#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3jzi s LEU 2 N 0.00 4.38 0.04 4.03 1.43 -1.26 -4.96 118.68 122.34 3jzi s LEU 2 Ca 0.00 2.04 -0.22 0.00 -1.03 0.00 0.00 54.13 54.92 3jzi s LEU 2 Cb 0.00 -3.58 -0.14 0.00 0.03 0.00 0.00 46.19 42.50 3jzi s LEU 2 CO 0.00 -0.45 1.44 -0.78 0.23 0.00 0.00 176.35 176.79 3jzi h ASP 3 N 6.55 0.22 -3.44 2.29 1.82 -1.94 -3.42 116.42 118.50 3jzi h ASP 3 Ca -0.42 -0.36 -0.16 0.00 -0.39 0.00 0.00 57.03 55.70 3jzi h ASP 3 Cb 1.21 -0.06 -0.28 0.00 0.68 0.00 0.00 39.33 40.89 3jzi h ASP 3 CO 0.80 0.53 -0.40 -0.75 -1.61 0.00 0.00 179.24 177.80 3jzi s LYS 4 N -4.79 0.29 0.09 0.28 2.20 -1.26 -1.24 119.74 115.32 3jzi s LYS 4 Ca -0.14 0.57 0.07 0.00 -0.36 0.00 0.00 55.97 56.11 3jzi s LYS 4 Cb 0.05 -0.02 -0.03 0.00 -1.51 0.00 0.00 37.83 36.31 3jzi s LYS 4 CO 0.71 -0.13 -0.18 0.96 -0.36 0.00 0.00 175.35 176.35 3jzi s ILE 5 N 1.02 1.46 -0.19 5.43 -5.25 -0.50 -0.41 121.20 122.76 3jzi s ILE 5 Ca -0.07 -1.48 -0.13 0.00 -0.99 0.00 0.00 60.65 57.98 3jzi s ILE 5 Cb -0.08 -1.38 -0.05 0.00 2.95 0.00 0.00 42.46 43.90 3jzi s ILE 5 CO -0.07 -0.16 0.26 -0.69 -1.79 0.00 0.00 174.94 172.49 3jzi s VAL 6 N -1.31 5.31 -0.68 8.37 1.01 -0.08 -0.63 120.40 132.40 3jzi s VAL 6 Ca 0.04 0.45 -0.18 0.00 0.00 0.00 0.00 61.98 62.29 3jzi s VAL 6 Cb -0.09 -3.60 0.12 0.00 0.00 0.00 0.00 36.38 32.81 3jzi s VAL 6 CO 0.03 0.36 0.79 -0.63 0.00 0.00 0.00 175.10 175.65 3jzi s ILE 7 N 0.74 4.90 -1.37 2.22 1.01 -0.50 -1.47 121.20 126.73 3jzi s ILE 7 Ca 0.14 -1.27 -0.09 0.00 0.00 0.00 0.00 60.65 59.43 3jzi s ILE 7 Cb -0.13 -4.54 0.10 0.00 0.01 0.00 0.00 42.46 37.90 3jzi s ILE 7 CO 0.04 -1.18 2.25 0.00 0.00 0.00 0.00 174.94 176.05 3jzi n ALA 8 N 6.08 6.20 -3.13 9.38 0.00 0.24 -3.91 120.51 135.37 3jzi n ALA 8 Ca -0.01 -4.07 0.01 0.00 0.00 0.00 0.00 53.44 49.37 3jzi n ALA 8 Cb 0.44 -3.04 0.00 0.00 0.00 0.00 0.00 19.45 16.85 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 3.40 -0.25 -2.38 0.00 2.85 -1.26 -4.43 115.26 113.19 3jzi n ASN 9 Ca 0.55 -1.13 -0.10 0.00 -0.11 0.00 0.00 54.58 53.79 3jzi n ASN 9 Cb 0.31 0.41 -0.01 0.00 1.24 0.00 0.00 39.78 41.72 3jzi n ASN 9 CO 0.00 0.00 0.00 -2.11 -2.11 0.00 0.00 177.26 173.04 3jzi n ARG 10 N -0.10 0.55 0.00 1.20 1.85 -1.26 -4.82 116.66 114.08 3jzi n ARG 10 Ca -0.00 -1.90 0.00 0.00 -1.00 0.00 0.00 57.85 54.95 3jzi n ARG 10 Cb 0.08 1.91 0.00 0.00 -1.05 0.00 0.00 32.46 33.41 3jzi n ARG 10 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 3jzi n GLY 11 N -0.40 2.08 0.33 2.89 0.00 -1.26 -3.03 105.19 105.79 3jzi n GLY 11 Ca -0.01 -0.49 -0.07 0.00 0.00 0.00 0.00 46.02 45.45 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 1.15 -0.69 1.61 -0.00 -1.88 -3.09 114.58 111.67 3jzi h GLU 12 Ca 0.00 -0.28 -0.05 0.00 -0.00 0.00 0.00 59.36 59.03 3jzi h GLU 12 Cb 0.00 -0.15 -0.03 0.00 -0.00 0.00 0.00 28.75 28.57 3jzi h GLU 12 CO 0.00 1.01 0.25 0.97 -0.00 0.00 0.00 179.01 181.24 3jzi h ILE 13 N 1.08 1.25 -0.88 -1.06 6.09 -1.97 -0.78 117.51 121.25 3jzi h ILE 13 Ca 0.22 -0.82 -0.01 0.00 -1.37 0.00 0.00 64.86 62.89 3jzi h ILE 13 Cb 0.38 0.48 -0.04 0.00 0.47 0.00 0.00 36.82 38.11 3jzi h ILE 13 CO 0.00 0.32 0.53 0.00 -3.07 0.00 0.00 178.15 175.93 3jzi h ALA 14 N 1.11 1.12 -0.49 0.18 0.00 -1.52 -0.91 119.26 118.76 3jzi h ALA 