07 0.00 0.00 176.91 179.03 3jzi h LYS 124 N 0.16 0.83 -0.51 1.72 3.64 -0.94 -0.09 116.57 121.38 3jzi h LYS 124 Ca 0.04 -0.05 -0.04 0.00 -1.27 0.00 0.00 60.65 59.33 3jzi h LYS 124 Cb 0.67 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 32.28 3jzi h LYS 124 CO 0.04 0.55 0.16 -0.22 -2.27 0.00 0.00 179.45 177.71 3jzi h LYS 125 N 0.85 0.75 0.00 1.90 3.64 -1.39 -2.82 116.57 119.51 3jzi h LYS 125 Ca 0.26 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 59.52 3jzi h LYS 125 Cb -0.02 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.67 3jzi h LYS 125 CO -0.09 0.65 0.00 0.00 -2.27 0.00 0.00 179.45 177.74 3jzi h ALA 126 N 1.45 1.00 0.00 5.00 0.00 -0.77 -3.47 119.26 122.46 3jzi h ALA 126 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.08 3jzi h ALA 126 Cb 0.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.00 3jzi h ALA 126 CO -0.01 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.65 3jzi n GLY 127 N 0.94 1.03 3.68 0.00 0.00 -0.78 -4.72 105.19 105.34 3jzi n GLY 127 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 3jzi n GLY 127 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3jzi s VAL 128 N -2.00 4.78 0.20 1.61 1.01 -0.12 -4.97 120.40 120.91 3jzi s VAL 128 Ca 0.00 1.99 -0.31 0.00 0.00 0.00 0.00 61.98 63.66 3jzi s VAL 128 Cb 0.00 -4.29 -0.10 0.00 0.00 0.00 0.00 36.38 31.99 3jzi s VAL 128 CO 0.00 -0.02 1.52 -2.16 0.00 0.00 0.00 175.10 174.43 3jzi s PRO 129 N 2.22 4.23 0.30 2.72 0.04 -1.26 -4.02 135.00 139.24 3jzi s PRO 129 Ca 0.46 2.34 0.10 0.00 0.04 0.00 0.00 61.00 63.94 3jzi s PRO 129 Cb -0.17 -3.14 -0.05 0.00 0.04 0.00 0.00 34.50 31.18 3jzi s PRO 129 CO 0.15 -0.53 -0.08 0.00 0.04 0.00 0.00 177.00 176.58 3jzi s VAL 131 N -2.49 3.52 0.21 0.00 1.01 -1.24 -4.68 120.40 116.73 3jzi s VAL 131 Ca 0.32 1.14 -0.31 0.00 0.00 0.00 0.00 61.98 63.13 3jzi s VAL 131 Cb -0.03 -3.73 -0.11 0.00 0.00 0.00 0.00 36.38 32.51 3jzi s VAL 131 CO 0.18 0.12 1.63 -2.84 0.00 0.00 0.00 175.10 174.18 3jzi s PRO 132 N 0.67 4.16 0.00 2.72 0.02 -1.26 -4.80 135.00 136.51 3jzi s PRO 132 Ca 0.60 2.50 0.00 0.00 0.02 0.00 0.00 61.00 64.12 3jzi s PRO 132 Cb -0.34 -3.09 0.00 0.00 0.02 0.00 0.00 34.50 31.08 3jzi s PRO 132 CO 0.32 -0.66 0.00 0.41 -0.33 0.00 0.00 177.00 176.75 3jzi n GLY 133 N 3.45 2.58 0.28 0.52 0.00 -1.26 -0.60 105.19 110.16 3jzi n GLY 133 Ca 0.13 -0.88 0.13 0.00 0.00 0.00 0.00 46.02 45.41 3jzi n GLY 133 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3jzi h SER 134 N 0.00 0.00 -6.25 1.61 4.64 -0.60 -3.47 113.55 109.48 3jzi h SER 134 Ca 0.00 0.00 -0.46 0.00 -0.47 0.00 0.00 61.79 60.86 3jzi h SER 134 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3jzi h SER 134 CO 0.00 0.07 -0.82 0.47 -0.87 0.00 0.00 176.83 175.68 3jzi n ASP 135 N -3.76 -2.25 0.00 4.97 10.43 -1.26 -4.87 116.55 119.81 3jzi n ASP 135 Ca -0.02 -0.85 0.00 0.00 2.57 0.00 0.00 54.79 56.49 3jzi n ASP 135 Cb 0.17 -3.78 0.00 0.00 1.84 0.00 0.00 41.12 39.35 3jzi n ASP 135 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3jzi n GLY 136 N -1.67 1.88 3.77 0.44 0.00 -1.26 -5.06 105.19 103.29 3jzi n GLY 136 Ca -0.18 -1.43 -0.34 0.00 0.00 0.00 0.00 46.02 44.07 3jzi n GLY 136 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3jzi s PRO 137 N -1.89 3.14 0.08 1.61 0.04 -1.26 -4.62 135.00 132.10 3jzi s PRO 137 Ca 0.00 1.50 -0.22 0.00 0.04 0.00 0.00 61.00 62.31 3jzi s PRO 137 Cb 0.00 -1.99 -0.07 0.00 0.04 0.00 0.00 34.50 32.49 3jzi s PRO 137 CO 0.00 -1.00 0.68 -0.51 0.04 0.00 0.00 177.00 176.21 3jzi s LEU 138 N -4.25 4.52 0.00 -3.56 1.43 -0.17 -4.99 118.68 111.66 3jzi s LEU 138 Ca 0.70 1.40 0.00 0.00 -1.03 0.00 0.00 54.13 55.20 3jzi s LEU 138 Cb -0.22 -3.09 0.00 0.00 0.03 0.00 0.00 46.19 42.91 3jzi s LEU 138 CO 0.33 0.17 0.00 0.61 0.23 0.00 0.00 176.35 177.70 3jzi n GLY 139 N 1.94 0.07 0.01 -3.19 0.00 -1.26 -4.77 105.19 97.98 3jzi n GLY 139 Ca -0.07 -1.84 0.11 0.00 0.00 0.00 0.00 46.02 44.22 3jzi n GLY 139 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3jzi n ASP 140 N -2.74 0.68 -4.57 1.61 10.43 -1.26 -4.86 116.55 115.84 3jzi n ASP 140 Ca 0.00 -0.46 -0.41 0.00 2.57 0.00 0.00 54.79 56.49 3jzi n ASP 140 Cb 0.00 0.66 -0.03 0.00 1.84 0.00 0.00 41.12 43.59 3jzi n ASP 140 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 3jzi s ASP 141 N -3.30 5.70 0.56 -2.24 -1.08 -1.26 -4.90 116.67 110.15 3jzi s ASP 141 Ca 0.08 0.59 0.34 0.00 -0.52 0.00 0.00 52.55 53.03 3jzi s ASP 141 Cb 0.16 -2.53 1.54 0.00 -1.46 0.00 0.00 42.92 40.63 3jzi s ASP 141 CO 0.78 -1.99 2.06 0.24 0.52 0.00 0.00 175.17 176.78 3jzi h MET 142 N 13.22 0.00 -0.37 4.34 2.86 -1.99 -2.31 114.93 130.69 3jzi h MET 142 Ca -0.28 0.00 -0.15 0.00 -2.06 0.00 0.00 59.70 57.21 3jzi h MET 142 Cb 1.14 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.80 3jzi h MET 142 CO 1.16 0.05 -0.35 -0.44 1.06 0.00 0.00 176.91 178.38 3jzi h ASP 143 N 0.00 0.95 -0.50 1.22 3.32 -1.99 -0.87 116.42 118.55 3jzi h ASP 143 Ca -0.00 -0.46 -0.11 0.00 0.02 0.00 0.00 57.03 56.48 3jzi h ASP 143 Cb 0.41 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.68 3jzi h ASP 143 CO 0.01 1.22 -0.11 0.11 -1.72 0.00 0.00 179.24 178.74 3jzi h LYS 144 N 0.69 0.96 -0.38 3.56 1.57 -1.89 -1.83 116.57 119.25 3jzi h LYS 144 Ca 0.06 -0.36 -0.11 0.00 -1.87 0.00 0.00 60.65 58.37 3jzi h LYS 144 Cb 0.94 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.18 3jzi h LYS 144 CO 0.09 1.03 -0.21 -0.91 -0.57 0.00 0.00 179.45 178.88 3jzi h ASN 145 N 0.81 0.74 -0.30 0.86 2.35 -1.35 -1.21 115.58 117.49 3jzi h ASN 145 Ca 0.13 -0.26 -0.12 0.00 -0.55 0.00 0.00 56.30 55.50 3jzi h ASN 145 Cb 0.67 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.82 3jzi h ASN 145 CO 0.05 0.94 -0.25 0.03 -1.65 0.00 0.00 177.43 176.55 3jzi h ARG 146 N 0.65 0.80 -0.64 0.81 3.08 -1.09 -2.00 114.38 115.98 3jzi h ARG 146 Ca 0.09 -0.34 -0.07 0.00 0.07 0.00 0.00 59.98 59.73 3jzi h ARG 146 Cb 0.71 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.70 3jzi h ARG 146 CO 0.05 0.96 0.11 0.00 -1.07 0.00 0.00 179.97 180.02 3jzi h ALA 147 N 1.03 0.85 -0.28 0.04 0.00 -1.07 -1.23 119.26 118.60 3jzi h ALA 147 Ca 0.09 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 3jzi h ALA 147 Cb 0.77 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 3jzi h ALA 147 CO 0.06 0.61 0.08 0.82 0.00 0.00 0.00 179.25 180.82 3jzi h ILE 148 N 0.97 1.20 -0.81 0.00 2.04 -1.15 -2.19 117.51 117.57 3jzi h ILE 148 Ca 0.19 -0.64 -0.01 0.00 1.00 0.00 0.00 64.86 65.40 3jzi h ILE 148 Cb 0.43 1.10 -0.04 0.00 -0.74 0.00 0.00 36.82 37.57 3jzi h ILE 148 CO 0.01 0.21 0.45 0.00 0.00 0.00 0.00 178.15 178.82 3jzi h ALA 149 N 0.92 1.27 -0.40 1.87 0.00 -1.23 -1.25 119.26 120.44 3jzi h ALA 149 Ca 0.09 -0.12 -0.13 0.00 0.00 0.00 0.00 54.91 54.75 3jzi h ALA 149 Cb 0.24 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3jzi h ALA 149 CO -0.00 0.60 -0.27 -0.22 0.00 0.00 0.00 179.25 179.35 3jzi h LYS 150 N 1.13 0.88 -0.37 0.00 3.64 -1.15 0.16 116.57 120.86 3jzi h LYS 150 Ca 0.29 -0.42 -0.03 0.00 -1.27 0.00 0.00 60.65 59.21 3jzi h LYS 150 Cb 0.01 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.81 3jzi h LYS 150 CO -0.05 1.07 0.10 -0.09 -2.27 0.00 0.00 179.45 178.21 3jzi h ARG 151 N 0.70 0.58 -0.15 1.90 1.12 -1.15 -3.09 114.38 114.30 3jzi h ARG 151 Ca 0.08 -0.14 -0.03 0.00 -1.11 0.00 0.00 59.98 58.78 3jzi h ARG 151 Cb 0.85 -0.08 -0.00 0.00 -0.01 0.00 0.00 29.97 30.73 3jzi h ARG 151 CO 0.07 0.62 -0.02 0.82 -3.11 0.00 0.00 179.97 178.36 3jzi h ILE 152 N 0.44 1.27 -0.21 1.20 2.04 -1.23 -3.50 117.51 117.52 3jzi h ILE 152 Ca 0.12 -0.90 0.00 0.00 1.00 0.00 0.00 64.86 65.07 3jzi h ILE 152 Cb 0.29 1.58 0.00 0.00 -0.74 0.00 0.00 36.82 37.95 3jzi h ILE 152 CO -0.00 0.27 0.00 0.61 0.00 0.00 0.00 178.15 179.02 3jzi n GLY 153 N -0.21 -0.17 3.75 5.37 0.00 0.55 -4.98 105.19 109.49 3jzi n GLY 153 Ca -0.05 -1.13 -0.36 0.00 0.00 0.00 0.00 46.02 44.48 3jzi n GLY 153 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3jzi s TYR 154 N -0.12 2.30 0.53 1.61 1.51 -1.25 -4.50 117.35 117.45 3jzi s TYR 154 Ca 0.00 1.52 -0.19 0.00 -1.01 0.00 0.00 57.07 57.39 3jzi s TYR 154 Cb 0.00 -3.51 -0.06 0.00 -0.11 0.00 0.00 41.96 38.28 3jzi s TYR 154 CO 0.00 -2.37 1.07 -1.25 -1.11 0.00 0.00 175.55 171.90 3jzi s PRO 155 N -3.43 3.52 0.36 -1.71 0.04 -1.26 -5.03 135.00 127.49 3jzi s PRO 155 Ca 0.78 1.41 0.07 0.00 0.04 0.00 0.00 61.00 63.29 3jzi s PRO 155 Cb -0.31 -2.05 -0.07 0.00 0.04 0.00 0.00 34.50 32.11 3jzi s PRO 155 CO 0.36 -0.67 -0.01 0.14 0.04 0.00 0.00 177.00 176.85 3jzi s VAL 156 N -2.02 1.85 -0.06 -0.36 -7.23 0.00 -1.92 120.40 110.66 3jzi s VAL 156 Ca 0.68 -2.06 0.02 0.00 -1.81 0.00 0.00 61.98 58.81 3jzi s VAL 156 Cb -0.19 -2.82 0.02 0.00 0.56 0.00 0.00 36.38 33.95 3jzi s VAL 156 CO 0.26 -0.08 -0.08 -0.51 -0.31 0.00 0.00 175.10 174.38 3jzi s ILE 157 N -2.84 0.87 -0.15 -0.62 2.07 0.44 -0.20 121.20 120.77 3jzi s ILE 157 Ca 0.34 -0.31 -0.19 0.00 -1.41 0.00 0.00 60.65 59.08 3jzi s ILE 157 Cb 0.07 -0.83 -0.04 0.00 0.13 0.00 0.00 42.46 41.79 3jzi s ILE 157 CO 0.16 0.30 0.53 -0.63 -1.91 0.00 0.00 174.94 173.40 3jzi s ILE 158 N 0.86 5.13 -0.00 2.00 -1.09 0.71 -1.63 121.20 127.18 3jzi s ILE 158 Ca -0.11 1.03 0.04 0.00 -2.23 0.00 0.00 60.65 59.37 3jzi s ILE 158 Cb -0.15 -3.86 -0.01 0.00 -1.58 0.00 0.00 42.46 36.86 3jzi s ILE 158 CO 0.01 0.24 -0.12 -0.54 -1.23 0.00 0.00 174.94 173.30 3jzi s LYS 159 N 1.16 0.97 0.03 2.79 1.02 -0.11 -0.49 119.74 125.10 3jzi s LYS 159 Ca 0.27 -0.49 -0.28 0.00 0.02 0.00 0.00 55.97 55.49 3jzi s LYS 159 Cb -0.16 -0.94 -0.04 0.00 -0.52 0.00 0.00 37.83 36.17 3jzi s LYS 159 CO 0.11 0.25 0.90 0.00 -0.92 0.00 0.00 175.35 175.69 3jzi s ALA 160 N -0.39 3.24 0.43 5.17 0.00 0.95 -0.48 121.76 130.70 3jzi s ALA 160 Ca 0.04 0.45 0.20 0.00 0.00 0.00 0.00 51.96 52.65 3jzi s ALA 160 Cb -0.05 -3.21 1.19 0.00 0.00 0.00 0.00 23.12 21.05 3jzi s ALA 160 CO -0.00 -0.10 2.02 1.03 0.00 0.00 0.00 175.76 178.70 3jzi h SER 161 N 6.26 0.00 -0.16 0.00 0.87 -1.21 -1.54 113.55 117.77 3jzi h SER 161 Ca -0.42 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.14 3jzi h SER 161 Cb 1.21 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.17 3jzi h SER 161 CO 0.73 0.17 0.00 0.61 -0.53 0.00 0.00 176.83 177.81 3jzi n GLY 162 N -0.86 0.59 0.00 5.77 0.00 -1.26 -1.43 105.19 108.01 3jzi n GLY 162 Ca -0.02 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.47 3jzi n GLY 162 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3jzi n GLY 163 N 1.24 -0.58 0.00 -0.02 0.00 -0.58 -4.91 105.19 100.34 3jzi n GLY 163 Ca 0.17 -1.74 0.00 0.00 0.00 0.00 0.00 46.02 44.45 3jzi n GLY 163 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3jzi n GLY 164 N 5.00 3.49 7.00 -0.02 0.00 -0.77 -4.85 105.19 115.04 3jzi n GLY 164 Ca 0.00 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.19 3jzi n GLY 164 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3jzi