14 Ca 0.23 -0.10 -0.11 0.00 0.00 0.00 0.00 54.91 54.93 3jzi h ALA 14 Cb 0.25 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 3jzi h ALA 14 CO -0.01 0.59 -0.13 1.25 0.00 0.00 0.00 179.25 180.94 3jzi h LEU 15 N 1.21 0.92 -0.22 0.00 5.85 -1.39 -0.90 115.31 120.77 3jzi h LEU 15 Ca 0.31 -0.30 0.01 0.00 0.84 0.00 0.00 57.88 58.74 3jzi h LEU 15 Cb -0.04 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 40.72 3jzi h LEU 15 CO -0.06 1.05 0.13 -0.09 -0.34 0.00 0.00 178.44 179.13 3jzi h ARG 16 N 0.82 0.26 -0.31 1.25 9.65 -0.54 -2.35 114.38 123.16 3jzi h ARG 16 Ca 0.13 -0.02 -0.06 0.00 -1.10 0.00 0.00 59.98 58.93 3jzi h ARG 16 Cb 0.67 -0.06 -0.01 0.00 -1.39 0.00 0.00 29.97 29.18 3jzi h ARG 16 CO 0.05 0.18 -0.03 0.82 2.80 0.00 0.00 179.97 183.79 3jzi h ILE 17 N 0.27 1.27 -0.36 1.20 2.04 -1.07 -2.84 117.51 118.02 3jzi h ILE 17 Ca 0.09 -1.01 0.05 0.00 1.00 0.00 0.00 64.86 64.99 3jzi h ILE 17 Cb -0.01 1.30 -0.05 0.00 -0.74 0.00 0.00 36.82 37.32 3jzi h ILE 17 CO -0.04 0.33 0.07 0.25 0.00 0.00 0.00 178.15 178.76 3jzi h LEU 18 N 0.36 0.01 -0.75 1.44 6.46 -1.07 -0.89 115.31 120.87 3jzi h LEU 18 Ca 0.09 0.06 0.04 0.00 -0.12 0.00 0.00 57.88 57.95 3jzi h LEU 18 Cb 0.48 0.08 -0.05 0.00 -0.73 0.00 0.00 40.66 40.44 3jzi h LEU 18 CO 0.02 0.04 0.46 0.03 -0.62 0.00 0.00 178.44 178.38 3jzi h ARG 19 N 0.19 0.86 -0.70 1.25 3.08 -1.36 -0.91 114.38 116.79 3jzi h ARG 19 Ca 0.17 -0.05 -0.04 0.00 0.07 0.00 0.00 59.98 60.13 3jzi h ARG 19 Cb 0.20 -0.19 -0.03 0.00 0.08 0.00 0.00 29.97 30.02 3jzi h ARG 19 CO -0.23 0.57 0.29 0.00 -1.07 0.00 0.00 179.97 179.53 3jzi h ALA 20 N 1.34 0.91 -0.08 0.04 0.00 -1.19 -1.38 119.26 118.90 3jzi h ALA 20 Ca 0.32 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 3jzi h ALA 20 Cb 0.08 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 3jzi h ALA 20 CO -0.14 0.52 0.04 0.00 0.00 0.00 0.00 179.25 179.67 3jzi h LYS 22 N 0.00 1.27 -0.37 0.00 1.57 -1.02 0.17 116.57 118.19 3jzi h LYS 22 Ca 0.03 -0.08 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 3jzi h LYS 22 Cb 0.13 -0.29 -0.02 0.00 0.08 0.00 0.00 32.23 32.14 3jzi h LYS 22 CO -0.00 0.84 0.15 0.93 -0.57 0.00 0.00 179.45 180.80 3jzi h GLU 23 N 1.31 0.52 -0.02 3.15 5.08 -1.11 -2.69 114.58 120.83 3jzi h GLU 23 Ca 0.37 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.66 3jzi h GLU 23 Cb -0.12 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.03 3jzi h GLU 23 CO -0.09 0.43 -0.17 1.28 -1.00 0.00 0.00 179.01 179.46 3jzi n LEU 24 N -4.39 1.95 -0.40 1.33 4.77 -0.83 -4.97 117.00 114.46 3jzi n LEU 24 Ca 0.02 -0.65 -0.05 0.00 -0.03 0.00 0.00 56.01 55.31 3jzi n LEU 24 Cb 0.14 -0.03 -0.01 0.00 -2.33 0.00 0.00 43.42 41.19 3jzi n LEU 24 CO 0.37 0.34 -0.05 0.61 -1.33 0.00 0.00 177.39 177.33 3jzi n GLY 25 N 1.32 0.56 3.72 -0.72 0.00 -0.53 -5.03 105.19 104.51 3jzi n GLY 25 Ca 0.14 -0.81 -0.39 0.00 0.00 0.00 0.00 46.02 44.95 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 -2.19 5.07 0.35 -0.61 1.01 0.50 -4.99 121.20 120.34 3jzi s ILE 26 Ca 0.00 1.35 -0.27 0.00 0.00 0.00 0.00 60.65 61.72 3jzi s ILE 26 Cb 0.00 -4.00 -0.09 0.00 0.01 0.00 0.00 42.46 38.38 3jzi s ILE 26 CO 0.00 0.26 1.18 -0.54 0.00 0.00 0.00 174.94 175.84 3jzi s LYS 27 N 0.80 4.30 -0.04 2.79 1.02 -0.37 -4.06 119.74 124.17 3jzi s LYS 27 Ca 0.35 1.90 0.03 0.00 0.02 0.00 0.00 55.97 58.28 3jzi s LYS 27 Cb -0.17 -2.91 -0.03 0.00 -0.52 0.00 0.00 37.83 34.20 3jzi s LYS 27 CO 0.16 -0.13 -0.12 0.95 -0.92 0.00 0.00 175.35 175.29 3jzi s THR 28 N -1.29 3.24 -0.26 2.17 -4.23 -1.26 -1.42 115.64 112.60 3jzi s THR 28 Ca 0.52 -0.70 0.01 0.00 -1.18 0.00 0.00 61.69 60.34 3jzi s THR 28 Cb -0.33 -2.30 0.05 0.00 1.34 0.00 0.00 72.50 71.26 3jzi s THR 28 CO 0.42 0.56 -0.09 -0.69 -0.54 0.00 0.00 174.62 174.28 3jzi s VAL 29 N -0.78 2.45 -0.38 2.29 1.01 0.20 -2.04 120.40 123.14 3jzi s VAL 29 Ca 0.12 -1.38 -0.17 0.00 0.00 0.00 0.00 61.98 60.55 3jzi s VAL 29 Cb -0.11 -2.35 0.01 0.00 0.00 0.00 0.00 36.38 33.93 3jzi s VAL 29 CO 0.02 0.07 0.47 0.00 0.00 0.00 0.00 175.10 175.66 3jzi s ALA 30 N 1.20 3.45 -0.08 5.51 0.00 0.33 -1.41 121.76 130.75 3jzi s ALA 30 Ca -0.05 -1.25 -0.17 0.00 0.00 0.00 0.00 51.96 50.49 3jzi s ALA 30 Cb -0.18 -3.02 -0.05 0.00 0.00 0.00 0.00 23.12 19.87 3jzi s ALA 30 CO -0.05 -1.37 0.46 0.14 0.00 0.00 0.00 175.76 174.94 3jzi s VAL 31 N 2.27 5.12 0.07 0.00 -7.23 -1.25 -1.05 120.40 118.32 3jzi s VAL 31 Ca 0.15 0.94 -0.11 0.00 -1.81 0.00 0.00 61.98 61.15 3jzi s VAL 31 Cb -0.16 -3.80 0.01 0.00 0.56 0.00 0.00 36.38 32.99 3jzi s VAL 31 CO 0.14 0.40 0.25 -1.38 -0.31 0.00 0.00 175.10 174.20 3jzi s HIS 32 N 0.13 0.01 0.82 2.82 -3.43 -0.70 -4.70 115.29 110.24 3jzi s HIS 32 Ca 0.25 -0.27 -0.12 0.00 -0.80 0.00 0.00 55.06 54.12 3jzi s HIS 32 Cb -0.16 0.03 0.08 0.00 -1.43 0.00 0.00 32.58 31.11 3jzi s HIS 32 CO 0.11 -0.52 1.11 -1.54 -2.00 0.00 0.00 174.74 171.91 3jzi s SER 33 N -2.40 4.33 0.61 7.38 1.04 -1.26 -0.99 113.70 122.41 3jzi s SER 33 Ca -0.01 1.15 0.39 0.00 0.48 0.00 0.00 55.95 57.97 3jzi s SER 33 Cb 0.01 -1.83 1.94 0.00 0.10 0.00 0.00 66.02 66.24 3jzi s SER 33 CO -0.07 -2.05 2.20 0.77 0.98 0.00 0.00 173.24 175.07 3jzi h SER 34 N -1.15 0.00 1.00 7.02 4.64 -1.38 -2.09 113.55 121.60 3jzi h SER 34 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 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 0.61 0.01 -0.36 0.00 -0.87 0.00 0.00 176.83 176.22 3jzi n ALA 35 N -2.10 2.76 -1.19 5.18 0.00 -1.26 -4.15 120.51 119.76 3jzi n ALA 35 Ca -0.01 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.25 3jzi n ALA 35 Cb 0.18 -1.28 0.24 0.00 0.00 0.00 0.00 19.45 18.58 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 -2.00 3.46 0.13 0.00 10.43 -0.78 -4.67 116.55 123.11 3jzi n ASP 36 Ca 0.05 -3.36 0.05 0.00 2.57 0.00 0.00 54.79 54.09 3jzi n ASP 36 Cb 0.41 -0.62 0.48 0.00 1.84 0.00 0.00 41.12 43.23 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 1.55 0.25 -0.25 -1.24 3.08 -1.72 -2.63 114.38 113.42 3jzi h ARG 37 Ca 0.15 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.17 3jzi h ARG 37 Cb 1.71 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 31.71 3jzi h ARG 37 CO 0.39 0.25 0.00 -0.25 -1.07 0.00 0.00 179.97 179.29 3jzi n ASP 38 N -4.42 2.20 -4.74 7.04 10.43 -1.26 -4.62 116.55 121.17 3jzi n ASP 38 Ca -0.00 -1.82 -0.42 0.00 2.57 0.00 0.00 54.79 55.12 3jzi n ASP 38 Cb 0.15 -0.16 -0.00 0.00 1.84 0.00 0.00 41.12 42.95 3jzi n ASP 38 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 3jzi n LEU 39 N 0.68 4.30 -0.14 0.64 4.77 -0.99 -4.86 117.00 121.39 3jzi n LEU 39 