n GLY 165 N -1.14 3.83 1.56 -0.02 0.00 -1.26 -1.95 105.19 106.22 3jzi n GLY 165 Ca 0.00 0.12 0.08 0.00 0.00 0.00 0.00 46.02 46.23 3jzi n GLY 165 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3jzi n GLY 166 N 0.00 2.99 3.27 -0.02 0.00 -1.26 -4.97 105.19 105.20 3jzi n GLY 166 Ca 0.00 -0.88 -0.27 0.00 0.00 0.00 0.00 46.02 44.87 3jzi n GLY 166 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3jzi s ARG 167 N -2.22 1.59 0.00 1.61 0.52 -0.82 -4.87 118.95 114.75 3jzi s ARG 167 Ca 0.50 -0.93 0.00 0.00 -0.52 0.00 0.00 55.73 54.78 3jzi s ARG 167 Cb 0.35 -1.67 0.00 0.00 0.52 0.00 0.00 34.95 34.15 3jzi s ARG 167 CO 0.20 0.44 0.00 0.41 0.02 0.00 0.00 175.30 176.36 3jzi n GLY 168 N 2.03 0.60 3.20 -3.53 0.00 -1.26 -1.84 105.19 104.38 3jzi n GLY 168 Ca -0.17 -0.45 -0.11 0.00 0.00 0.00 0.00 46.02 45.29 3jzi n GLY 168 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 3jzi s MET 169 N -3.51 0.71 -0.17 1.61 0.23 -1.26 -0.03 119.30 116.88 3jzi s MET 169 Ca 0.00 -0.56 -0.07 0.00 -1.03 0.00 0.00 55.69 54.02 3jzi s MET 169 Cb 0.00 0.30 0.07 0.00 -1.53 0.00 0.00 34.83 33.67 3jzi s MET 169 CO 0.00 -0.21 0.38 0.50 -2.03 0.00 0.00 175.02 173.66 3jzi s ARG 170 N -2.44 0.31 0.12 3.16 3.52 0.36 -4.97 118.95 119.01 3jzi s ARG 170 Ca -0.06 0.87 -0.30 0.00 -0.13 0.00 0.00 55.73 56.11 3jzi s ARG 170 Cb -0.02 0.11 -0.06 0.00 -1.56 0.00 0.00 34.95 33.43 3jzi s ARG 170 CO -0.03 -0.21 1.05 0.08 -0.81 0.00 0.00 175.30 175.38 3jzi s VAL 171 N 2.03 4.22 -0.13 7.11 1.01 -1.26 -0.21 120.40 133.18 3jzi s VAL 171 Ca -0.05 1.81 0.02 0.00 0.00 0.00 0.00 61.98 63.76 3jzi s VAL 171 Cb -0.11 -4.15 0.01 0.00 0.00 0.00 0.00 36.38 32.13 3jzi s VAL 171 CO -0.12 0.26 -0.19 -0.69 0.00 0.00 0.00 175.10 174.36 3jzi s VAL 172 N 0.15 1.83 -0.66 2.92 1.01 0.72 -4.96 120.40 121.42 3jzi s VAL 172 Ca 0.50 -0.84 0.21 0.00 0.00 0.00 0.00 61.98 61.85 3jzi s VAL 172 Cb -0.26 -1.64 -0.27 0.00 0.00 0.00 0.00 36.38 34.22 3jzi s VAL 172 CO 0.32 0.50 0.75 0.54 0.00 0.00 0.00 175.10 177.21 3jzi n ARG 173 N 4.15 0.26 -3.69 2.72 1.74 -1.26 -0.82 116.66 119.76 3jzi n ARG 173 Ca -0.20 -0.07 -0.05 0.00 -0.77 0.00 0.00 57.85 56.77 3jzi n ARG 173 Cb 0.51 -1.50 -0.02 0.00 -1.02 0.00 0.00 32.46 30.44 3jzi n ARG 173 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 3jzi s GLY 174 N -3.51 -0.29 0.43 -0.13 0.00 -1.26 -4.65 107.32 97.91 3jzi s GLY 174 Ca 0.02 0.33 0.19 0.00 0.00 0.00 0.00 44.72 45.27 3jzi s GLY 174 CO 0.88 0.08 1.85 -0.55 0.00 0.00 0.00 173.10 175.36 3jzi h ASP 175 N 2.00 0.36 -0.65 1.64 3.45 -1.99 -2.62 116.42 118.60 3jzi h ASP 175 Ca -0.24 0.04 0.03 0.00 0.43 0.00 0.00 57.03 57.29 3jzi h ASP 175 Cb 1.24 -0.02 -0.04 0.00 -0.56 0.00 0.00 39.33 39.95 3jzi h ASP 175 CO 0.27 0.13 0.43 0.00 -1.57 0.00 0.00 179.24 178.50 3jzi h ALA 176 N 1.60 1.62 0.00 3.45 0.00 -2.03 -2.93 119.26 120.98 3jzi h ALA 176 Ca 0.48 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.35 3jzi h ALA 176 Cb 1.27 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.84 3jzi h ALA 176 CO -0.17 0.32 -0.94 0.39 0.00 0.00 0.00 179.25 178.85 3jzi n GLU 177 N -4.46 0.24 0.07 0.00 4.71 -0.99 -4.70 120.64 115.51 3jzi n GLU 177 Ca 0.08 0.00 -0.16 0.00 -0.01 0.00 0.00 57.16 57.08 3jzi n GLU 177 Cb 0.11 -1.59 -0.09 0.00 -1.01 0.00 0.00 31.44 28.86 3jzi n GLU 177 CO 0.00 0.00 0.00 1.25 0.09 0.00 0.00 177.13 178.47 3jzi h LEU 178 N 0.00 -1.60 -0.23 -4.62 5.85 -1.46 -1.28 115.31 111.98 3jzi h LEU 178 Ca 0.00 0.18 0.04 0.00 0.84 0.00 0.00 57.88 58.94 3jzi h LEU 178 Cb 0.70 0.60 -0.03 0.00 0.37 0.00 0.00 40.66 42.30 3jzi h LEU 178 CO 0.00 -0.52 0.00 0.00 -0.34 0.00 0.00 178.44 177.58 3jzi h ALA 179 N -0.38 0.20 -0.28 1.25 0.00 -1.84 -0.95 119.26 117.26 3jzi h ALA 179 Ca 0.01 0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 3jzi h ALA 179 Cb 0.72 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 3jzi h ALA 179 CO -0.34 -0.42 0.03 0.37 0.00 0.00 0.00 179.25 178.89 3jzi h GLN 180 N 0.08 0.48 -0.85 0.00 4.15 -1.87 -0.99 115.11 116.10 3jzi h GLN 180 Ca 0.11 -0.14 0.01 0.00 0.77 0.00 0.00 58.65 59.40 3jzi h GLN 180 Cb 0.13 -0.05 -0.04 0.00 0.21 0.00 0.00 27.48 27.73 3jzi h GLN 180 CO -0.18 0.60 0.56 0.77 -1.93 0.00 0.00 178.83 178.65 3jzi h SER 181 N 0.29 0.98 -0.03 -0.69 0.02 -1.10 0.21 113.55 113.24 3jzi h SER 181 Ca 0.08 -0.03 -0.00 0.00 -0.84 0.00 0.00 61.79 61.00 3jzi h SER 181 Cb 0.36 -0.25 -0.00 0.00 0.14 0.00 0.00 62.40 62.66 3jzi h SER 181 CO 0.01 0.72 0.01 0.40 -1.14 0.00 0.00 176.83 176.82 3jzi h ILE 182 N 1.15 1.17 -0.57 3.27 2.04 -1.03 -1.38 117.51 122.16 3jzi h ILE 182 Ca 0.31 -0.50 0.00 0.00 1.00 0.00 0.00 64.86 65.67 3jzi h ILE 182 Cb -0.12 1.46 -0.03 0.00 -0.74 0.00 0.00 36.82 37.39 3jzi h ILE 182 CO -0.07 0.13 0.36 -1.28 0.00 0.00 0.00 178.15 177.30 3jzi h SER 183 N -0.16 0.67 -0.68 1.72 0.87 -0.88 -1.16 113.55 113.92 3jzi h SER 183 Ca 0.01 -0.04 -0.07 0.00 -1.23 0.00 0.00 61.79 60.46 3jzi h SER 183 Cb 0.21 -0.17 -0.03 0.00 -0.44 0.00 0.00 62.40 61.97 3jzi h SER 183 CO -0.00 0.52 0.15 0.24 -0.53 0.00 0.00 176.83 177.21 3jzi h MET 184 N 0.77 1.11 -0.55 2.24 2.86 -0.56 -1.99 114.93 118.81 3jzi h MET 184 Ca 0.21 -0.27 -0.09 0.00 -2.06 0.00 0.00 59.70 57.49 3jzi h MET 184 Cb -0.05 -0.14 -0.02 0.00 0.06 0.00 0.00 31.60 31.45 3jzi h MET 184 CO -0.04 0.99 -0.01 1.15 1.06 0.00 0.00 176.91 180.06 3jzi h THR 185 N 1.05 1.26 0.02 2.22 2.02 -0.93 -2.11 112.91 116.45 3jzi h THR 185 Ca 0.22 -1.13 0.00 0.00 0.77 0.00 0.00 66.41 66.27 3jzi h THR 185 Cb 0.39 0.89 -0.01 0.00 -1.74 0.00 0.00 68.15 67.68 3jzi h THR 185 CO 0.00 0.40 -0.04 0.03 0.37 0.00 0.00 175.52 176.29 3jzi h ARG 186 N 0.86 -0.08 -0.56 6.66 3.08 -1.03 0.19 114.38 123.51 3jzi h ARG 186 Ca 0.16 0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.19 3jzi h ARG 186 Cb 0.55 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.59 3jzi h ARG 186 CO 0.03 -0.05 0.27 0.00 -1.07 0.00 0.00 179.97 179.14 3jzi h ALA 187 N 0.90 0.72 -0.62 0.04 0.00 -1.32 0.01 119.26 118.99 3jzi h ALA 187 Ca 0.01 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 3jzi h ALA 187 Cb 0.09 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 3jzi h ALA 187 CO -0.03 0.29 0.13 0.93 0.00 0.00 0.00 179.25 180.57 3jzi h GLU 188 N 0.76 1.01 -0.43 0.00 5.08 -1.31 -2.12 114.58 117.56 3jzi h GLU 188 Ca 0.19 -0.25 -0.07 0.00 -1.00 0.00 0.00 59.36 58.23 3jzi h GLU 188 Cb 0.12 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 3jzi h GLU 188 CO -0.02 0.92 0.02 0.00 -1.00 0.00 0.00 179.01 178.93 3jzi h ALA 189 N 1.04 0.58 -0.58 3.43 0.00 -0.65 -1.19 119.26 121.89 3jzi h ALA 189 Ca 0.19 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 3jzi h ALA 189 Cb 0.38 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 3jzi h ALA 189 CO 0.01 0.36 0.30 -0.22 0.00 0.00 0.00 179.25 179.69 3jzi h LYS 190 N 0.60 0.83 -0.30 0.00 3.64 -0.92 0.14 116.57 120.56 3jzi h LYS 190 Ca 0.13 -0.11 -0.13 0.00 -1.27 0.00 0.00 60.65 59.26 3jzi h LYS 190 Cb 0.47 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 32.13 3jzi h LYS 190 CO 0.02 0.66 -0.32 0.00 -2.27 0.00 0.00 179.45 177.54 3jzi h ALA 191 N 1.13 0.44 0.18 5.00 0.00 -1.29 -2.12 119.26 122.60 3jzi h ALA 191 Ca 0.20 -0.42 -0.32 0.00 0.00 0.00 0.00 54.91 54.38 3jzi h ALA 191 Cb 0.09 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.80 3jzi h ALA 191 CO -0.03 0.49 -1.52 0.00 0.00 0.00 0.00 179.25 178.19 3jzi h ALA 192 N 0.71 0.06 -0.01 0.00 0.00 -1.19 -3.41 119.26 115.43 3jzi h ALA 192 Ca 0.04 -1.02 0.00 0.00 0.00 0.00 0.00 54.91 53.93 3jzi h ALA 192 Cb 0.90 0.37 0.00 0.00 0.00 0.00 0.00 17.79 19.06 3jzi h ALA 192 CO 0.08 0.84 -0.06 1.19 0.00 0.00 0.00 179.25 181.30 3jzi n PHE 193 N -3.75 0.00 -3.76 0.00 3.01 0.49 -5.00 117.46 108.45 3jzi n PHE 193 Ca -0.22 0.00 -0.29 0.00 1.01 0.00 0.00 57.45 57.95 3jzi n PHE 193 Cb 1.02 0.00 0.02 0.00 -0.01 0.00 0.00 39.48 40.51 3jzi n PHE 193 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 3jzi n SER 194 N 0.07 -4.71 -3.20 4.37 7.64 -0.80 -4.94 113.62 112.05 3jzi n SER 194 Ca 0.03 -0.68 0.01 0.00 1.01 0.00 0.00 58.87 59.25 3jzi n SER 194 Cb 0.15 -3.79 -0.02 0.00 -1.01 0.00 0.00 64.21 59.54 3jzi n SER 194 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 3jzi s ASN 195 N -3.15 -1.05 0.00 6.43 3.84 -1.24 -5.00 114.94 114.76 3jzi s ASN 195 Ca 0.60 0.76 0.16 0.00 0.21 0.00 0.00 52.86 54.58 3jzi s ASN 195 Cb -0.30 1.96 0.49 0.00 -0.55 0.00 0.00 41.25 42.85 3jzi s ASN 195 CO 0.74 -0.27 1.39 -0.90 -2.79 0.00 0.00 177.10 175.27 3jzi n ASP 196 N 5.42 1.99 -4.71 -4.21 3.85 -1.26 -3.50 116.55 114.13 3jzi n ASP 196 Ca -0.02 -1.89 -0.42 0.00 -0.71 0.00 0.00 54.79 51.75 3jzi n ASP 196 Cb 0.51 -0.21 -0.03 0.00 -1.35 0.00 0.00 41.12 40.04 3jzi n ASP 196 CO 0.00 0.00 0.00 -0.32 -1.01 0.00 0.00 177.20 175.87 3jzi s MET 197 N -1.59 4.34 0.16 0.11 1.75 -1.26 -4.70 119.30 118.11 3jzi s MET 197 Ca 0.29 1.97 0.07 0.00 -1.25 0.00 0.00 55.69 56.77 3jzi s MET 197 Cb 0.15 -3.35 -0.04 0.00 2.84 0.00 0.00 34.83 34.43 3jzi s MET 197 CO 0.21 -0.43 -0.15 0.14 -0.65 0.00 0.00 175.02 174.15 3jzi s VAL 198 N 1.42 1.55 0.11 10.11 -7.23 -1.26 -0.63 120.40 124.47 3jzi s VAL 198 Ca 0.63 -1.93 -0.01 0.00 -1.81 0.00 0.00 61.98 58.86 3jzi s VAL 198 Cb -0.34 -1.78 -0.04 0.00 0.56 0.00 0.00 36.38 34.79 3jzi s VAL 198 CO 0.29 -0.47 0.03 -0.72 -0.31 0.00 0.00 175.10 173.92 3jzi s TYR 199 N -2.44 0.77 -0.02 2.82 -0.85 0.37 -1.00 117.35 117.00 3jzi s TYR 199 Ca 0.15 -1.18 0.02 0.00 -0.52 0.00 0.00 57.07 55.53 3jzi s TYR 199 Cb -0.03 -0.46 -0.03 0.00 0.38 0.00 0.00 41.96 41.82 3jzi s TYR 199 CO 0.05 -0.47 -0.04 1.41 -1.52 0.00 0.00 175.55 174.98 3jzi s MET 200 N -4.01 2.71 0.02 -3.49 -2.45 -1.26 -0.94 119.30 109.89 3jzi s MET 200 Ca 0.19 -0.62 0.00 0.00 -1.25 0.00 0.00 55.69 54.01 3jzi s MET 200 Cb 0.08 -2.61 -0.02 0.00 1.25 0.00 0.00 34.83 33.53 3jzi s MET 200 CO -0.02 0.63 -0.03 -2.00 1.05 0.00 0.00 175.02 174.65 3jzi s GLU 201 N -1.28 0.33 0.15 4.11 2.12 -0.64 0.21 118.70 123.69 3jzi s GLU 201 Ca 0.17 -0.63 -0.31 0.00 0.36 0.00 0.00 54.97 54.56 3jzi s GLU 201 Cb -0.11 0.09 -0.08 0.00 0.26 0.00 0.00 34.13 34.29 3jzi s GLU 201 CO 0.07 -0.05 1.35 0.21 -0.54 0.00 0.00 175.26 176.30 3jzi s LYS 202 N -1.52 4.35 -0.17 4.30 2.20 0.23 -0.42 119.74 128.72 3jzi s LYS 202 Ca -0.15 2.06 -0.21 0.00 -0.36 0.00 0.00 55.97 57.31 3jzi s LYS 202 Cb -0.10 -3.23 -0.03 0.00 -1.51 0.00 0.00 37.83 32.97 3jzi s LYS 202 CO -0.01 -0.35 0.64 -0.47 -0.36 0.00 0.00 175.35 174.79 3jzi s TYR 203 N 0.66 3.43 -0.09 4.03 6.14 -0.81 -4.75 117.35 125.95 3jzi s TYR 203 Ca 0.61 1.00 -0.17 0.00 0.64 0.00 0.00 57.07 59.15 3jzi s TYR 203 Cb -0.37 -2.79 -0.05 0.00 0.42 0.00 0.00 41.96 39.18 3jzi s TYR 203 CO 0.34 -0.10 0.44 -0.51 0.64 0.00 0.00 175.55 176.36 3jzi s LEU 204 N 1.60 4.32 -0.05 6.97 1.43 -1.26 -4.68 118.68 127.01 3jzi s LEU 204 Ca 0.30 0.82 -0.21 0.00 -1.03 0.00 0.00 54.13 54.02 3jzi s LEU 204 Cb -0.16 -2.64 -0.15 0.00 0.03 0.00 0.00 46.19 43.26 3jzi s LEU 204 CO 0.12 0.09 0.90 -0.08 0.23 0.00 0.00 176.35 177.60 3jzi h GLU 205 N 6.23 -0.23 -2.26 1.70 4.57 -1.98 -3.40 114.58 119.21 3jzi h GLU 205 Ca -0.43 0.02 -0.59 0.00 -1.18 0.00 0.00 59.36 57.17 3jzi h GLU 205 Cb 1.19 0.05 -0.42 0.00 -0.16 0.00 0.00 28.75 29.41 3jzi h GLU 205 CO 0.72 0.18 -0.64 0.27 -1.18 0.00 0.00 179.01 178.36 3jzi n ASN 206 N -4.95 4.20 -4.91 1.04 2.04 -1.26 -4.98 115.26 106.44 3jzi n ASN 206 Ca -0.08 -3.60 -0.27 0.00 -0.44 0.00 0.00 54.58 50.19 3jzi n ASN 206 Cb 0.26 -0.59 -0.01 0.00 -2.53 0.00 0.00 39.78 36.91 3jzi n ASN 206 CO 0.00 0.00 0.00 -2.16 -0.44 0.00 0.00 177.26 174.66 3jzi s PRO 207 N -3.18 3.57 -0.02 -0.53 0.04 -1.26 -4.80 135.00 128.82 3jzi s PRO 207 Ca 0.46 0.11 -0.01 0.00 0.04 0.00 0.00 61.00 61.61 3jzi s PRO 207 Cb 0.25 -2.46 -0.04 0.00 0.04 0.00 0.00 34.50 32.29 3jzi s PRO 207 CO -0.10 -0.07 0.07 1.03 0.04 0.00 0.00 177.00 177.96 3jzi s ARG 208 N -4.41 3.05 -0.55 4.56 0.52 0.16 -1.64 118.95 120.64 3jzi s ARG 208 Ca 0.46 -0.46 -0.19 0.00 -0.52 0.00 0.00 55.73 55.02 3jzi s ARG 208 Cb -0.10 -2.85 0.08 0.00 0.52 0.00 0.00 34.95 32.59 3jzi s ARG 208 CO 0.40 0.66 0.67 -1.58 0.02 0.00 0.00 175.30 175.47 3jzi s HIS 209 N -1.13 3.02 -0.13 -0.53 5.65 -1.26 0.22 115.29 121.12 3jzi s HIS 209 Ca 0.21 -0.75 0.02 0.00 0.25 0.00 0.00 55.06 54.79 3jzi s HIS 209 Cb -0.12 -3.79 0.01 0.00 -1.18 0.00 0.00 32.58 27.50 3jzi s HIS 209 CO 0.11 -1.17 -0.21 0.08 -0.65 0.00 0.00 174.74 172.90 3jzi s VAL 210 N 2.68 2.18 0.01 0.89 1.01 -0.69 -0.25 120.40 126.24 3jzi s VAL 210 Ca 0.13 -0.95 0.07 0.00 0.00 0.00 0.00 61.98 61.23 3jzi s VAL 210 Cb -0.22 -1.87 -0.02 0.00 0.00 0.00 0.00 36.38 34.27 3jzi s VAL 210 CO 0.09 0.55 -0.20 -1.83 0.00 0.00 0.00 175.10 173.71 3jzi s GLU 211 N 0.69 1.48 -0.23 2.72 -1.05 -0.32 -1.29 118.70 120.70 3jzi s GLU 211 Ca -0.10 -0.82 -0.11 0.00 -0.15 0.00 0.00 54.97 53.80 3jzi s GLU 211 Cb -0.16 -1.51 -0.05 0.00 -0.44 0.00 0.00 34.13 31.97 3jzi s GLU 211 CO 0.01 0.40 0.17 0.42 0.95 0.00 0.00 175.26 177.21 3jzi s ILE 212 N -0.63 5.35 0.02 1.83 -1.09 0.56 -1.39 121.20 125.86 3jzi s ILE 212 Ca 0.07 0.22 -0.25 0.00 -2.23 0.00 0.00 60.65 58.46 3jzi s ILE 212 Cb -0.08 -3.51 -0.05 0.00 -1.58 0.00 0.00 42.46 37.24 3jzi s ILE 212 CO 0.00 0.35 0.78 -1.58 -1.23 0.00 0.00 174.94 173.26 3jzi s GLN 213 N 1.00 4.50 0.18 2.79 2.00 -1.04 -1.10 119.66 127.99 3jzi s GLN 213 Ca 0.08 1.08 0.07 0.00 -2.00 0.00 0.00 55.36 54.59 3jzi s GLN 213 Cb -0.13 -3.39 -0.04 0.00 0.80 0.00 0.00 33.01 30.24 3jzi s GLN 213 CO 0.04 0.21 -0.14 0.14 -0.50 0.00 0.00 175.29 175.04 3jzi s VAL 214 N 0.21 1.58 -0.04 1.34 -7.23 0.17 -0.23 120.40 116.20 3jzi s VAL 214 Ca 0.40 -2.11 -0.01 0.00 -1.81 0.00 0.00 61.98 58.45 3jzi s VAL 214 Cb -0.20 -1.93 0.03 0.00 0.56 0.00 0.00 36.38 34.83 3jzi s VAL 214 CO 0.23 -0.59 0.08 -0.76 -0.31 0.00 0.00 175.10 173.75 3jzi s LEU 215 N -3.14 1.11 -0.03 1.32 1.43 -0.88 -1.93 118.68 116.55 3jzi s LEU 215 Ca 0.19 0.15 -0.01 0.00 -1.03 0.00 0.00 54.13 53.44 3jzi s LEU 215 Cb -0.01 0.14 0.03 0.00 0.03 0.00 0.00 46.19 46.39 3jzi s LEU 215 CO 0.05 -0.11 0.06 0.00 0.23 0.00 0.00 176.35 176.57 3jzi s ALA 216 N 0.87 0.00 0.48 4.21 0.00 -0.59 -0.87 121.76 125.85 3jzi s ALA 216 Ca -0.07 0.38 0.05 0.00 0.00 0.00 0.00 51.96 52.32 3jzi s ALA 216 Cb -0.10 -0.29 0.08 0.00 0.00 0.00 0.00 23.12 22.81 3jzi s ALA 216 CO -0.03 -0.12 0.61 -0.40 0.00 0.00 0.00 175.76 175.82 3jzi n ASP 217 N 4.17 1.34 -0.23 0.00 3.85 -0.55 0.70 116.55 125.83 3jzi n ASP 217 Ca -0.27 -2.01 0.15 0.00 -0.71 0.00 0.00 54.79 51.95 3jzi n ASP 217 Cb 0.51 -0.35 0.66 0.00 -1.35 0.00 0.00 41.12 40.59 3jzi n ASP 217 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3jzi n GLY 218 N -0.12 -0.58 1.00 6.12 0.00 -1.26 -3.86 105.19 106.48 3jzi n GLY 218 Ca 0.12 -0.32 0.12 0.00 0.00 0.00 0.00 46.02 45.93 3jzi n GLY 218 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3jzi n GLN 219 N -0.52 2.32 -0.29 1.61 3.00 -1.26 -4.96 117.38 117.28 3jzi n GLN 219 Ca 0.19 -1.98 0.00 0.00 -0.01 0.00 0.00 57.00 55.20 3jzi n GLN 219 Cb 0.26 -1.48 0.00 0.00 0.00 0.00 0.00 30.24 29.02 3jzi n GLN 219 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3jzi n GLY 220 N 1.41 0.70 3.78 1.08 0.00 -1.25 -5.07 105.19 105.83 3jzi n GLY 220 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 3jzi n GLY 220 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3jzi s ASN 221 N -2.73 7.06 -0.09 1.61 0.01 -1.26 -4.97 114.94 114.57 3jzi s ASN 221 Ca 0.00 1.26 -0.04 0.00 -0.71 0.00 0.00 52.86 53.38 3jzi s ASN 221 Cb 0.00 -2.38 0.05 0.00 0.41 0.00 0.00 41.25 39.32 3jzi s ASN 221 CO 0.00 0.16 0.18 0.00 -1.51 0.00 0.00 177.10 175.92 3jzi s ALA 222 N -0.55 -0.25 0.23 0.60 0.00 -1.26 -1.48 121.76 119.05 3jzi s ALA 222 Ca 0.31 0.65 0.10 0.00 0.00 0.00 0.00 51.96 53.02 3jzi s ALA 222 Cb -0.19 -0.78 -0.05 0.00 0.00 0.00 0.00 23.12 22.10 3jzi s ALA 222 CO 0.19 -0.49 -0.18 0.96 0.00 0.00 0.00 175.76 176.24 3jzi s ILE 223 N 2.08 2.11 -0.06 0.00 -4.36 -0.05 -4.88 121.20 116.03 3jzi s ILE 223 Ca 0.00 -2.23 0.02 0.00 -0.26 0.00 0.00 60.65 58.18 3jzi s ILE 223 Cb -0.12 -2.12 -0.03 0.00 1.25 0.00 0.00 42.46 41.44 3jzi s ILE 223 CO -0.06 -0.43 -0.09 -0.72 0.24 0.00 0.00 174.94 173.88 3jzi s TYR 224 N -2.51 2.86 -0.62 1.37 1.13 -1.26 -2.08 117.35 116.24 3jzi s TYR 224 Ca 0.24 -0.04 0.05 0.00 -1.41 0.00 0.00 57.07 55.91 3jzi s TYR 224 Cb -0.04 -1.69 0.32 0.00 -1.10 0.00 0.00 41.96 39.46 3jzi s TYR 224 CO 0.10 0.28 0.97 1.28 -2.51 0.00 0.00 175.55 175.67 3jzi n LEU 225 N 2.27 4.54 0.00 -3.49 4.32 0.68 -4.99 117.00 120.32 3jzi n LEU 225 Ca -0.18 -5.63 0.00 0.00 -0.02 0.00 0.00 56.01 50.19 3jzi n LEU 225 Cb 0.53 -0.62 0.00 0.00 -1.62 0.00 0.00 43.42 41.71 3jzi n LEU 225 CO 0.26 2.28 0.00 0.00 -1.22 0.00 0.00 177.39 178.72 3jzi n ALA 226 N -0.03 0.00 -2.47 -1.18 0.00 -1.26 -4.42 120.51 111.14 3jzi n ALA 226 Ca 0.32 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.53 3jzi n ALA 226 Cb 0.39 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.73 3jzi n ALA 226 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 3jzi s GLU 227 N 0.00 1.69 0.01 0.00 1.03 -1.26 -2.48 118.70 117.69 3jzi s GLU 227 Ca 0.00 -1.94 0.03 0.00 0.03 0.00 0.00 54.97 53.09 3jzi s GLU 227 Cb 0.00 -0.99 -0.01 0.00 -0.80 0.00 0.00 34.13 32.33 3jzi s GLU 227 CO 0.00 -0.16 -0.09 1.03 -1.33 0.00 0.00 175.26 174.72 3jzi s ARG 228 N -3.86 0.65 -0.28 -4.83 0.52 -0.48 -4.12 118.95 106.55 3jzi s ARG 228 Ca 0.36 -0.41 -0.09 0.00 -0.52 0.00 0.00 55.73 55.07 3jzi s ARG 228 Cb 0.09 -0.60 -0.02 0.00 0.52 0.00 0.00 34.95 34.93 3jzi s ARG 228 CO 0.16 0.16 0.12 0.34 0.02 0.00 0.00 175.30 176.09 3jzi s ASP 229 N -0.52 5.42 -0.08 0.23 3.68 0.68 -1.18 116.67 124.91 3jzi s ASP 229 Ca 0.01 -0.30 0.12 0.00 2.13 0.00 0.00 52.55 54.51 3jzi s ASP 229 Cb -0.05 -1.98 0.31 0.00 -1.45 0.00 0.00 42.92 39.75 3jzi s ASP 229 CO 0.00 -0.10 1.23 0.00 0.13 0.00 0.00 175.17 176.44 3jzi h SER 231 N 1.16 0.31 -0.76 0.00 0.02 -1.81 -3.37 113.55 109.10 3jzi h SER 231 Ca 0.00 0.01 -0.39 0.00 -0.84 0.00 0.00 61.79 60.57 3jzi h SER 231 Cb 0.95 -0.05 -0.06 0.00 0.14 0.00 0.00 62.40 63.38 3jzi h SER 231 CO 0.07 0.18 1.06 -0.32 -1.14 0.00 0.00 176.83 176.68 3jzi s MET 232 N -5.33 2.86 0.17 3.45 1.75 -1.26 -4.12 119.30 116.82 3jzi s MET 232 Ca -0.07 -0.75 -0.08 0.00 -1.25 0.00 0.00 55.69 53.54 3jzi s MET 232 Cb 0.20 -5.19 -0.01 0.00 2.84 0.00 0.00 34.83 32.66 3jzi s MET 232 CO 0.75 -3.18 0.26 1.14 -0.65 0.00 0.00 175.02 173.34 3jzi s GLN 233 N 6.30 1.17 -0.11 4.11 1.03 -1.26 -2.11 119.66 128.79 3jzi s GLN 233 Ca 0.64 -1.26 -0.04 0.00 0.04 0.00 0.00 55.36 54.74 3jzi s GLN 233 Cb -0.03 0.36 0.06 0.00 0.03 0.00 0.00 33.01 33.42 3jzi s GLN 233 CO 0.01 -0.42 0.22 0.50 -2.54 0.00 0.00 175.29 173.06 3jzi s ARG 234 N -4.00 0.11 -1.29 9.60 3.52 -0.34 -4.33 118.95 122.23 3jzi s ARG 234 Ca 0.21 0.66 -0.10 0.00 -0.13 0.00 0.00 55.73 56.37 3jzi s ARG 234 Cb 0.04 -0.12 -0.00 0.00 -1.56 0.00 0.00 34.95 33.30 3jzi s ARG 234 CO 0.02 -0.28 0.59 0.54 -0.81 0.00 0.00 175.30 175.36 3jzi n ARG 235 N 5.21 -2.47 -2.10 5.12 1.74 -1.26 -1.86 116.66 121.04 3jzi n ARG 235 Ca -0.08 0.42 -0.18 0.00 -0.77 0.00 0.00 57.85 57.24 3jzi n ARG 235 Cb 0.50 -4.32 -0.03 0.00 -1.02 0.00 0.00 32.46 27.59 3jzi n ARG 235 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 3jzi n HIS 236 N -4.34 -0.61 -3.94 -1.55 8.25 -1.26 -4.99 115.22 106.77 3jzi n HIS 236 Ca -0.22 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 56.94 3jzi n HIS 236 Cb 0.64 -3.47 -0.16 0.00 1.12 0.00 0.00 29.99 28.13 3jzi n HIS 236 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 3jzi s GLN 237 N -4.50 1.71 0.31 -0.41 -0.21 -0.78 -4.81 119.66 110.98 3jzi s GLN 237 Ca 0.00 -0.77 -0.29 0.00 0.02 0.00 0.00 55.36 54.32 3jzi s GLN 237 Cb 0.00 -2.33 -0.10 0.00 1.00 0.00 0.00 33.01 31.58 3jzi s GLN 237 CO 0.00 -0.48 1.27 0.15 -2.12 0.00 0.00 175.29 174.11 3jzi s LYS 238 N 1.48 4.41 -0.01 2.91 1.02 -1.26 -1.20 119.74 127.09 3jzi s LYS 238 Ca -0.02 2.13 -0.00 0.00 0.02 0.00 0.00 55.97 58.10 3jzi s LYS 238 Cb -0.17 -3.11 -0.01 0.00 -0.52 0.00 0.00 37.83 34.03 3jzi s LYS 238 CO -0.08 -0.12 -0.01 0.28 -0.92 0.00 0.00 175.35 174.50 3jzi n VAL 239 N 1.09 0.06 -4.35 3.17 0.31 -0.90 -4.91 118.33 112.81 3jzi n VAL 239 Ca 0.01 -0.02 -0.21 0.00 -0.01 0.00 0.00 64.34 64.11 3jzi n VAL 239 Cb 0.42 -0.91 -0.16 0.00 -0.91 0.00 0.00 33.84 32.28 3jzi n VAL 239 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 3jzi s VAL 240 N -2.02 0.76 0.12 2.52 1.01 -0.97 -1.72 120.40 120.09 3jzi s VAL 240 Ca -0.02 -0.30 0.07 0.00 0.00 0.00 0.00 61.98 61.73 3jzi s VAL 240 Cb 0.00 -0.71 -0.04 0.00 0.00 0.00 0.00 36.38 35.64 3jzi s VAL 240 CO 0.02 0.26 -0.16 -1.61 0.00 0.00 0.00 175.10 173.61 3jzi s GLU 241 N 0.52 1.05 0.03 2.72 8.01 -0.69 -4.07 118.70 126.27 3jzi s GLU 241 Ca -0.08 -1.20 -0.11 0.00 0.01 0.00 0.00 54.97 53.58 3jzi s GLU 241 Cb -0.12 -1.05 0.01 0.00 -4.31 0.00 0.00 34.13 28.67 3jzi s GLU 241 CO 0.01 0.22 0.24 -1.83 0.01 0.00 0.00 175.26 173.91 3jzi s GLU 242 N -2.39 0.72 -0.06 1.61 -1.05 -0.70 0.26 118.70 117.10 3jzi s GLU 242 Ca 0.08 -0.53 -0.04 0.00 -0.15 0.00 0.00 54.97 54.32 3jzi s GLU 242 Cb -0.07 0.31 0.02 0.00 -0.44 0.00 0.00 34.13 33.95 3jzi s GLU 242 CO 0.04 -0.22 0.14 0.00 0.95 0.00 0.00 175.26 176.17 3jzi s ALA 243 N -2.39 -0.31 1.17 -0.84 0.00 -0.42 -0.23 121.76 118.73 3jzi s ALA 243 Ca -0.06 0.48 -0.17 0.00 0.00 0.00 0.00 51.96 52.20 3jzi s ALA 243 Cb -0.02 -0.30 0.25 0.00 0.00 0.00 0.00 23.12 23.06 3jzi s ALA 243 CO -0.03 -0.09 1.02 -0.35 0.00 0.00 0.00 175.76 176.31 3jzi n PRO 244 N 3.40 -2.50 -2.97 0.00 -0.04 -1.26 -0.47 135.00 131.16 3jzi