Ca 0.17 1.21 -0.03 0.00 -0.03 0.00 0.00 56.01 57.33 3jzi n LEU 39 Cb 0.41 -1.56 0.05 0.00 -2.33 0.00 0.00 43.42 39.98 3jzi n LEU 39 CO 0.13 -0.14 0.88 0.50 -1.33 0.00 0.00 177.39 177.43 3jzi h LYS 40 N 2.72 0.17 -0.38 3.23 1.63 -1.92 -2.13 116.57 119.88 3jzi h LYS 40 Ca -0.49 -0.01 -0.05 0.00 -0.85 0.00 0.00 60.65 59.25 3jzi h LYS 40 Cb 1.26 -0.04 -0.02 0.00 -0.60 0.00 0.00 32.23 32.83 3jzi h LYS 40 CO 0.63 0.11 0.02 1.12 -3.45 0.00 0.00 179.45 177.88 3jzi h HIS 41 N 0.17 0.62 -0.56 1.91 2.07 -1.90 -2.05 115.15 115.40 3jzi h HIS 41 Ca 0.23 -0.06 -0.00 0.00 -2.85 0.00 0.00 60.37 57.69 3jzi h HIS 41 Cb 0.32 -0.18 -0.03 0.00 2.57 0.00 0.00 27.41 30.09 3jzi h HIS 41 CO -0.25 0.59 0.35 0.28 -3.07 0.00 0.00 177.93 175.82 3jzi h VAL 42 N 0.57 1.16 0.00 6.12 2.07 -1.74 -0.31 116.25 124.13 3jzi h VAL 42 Ca 0.12 -0.34 -0.02 0.00 0.82 0.00 0.00 66.70 67.27 3jzi h VAL 42 Cb 0.34 0.38 -0.00 0.00 -1.52 0.00 0.00 31.29 30.48 3jzi h VAL 42 CO 0.01 0.16 -0.12 -0.07 0.02 0.00 0.00 177.57 177.57 3jzi h LEU 43 N 0.76 0.00 0.00 2.57 3.38 -0.96 -3.03 115.31 118.03 3jzi h LEU 43 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.17 3jzi h LEU 43 Cb -0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.71 3jzi h LEU 43 CO -0.04 0.12 -1.34 0.18 0.09 0.00 0.00 178.44 177.45 3jzi n LEU 44 N -3.37 0.50 -4.76 1.67 4.77 -0.77 -5.00 117.00 110.04 3jzi n LEU 44 Ca -0.01 -0.07 -0.33 0.00 -0.03 0.00 0.00 56.01 55.57 3jzi n LEU 44 Cb 0.31 -0.04 0.06 0.00 -2.33 0.00 0.00 43.42 41.41 3jzi n LEU 44 CO 0.30 0.05 0.75 0.00 -1.33 0.00 0.00 177.39 177.15 3jzi s ALA 45 N -3.28 2.40 0.11 -1.18 0.00 -0.20 -4.98 121.76 114.63 3jzi s ALA 45 Ca 0.00 0.60 -0.12 0.00 0.00 0.00 0.00 51.96 52.44 3jzi s ALA 45 Cb 0.14 -3.34 -0.12 0.00 0.00 0.00 0.00 23.12 19.80 3jzi s ALA 45 CO 0.85 -1.39 1.35 -0.44 0.00 0.00 0.00 175.76 176.12 3jzi h ASP 46 N -0.06 0.95 -4.47 0.00 3.45 -1.88 -3.45 116.42 110.96 3jzi h ASP 46 Ca -0.47 -0.58 -0.31 0.00 0.43 0.00 0.00 57.03 56.10 3jzi h ASP 46 Cb 1.25 -0.28 -0.24 0.00 -0.56 0.00 0.00 39.33 39.51 3jzi h ASP 46 CO 0.53 1.38 -0.75 -1.61 -1.57 0.00 0.00 179.24 177.23 3jzi s GLU 47 N -3.89 0.55 -0.00 3.56 2.02 -0.87 -5.04 118.70 115.03 3jzi s GLU 47 Ca -0.10 -0.61 0.04 0.00 0.02 0.00 0.00 54.97 54.32 3jzi s GLU 47 Cb 0.09 -0.41 -0.01 0.00 0.10 0.00 0.00 34.13 33.90 3jzi s GLU 47 CO 0.90 0.09 -0.13 0.95 0.02 0.00 0.00 175.26 177.09 3jzi s THR 48 N -0.98 1.04 -0.08 3.63 -4.23 -1.26 -0.51 115.64 113.26 3jzi s THR 48 Ca -0.05 -0.61 -0.01 0.00 -1.18 0.00 0.00 61.69 59.84 3jzi s THR 48 Cb -0.08 -0.88 0.03 0.00 1.34 0.00 0.00 72.50 72.91 3jzi s THR 48 CO 0.00 0.26 -0.03 -0.69 -0.54 0.00 0.00 174.62 173.62 3jzi s VAL 49 N -0.37 0.60 -0.34 2.29 1.01 -0.22 -4.94 120.40 118.43 3jzi s VAL 49 Ca 0.05 -0.04 -0.29 0.00 0.00 0.00 0.00 61.98 61.70 3jzi s VAL 49 Cb -0.05 -0.69 0.02 0.00 0.00 0.00 0.00 36.38 35.65 3jzi s VAL 49 CO -0.00 0.29 1.11 0.00 0.00 0.00 0.00 175.10 176.50 3jzi n ILE 51 N 6.06 0.27 -0.26 0.00 -5.35 -0.16 -4.92 119.36 114.99 3jzi n ILE 51 Ca 0.12 -0.49 0.00 0.00 -0.27 0.00 0.00 62.75 62.12 3jzi n ILE 51 Cb 0.47 0.70 0.00 0.00 -1.74 0.00 0.00 39.64 39.07 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 1.28 0.02 3.68 3.28 0.00 -1.26 -4.54 105.19 107.65 