n PRO 244 Ca -0.17 -1.61 -0.40 0.00 -0.04 0.00 0.00 63.50 61.28 3jzi n PRO 244 Cb 0.57 -1.40 -0.04 0.00 -0.04 0.00 0.00 33.50 32.59 3jzi n PRO 244 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3jzi s ALA 245 N -3.24 3.30 0.38 0.55 0.00 -1.26 -4.69 121.76 116.80 3jzi s ALA 245 Ca 0.64 0.23 -0.27 0.00 0.00 0.00 0.00 51.96 52.56 3jzi s ALA 245 Cb -0.05 -3.04 -0.11 0.00 0.00 0.00 0.00 23.12 19.91 3jzi s ALA 245 CO 0.48 -0.13 1.40 -2.30 0.00 0.00 0.00 175.76 175.21 3jzi n PRO 246 N 3.78 2.38 0.00 0.00 -0.02 -1.26 -2.52 135.00 137.36 3jzi n PRO 246 Ca 0.00 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.32 3jzi n PRO 246 Cb 0.51 -2.53 0.00 0.00 -0.02 0.00 0.00 33.50 31.46 3jzi n PRO 246 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3jzi n GLY 247 N 0.60 2.67 3.68 -1.23 0.00 -1.26 -4.79 105.19 104.85 3jzi n GLY 247 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.63 3jzi n GLY 247 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3jzi s ILE 248 N -2.10 4.46 0.50 -0.61 -1.09 -1.05 -5.04 121.20 116.27 3jzi s ILE 248 Ca 0.00 1.77 -0.08 0.00 -2.23 0.00 0.00 60.65 60.10 3jzi s ILE 248 Cb 0.00 -4.14 -0.05 0.00 -1.58 0.00 0.00 42.46 36.70 3jzi s ILE 248 CO 0.00 -0.06 0.85 0.42 -1.23 0.00 0.00 174.94 174.92 3jzi s THR 249 N 2.59 4.82 0.40 2.92 -4.23 -1.26 -4.92 115.64 115.96 3jzi s THR 249 Ca 0.52 0.50 0.11 0.00 -1.18 0.00 0.00 61.69 61.64 3jzi s THR 249 Cb -0.21 -3.83 0.31 0.00 1.34 0.00 0.00 72.50 70.12 3jzi s THR 249 CO 0.17 -0.83 1.97 -0.65 -0.54 0.00 0.00 174.62 174.73 3jzi h PRO 250 N 0.38 0.53 -0.56 3.99 0.11 -1.99 -0.90 132.00 133.56 3jzi h PRO 250 Ca -0.46 -0.03 -0.10 0.00 0.11 0.00 0.00 66.00 65.51 3jzi h PRO 250 Cb 1.20 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.17 3jzi h PRO 250 CO 0.62 0.35 -0.06 0.93 -0.21 0.00 0.00 178.00 179.63 3jzi h GLU 251 N 0.54 1.00 -0.28 1.05 3.07 -1.99 -0.59 114.58 117.39 3jzi h GLU 251 Ca 0.30 -0.34 -0.16 0.00 -0.50 0.00 0.00 59.36 58.66 3jzi h GLU 251 Cb 0.45 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 28.28 3jzi h GLU 251 CO -0.09 1.02 -0.46 1.25 -1.40 0.00 0.00 179.01 179.32 3jzi h LEU 252 N 0.91 0.78 -0.02 1.33 5.85 -1.70 -2.07 115.31 120.40 3jzi h LEU 252 Ca 0.15 -0.38 -0.00 0.00 0.84 0.00 0.00 57.88 58.49 3jzi h LEU 252 Cb 0.60 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 41.41 3jzi h LEU 252 CO 0.04 1.13 0.01 -0.09 -0.34 0.00 0.00 178.44 179.18 3jzi h ARG 253 N 0.58 0.03 -0.17 1.25 2.43 -1.02 -2.33 114.38 115.14 3jzi h ARG 253 Ca 0.03 -0.00 0.03 0.00 -0.81 0.00 0.00 59.98 59.23 3jzi h ARG 253 Cb 1.02 -0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.54 3jzi h ARG 253 CO 0.10 0.17 -0.01 -0.09 -1.51 0.00 0.00 179.97 178.62 3jzi h ARG 254 N -0.12 0.04 0.24 0.20 2.43 -1.09 -1.14 114.38 114.93 3jzi h ARG 254 Ca 0.01 -0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.18 3jzi h ARG 254 Cb 0.15 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.66 3jzi h ARG 254 CO -0.00 0.02 -0.38 -0.92 -1.51 0.00 0.00 179.97 177.18 3jzi h TYR 255 N 0.04 -1.05 -0.46 2.20 5.03 -1.31 -1.50 116.97 119.93 3jzi h TYR 255 Ca 0.08 0.02 -0.11 0.00 2.58 0.00 0.00 58.73 61.30 3jzi h TYR 255 Cb 0.11 0.43 -0.01 0.00 1.55 0.00 0.00 36.73 38.80 3jzi h TYR 255 CO -0.17 -0.50 -0.13 0.97 -1.32 0.00 0.00 178.16 177.01 3jzi h ILE 256 N -0.69 1.27 -0.32 1.81 6.09 -1.41 -3.12 117.51 121.14 3jzi h ILE 256 Ca 0.00 -1.25 0.00 0.00 -1.37 0.00 0.00 64.86 62.24 3jzi h ILE 256 Cb 0.67 1.13 -0.02 0.00 0.47 0.00 0.00 36.82 39.08 3jzi h ILE 256 CO -0.15 0.43 0.21 1.23 -3.07 0.00 0.00 178.15 176.80 3jzi h GLY 257 N 0.73 0.45 1.14 8.18 0.00 -1.14 -1.56 103.07 110.87 3jzi h GLY 257 Ca 0.11 -0.16 -0.02 0.00 0.00 0.00 0.00 47.33 47.26 3jzi h GLY 257 CO 0.05 0.16 0.44 0.83 0.00 0.00 0.00 176.54 178.02 3jzi h GLU 258 N 0.43 1.13 -0.60 4.80 5.08 -1.34 -0.12 114.58 123.96 3jzi h GLU 258 Ca 0.12 -0.13 -0.09 0.00 -1.00 0.00 0.00 59.36 58.26 3jzi h GLU 258 Cb -0.04 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 28.96 3jzi h GLU 258 CO -0.03 0.83 0.01 0.00 -1.00 0.00 0.00 179.01 178.81 3jzi h ARG 259 N 1.14 1.04 -0.30 2.33 3.08 -1.41 -1.27 114.38 118.98 3jzi h ARG 259 Ca 0.29 -0.32 -0.08 0.00 0.07 0.00 0.00 59.98 59.94 3jzi h ARG 259 Cb 0.03 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 29.97 3jzi h ARG 259 CO -0.05 1.01 -0.12 0.00 -1.07 0.00 0.00 179.97 179.75 3jzi h ALA 261 N 0.77 0.88 -0.60 0.00 0.00 -0.96 -2.09 119.26 117.26 3jzi h ALA 261 Ca 0.07 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 3jzi h ALA 261 Cb 0.63 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 3jzi h ALA 261 CO 0.04 0.38 0.02 -0.22 0.00 0.00 0.00 179.25 179.46 3jzi h LYS 262 N 0.94 1.04 -0.45 0.00 3.64 -1.20 -2.90 116.57 117.64 3jzi h LYS 262 Ca 0.24 -0.32 -0.03 0.00 -1.27 0.00 0.00 60.65 59.27 3jzi h LYS 262 Cb 0.02 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.72 3jzi h LYS 262 CO -0.04 1.02 0.16 0.00 -2.27 0.00 0.00 179.45 178.32 3jzi h ALA 263 N 0.99 1.44 -0.03 5.00 0.00 -0.99 -1.57 119.26 124.10 3jzi h ALA 263 Ca 0.17 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3jzi h ALA 263 Cb 0.54 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 3jzi h ALA 263 CO 0.03 0.42 0.00 0.00 0.00 0.00 0.00 179.25 179.70 3jzi h VAL 265 N 0.01 1.07 -0.85 0.00 2.07 -1.32 0.30 116.25 117.53 3jzi h VAL 265 Ca 0.01 -0.12 -0.01 0.00 0.82 0.00 0.00 66.70 67.40 3jzi h VAL 265 Cb 0.01 0.69 -0.04 0.00 -1.52 0.00 0.00 31.29 30.43 3jzi h VAL 265 CO -0.02 0.06 0.49 0.44 0.02 0.00 0.00 177.57 178.57 3jzi h ASP 266 N 0.35 1.04 0.16 0.57 3.45 -1.15 -2.84 116.42 118.00 3jzi h ASP 266 Ca 0.09 -0.07 0.00 0.00 0.43 0.00 0.00 57.03 57.48 3jzi h ASP 266 Cb -0.04 -0.26 0.00 0.00 -0.56 0.00 0.00 39.33 38.47 3jzi h ASP 266 CO -0.02 0.81 -0.25 2.30 -1.57 0.00 0.00 179.24 180.51 3jzi n ILE 267 N -4.35 0.00 -3.16 0.35 -5.35 -0.60 -4.96 119.36 101.29 3jzi n ILE 267 Ca 0.09 -0.17 -0.15 0.00 -0.27 0.00 0.00 62.75 62.25 3jzi n ILE 267 Cb 0.08 0.56 0.06 0.00 -1.74 0.00 0.00 39.64 38.60 3jzi n ILE 267 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3jzi n GLY 268 N 1.33 -0.08 3.77 3.28 0.00 -0.31 -4.94 105.19 108.23 3jzi n GLY 268 Ca 0.13 -0.05 -0.37 0.00 0.00 0.00 0.00 46.02 45.72 3jzi n GLY 268 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3jzi s TYR 269 N -3.23 2.80 -0.02 1.61 6.14 0.92 -4.83 117.35 120.75 3jzi s TYR 269 Ca 0.27 1.52 0.01 0.00 0.64 0.00 0.00 57.07 59.50 3jzi s TYR 269 Cb -0.12 -3.42 0.01 0.00 0.42 0.00 0.00 41.96 38.86 3jzi s TYR 269 CO 0.50 -1.66 -0.01 0.50 0.64 0.00 0.00 175.55 175.52 3jzi s ARG 270 N -2.75 0.25 0.84 4.97 3.52 -1.26 -4.66 118.95 119.85 3jzi s ARG 270 Ca 0.65 0.01 0.00 0.00 -0.13 0.00 0.00 55.73 56.26 3jzi s ARG 270 Cb -0.30 -0.35 0.00 0.00 -1.56 0.00 0.00 34.95 32.74 3jzi s ARG 270 CO 0.36 -0.06 0.00 0.41 -0.81 0.00 0.00 175.30 175.20 3jzi n GLY 271 N 3.66 -1.43 3.80 8.12 0.00 0.22 -2.89 105.19 116.68 3jzi n GLY 271 Ca -0.21 -1.71 -0.37 0.00 0.00 0.00 0.00 46.02 43.74 3jzi n GLY 271 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3jzi s ALA 272 N -1.62 3.32 0.13 4.61 0.00 -1.26 -1.55 121.76 125.39 3jzi s ALA 272 Ca 0.00 0.35 -0.24 0.00 0.00 0.00 0.00 51.96 52.06 3jzi s ALA 272 Cb 0.00 -3.00 0.07 0.00 0.00 0.00 0.00 23.12 20.19 3jzi s ALA 272 CO 0.00 0.25 0.62 0.20 0.00 0.00 0.00 175.76 176.84 3jzi s GLY 273 N -1.61 -0.61 -0.04 0.00 0.00 -0.82 -4.00 107.32 100.24 3jzi s GLY 273 Ca 0.46 0.61 0.01 0.00 0.00 0.00 0.00 44.72 45.81 3jzi s GLY 273 CO 0.23 0.27 -0.06 -1.59 0.00 0.00 0.00 173.10 171.94 3jzi s THR 274 N -3.41 0.64 -0.37 0.90 2.01 -0.50 -0.66 115.64 114.26 3jzi s THR 274 Ca -0.00 -0.20 -0.17 0.00 0.31 0.00 0.00 61.69 61.63 3jzi s THR 274 Cb -0.01 -0.64 0.00 0.00 0.01 0.00 0.00 72.50 71.86 3jzi s THR 274 CO -0.10 0.24 0.45 -0.36 -0.69 0.00 0.00 174.62 174.16 3jzi s PHE 275 N 0.78 3.18 -0.08 4.92 0.40 -0.26 -0.12 117.98 126.81 3jzi s PHE 275 Ca -0.12 -0.04 -0.19 0.00 -0.60 0.00 0.00 56.93 55.98 3jzi s PHE 275 Cb -0.14 -2.85 -0.04 0.00 0.51 0.00 0.00 43.02 40.49 3jzi s PHE 275 CO 0.01 -0.56 0.53 -1.21 0.70 0.00 0.00 175.22 174.69 3jzi s GLU 276 N 2.22 4.32 0.09 0.44 2.02 0.52 -0.32 118.70 128.00 3jzi s GLU 276 Ca 0.15 0.57 0.05 0.00 0.02 0.00 0.00 54.97 55.76 3jzi s GLU 276 Cb -0.16 -3.40 -0.03 0.00 0.10 0.00 0.00 34.13 30.63 3jzi s GLU 276 CO 0.13 0.22 -0.13 -0.06 0.02 0.00 0.00 175.26 175.45 3jzi s PHE 277 N 0.37 1.21 -0.19 1.61 0.40 -0.41 -1.22 117.98 119.75 3jzi s PHE 277 Ca 0.29 -0.54 -0.08 0.00 -0.60 0.00 0.00 56.93 55.99 3jzi s PHE 277 Cb -0.16 -0.66 -0.04 0.00 0.51 0.00 0.00 43.02 42.67 3jzi s PHE 277 CO 0.13 0.06 0.08 -0.51 0.70 0.00 0.00 175.22 175.69 3jzi s LEU 278 N -2.14 3.93 -0.17 -0.37 1.43 0.15 -1.71 118.68 119.81 3jzi s LEU 278 Ca 0.03 0.13 0.01 0.00 -1.03 0.00 0.00 54.13 53.27 3jzi s LEU 278 Cb -0.07 -2.00 0.01 0.00 0.03 0.00 0.00 46.19 44.17 3jzi s LEU 278 CO 0.02 0.18 -0.19 0.12 0.23 0.00 0.00 176.35 176.70 3jzi s PHE 279 N 0.35 2.76 -0.18 0.29 2.19 0.13 -0.98 117.98 122.54 3jzi s PHE 279 Ca 0.05 -1.47 -0.13 0.00 0.33 0.00 0.00 56.93 55.71 3jzi s PHE 279 Cb -0.12 -1.90 0.05 0.00 -1.31 0.00 0.00 43.02 39.75 3jzi s PHE 279 CO -0.01 -0.71 0.45 -2.00 1.83 0.00 0.00 175.22 174.79 3jzi s GLU 280 N 1.12 0.48 -1.39 10.12 2.12 -0.99 0.37 118.70 130.52 3jzi s GLU 280 Ca 0.01 0.75 -0.07 0.00 0.36 0.00 0.00 54.97 56.02 3jzi s GLU 280 Cb -0.14 0.12 0.04 0.00 0.26 0.00 0.00 34.13 34.40 3jzi s GLU 280 CO -0.08 -0.12 0.93 0.09 -0.54 0.00 0.00 175.26 175.54 3jzi n ASN 281 N 3.63 -3.57 -0.96 -1.70 3.02 -1.26 -2.19 115.26 112.22 3jzi n ASN 281 Ca -0.19 -0.74 -0.12 0.00 -0.03 0.00 0.00 54.58 53.50 3jzi n ASN 281 Cb 0.56 -4.27 -0.05 0.00 -0.61 0.00 0.00 39.78 35.41 3jzi n ASN 281 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3jzi n GLY 282 N -1.65 1.29 3.20 7.41 0.00 -1.26 -5.00 105.19 109.18 3jzi n GLY 282 Ca -0.11 -0.23 -0.27 0.00 0.00 0.00 0.00 46.02 45.40 3jzi n GLY 282 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3jzi s GLU 283 N -2.96 1.86 -0.03 1.61 0.41 -0.93 -5.14 118.70 113.52 3jzi s GLU 283 Ca 0.00 -0.72 -0.15 0.00 -0.41 0.00 0.00 54.97 53.69 3jzi s GLU 283 Cb 0.00 -1.69 -0.05 0.00 -1.78 0.00 0.00 34.13 30.61 3jzi s GLU 283 CO 0.00 0.36 0.40 -0.06 -0.49 0.00 0.00 175.26 175.48 3jzi s PHE 284 N -0.25 3.67 -0.15 1.61 0.40 -1.26 -2.35 117.98 119.66 3jzi s PHE 284 Ca 0.02 0.93 -0.02 0.00 -0.60 0.00 0.00 56.93 57.26 3jzi s PHE 284 Cb -0.10 -2.32 0.05 0.00 0.51 0.00 0.00 43.02 41.15 3jzi s PHE 284 CO 0.01 0.54 0.01 0.71 0.70 0.00 0.00 175.22 177.19 3jzi s TYR 285 N -0.69 1.02 0.25 0.36 1.51 -0.15 -4.57 117.35 115.09 3jzi s TYR 285 Ca 0.23 -0.67 -0.30 0.00 -1.01 0.00 0.00 57.07 55.31 3jzi s TYR 285 Cb -0.16 -1.00 -0.11 0.00 -0.11 0.00 0.00 41.96 40.58 3jzi s TYR 285 CO 0.12 -0.52 1.56 0.12 -1.11 0.00 0.00 175.55 175.71 3jzi s PHE 286 N 1.86 2.90 -0.08 2.71 2.19 0.62 -0.67 117.98 127.50 3jzi s PHE 286 Ca 0.01 0.78 -0.03 0.00 0.33 0.00 0.00 56.93 58.02 3jzi s PHE 286 Cb -0.15 -3.98 -0.04 0.00 -1.31 0.00 0.00 43.02 37.54 3jzi s PHE 286 CO -0.07 -3.36 -0.10 0.44 1.83 0.00 0.00 175.22 173.96 3jzi n ILE 287 N 2.71 0.46 -3.61 3.12 -5.35 -0.36 -3.67 119.36 112.65 3jzi n ILE 287 Ca 0.09 -0.13 -0.07 0.00 -0.27 0.00 0.00 62.75 62.37 3jzi n ILE 287 Cb 0.38 -1.42 -0.02 0.00 -1.74 0.00 0.00 39.64 36.84 3jzi n ILE 287 CO 0.00 0.00 0.00 -1.83 -1.76 0.00 0.00 176.55 172.96 3jzi s GLU 288 N -2.15 1.15 -0.14 6.28 -1.05 -1.21 -4.97 118.70 116.60 3jzi s GLU 288 Ca -0.11 -0.53 0.00 0.00 -0.15 0.00 0.00 54.97 54.18 3jzi s GLU 288 Cb 0.04 0.46 -0.01 0.00 -0.44 0.00 0.00 34.13 34.18 3jzi s GLU 288 CO 0.15 -0.51 -0.14 1.41 0.95 0.00 0.00 175.26 177.12 3jzi s MET 289 N -3.39 3.31 -0.23 -4.83 -2.45 -1.26 -0.35 119.30 110.10 3jzi s MET 289 Ca 0.07 -0.72 -0.23 0.00 -1.25 0.00 0.00 55.69 53.57 3jzi s MET 289 Cb -0.02 -2.61 -0.01 0.00 1.25 0.00 0.00 34.83 33.44 3jzi s MET 289 CO -0.04 0.15 0.75 -0.80 1.05 0.00 0.00 175.02 176.12 3jzi s ASN 290 N 0.50 6.76 -0.39 1.11 0.01 0.83 -4.86 114.94 118.90 3jzi s ASN 290 Ca -0.10 0.94 -0.00 0.00 -0.71 0.00 0.00 52.86 52.99 3jzi s ASN 290 Cb -0.16 -2.40 0.34 0.00 0.41 0.00 0.00 41.25 39.44 3jzi s ASN 290 CO 0.04 -0.42 1.89 0.35 -1.51 0.00 0.00 177.10 177.45 3jzi n THR 291 N 5.08 2.87 -3.82 1.60 -2.24 -1.26 -1.41 114.28 115.10 3jzi n THR 291 Ca 0.03 -1.82 -0.09 0.00 -2.27 0.00 0.00 64.05 59.90 3jzi n THR 291 Cb 0.48 -1.09 0.02 0.00 -2.10 0.00 0.00 70.33 67.65 3jzi n THR 291 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3jzi s ARG 292 N -2.38 2.25 0.57 -0.78 3.03 -1.26 -4.52 118.95 115.88 3jzi s ARG 292 Ca 0.41 -1.48 -0.17 0.00 2.03 0.00 0.00 55.73 56.51 3jzi s ARG 292 Cb 0.32 0.62 -0.04 0.00 -1.03 0.00 0.00 34.95 34.82 3jzi s ARG 292 CO 0.02 -1.05 1.08 -1.50 -1.13 0.00 0.00 175.30 172.71 3jzi s ILE 293 N -2.24 3.55 0.31 4.99 1.10 -1.26 -4.30 121.20 123.35 3jzi s ILE 293 Ca 0.16 0.83 0.08 0.00 -0.51 0.00 0.00 60.65 61.21 3jzi s ILE 293 Cb -0.05 -3.32 -0.04 0.00 0.15 0.00 0.00 42.46 39.20 3jzi s ILE 293 CO 0.12 -0.34 0.15 -1.10 -2.11 0.00 0.00 174.94 171.66 3jzi s GLN 294 N -3.72 2.52 0.16 3.50 -0.21 -1.26 -4.54 119.66 116.11 3jzi s GLN 294 Ca 0.67 -1.39 -0.18 0.00 0.02 0.00 0.00 55.36 54.49 3jzi s GLN 294 Cb -0.19 -2.30 0.07 0.00 1.00 0.00 0.00 33.01 31.60 3jzi s GLN 294 CO 0.32 0.21 1.67 0.28 -2.12 0.00 0.00 175.29 175.66 3jzi h VAL 295 N 1.56 0.64 0.00 1.09 2.07 -2.00 -2.92 116.25 116.69 3jzi h VAL 295 Ca -0.45 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.07 3jzi h VAL 295 Cb 1.25 0.64 0.00 0.00 -1.52 0.00 0.00 31.29 31.66 3jzi h VAL 295 CO 0.61 0.00 0.00 -1.84 0.02 0.00 0.00 177.57 176.36 3jzi n GLU 296 N -5.29 0.85 -0.24 1.57 0.00 -1.26 -4.37 120.64 111.91 3jzi n GLU 296 Ca 0.01 0.00 0.21 0.00 0.00 0.00 0.00 57.16 57.39 3jzi n GLU 296 Cb 0.20 -1.14 0.55 0.00 0.00 0.00 0.00 31.44 31.05 3jzi n GLU 296 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.13 178.25 3jzi h HIS 297 N 0.00 0.46 -0.60 -1.84 2.07 -1.93 -2.91 115.15 110.40 3jzi h HIS 297 Ca 0.00 0.01 0.12 0.00 -2.85 0.00 0.00 60.37 57.65 3jzi h HIS 297 Cb 0.00 -0.14 -0.04 0.00 2.57 0.00 0.00 27.41 29.80 3jzi h HIS 297 CO 0.00 0.11 0.41 -1.35 -3.07 0.00 0.00 177.93 174.03 3jzi h PRO 298 N 0.33 0.30 -0.19 5.12 0.11 -1.88 -2.11 132.00 133.68 3jzi h PRO 298 Ca 0.48 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 66.54 3jzi h PRO 298 Cb 1.32 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 3jzi h PRO 298 CO -0.16 0.20 -0.05 -0.39 -0.21 0.00 0.00 178.00 177.38 3jzi h VAL 299 N 0.30 1.15 -0.12 3.15 -1.51 -1.89 -1.85 116.25 115.49 3jzi h VAL 299 Ca 0.29 -0.63 -0.19 0.00 -1.23 0.00 0.00 66.70 64.94 3jzi h VAL 299 Cb 0.71 1.07 0.00 0.00 -2.13 0.00 0.00 31.29 30.93 3jzi h VAL 299 CO -0.07 0.20 -0.72 0.74 -1.23 0.00 0.00 177.57 176.50 3jzi h THR 300 N 0.28 1.33 -0.58 7.19 2.02 -1.58 -3.18 112.91 118.40 3jzi h THR 300 Ca 0.06 -2.03 -0.03 0.00 0.77 0.00 0.00 66.41 65.19 3jzi h THR 300 Cb 0.27 2.01 -0.03 0.00 -1.74 0.00 0.00 68.15 68.66 3jzi h THR 300 CO 0.01 0.62 0.25 -0.33 0.37 0.00 0.00 175.52 176.44 3jzi h GLU 301 N 0.39 0.85 -0.76 6.66 5.08 -1.13 -2.72 114.58 122.96 3jzi h GLU 301 Ca -0.03 -0.14 -0.02 0.00 -1.00 0.00 0.00 59.36 58.16 3jzi h GLU 301 Cb 1.30 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 30.38 3jzi h GLU 301 CO 0.13 0.72 0.38 0.52 -1.00 0.00 0.00 179.01 179.77 3jzi h MET 302 N 0.79 1.08 0.00 2.33 2.86 -1.40 0.13 114.93 120.72 3jzi h MET 302 Ca 0.19 -0.15 0.00 0.00 -2.06 0.00 0.00 59.70 57.69 3jzi h MET 302 Cb 0.17 -0.20 0.00 0.00 0.06 0.00 0.00 31.60 31.63 3jzi h MET 302 CO -0.02 0.83 -0.34 0.44 1.06 0.00 0.00 176.91 178.88 3jzi n ILE 303 N -4.41 0.20 -0.01 -1.22 -5.35 -1.20 -4.20 119.36 103.18 3jzi n ILE 303 Ca 0.07 -0.13 0.00 0.00 -0.27 0.00 0.00 62.75 62.42 3jzi n ILE 303 Cb 0.12 -0.17 -0.02 0.00 -1.74 0.00 0.00 39.64 37.82 3jzi n ILE 303 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 3jzi n THR 304 N -1.81 0.09 -0.78 7.28 -2.24 -1.03 -1.06 114.28 114.73 3jzi n THR 304 Ca 0.05 -0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 3jzi n THR 304 Cb 0.38 -0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.35 3jzi n THR 304 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3jzi n GLY 305 N 2.61 0.89 3.67 3.38 0.00 0.45 -4.70 105.19 111.49 3jzi n GLY 305 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.58 3jzi n GLY 305 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3jzi s VAL 306 N -3.57 4.88 -0.67 1.61 1.01 -1.22 -5.00 120.40 117.44 3jzi s VAL 306 Ca 0.00 1.60 -0.26 0.00 0.00 0.00 0.00 61.98 63.32 3jzi s VAL 306 Cb 0.00 -4.13 0.04 0.00 0.00 0.00 0.00 36.38 32.29 3jzi s VAL 306 CO 0.00 0.02 1.16 -0.62 0.00 0.00 0.00 175.10 175.66 3jzi s ASP 307 N 1.18 6.23 0.33 3.32 3.68 -1.26 -4.31 116.67 125.83 3jzi s ASP 307 Ca 0.37 -0.45 0.05 0.00 2.13 0.00 0.00 52.55 54.66 3jzi s ASP 307 Cb -0.16 -2.52 0.57 0.00 -1.45 0.00 0.00 42.92 39.36 3jzi s ASP 307 CO 0.12 -1.63 1.82 -0.07 0.13 0.00 0.00 175.17 175.54 3jzi h LEU 308 N 12.27 0.41 -0.09 -1.34 3.38 -1.95 -2.06 115.31 125.93 3jzi h LEU 308 Ca -0.27 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 57.55 3jzi h LEU 308 Cb 1.06 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.70 3jzi h LEU 308 CO 1.22 0.58 -0.11 0.40 0.09 0.00 0.00 178.44 180.62 3jzi h ILE 309 N 0.39 1.38 -0.63 1.22 1.08 -1.97 -2.00 117.51 116.97 3jzi h ILE 309 Ca 0.07 -1.31 0.03 0.00 -0.39 0.00 0.00 64.86 63.26 3jzi h ILE 309 Cb 0.49 2.05 -0.03 0.00 -3.07 0.00 0.00 36.82 36.25 3jzi h ILE 309 CO 0.03 0.37 0.42 0.11 -0.69 0.00 0.00 178.15 178.39 3jzi h LYS 310 N -0.21 0.73 -0.54 2.37 1.57 -1.88 -1.66 116.57 116.95 3jzi h LYS 310 Ca 0.01 -0.04 -0.10 0.00 -1.87 0.00 0.00 60.65 58.65 3jzi h LYS 310 Cb 0.65 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.77 3jzi h LYS 310 CO 0.03 0.48 -0.06 0.93 -0.57 0.00 0.00 179.45 180.26 3jzi h GLU 311 N 0.75 0.97 -0.45 3.15 4.39 -1.23 -1.09 114.58 121.07 3jzi h GLU 311 Ca 0.25 -0.32 0.01 0.00 0.34 0.00 0.00 59.36 59.64 3jzi h GLU 311 Cb 0.07 -0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 28.61 3jzi h GLU 311 CO -0.07 0.99 0.29 1.96 -1.16 0.00 0.00 179.01 181.01 3jzi h GLN 312 N 0.88 0.56 -0.43 2.33 4.20 -0.56 -0.54 115.11 121.55 3jzi h GLN 312 Ca 0.15 -0.03 -0.08 0.00 0.06 0.00 0.00 58.65 58.74 3jzi h GLN 312 Cb 0.59 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 28.22 3jzi h GLN 312 CO 0.04 0.37 -0.06 -0.07 -0.67 0.00 0.00 178.83 178.44 3jzi h LEU 313 N 0.58 0.72 -0.15 1.46 3.38 -1.19 -1.73 115.31 118.38 3jzi h LEU 313 Ca 0.17 -0.19 -0.06 0.00 0.09 0.00 0.00 57.88 57.89 3jzi h LEU 313 Cb -0.04 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.51 3jzi h LEU 313 CO -0.05 0.83 -0.12 0.03 0.09 0.00 0.00 178.44 179.21 3jzi h ARG 314 N 0.69 0.35 -0.04 1.13 3.08 -0.89 -2.25 114.38 116.45 3jzi h ARG 314 Ca 0.13 -0.18 0.01 0.00 0.07 0.00 0.00 59.98 60.01 3jzi h ARG 314 Cb 0.51 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.55 3jzi h ARG 314 CO 0.03 0.72 -0.03 0.82 -1.07 0.00 0.00 179.97 180.43 3jzi h ILE 315 N -0.00 0.91 -0.45 2.04 2.04 -1.05 -0.07 117.51 120.93 3jzi h ILE 315 Ca 0.03 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.90 3jzi h ILE 315 Cb 0.64 0.91 -0.02 0.00 -0.74 0.00 0.00 36.82 37.60 3jzi h ILE 315 CO 0.03 0.00 0.30 0.00 0.00 0.00 0.00 178.15 178.48 3jzi h ALA 316 N 0.99 1.73 0.00 1.87 0.00 -1.35 -0.29 119.26 122.22 3jzi h ALA 316 Ca 0.03 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3jzi h ALA 316 Cb 0.08 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.70 3jzi h ALA 316 CO -0.06 0.24 0.00 0.00 0.00 0.00 0.00 179.25 179.43 3jzi n ALA 317 N -2.48 2.06 -0.46 0.00 0.00 -0.85 -4.89 120.51 113.90 3jzi n ALA 317 Ca 0.04 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.39 3jzi n ALA 317 Cb 0.09 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.19 3jzi n ALA 317 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3jzi n GLY 318 N 0.63 0.73 3.88 0.00 0.00 -0.12 -4.81 105.19 105.50 3jzi n GLY 318 Ca 0.08 -0.41 -0.31 0.00 0.00 0.00 0.00 46.02 45.38 3jzi n GLY 318 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3jzi s GLN 319 N -0.85 3.74 0.93 1.61 -0.21 -0.07 -4.97 119.66 119.85 3jzi s GLN 319 Ca 0.00 0.18 -0.12 0.00 0.02 0.00 0.00 55.36 55.44 3jzi s GLN 319 Cb 0.00 -2.64 0.15 0.00 1.00 0.00 0.00 33.01 31.51 3jzi s GLN 319 CO 0.00 0.28 1.11 -1.25 -2.12 0.00 0.00 175.29 173.30 3jzi s PRO 320 N -3.08 0.97 0.32 2.91 0.04 -1.26 -4.06 135.00 130.84 3jzi s PRO 320 Ca 0.46 0.51 -0.29 0.00 0.04 0.00 0.00 61.00 61.72 3jzi s PRO 320 Cb -0.11 -1.80 -0.12 0.00 0.04 0.00 0.00 34.50 32.51 3jzi s PRO 320 CO 0.24 -2.36 1.54 1.28 0.04 0.00 0.00 177.00 177.74 3jzi n LEU 321 N -3.92 4.37 0.16 -3.56 4.77 -1.26 -4.80 117.00 112.76 3jzi n LEU 321 Ca 0.06 1.17 0.13 0.00 -0.03 0.00 0.00 56.01 57.35 3jzi n LEU 321 Cb 0.57 -1.59 0.52 0.00 -2.33 0.00 0.00 43.42 40.59 3jzi n LEU 321 CO 0.57 0.08 0.89 0.77 -1.33 0.00 0.00 177.39 178.37 3jzi h SER 322 N 4.07 0.00 -4.46 -1.43 4.64 -1.96 -3.44 113.55 110.97 3jzi h SER 322 Ca -0.48 0.00 -0.40 0.00 -0.47 0.00 0.00 61.79 60.44 3jzi h SER 322 Cb 1.24 0.00 -0.23 0.00 -0.31 0.00 0.00 62.40 63.10 3jzi h SER 322 CO 0.73 0.00 -0.78 0.27 -0.87 0.00 0.00 176.83 176.19 3jzi s ILE 323 N -3.37 1.00 0.34 0.95 -0.00 -1.26 -5.17 121.20 113.70 3jzi s ILE 323 Ca 0.04 -1.14 0.03 0.00 -0.00 0.00 0.00 60.65 59.58 3jzi s ILE 323 Cb 0.09 -0.96 -0.02 0.00 -0.00 0.00 0.00 42.46 41.58 3jzi s ILE 323 CO 0.46 -0.17 0.51 -0.54 -0.00 0.00 0.00 174.94 175.19 3jzi s LYS 324 N -1.48 3.29 0.20 0.37 1.02 -1.26 -5.00 119.74 116.88 