3jzi n GLY 52 Ca 0.17 -1.76 -0.29 0.00 0.00 0.00 0.00 46.02 44.14 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 -1.45 0.32 0.27 1.61 0.04 -1.26 -1.22 135.00 133.31 3jzi s PRO 53 Ca 0.00 0.44 -0.07 0.00 0.04 0.00 0.00 61.00 61.41 3jzi s PRO 53 Cb 0.00 -1.73 0.48 0.00 0.04 0.00 0.00 34.50 33.29 3jzi s PRO 53 CO 0.00 -2.79 1.59 0.00 0.04 0.00 0.00 177.00 175.84 3jzi h ALA 54 N -1.93 0.74 -2.81 8.56 0.00 -1.93 -3.37 119.26 118.52 3jzi h ALA 54 Ca -0.54 0.33 -0.53 0.00 0.00 0.00 0.00 54.91 54.17 3jzi h ALA 54 Cb 1.33 0.62 0.09 0.00 0.00 0.00 0.00 17.79 19.83 3jzi h ALA 54 CO 0.57 -0.43 0.89 -2.14 0.00 0.00 0.00 179.25 178.14 3jzi s PRO 55 N -6.18 4.11 0.28 0.00 0.02 -1.26 -4.86 135.00 127.11 3jzi s PRO 55 Ca -0.14 2.60 0.01 0.00 0.02 0.00 0.00 61.00 63.49 3jzi s PRO 55 Cb 0.25 -3.01 0.57 0.00 0.02 0.00 0.00 34.50 32.33 3jzi s PRO 55 CO 0.77 -0.65 1.81 0.77 -0.33 0.00 0.00 177.00 179.37 3jzi h SER 56 N 4.77 0.80 -0.74 2.53 0.02 -1.87 -1.32 113.55 117.75 3jzi h SER 56 Ca -0.47 0.07 0.21 0.00 -0.84 0.00 0.00 61.79 60.75 3jzi h SER 56 Cb 1.22 -0.09 -0.03 0.00 0.14 0.00 0.00 62.40 63.64 3jzi h SER 56 CO 0.79 0.39 0.53 1.62 -1.14 0.00 0.00 176.83 179.02 3jzi h VAL 57 N 0.86 0.64 0.00 2.27 3.04 -1.91 0.34 116.25 121.50 3jzi h VAL 57 Ca 0.50 -0.02 0.00 0.00 -1.01 0.00 0.00 66.70 66.17 3jzi h VAL 57 Cb 0.59 0.60 0.00 0.00 -2.01 0.00 0.00 31.29 30.47 3jzi h VAL 57 CO -0.30 0.01 -1.05 0.29 -1.01 0.00 0.00 177.57 175.50 3jzi n LYS 58 N -4.34 0.21 0.00 4.17 4.76 -0.53 -3.92 118.16 118.52 3jzi n LYS 58 Ca 0.15 -0.02 0.00 0.00 -2.87 0.00 0.00 58.31 55.57 3jzi n LYS 58 Cb 0.78 -1.55 0.00 0.00 -1.84 0.00 0.00 35.03 32.42 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 -1.82 0.00 0.26 4.39 3.41 -0.25 -4.29 113.62 115.33 3jzi n SER 59 Ca 0.02 0.00 0.18 0.00 -0.26 0.00 0.00 58.87 58.81 3jzi n SER 59 Cb 0.41 0.00 0.92 0.00 -0.26 0.00 0.00 64.21 65.28 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 -0.12 7.33 0.05 -1.72 -1.75 116.97 120.76 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 0.00 1.28 -1.05 0.00 0.00 178.16 178.39 3jzi n LEU 61 N -2.77 2.46 -4.50 3.88 4.77 0.10 -4.58 117.00 116.37 3jzi n LEU 61 Ca -0.02 -1.23 -0.43 0.00 -0.03 0.00 0.00 56.01 54.31 3jzi n LEU 61 Cb 0.09 -0.07 -0.03 0.00 -2.33 0.00 0.00 43.42 41.09 3jzi n LEU 61 CO 0.18 0.50 1.14 0.21 -1.33 0.00 0.00 177.39 178.08 3jzi s ASN 62 N -1.18 6.49 0.11 -1.43 3.84 -0.66 -4.92 114.94 117.20 3jzi s ASN 62 Ca 0.20 -1.60 -0.30 0.00 0.21 0.00 0.00 52.86 51.37 3jzi s ASN 62 Cb 0.13 -2.47 -0.10 0.00 -0.55 0.00 0.00 41.25 38.26 3jzi s ASN 62 CO 0.19 -1.32 1.60 0.40 -2.79 0.00 0.00 177.10 175.18 3jzi h ILE 63 N 6.20 0.20 -0.88 -5.21 2.04 -1.91 -2.23 117.51 115.73 3jzi h ILE 63 Ca 0.08 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.04 3jzi h ILE 63 Cb 1.03 0.20 -0.07 0.00 -0.74 0.00 0.00 36.82 37.24 3jzi h ILE 63 CO 1.24 0.00 0.52 -0.65 0.00 0.00 0.00 178.15 179.26 3jzi h PRO 64 N -0.64 0.85 -0.61 2.37 0.11 -1.98 -0.30 132.00 131.80 3jzi h PRO 64 Ca 0.02 -0.05 -0.06 0.00 0.11 0.00 0.00 66.00 66.01 3jzi h PRO 64 Cb 0.66 -0.19 -0.03 0.00 0.11 0.00 0.00 31.00 31.55 3jzi h PRO 64 CO -0.21 0.57 0.12 0.00 -0.21 0.00 0.00 178.00 178.27 3jzi h ALA 65 N 1.47 1.07 -0.18 -0.75 0.00 -1.86 0.39 119.26 119.39 3jzi h ALA 65 Ca 0.42 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 55.03 3jzi h ALA 65 Cb 0.35 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 3jzi h ALA 65 CO -0.24 0.61 -0.11 0.82 0.00 0.00 0.00 179.25 180.33 3jzi h ILE 66 N 0.92 1.32 -0.34 0.00 2.04 -0.77 -1.73 117.51 118.95 3jzi h ILE 66 Ca 0.19 -1.21 0.01 0.00 1.00 0.00 0.00 64.86 64.86 3jzi h ILE 66 Cb 0.37 1.72 -0.02 0.00 -0.74 0.00 0.00 36.82 38.15 3jzi h ILE 66 CO 0.00 0.36 0.20 0.40 0.00 0.00 0.00 178.15 179.12 3jzi h ILE 67 N 0.07 1.04 -0.87 -0.67 1.08 -0.96 -1.82 117.51 115.38 3jzi h ILE 67 Ca 0.04 -0.14 0.00 0.00 -0.39 0.00 0.00 64.86 64.37 3jzi h ILE 67 Cb 0.62 0.60 -0.04 0.00 -3.07 0.00 0.00 36.82 34.92 3jzi h ILE 67 CO 0.03 0.07 0.54 -1.28 -0.69 0.00 0.00 178.15 176.83 3jzi h SER 68 N 0.41 1.03 -0.20 1.72 0.87 -0.88 -0.30 113.55 116.21 3jzi h SER 68 Ca 0.13 -0.05 -0.09 0.00 -1.23 0.00 0.00 61.79 60.55 3jzi h SER 68 Cb -0.01 -0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 61.68 3jzi h SER 68 CO -0.06 0.78 -0.17 0.00 -0.53 0.00 0.00 176.83 176.85 3jzi h ALA 69 N 1.30 1.08 -0.28 6.23 0.00 -1.05 -0.41 119.26 126.12 3jzi h ALA 69 Ca 0.31 -0.32 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 3jzi h ALA 69 Cb -0.08 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 3jzi h ALA 69 CO -0.06 0.56 -0.38 0.00 0.00 0.00 0.00 179.25 179.37 3jzi h ALA 70 N 1.27 0.80 -0.20 0.00 0.00 -0.79 -2.25 119.26 118.09 3jzi h ALA 70 Ca 0.09 -0.44 -0.09 0.00 0.00 0.00 0.00 54.91 54.48 3jzi h ALA 70 Cb 0.60 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 3jzi h ALA 70 CO 0.04 0.65 -0.21 0.93 0.00 0.00 0.00 179.25 180.66 3jzi h GLU 71 N 0.55 0.49 -0.48 0.00 5.08 -0.75 -2.27 114.58 117.19 3jzi h GLU 71 Ca 0.05 -0.27 -0.07 0.00 -1.00 0.00 0.00 59.36 58.08 3jzi h GLU 71 Cb 0.90 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.15 3jzi h GLU 71 CO 0.08 0.85 0.02 0.82 -1.00 0.00 0.00 179.01 179.78 3jzi h ILE 72 N 0.16 1.24 -0.00 3.13 5.03 -1.05 -3.01 117.51 123.00 3jzi h ILE 72 Ca 0.03 -0.96 0.00 0.00 -0.12 0.00 0.00 64.86 63.81 3jzi h ILE 72 Cb 0.77 0.84 0.00 0.00 -3.03 0.00 0.00 36.82 35.40 3jzi h ILE 72 CO 0.05 0.34 -0.34 0.35 -0.68 0.00 0.00 178.15 177.88 3jzi n THR 73 N -4.23 0.00 -1.82 -0.27 -2.24 -0.85 -4.94 114.28 99.93 3jzi n THR 73 Ca 0.03 -0.02 -0.05 0.00 -2.27 0.00 0.00 64.05 61.74 3jzi n THR 73 Cb 0.28 0.07 -0.01 0.00 -2.10 0.00 0.00 70.33 68.57 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 1.47 0.34 3.78 3.38 0.00 -1.14 -5.04 105.19 107.98 3jzi n GLY 74 Ca 0.07 -0.70 -0.32 0.00 0.00 0.00 0.00 46.02 45.07 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 -2.25 2.43 -0.19 4.61 0.00 -0.87 -4.83 121.76 120.66 3jzi s ALA 75 Ca 0.00 0.31 0.07 0.00 0.00 0.00 0.00 51.96 52.34 3jzi s ALA 75 Cb 0.00 -3.26 -0.09 0.00 0.00 0.00 0.00 23.12 19.76 3jzi s ALA 75 CO 0.00 -1.46 0.24 1.33 0.00 0.00 0.00 175.76 175.86 3jzi n VAL 76 N -3.05 0.00 -3.84 0.00 0.24 0.46 -4.85 118.33 107.29 3jzi n VAL 76 Ca 0.09 -0.26 -0.10 0.00 -2.04 0.00 0.00 64.34 62.03 3jzi n VAL 76 Cb 0.53 0.70 -0.08 0.00 -1.47 0.00 0.00 33.84 33.52 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 -2.04 -0.33 -0.08 2.33 0.00 -1.19 -0.29 121.76 120.17 3jzi s ALA 77 Ca 