3jzi s LYS 324 Ca -0.02 -0.64 -0.11 0.00 0.02 0.00 0.00 55.97 55.21 3jzi s LYS 324 Cb -0.09 -2.74 0.26 0.00 -0.52 0.00 0.00 37.83 34.75 3jzi s LYS 324 CO 0.02 0.11 1.67 0.37 -0.92 0.00 0.00 175.35 176.60 3jzi h GLN 325 N 0.81 0.13 0.00 1.68 5.75 -1.95 -1.21 115.11 120.33 3jzi h GLN 325 Ca -0.49 -0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.01 3jzi h GLN 325 Cb 1.24 -0.03 0.00 0.00 1.07 0.00 0.00 27.48 29.76 3jzi h GLN 325 CO 0.58 0.09 0.01 1.05 -2.65 0.00 0.00 178.83 177.91 3jzi h GLU 326 N 0.14 0.00 -0.00 1.69 9.09 -1.99 -0.45 114.58 123.05 3jzi h GLU 326 Ca 0.30 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.71 3jzi h GLU 326 Cb 0.47 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.57 3jzi h GLU 326 CO -0.48 0.00 -0.68 0.39 0.05 0.00 0.00 179.01 178.30 3jzi n GLU 327 N -2.75 0.03 -2.97 1.06 1.02 -0.47 -4.85 120.64 111.73 3jzi n GLU 327 Ca -0.02 -0.02 -0.42 0.00 -0.02 0.00 0.00 57.16 56.68 3jzi n GLU 327 Cb 0.06 -1.50 -0.05 0.00 -0.02 0.00 0.00 31.44 29.93 3jzi n GLU 327 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3jzi s VAL 328 N -2.98 4.81 -0.05 2.62 1.01 -0.18 -4.95 120.40 120.68 3jzi s VAL 328 Ca 0.10 1.15 0.02 0.00 0.00 0.00 0.00 61.98 63.25 3jzi s VAL 328 Cb 0.17 -4.13 0.01 0.00 0.00 0.00 0.00 36.38 32.44 3jzi s VAL 328 CO 0.76 -0.23 -0.10 -1.00 0.00 0.00 0.00 175.10 174.53 3jzi s HIS 329 N 2.91 1.16 -0.17 5.22 3.76 -1.26 -5.02 115.29 121.88 3jzi s HIS 329 Ca 0.31 -0.37 -0.29 0.00 -0.15 0.00 0.00 55.06 54.56 3jzi s HIS 329 Cb -0.14 -0.87 -0.00 0.00 1.11 0.00 0.00 32.58 32.68 3jzi s HIS 329 CO 0.12 -0.21 1.05 0.08 -0.85 0.00 0.00 174.74 174.94 3jzi s VAL 330 N 0.59 4.67 -0.06 -0.90 1.01 -1.26 -4.27 120.40 120.18 3jzi s VAL 330 Ca -0.11 1.98 -0.01 0.00 0.00 0.00 0.00 61.98 63.84 3jzi s VAL 330 Cb -0.14 -4.27 0.03 0.00 0.00 0.00 0.00 36.38 32.00 3jzi s VAL 330 CO 0.02 -0.10 -0.00 -0.60 0.00 0.00 0.00 175.10 174.42 3jzi s ARG 331 N 2.73 0.54 2.95 2.72 3.52 -0.22 -5.05 118.95 126.14 3jzi s ARG 331 Ca 0.47 0.08 0.00 0.00 -0.13 0.00 0.00 55.73 56.15 3jzi s ARG 331 Cb -0.17 -0.82 0.00 0.00 -1.56 0.00 0.00 34.95 32.40 3jzi s ARG 331 CO 0.12 -0.23 0.00 0.41 -0.81 0.00 0.00 175.30 174.79 3jzi n GLY 332 N 4.76 -0.18 3.21 8.12 0.00 -1.26 -4.37 105.19 115.47 3jzi n GLY 332 Ca -0.14 -1.01 -0.13 0.00 0.00 0.00 0.00 46.02 44.74 3jzi n GLY 332 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3jzi s HIS 333 N 0.00 -0.21 0.02 1.61 2.46 0.67 -4.53 115.29 115.31 3jzi s HIS 333 Ca 0.00 0.40 0.03 0.00 0.47 0.00 0.00 55.06 55.96 3jzi s HIS 333 Cb 0.00 0.09 -0.01 0.00 -0.13 0.00 0.00 32.58 32.52 3jzi s HIS 333 CO 0.00 -0.31 -0.09 0.00 -2.47 0.00 0.00 174.74 171.87 3jzi s ALA 334 N -0.87 0.71 -0.04 1.58 0.00 0.38 -1.30 121.76 122.22 3jzi s ALA 334 Ca -0.10 -0.53 0.04 0.00 0.00 0.00 0.00 51.96 51.37 3jzi s ALA 334 Cb -0.05 -0.11 -0.00 0.00 0.00 0.00 0.00 23.12 22.96 3jzi s ALA 334 CO 0.03 0.12 -0.14 0.08 0.00 0.00 0.00 175.76 175.85 3jzi s VAL 335 N -0.61 1.20 -0.14 0.00 1.01 -0.42 -1.31 120.40 120.14 3jzi s VAL 335 Ca -0.01 -0.59 0.01 0.00 0.00 0.00 0.00 61.98 61.40 3jzi s VAL 335 Cb -0.06 -1.03 -0.00 0.00 0.00 0.00 0.00 36.38 35.29 3jzi s VAL 335 CO 0.00 0.35 -0.17 -0.70 0.00 0.00 0.00 175.10 174.58 3jzi s GLU 336 N 0.07 3.20 -0.24 2.72 2.12 0.14 -1.52 118.70 125.19 3jzi s GLU 336 Ca -0.03 -0.77 -0.05 0.00 0.36 0.00 0.00 54.97 54.48 3jzi s GLU 336 Cb -0.10 -2.54 -0.01 0.00 0.26 0.00 0.00 34.13 31.74 3jzi s GLU 336 CO 0.01 0.09 -0.00 0.00 -0.54 0.00 0.00 175.26 174.83 3jzi s ARG 338 N 1.51 4.56 -0.24 0.00 0.52 -0.70 -0.84 118.95 123.76 3jzi s ARG 338 Ca 0.05 1.56 -0.08 0.00 -0.52 0.00 0.00 55.73 56.74 3jzi s ARG 338 Cb -0.15 -3.39 -0.03 0.00 0.52 0.00 0.00 34.95 31.90 3jzi s ARG 338 CO -0.01 -0.03 0.09 0.42 0.02 0.00 0.00 175.30 175.79 3jzi s ILE 339 N 0.63 4.51 0.03 1.52 -1.09 0.84 -4.95 121.20 122.70 3jzi s ILE 339 Ca 0.52 -0.11 0.08 0.00 -2.23 0.00 0.00 60.65 58.92 3jzi s ILE 339 Cb -0.25 -3.10 -0.03 0.00 -1.58 0.00 0.00 42.46 37.50 3jzi s ILE 339 CO 0.30 0.34 -0.25 0.20 -1.23 0.00 0.00 174.94 174.30 3jzi s ASN 340 N 1.47 2.92 -1.18 3.58 -0.87 -1.26 -1.13 114.94 118.47 3jzi s ASN 340 Ca 0.06 -0.54 -0.16 0.00 -1.57 0.00 0.00 52.86 50.65 3jzi s ASN 340 Cb -0.15 -0.27 0.13 0.00 -0.02 0.00 0.00 41.25 40.94 3jzi s ASN 340 CO 0.04 0.24 1.47 0.00 -2.57 0.00 0.00 177.10 176.29 3jzi s ALA 341 N -0.75 3.67 0.02 0.60 0.00 0.57 -2.76 121.76 123.11 3jzi s ALA 341 Ca 0.10 -3.10 -0.01 0.00 0.00 0.00 0.00 51.96 48.95 3jzi s ALA 341 Cb -0.10 -4.27 -0.02 0.00 0.00 0.00 0.00 23.12 18.74 3jzi s ALA 341 CO 0.01 -2.98 -0.00 -1.83 0.00 0.00 0.00 175.76 170.96 3jzi s GLU 342 N 2.59 0.34 -0.03 0.00 -1.05 -0.96 0.45 118.70 120.04 3jzi s GLU 342 Ca 0.44 -0.58 -0.30 0.00 -0.15 0.00 0.00 54.97 54.39 3jzi s GLU 342 Cb -0.01 0.12 -0.04 0.00 -0.44 0.00 0.00 34.13 33.77 3jzi s GLU 342 CO 0.00 -0.06 1.19 0.34 0.95 0.00 0.00 175.26 177.68 3jzi s ASP 343 N -1.45 7.07 0.50 0.83 3.68 -0.94 -3.43 116.67 122.93 3jzi s ASP 343 Ca -0.16 1.85 0.28 0.00 2.13 0.00 0.00 52.55 56.66 3jzi s ASP 343 Cb -0.10 -2.56 1.23 0.00 -1.45 0.00 0.00 42.92 40.04 3jzi s ASP 343 CO -0.01 -0.55 1.95 -0.65 0.13 0.00 0.00 175.17 176.05 3jzi h PRO 344 N 7.30 0.00 0.20 4.34 0.11 -1.92 0.98 132.00 143.01 3jzi h PRO 344 Ca -0.36 0.00 -0.33 0.00 0.11 0.00 0.00 66.00 65.42 3jzi h PRO 344 Cb 1.17 0.00 0.02 0.00 0.11 0.00 0.00 31.00 32.30 3jzi h PRO 344 CO 0.86 0.13 -1.53 -0.91 -0.21 0.00 0.00 178.00 176.34 3jzi h ASN 345 N 0.00 0.65 0.15 -2.05 4.21 -1.99 -3.39 115.58 113.17 3jzi h ASN 345 Ca -0.00 -0.79 -0.20 0.00 1.21 0.00 0.00 56.30 56.51 3jzi h ASN 345 Cb 0.56 -0.21 -0.04 0.00 -1.12 0.00 0.00 38.32 37.51 3jzi h ASN 345 CO 0.02 1.64 -2.05 0.35 -1.29 0.00 0.00 177.43 176.10 3jzi n THR 346 N -3.61 0.88 -1.22 2.81 -2.24 -1.20 -5.00 114.28 104.70 3jzi n THR 346 Ca -0.18 -0.70 -0.08 0.00 -2.27 0.00 0.00 64.05 60.82 3jzi n THR 346 Cb 1.08 -0.37 -0.03 0.00 -2.10 0.00 0.00 70.33 68.91 3jzi n THR 346 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 3jzi n PHE 347 N -2.62 0.00 -3.37 4.78 3.72 0.34 -5.01 117.46 115.30 3jzi n PHE 347 Ca -0.18 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 56.91 3jzi n PHE 347 Cb 0.89 -2.10 -0.05 0.00 -0.94 0.00 0.00 39.48 37.29 3jzi n PHE 347 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 3jzi s LEU 348 N -1.74 4.12 0.32 4.37 1.43 -1.26 -4.85 118.68 121.07 3jzi s LEU 348 Ca 0.00 0.88 -0.29 0.00 -1.03 0.00 0.00 54.13 53.69 3jzi s LEU 348 Cb 0.00 -3.66 -0.12 0.00 0.03 0.00 0.00 46.19 42.44 3jzi s LEU 348 CO 0.00 -0.12 1.32 -2.65 0.23 0.00 0.00 176.35 175.13 3jzi n PRO 349 N -0.40 2.13 -3.76 1.29 -0.02 -1.26 -2.22 135.00 130.76 3jzi n PRO 349 Ca 0.00 0.75 -0.33 0.00 -2.02 0.00 0.00 63.50 61.90 3jzi n PRO 349 Cb 0.53 -2.35 -0.09 0.00 -0.02 0.00 0.00 33.50 31.56 3jzi n PRO 349 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3jzi s SER 350 N -0.17 5.37 0.91 2.55 0.15 0.17 -4.74 113.70 117.95 3jzi s SER 350 Ca 0.58 -3.62 -0.12 0.00 0.70 0.00 0.00 55.95 53.50 3jzi s SER 350 Cb -0.58 -1.79 0.14 0.00 -1.71 0.00 0.00 66.02 62.08 3jzi s SER 350 CO 0.59 -0.17 1.10 -2.16 1.20 0.00 0.00 173.24 173.80 3jzi s PRO 351 N -1.16 1.12 0.00 5.44 0.04 -1.26 -4.53 135.00 134.66 3jzi s PRO 351 Ca 0.24 0.61 0.00 0.00 0.04 0.00 0.00 61.00 61.89 3jzi s PRO 351 Cb -0.09 -1.81 0.00 0.00 0.04 0.00 0.00 34.50 32.64 3jzi s PRO 351 CO -0.12 -2.28 0.00 0.41 0.04 0.00 0.00 177.00 175.05 3jzi n GLY 352 N -1.46 -0.14 3.75 0.56 0.00 -1.05 -4.94 105.19 101.91 3jzi n GLY 352 Ca 0.06 -1.77 -0.38 0.00 0.00 0.00 0.00 46.02 43.93 3jzi n GLY 352 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3jzi s LYS 353 N -1.29 4.30 -0.31 1.61 2.20 -1.26 0.29 119.74 125.27 3jzi s LYS 353 Ca 0.00 0.62 -0.25 0.00 -0.36 0.00 0.00 55.97 55.98 3jzi s LYS 353 Cb 0.00 -3.37 0.01 0.00 -1.51 0.00 0.00 37.83 32.96 3jzi s LYS 353 CO 0.00 0.30 0.87 0.42 -0.36 0.00 0.00 175.35 176.58 3jzi s ILE 354 N 0.08 4.71 -0.06 5.43 1.01 0.68 -4.29 121.20 128.76 3jzi s ILE 354 Ca 0.29 1.34 -0.04 0.00 0.00 0.00 0.00 60.65 62.24 3jzi s ILE 354 Cb -0.17 -4.23 -0.27 0.00 0.01 0.00 0.00 42.46 37.80 3jzi s ILE 354 CO 0.15 -0.32 0.61 0.71 0.00 0.00 0.00 174.94 176.09 3jzi h THR 355 N 5.64 0.87 -3.56 2.92 1.35 -1.63 0.17 112.91 118.67 3jzi h THR 355 Ca -0.23 -2.55 -0.36 0.00 -0.55 0.00 0.00 66.41 62.72 3jzi h THR 355 Cb 1.09 2.62 -0.33 0.00 -1.73 0.00 0.00 68.15 69.80 3jzi h THR 355 CO 0.93 0.81 -0.76 -0.60 -0.25 0.00 0.00 175.52 175.65 3jzi s ARG 356 N -2.58 0.48 -0.04 4.72 3.52 -1.25 -4.54 118.95 119.26 3jzi s ARG 356 Ca -0.15 -0.03 0.00 0.00 -0.13 0.00 0.00 55.73 55.43 3jzi s ARG 356 Cb 0.07 -0.57 0.03 0.00 -1.56 0.00 0.00 34.95 32.91 3jzi s ARG 356 CO 0.82 -0.07 -0.01 0.12 -0.81 0.00 0.00 175.30 175.34 3jzi s PHE 357 N 0.76 0.48 -0.06 5.12 2.19 -1.26 -1.73 117.98 123.49 3jzi s PHE 357 Ca -0.09 -0.08 -0.01 0.00 0.33 0.00 0.00 56.93 57.09 3jzi s PHE 357 Cb -0.12 -0.53 0.03 0.00 -1.31 0.00 0.00 43.02 41.09 3jzi s PHE 357 CO -0.01 -0.17 0.00 -1.58 1.83 0.00 0.00 175.22 175.30 3jzi s HIS 358 N 1.09 0.56 0.07 10.12 2.46 -0.02 -4.74 115.29 124.82 3jzi s HIS 358 Ca -0.09 -0.10 -0.19 0.00 0.47 0.00 0.00 55.06 55.16 3jzi s HIS 358 Cb -0.14 -0.70 -0.07 0.00 -0.13 0.00 0.00 32.58 31.55 3jzi s HIS 358 CO -0.01 -0.27 0.55 0.00 -2.47 0.00 0.00 174.74 172.53 3jzi s ALA 359 N 1.75 3.60 0.75 1.58 0.00 -1.26 -1.13 121.76 127.05 3jzi s ALA 359 Ca 0.01 -0.00 -0.11 0.00 0.00 0.00 0.00 51.96 51.86 3jzi s ALA 359 Cb -0.13 -2.60 0.04 0.00 0.00 0.00 0.00 23.12 20.43 3jzi s ALA 359 CO -0.04 0.41 1.08 -1.25 0.00 0.00 0.00 175.76 175.96 3jzi s PRO 360 N -1.15 2.49 0.00 0.00 0.04 -1.26 -4.88 135.00 130.24 3jzi s PRO 360 Ca 0.29 0.89 0.00 0.00 0.04 0.00 0.00 61.00 62.22 3jzi s PRO 360 Cb -0.19 -1.94 -0.00 0.00 0.04 0.00 0.00 34.50 32.41 3jzi s PRO 360 CO 0.18 -1.40 0.00 0.41 0.04 0.00 0.00 177.00 176.24 3jzi n GLY 361 N -1.86 4.00 0.00 0.56 0.00 -1.26 -4.87 105.19 101.76 3jzi n GLY 361 Ca 0.08 -1.66 0.00 0.00 0.00 0.00 0.00 46.02 44.44 3jzi n GLY 361 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3jzi n GLY 362 N -0.01 1.54 3.70 -0.02 0.00 -1.26 -4.81 105.19 104.33 3jzi n GLY 362 Ca 0.00 -2.17 -0.42 0.00 0.00 0.00 0.00 46.02 43.43 3jzi n GLY 362 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3jzi s PHE 363 N -1.58 2.66 -0.01 1.61 5.36 -1.26 -2.58 117.98 122.19 3jzi s PHE 363 Ca 0.00 0.49 0.00 0.00 -0.96 0.00 0.00 56.93 56.46 3jzi s PHE 363 Cb 0.00 -3.89 0.00 0.00 -0.34 0.00 0.00 43.02 38.79 3jzi s PHE 363 CO 0.00 -3.47 0.00 0.41 -1.46 0.00 0.00 175.22 170.70 3jzi n GLY 364 N 3.86 0.46 3.65 13.12 0.00 -1.26 -4.91 105.19 120.10 3jzi n GLY 364 Ca 0.15 -0.03 -0.36 0.00 0.00 0.00 0.00 46.02 45.78 3jzi n GLY 364 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3jzi s VAL 365 N -1.91 