0.00 -0.42 0.01 0.00 0.00 0.00 0.00 51.96 51.55 3jzi s ALA 77 Cb 0.05 0.39 0.02 0.00 0.00 0.00 0.00 23.12 23.58 3jzi s ALA 77 CO 0.29 -0.44 -0.08 0.42 0.00 0.00 0.00 175.76 175.95 3jzi s ILE 78 N -3.19 0.95 -0.29 0.00 1.01 -0.39 -0.90 121.20 118.39 3jzi s ILE 78 Ca -0.00 -0.31 -0.09 0.00 0.00 0.00 0.00 60.65 60.25 3jzi s ILE 78 Cb 0.02 -0.94 -0.02 0.00 0.01 0.00 0.00 42.46 41.53 3jzi s ILE 78 CO -0.07 0.33 0.14 -2.28 0.00 0.00 0.00 174.94 173.06 3jzi s HIS 79 N 1.22 3.16 -1.80 3.97 2.46 -0.54 -0.92 115.29 122.84 3jzi s HIS 79 Ca -0.05 -0.36 0.28 0.00 0.47 0.00 0.00 55.06 55.40 3jzi s HIS 79 Cb -0.14 -2.33 1.02 0.00 -0.13 0.00 0.00 32.58 30.99 3jzi s HIS 79 CO -0.02 -0.36 1.73 -0.35 -2.47 0.00 0.00 174.74 173.26 3jzi n PRO 80 N 4.99 0.87 0.00 2.88 -0.04 -1.26 -0.59 135.00 141.85 3jzi n PRO 80 Ca -0.14 -0.42 0.00 0.00 -0.04 0.00 0.00 63.50 62.89 3jzi n PRO 80 Cb 0.50 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.47 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 1.29 2.59 3.47 0.55 0.00 -1.26 -4.39 105.19 107.43 3jzi n GLY 81 Ca 0.14 -0.37 -0.25 0.00 0.00 0.00 0.00 46.02 45.55 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 2.31 0.00 1.61 -0.85 -1.26 -4.41 117.35 114.75 3jzi s TYR 82 Ca 0.00 -0.33 0.00 0.00 -0.52 0.00 0.00 57.07 56.22 3jzi s TYR 82 Cb 0.00 -1.03 0.00 0.00 0.38 0.00 0.00 41.96 41.31 3jzi s TYR 82 CO 0.00 0.67 0.00 0.41 -1.52 0.00 0.00 175.55 175.11 3jzi n GLY 83 N -0.45 0.02 6.73 5.49 0.00 -1.26 -4.84 105.19 110.89 3jzi n GLY 83 Ca -0.07 -0.97 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 -0.37 1.61 3.01 -1.26 -1.12 117.46 119.33 3jzi n PHE 84 Ca 0.00 0.00 0.12 0.00 1.01 0.00 0.00 57.45 58.58 3jzi n PHE 84 Cb 0.00 0.00 0.32 0.00 -0.01 0.00 0.00 39.48 39.79 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 3.94 0.08 4.37 4.77 -1.26 -4.59 117.00 124.31 3jzi n LEU 85 Ca 0.00 -2.01 0.02 0.00 -0.03 0.00 0.00 56.01 54.00 3jzi n LEU 85 Cb 0.00 -0.48 0.39 0.00 -2.33 0.00 0.00 43.42 41.00 3jzi n LEU 85 CO 0.00 0.98 0.96 0.77 -1.33 0.00 0.00 177.39 178.78 3jzi h SER 86 N 4.22 0.32 -0.24 -1.43 4.64 -1.33 -2.85 113.55 116.89 3jzi h SER 86 Ca 0.00 -0.05 -0.03 0.00 -0.47 0.00 0.00 61.79 61.24 3jzi h SER 86 Cb 0.99 -0.08 -0.02 0.00 -0.31 0.00 0.00 62.40 62.98 3jzi h SER 86 CO 0.00 0.39 -0.01 -0.62 -0.87 0.00 0.00 176.83 175.73 3jzi n GLU 87 N -4.33 2.52 -3.12 4.77 1.02 -1.26 -4.84 120.64 115.39 3jzi n GLU 87 Ca 0.00 -2.86 -0.45 0.00 -0.02 0.00 0.00 57.16 53.84 3jzi n GLU 87 Cb 0.21 -1.79 -0.05 0.00 -0.02 0.00 0.00 31.44 29.79 3jzi n GLU 87 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 3jzi s ASN 88 N -2.17 6.18 0.42 1.62 3.84 -1.08 -4.95 114.94 118.81 3jzi s ASN 88 Ca 0.41 -1.43 0.14 0.00 0.21 0.00 0.00 52.86 52.19 3jzi s ASN 88 Cb 0.34 -2.30 1.00 0.00 -0.55 0.00 0.00 41.25 39.75 3jzi s ASN 88 CO 0.07 -1.09 1.94 0.00 -2.79 0.00 0.00 177.10 175.22 3jzi h ALA 89 N 9.16 2.03 -0.24 1.71 0.00 -1.87 -2.12 119.26 127.93 3jzi h ALA 89 Ca -0.29 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.51 3jzi h ALA 89 Cb 1.09 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 3jzi h ALA 89 CO 1.09 -0.21 -0.29 -0.91 0.00 0.00 0.00 179.25 178.94 3jzi h ASN 90 N 0.46 0.47 -0.12 0.00 2.35 -1.92 -1.79 115.58 115.04 