5.20 -0.08 1.61 1.01 -1.06 0.02 120.40 125.18 3jzi s VAL 365 Ca 0.00 0.12 0.01 0.00 0.00 0.00 0.00 61.98 62.11 3jzi s VAL 365 Cb 0.00 -3.41 0.02 0.00 0.00 0.00 0.00 36.38 32.99 3jzi s VAL 365 CO 0.00 0.37 -0.10 -0.60 0.00 0.00 0.00 175.10 174.77 3jzi s ARG 366 N 0.90 1.61 -0.24 2.72 3.52 0.14 -4.78 118.95 122.82 3jzi s ARG 366 Ca 0.07 -0.35 -0.01 0.00 -0.13 0.00 0.00 55.73 55.31 3jzi s ARG 366 Cb -0.13 -1.44 0.03 0.00 -1.56 0.00 0.00 34.95 31.84 3jzi s ARG 366 CO 0.03 -0.07 -0.07 -0.46 -0.81 0.00 0.00 175.30 173.91 3jzi s TRP 367 N 1.01 3.06 -0.50 5.12 -0.11 -1.26 -0.57 118.94 125.69 3jzi s TRP 367 Ca -0.08 -1.63 -0.04 0.00 1.22 0.00 0.00 56.10 55.57 3jzi s TRP 367 Cb -0.15 -2.04 0.13 0.00 -1.50 0.00 0.00 33.47 29.92 3jzi s TRP 367 CO -0.00 -0.75 0.32 -1.21 -4.62 0.00 0.00 176.95 170.68 3jzi s GLU 368 N 1.30 2.30 -0.10 5.86 0.41 -0.14 -5.00 118.70 123.33 3jzi s GLU 368 Ca -0.00 -2.06 -0.30 0.00 -0.41 0.00 0.00 54.97 52.19 3jzi s GLU 368 Cb -0.17 -3.71 0.09 0.00 -1.78 0.00 0.00 34.13 28.56 3jzi s GLU 368 CO -0.05 -1.13 0.79 0.45 -0.49 0.00 0.00 175.26 174.82 3jzi s SER 369 N 1.60 -0.57 0.03 -0.19 0.15 -1.26 -0.43 113.70 113.03 3jzi s SER 369 Ca 0.11 0.66 0.24 0.00 0.70 0.00 0.00 55.95 57.65 3jzi s SER 369 Cb -0.22 0.51 0.24 0.00 -1.71 0.00 0.00 66.02 64.84 3jzi s SER 369 CO -0.04 -0.50 1.21 0.00 1.20 0.00 0.00 173.24 175.11 3jzi n HIS 370 N 0.95 0.14 -2.03 3.44 1.44 -1.26 -4.97 115.22 112.93 3jzi n HIS 370 Ca -0.16 0.04 -0.35 0.00 -2.01 0.00 0.00 57.72 55.24 3jzi n HIS 370 Cb 0.57 -0.31 0.03 0.00 0.12 0.00 0.00 29.99 30.40 3jzi n HIS 370 CO 0.00 0.00 0.00 0.96 -2.81 0.00 0.00 176.34 174.49 3jzi s ILE 371 N -3.08 2.85 0.18 0.61 -4.36 -1.26 -4.22 121.20 111.92 3jzi s ILE 371 Ca 0.08 0.51 -0.14 0.00 -0.26 0.00 0.00 60.65 60.83 3jzi s ILE 371 Cb 0.16 -3.16 0.01 0.00 1.25 0.00 0.00 42.46 40.72 3jzi s ILE 371 CO 0.76 -0.14 0.42 -0.72 0.24 0.00 0.00 174.94 175.50 3jzi s TYR 372 N -1.76 0.06 0.09 1.37 1.13 -1.26 -5.08 117.35 111.89 3jzi s TYR 372 Ca 0.74 -0.42 -0.31 0.00 -1.41 0.00 0.00 57.07 55.68 3jzi s TYR 372 Cb -0.27 0.21 -0.08 0.00 -1.10 0.00 0.00 41.96 40.72 3jzi s TYR 372 CO 0.33 -0.82 1.54 0.00 -2.51 0.00 0.00 175.55 174.09 3jzi s ALA 373 N -3.90 3.67 0.00 9.51 0.00 -1.26 -2.06 121.76 127.72 3jzi s ALA 373 Ca 0.11 1.17 0.00 0.00 0.00 0.00 0.00 51.96 53.24 3jzi s ALA 373 Cb 0.01 -3.63 0.00 0.00 0.00 0.00 0.00 23.12 19.50 3jzi s ALA 373 CO -0.03 -0.91 0.00 0.41 0.00 0.00 0.00 175.76 175.24 3jzi n GLY 374 N 3.79 1.35 3.76 0.00 0.00 0.60 -5.01 105.19 109.68 3jzi n GLY 374 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 3jzi n GLY 374 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3jzi s TYR 375 N -2.37 3.29 -0.23 1.61 5.04 -0.88 -4.69 117.35 119.12 3jzi s TYR 375 Ca 0.00 1.53 -0.07 0.00 -2.44 0.00 0.00 57.07 56.09 3jzi s TYR 375 Cb 0.00 -3.50 -0.03 0.00 0.35 0.00 0.00 41.96 38.77 3jzi s TYR 375 CO 0.00 -1.28 0.07 0.99 -1.34 0.00 0.00 175.55 173.99 3jzi s THR 376 N -1.11 4.47 -0.23 4.34 2.01 -1.26 -0.23 115.64 123.62 3jzi s THR 376 Ca 0.47 -0.13 -0.29 0.00 0.31 0.00 0.00 61.69 62.05 3jzi s THR 376 Cb -0.36 -3.07 -0.01 0.00 0.01 0.00 0.00 72.50 69.06 3jzi s THR 376 CO 0.47 0.37 1.43 -0.69 -0.69 0.00 0.00 174.62 175.51 3jzi s VAL 377 N 1.29 3.97 0.46 3.82 1.01 0.14 -4.94 120.40 126.14 3jzi s VAL 377 Ca 0.05 1.11 -0.22 0.00 0.00 0.00 0.00 61.98 62.92 3jzi s VAL 377 Cb -0.15 -3.92 -0.08 0.00 0.00 0.00 0.00 36.38 32.23 3jzi s VAL 377 CO 0.04 -0.33 1.07 -2.84 0.00 0.00 0.00 175.10 173.04 3jzi s PRO 378 N 4.23 3.86 0.00 2.72 0.02 -1.26 -2.53 135.00 142.04 3jzi s PRO 378 Ca 0.63 1.50 0.31 0.00 0.02 0.00 0.00 61.00 63.46 3jzi s PRO 378 Cb -0.22 -2.28 1.74 0.00 0.02 0.00 0.00 34.50 33.77 3jzi s PRO 378 CO 0.24 -0.40 2.14 -0.35 -0.33 0.00 0.00 177.00 178.30 3jzi n PRO 379 N -0.64 0.98 0.18 5.54 -0.04 -1.26 -4.11 135.00 135.65 3jzi n PRO 379 Ca 0.08 -0.11 0.07 0.00 -0.04 0.00 0.00 63.50 63.50 3jzi n PRO 379 Cb 0.51 -1.50 0.10 0.00 -0.04 0.00 0.00 33.50 32.57 3jzi n PRO 379 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 3jzi h TYR 380 N 0.27 0.00 -3.83 0.54 -1.99 -1.94 -3.48 116.97 106.54 3jzi h TYR 380 Ca 0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 3jzi h TYR 380 Cb 0.10 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.83 3jzi h TYR 380 CO 0.00 0.25 0.00 0.66 -0.00 0.00 0.00 178.16 179.07 3jzi n TYR 381 N -3.16 -0.32 -1.00 4.88 4.02 -1.26 -4.85 117.16 115.48 3jzi n TYR 381 Ca 0.03 0.00 -0.30 0.00 -0.01 0.00 0.00 57.90 57.62 3jzi n TYR 381 Cb 0.63 0.00 0.16 0.00 -0.02 0.00 0.00 39.34 40.11 3jzi n TYR 381 CO 0.00 0.00 0.00 0.16 -1.01 0.00 0.00 176.86 176.01 3jzi s ASP 382 N -0.70 3.02 0.32 7.72 3.84 -1.26 -4.97 116.67 124.63 3jzi s ASP 382 Ca 0.00 1.65 0.26 0.00 -0.00 0.00 0.00 52.55 54.46 3jzi s ASP 382 Cb 0.00 -2.29 0.80 0.00 -1.38 0.00 0.00 42.92 40.05 3jzi s ASP 382 CO 0.00 -2.95 1.75 0.77 -0.00 0.00 0.00 175.17 174.74 3jzi h SER 383 N -1.76 0.00 -2.52 2.11 4.64 -1.97 -3.46 113.55 110.59 3jzi h SER 383 Ca -0.50 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.27 3jzi h SER 383 Cb 1.29 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.37 3jzi h SER 383 CO 0.51 0.00 1.16 -0.32 -0.87 0.00 0.00 176.83 177.31 3jzi s MET 384 N -3.24 4.05 -0.01 4.77 0.00 -1.26 -0.32 119.30 123.29 3jzi s MET 384 Ca 0.07 2.23 0.11 0.00 0.00 0.00 0.00 55.69 58.10 3jzi s MET 384 Cb 0.09 -4.07 -0.15 0.00 0.00 0.00 0.00 34.83 30.71 3jzi s MET 384 CO 0.57 -1.02 0.38 0.44 0.00 0.00 0.00 175.02 175.39 3jzi n ILE 385 N 5.77 0.00 -3.63 10.11 -5.35 -0.28 -4.88 119.36 121.09 3jzi n ILE 385 Ca 0.19 -0.25 0.04 0.00 -0.27 0.00 0.00 62.75 62.46 3jzi n ILE 385 Cb 0.43 0.66 0.00 0.00 -1.74 0.00 0.00 39.64 38.98 3jzi n ILE 385 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 3jzi s GLY 386 N -2.64 -0.46 -0.04 3.28 0.00 -0.92 -4.20 107.32 102.35 3jzi s GLY 386 Ca 0.00 0.83 0.01 0.00 0.00 0.00 0.00 44.72 45.56 3jzi s GLY 386 CO 0.47 1.11 -0.03 0.54 0.00 0.00 0.00 173.10 175.19 3jzi s LYS 387 N -2.05 0.66 -0.23 2.90 1.02 0.43 -0.11 119.74 122.36 3jzi s LYS 387 Ca 0.17 -0.05 -0.06 0.00 0.02 0.00 0.00 55.97 56.05 3jzi s LYS 387 Cb 0.07 -0.72 -0.03 0.00 -0.52 0.00 0.00 37.83 36.63 3jzi s LYS 387 CO -0.06 -0.10 0.04 -1.17 -0.92 0.00 0.00 175.35 173.14 3jzi s LEU 388 N 0.93 3.37 -0.13 3.17 2.96 -0.02 -0.97 118.68 127.99 3jzi s LEU 388 Ca -0.11 -0.20 0.01 0.00 -0.22 0.00 0.00 54.13 53.61 3jzi s LEU 388 Cb -0.14 -1.88 0.02 0.00 0.50 0.00 0.00 46.19 44.69 3jzi s LEU 388 CO -0.00 0.01 -0.14 -0.63 -1.32 0.00 0.00 176.35 174.27 3jzi s ILE 389 N 1.34 1.50 -0.08 6.68 1.09 0.26 -0.02 121.20 131.98 3jzi s ILE 389 Ca 0.05 -0.60 0.05 0.00 -1.10 0.00 0.00 60.65 59.04 3jzi s ILE 389 Cb -0.15 -1.41 -0.01 0.00 -1.06 0.00 0.00 42.46 39.84 3jzi s ILE 389 CO 0.02 0.45 -0.23 0.00 -0.10 0.00 0.00 174.94 175.08 3jzi s TYR 391 N 0.08 2.79 0.16 0.00 6.14 0.10 -1.30 117.35 125.32 3jzi s TYR 391 Ca -0.10 -0.14 -0.18 0.00 0.64 0.00 0.00 57.07 57.29 3jzi s TYR 391 Cb -0.16 -1.42 0.04 0.00 0.42 0.00 0.00 41.96 40.84 3jzi s TYR 391 CO 0.06 0.46 0.49 0.20 0.64 0.00 0.00 175.55 177.40 3jzi s GLY 392 N -2.43 -0.30 0.11 8.97 0.00 -0.42 -4.51 107.32 108.74 3jzi s GLY 392 Ca 0.24 0.03 0.12 0.00 0.00 0.00 0.00 44.72 45.10 3jzi s GLY 392 CO 0.16 -0.18 1.38 -1.84 0.00 0.00 0.00 173.10 172.61 3jzi n GLU 393 N -0.30 0.06 -3.71 2.90 0.00 -1.26 -0.23 120.64 118.09 3jzi n GLU 393 Ca -0.14 0.45 -0.10 0.00 0.00 0.00 0.00 57.16 57.37 3jzi n GLU 393 Cb 0.64 -1.66 -0.04 0.00 0.00 0.00 0.00 31.44 30.38 3jzi n GLU 393 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 3jzi s ASN 394 N -3.42 -0.27 0.23 -1.84 2.20 -1.26 -4.20 114.94 106.39 3jzi s ASN 394 Ca 0.02 -0.45 -0.07 0.00 -0.94 0.00 0.00 52.86 51.42 3jzi s ASN 394 Cb 0.05 0.56 0.38 0.00 -2.00 0.00 0.00 41.25 40.24 3jzi s ASN 394 CO 0.18 -1.02 1.69 -0.09 -2.94 0.00 0.00 177.10 174.92 3jzi h ARG 395 N 2.21 0.25 -0.87 3.55 2.43 -1.89 -2.62 114.38 117.46 3jzi h ARG 395 Ca -0.30 -0.02 0.03 0.00 -0.81 0.00 0.00 59.98 58.88 3jzi h ARG 395 Cb 1.26 -0.06 -0.05 0.00 -0.42 0.00 0.00 29.97 30.71 3jzi h ARG 395 CO 0.39 0.17 0.56 -0.44 -1.51 0.00 0.00 179.97 179.14 3jzi h ASP 396 N 0.26 0.95 -0.25 -3.80 3.45 -1.97 -1.61 116.42 113.45 3jzi h ASP 396 Ca 0.37 -0.01 -0.03 0.00 0.43 0.00 0.00 57.03 57.78 3jzi h ASP 396 Cb 0.59 -0.22 -0.01 0.00 -0.56 0.00 0.00 39.33 39.13 3jzi h ASP 396 CO -0.46 0.66 0.04 0.58 -1.57 0.00 0.00 179.24 178.49 3jzi h VAL 397 N 1.11 1.23 -0.48 -1.35 2.07 -1.85 -0.78 116.25 116.21 3jzi h VAL 397 Ca 0.34 -0.78 0.07 0.00 0.82 0.00 0.00 66.70 67.14 3jzi h VAL 397 Cb -0.03 1.26 -0.06 0.00 -1.52 0.00 0.00 31.29 30.94 3jzi h VAL 397 CO -0.10 0.25 0.15 0.00 0.02 0.00 0.00 177.57 177.88 3jzi h ALA 398 N 0.85 0.56 -0.49 1.67 0.00 -1.24 0.86 119.26 121.48 3jzi h ALA 398 Ca 0.08 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 3jzi h ALA 398 Cb 0.34 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 3jzi h ALA 398 CO 0.01 -0.25 0.10 0.82 0.00 0.00 0.00 179.25 179.93 3jzi h ILE 399 N 0.31 1.24 -0.70 0.00 2.04 -1.20 -1.26 117.51 117.93 3jzi h ILE 399 Ca 0.23 -0.88 -0.04 0.00 1.00 0.00 0.00 64.86 65.18 3jzi h ILE 399 Cb 0.26 0.87 -0.03 0.00 -0.74 0.00 0.00 36.82 37.17 3jzi h ILE 399 CO -0.25 0.31 0.30 0.00 0.00 0.00 0.00 178.15 178.51 3jzi h ALA 400 N 0.98 0.91 -0.08 1.87 0.00 -0.66 -1.89 119.26 120.39 3jzi h ALA 400 Ca 0.15 -0.17 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 3jzi h ALA 400 Cb 0.36 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3jzi h ALA 400 CO 0.00 0.52 -0.38 0.00 0.00 0.00 0.00 179.25 179.39 3jzi h ARG 401 N 1.00 0.16 -0.21 0.00 3.08 -0.67 -2.98 114.38 114.76 3jzi h ARG 401 Ca 0.24 -0.07 -0.04 0.00 0.07 0.00 0.00 59.98 60.18 3jzi h ARG 401 Cb 0.18 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.22 3jzi h ARG 401 CO -0.02 0.52 -0.03 1.98 -1.07 0.00 0.00 179.97 181.35 3jzi h MET 402 N 0.14 0.39 -0.38 0.04 4.05 -0.70 -1.10 114.93 117.37 3jzi h MET 402 Ca 0.01 -0.14 0.07 0.00 -0.28 0.00 0.00 59.70 59.36 3jzi h MET 402 Cb 0.74 -0.03 -0.06 0.00 -0.80 0.00 0.00 31.60 31.45 3jzi h MET 402 CO 0.06 0.62 0.01 0.87 0.23 0.00 0.00 176.91 178.69 3jzi h LYS 403 N 0.13 0.11 -0.41 0.39 1.57 -1.30 0.50 116.57 117.55 3jzi h LYS 403 Ca 0.05 -0.01 -0.09 0.00 -1.87 0.00 0.00 60.65 58.73 3jzi h LYS 403 Cb 0.47 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.74 3jzi h LYS 403 CO 0.02 0.07 -0.11 -0.91 -0.57 0.00 0.00 179.45 177.95 3jzi h ASN 404 N 0.11 0.81 -0.57 0.86 -0.26 -1.51 -2.75 115.58 112.27 3jzi h ASN 404 Ca 0.19 -0.37 -0.02 0.00 -0.56 0.00 0.00 56.30 55.53 3jzi h ASN 404 Cb 0.26 -0.22 -0.03 0.00 -1.06 0.00 0.00 38.32 37.27 3jzi h ASN 404 CO -0.31 0.99 0.27 0.00 -1.06 0.00 0.00 177.43 177.32 3jzi h ALA 405 N 0.84 0.73 -0.37 -0.83 0.00 -0.79 -2.64 119.26 116.20 3jzi h ALA 405 Ca 0.10 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 3jzi h ALA 405 Cb 0.65 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 3jzi h ALA 405 CO 0.04 0.30 0.03 -0.07 0.00 0.00 0.00 179.25 179.56 3jzi h LEU 406 N 0.77 0.53 -1.10 0.00 3.38 -0.88 -2.13 115.31 115.87 3jzi h LEU 406 Ca 0.19 -0.09 -0.07 0.00 0.09 0.00 0.00 57.88 58.00 3jzi h LEU 406 Cb 0.13 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 3jzi h LEU 406 CO -0.02 0.58 -0.34 1.56 0.09 0.00 0.00 178.44 180.31 3jzi h GLN 407 N 0.55 0.00 0.00 1.13 4.20 -1.19 -2.89 115.11 116.92 3jzi h GLN 407 Ca 0.12 0.00 -0.13 0.00 0.06 0.00 0.00 58.65 58.71 3jzi h GLN 407 Cb 0.30 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.06 3jzi h GLN 407 CO 0.01 0.34 -0.99 0.93 -0.67 0.00 0.00 178.83 178.45 3jzi h GLU 408 N 0.00 0.00 -6.25 1.46 5.08 -1.15 -3.46 114.58 110.26 3jzi h GLU 408 Ca -0.00 0.00 -0.55 0.00 -1.00 0.00 0.00 59.36 57.81 3jzi h GLU 408 Cb 0.80 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.03 3jzi h GLU 408 CO 0.04 0.35 1.05 -1.17 -1.00 0.00 0.00 179.01 178.28 3jzi s LEU 409 N -6.03 4.30 -0.19 1.33 2.96 -0.83 -4.54 118.68 115.68 3jzi s LEU 409 Ca 0.00 2.14 0.00 0.00 -0.22 0.00 0.00 54.13 56.05 3jzi s LEU 409 Cb 0.08 -3.53 0.02 0.00 0.50 0.00 0.00 46.19 43.25 3jzi s LEU 409 CO 0.78 -0.89 -0.17 -0.63 -1.32 0.00 0.00 176.35 174.12 3jzi s ILE 410 N 3.91 2.28 -0.38 6.68 1.01 -0.29 -4.98 121.20 129.43 3jzi s ILE 410 Ca 0.70 -0.90 0.01 0.00 0.00 0.00 0.00 60.65 60.45 3jzi s ILE 410 Cb -0.31 -1.99 0.14 0.00 0.01 0.00 0.00 42.46 40.31 3jzi s ILE 410 CO 0.27 0.49 0.21 -0.63 0.00 0.00 0.00 174.94 175.29 3jzi s ILE 411 N 1.31 0.60 0.22 2.92 1.01 -1.26 -0.84 121.20 125.17 3jzi s ILE 411 Ca 0.05 -1.98 0.01 0.00 0.00 0.00 0.00 60.65 58.73 3jzi s ILE 411 Cb -0.14 -1.44 -0.04 0.00 0.01 0.00 0.00 42.46 40.86 3jzi s ILE 411 CO -0.11 -0.94 0.39 -1.81 0.00 0.00 0.00 174.94 172.46 3jzi s ASP 412 N 0.86 6.35 0.00 3.58 -0.00 -0.70 -4.52 116.67 122.24 3jzi s ASP 412 Ca 0.17 0.31 0.00 0.00 -0.00 0.00 0.00 52.55 53.04 3jzi s ASP 412 Cb -0.23 -1.97 0.00 0.00 -0.00 0.00 0.00 42.92 40.72 3jzi s ASP 412 CO -0.01 -0.06 0.00 0.61 -0.00 0.00 0.00 175.17 175.71 3jzi n GLY 413 N -0.91 2.27 3.08 0.21 0.00 -1.26 -1.64 105.19 106.94 3jzi n GLY 413 Ca -0.06 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.88 3jzi n GLY 413 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3jzi s ILE 414 N -2.51 0.17 0.23 -0.61 -4.36 -1.26 -4.53 121.20 108.33 3jzi s ILE 414 Ca 0.00 -1.39 -0.27 0.00 -0.26 0.00 0.00 60.65 58.73 3jzi s ILE 414 Cb 0.00 -1.09 -0.09 0.00 1.25 0.00 0.00 42.46 42.53 3jzi s ILE 414 CO 0.00 -0.77 0.87 -0.54 0.24 0.00 0.00 174.94 174.74 3jzi s LYS 415 N -3.08 4.67 0.29 0.37 1.02 -1.26 -5.01 119.74 116.74 3jzi s LYS 415 Ca -0.01 1.31 0.02 0.00 0.02 0.00 0.00 55.97 57.31 3jzi s LYS 415 Cb 0.02 -3.17 -0.04 0.00 -0.52 0.00 0.00 37.83 34.12 3jzi s LYS 415 CO -0.07 0.49 0.13 0.95 -0.92 0.00 0.00 175.35 175.94 3jzi s THR 416 N -1.26 0.41 -0.73 2.17 -4.23 -1.22 -2.26 115.64 108.51 3jzi s THR 416 Ca 0.41 -2.00 0.15 0.00 -1.18 0.00 0.00 61.69 59.06 3jzi s THR 416 Cb -0.23 -2.56 0.71 0.00 1.34 0.00 0.00 72.50 71.76 3jzi s THR 416 CO 0.28 0.00 1.60 -0.46 -0.54 0.00 0.00 174.62 175.50 3jzi n ASN 417 N -0.74 4.88 -0.18 3.99 6.94 -1.11 -4.61 115.26 124.43 3jzi n ASN 417 Ca 0.00 -2.64 -0.01 0.00 -0.02 0.00 0.00 54.58 51.92 3jzi n ASN 417 Cb 0.65 -0.62 0.09 0.00 -2.36 0.00 0.00 39.78 37.55 3jzi n ASN 417 CO 0.00 0.00 0.00 0.58 -1.03 0.00 0.00 177.26 176.81 3jzi h VAL 418 N 3.70 0.69 -0.52 3.53 2.07 -1.92 -1.18 116.25 122.61 3jzi h VAL 418 Ca 0.00 -0.09 -0.04 0.00 0.82 0.00 0.00 66.70 67.39 3jzi h VAL 418 Cb 1.61 0.41 -0.02 0.00 -1.52 0.00 0.00 31.29 31.76 3jzi h VAL 418 CO 0.34 0.05 0.17 0.44 0.02 0.00 0.00 177.57 178.59 3jzi h ASP 419 N 0.26 0.70 -0.46 0.57 3.32 -1.97 -1.44 116.42 117.40 3jzi h ASP 419 Ca 0.28 -0.10 -0.10 0.00 0.02 0.00 0.00 57.03 57.13 3jzi h ASP 419 Cb 0.40 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.75 3jzi h ASP 419 CO -0.36 0.66 -0.11 0.25 -1.72 0.00 0.00 179.24 177.96 3jzi h LEU 420 N 0.75 0.90 -0.95 1.55 5.85 -1.74 -1.84 115.31 119.83 3jzi h LEU 420 Ca 0.18 -0.36 -0.03 0.00 0.84 0.00 0.00 57.88 58.51 3jzi h LEU 420 Cb 0.21 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 40.95 3jzi h LEU 420 CO -0.01 1.05 0.38 1.56 -0.34 0.00 0.00 178.44 181.08 3jzi h GLN 421 N 0.73 1.14 -0.60 1.25 1.08 -0.68 -0.69 115.11 117.33 3jzi h GLN 421 Ca 0.12 -0.16 -0.02 0.00 -1.45 0.00 0.00 58.65 57.13 3jzi h GLN 421 Cb 0.66 -0.21 -0.03 0.00 -0.05 0.00 0.00 27.48 27.85 3jzi h GLN 421 CO 0.05 0.87 0.28 0.82 -0.95 0.00 0.00 178.83 179.90 3jzi h ILE 422 N 1.13 1.22 -0.50 2.54 2.04 -1.07 -2.02 117.51 120.84 3jzi h ILE 422 Ca 0.27 -0.62 -0.00 0.00 1.00 0.00 0.00 64.86 65.51 3jzi h ILE 422 Cb 0.11 0.51 -0.02 0.00 -0.74 0.00 0.00 36.82 36.67 3jzi h ILE 422 CO -0.04 0.25 0.30 0.03 0.00 0.00 0.00 178.15 178.70 3jzi h ARG 423 N 0.83 0.68 -0.56 2.37 3.08 -0.78 -1.99 114.38 118.00 3jzi h ARG 423 Ca 0.21 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 60.17 3jzi h ARG 423 Cb 0.13 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.02 3jzi h ARG 423 CO -0.02 0.49 0.23 0.82 -1.07 0.00 0.00 179.97 180.41 3jzi h ILE 424 N 0.67 1.22 -0.43 2.04 2.04 -0.96 -1.82 117.51 120.26 3jzi h ILE 424 Ca 0.18 -0.67 -0.02 0.00 1.00 0.00 0.00 64.86 65.35 3jzi h ILE 424 Cb -0.02 0.62 -0.02 0.00 -0.74 0.00 0.00 36.82 36.66 3jzi h ILE 424 CO -0.03 0.26 0.19 0.24 0.00 0.00 0.00 178.15 178.81 3jzi h MET 425 N 0.76 0.61 -0.00 2.37 2.86 -1.17 -2.15 114.93 118.20 3jzi h MET 425 Ca 0.19 -0.07 0.00 0.00 -2.06 0.00 0.00 59.70 57.75 3jzi h MET 425 Cb 0.19 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 31.73 3jzi h MET 425 CO -0.02 0.49 -0.11 0.09 1.06 0.00 0.00 176.91 178.42 3jzi n ASN 426 N -4.38 0.14 -4.65 1.22 3.02 -0.77 -4.75 115.26 105.09 3jzi n ASN 426 Ca 0.03 0.23 -0.43 0.00 -0.03 0.00 0.00 54.58 54.39 3jzi n ASN 426 Cb 0.13 -0.30 -0.02 0.00 -0.61 0.00 0.00 39.78 38.98 3jzi n ASN 426 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3jzi s ASP 427 N -2.94 6.74 0.45 6.41 2.15 -0.71 -4.94 116.67 123.83 3jzi s ASP 427 Ca 0.15 1.76 0.11 0.00 0.43 0.00 0.00 52.55 55.00 3jzi s ASP 427 Cb 0.19 -2.54 1.03 0.00 -0.30 0.00 0.00 42.92 41.30 3jzi s ASP 427 CO 0.56 -0.93 2.09 1.05 -0.17 0.00 0.00 175.17 177.77 3jzi h GLU 428 N 9.14 0.31 -0.28 4.34 4.11 -1.89 0.15 114.58 130.46 3jzi h GLU 428 Ca -0.31 -0.02 -0.18 0.00 0.07 0.00 0.00 59.36 58.92 3jzi h GLU 428 Cb 1.13 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.31 3jzi h GLU 428 CO 0.98 0.21 -0.54 -0.91 0.07 0.00 0.00 179.01 178.82 3jzi h ASN 429 N 0.32 0.95 -0.61 3.06 2.35 -1.95 -0.91 115.58 118.79 3jzi h ASN 429 Ca 0.08 -0.54 -0.09 0.00 -0.55 0.00 0.00 56.30 55.21 3jzi h ASN 429 Cb -0.02 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.05 3jzi h ASN 429 CO -0.02 1.31 0.05 0.15 -1.65 0.00 0.00 177.43 177.28 3jzi h PHE 430 N 0.63 1.13 0.00 1.19 3.04 -1.69 0.13 116.94 121.37 3jzi h PHE 430 Ca 0.01 -0.17 -0.06 0.00 3.98 0.00 0.00 57.97 61.73 3jzi h PHE 430 Cb 1.15 -0.31 -0.01 0.00 2.56 0.00 0.00 35.95 39.35 3jzi h PHE 430 CO 0.08 0.97 -0.29 1.96 -2.02 0.00 0.00 178.31 179.01 3jzi h GLN 431 N 0.98 0.00 -0.02 1.11 4.20 -0.60 -2.29 115.11 118.49 3jzi h GLN 431 Ca 0.19 0.00 -0.19 0.00 0.06 0.00 0.00 58.65 58.71 3jzi h GLN 431 Cb 0.49 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.28 3jzi h GLN 431 CO 0.02 0.29 -0.73 1.25 -0.67 0.00 0.00 178.83 178.99 3jzi h HIS 432 N 0.00 0.78 0.00 2.96 2.76 -0.79 -3.49 115.15 117.36 3jzi h HIS 432 Ca -0.00 -0.41 0.00 0.00 -2.20 0.00 0.00 60.37 57.76 3jzi h HIS 432 Cb 0.54 -0.09 0.00 0.00 1.55 0.00 0.00 27.41 29.41 3jzi h HIS 432 CO 0.00 1.23 0.00 0.41 -1.30 0.00 0.00 177.93 178.27 3jzi n GLY 433 N 1.00 0.47 2.20 5.26 0.00 0.00 -5.03 105.19 109.09 3jzi n GLY 433 Ca -0.10 -1.89 -0.07 0.00 0.00 0.00 0.00 46.02 43.96 3jzi n GLY 433 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3jzi n GLY 434 N 0.76 0.88 3.77 -0.02 0.00 -1.26 -4.89 105.19 104.42 3jzi n GLY 434 Ca 0.00 -0.72 -0.38 0.00 0.00 0.00 0.00 46.02 44.92 3jzi n GLY 434 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3jzi s THR 435 N -2.27 2.95 0.88 2.61 -4.23 -1.26 -5.03 115.64 109.29 3jzi s THR 435 Ca 0.00 0.76 -0.14 0.00 -1.18 0.00 0.00 61.69 61.13 3jzi s THR 435 Cb 0.00 -3.40 0.14 0.00 1.34 0.00 0.00 72.50 70.57 3jzi s THR 435 CO 0.00 0.03 1.24 0.54 -0.54 0.00 0.00 174.62 175.89 3jzi s ASN 436 N -1.16 3.82 0.57 3.99 2.20 -1.26 -4.79 114.94 118.31 3jzi s ASN 436 Ca 0.61 0.49 0.27 0.00 -0.94 0.00 0.00 52.86 53.29 3jzi s ASN 436 Cb -0.32 -0.76 1.61 0.00 -2.00 0.00 0.00 41.25 39.78 3jzi s ASN 436 CO 0.39 -2.31 2.14 0.16 -2.94 0.00 0.00 177.10 174.55 3jzi h ILE 437 N -1.32 0.60 0.00 0.54 3.07 -1.46 -2.64 117.51 116.29 3jzi h ILE 437 Ca -0.45 0.00 0.00 0.00 1.55 0.00 0.00 64.86 65.96 3jzi h ILE 437 Cb 1.28 0.90 0.00 0.00 -0.27 0.00 0.00 36.82 38.73 3jzi h ILE 437 CO 0.51 0.00 -0.41 0.45 -1.05 0.00 0.00 178.15 177.65 3jzi h HIS 438 N 0.00 0.00 -0.30 0.16 3.86 -1.83 -3.42 115.15 113.62 3jzi h HIS 438 Ca 0.06 0.00 0.05 0.00 -1.16 0.00 0.00 60.37 59.33 3jzi h HIS 438 Cb 0.33 0.00 -0.08 0.00 1.06 0.00 0.00 27.41 28.72 3jzi h HIS 438 CO 0.00 0.00 -0.48 -0.92 0.86 0.00 0.00 177.93 177.39 3jzi h TYR 439 N 0.00 -1.41 -0.58 2.45 3.20 -1.80 -2.39 116.97 116.44 3jzi h TYR 439 Ca 0.00 0.07 0.05 0.00 3.14 0.00 0.00 58.73 61.99 3jzi h TYR 439 Cb 0.78 0.66 -0.05 0.00 1.54 0.00 0.00 36.73 39.66 3jzi h TYR 439 CO 0.00 -0.48 0.30 1.25 -1.64 0.00 0.00 178.16 177.59 3jzi h LEU 440 N -0.43 0.44 -0.63 2.82 5.85 -1.80 0.20 115.31 121.76 3jzi h LEU 440 Ca 0.09 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.85 3jzi h LEU 440 Cb 0.62 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.57 3jzi h LEU 440 CO -0.52 0.29 0.40 -0.08 -0.34 0.00 0.00 178.44 178.19 3jzi h GLU 441 N 0.57 0.85 -0.68 1.25 4.57 -1.72 -0.56 114.58 118.86 3jzi h GLU 441 Ca 0.26 -0.06 -0.04 0.00 -1.18 0.00 0.00 59.36 58.34 3jzi h GLU 441 Cb 0.17 -0.18 -0.03 0.00 -0.16 0.00 0.00 28.75 28.55 3jzi h GLU 441 CO -0.18 0.58 0.25 0.87 -1.18 0.00 0.00 179.01 179.35 3jzi h LYS 442 N 0.86 1.01 -0.38 1.92 1.57 -0.90 -2.83 116.57 117.82 3jzi h LYS 442 Ca 0.23 -0.18 -0.12 0.00 -1.87 0.00 0.00 60.65 58.71 3jzi h LYS 442 Cb -0.06 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.07 3jzi h LYS 442 CO -0.05 0.83 -0.24 -0.22 -0.57 0.00 0.00 179.45 179.21 3jzi h LYS 443 N 0.98 0.82 -0.02 3.15 3.64 -0.60 -3.51 116.57 121.04 3jzi h LYS 443 Ca 0.23 -0.38 0.00 0.00 -1.27 0.00 0.00 60.65 59.22 3jzi h LYS 443 Cb 0.22 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 3jzi h LYS 443 CO -0.02 1.02 0.00 1.28 -2.27 0.00 0.00 179.45 179.46