3jzi h ASN 90 Ca 0.35 -0.17 -0.04 0.00 -0.55 0.00 0.00 56.30 55.89 3jzi h ASN 90 Cb 0.70 -0.13 -0.00 0.00 0.05 0.00 0.00 38.32 38.94 3jzi h ASN 90 CO -0.11 0.75 -0.07 0.15 -1.65 0.00 0.00 177.43 176.50 3jzi h PHE 91 N 0.41 0.30 -0.56 1.19 3.04 -1.73 -1.80 116.94 117.79 3jzi h PHE 91 Ca 0.06 -0.08 0.05 0.00 3.98 0.00 0.00 57.97 61.98 3jzi h PHE 91 Cb 0.71 -0.07 -0.05 0.00 2.56 0.00 0.00 35.95 39.11 3jzi h PHE 91 CO 0.02 0.62 0.28 0.00 -2.02 0.00 0.00 178.31 177.21 3jzi h ALA 92 N 0.64 0.72 -0.45 2.41 0.00 -1.37 0.45 119.26 121.67 3jzi h ALA 92 Ca 0.02 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 3jzi h ALA 92 Cb 0.54 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 3jzi h ALA 92 CO 0.02 -0.07 0.12 1.49 0.00 0.00 0.00 179.25 180.81 3jzi h GLU 93 N 0.53 0.71 -0.53 0.00 4.81 -1.35 -2.58 114.58 116.18 3jzi h GLU 93 Ca 0.25 -0.16 -0.06 0.00 -0.13 0.00 0.00 59.36 59.26 3jzi h GLU 93 Cb 0.18 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.44 3jzi h GLU 93 CO -0.18 0.70 0.11 0.37 -0.73 0.00 0.00 179.01 179.27 3jzi h GLN 94 N 0.59 0.86 -0.41 1.92 4.15 -0.77 -1.17 115.11 120.28 3jzi h GLN 94 Ca 0.14 -0.22 0.06 0.00 0.77 0.00 0.00 58.65 59.40 3jzi h GLN 94 Cb 0.30 -0.11 -0.05 0.00 0.21 0.00 0.00 27.48 27.83 3jzi h GLN 94 CO -0.00 0.83 0.10 0.28 -1.93 0.00 0.00 178.83 178.11 3jzi h VAL 95 N 0.75 0.81 -0.14 2.39 2.07 -0.79 -0.13 116.25 121.21 3jzi h VAL 95 Ca 0.16 -0.08 -0.05 0.00 0.82 0.00 0.00 66.70 67.55 3jzi h VAL 95 Cb 0.37 0.55 -0.00 0.00 -1.52 0.00 0.00 31.29 30.68 3jzi h VAL 95 CO 0.01 0.04 -0.10 -0.33 0.02 0.00 0.00 177.57 177.21 3jzi h GLU 96 N 0.25 0.31 0.00 1.57 5.08 -1.39 -1.52 114.58 118.88 3jzi h GLU 96 Ca 0.20 -0.15 -0.03 0.00 -1.00 0.00 0.00 59.36 58.38 3jzi h GLU 96 Cb 0.23 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.47 3jzi h GLU 96 CO -0.24 0.67 -0.15 0.00 -1.00 0.00 0.00 179.01 178.29 3jzi h ARG 97 N -0.05 0.00 0.00 2.33 2.47 -1.07 0.53 114.38 118.59 3jzi h ARG 97 Ca 0.03 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.75 3jzi h ARG 97 Cb 0.59 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.91 3jzi h ARG 97 CO 0.03 0.15 0.00 0.43 0.56 0.00 0.00 179.97 181.13 3jzi n SER 98 N -4.31 0.00 0.00 7.04 7.64 -0.08 -4.90 113.62 119.01 3jzi n SER 98 Ca -0.03 -0.44 0.00 0.00 1.01 0.00 0.00 58.87 59.41 3jzi n SER 98 Cb 0.22 -0.15 0.00 0.00 -1.01 0.00 0.00 64.21 63.26 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 0.81 0.75 3.93 0.23 0.00 0.18 -5.07 105.19 106.02 3jzi n GLY 99 Ca 0.16 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.93 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 -2.55 3.30 -0.14 1.61 0.08 -0.58 -5.00 117.98 114.70 3jzi s PHE 100 Ca 0.00 0.49 -0.19 0.00 0.12 0.00 0.00 56.93 57.34 3jzi s PHE 100 Cb 0.00 -2.46 -0.04 0.00 -0.57 0.00 0.00 43.02 39.95 3jzi s PHE 100 CO 0.00 -0.51 0.54 0.42 -0.10 0.00 0.00 175.22 175.57 3jzi s ILE 101 N -2.74 5.13 -0.27 0.64 1.01 0.61 -3.83 121.20 121.74 3jzi s ILE 101 Ca 0.50 1.06 -0.19 0.00 0.00 0.00 0.00 60.65 62.02 3jzi s ILE 101 Cb -0.10 -3.87 -0.02 0.00 0.01 0.00 0.00 42.46 38.48 3jzi s ILE 101 CO 0.42 0.26 0.56 0.12 0.00 0.00 0.00 174.94 176.30 3jzi s PHE 102 N 1.01 3.25 -1.20 3.97 2.19 -1.26 -1.26 117.98 124.68 3jzi s PHE 102 Ca 0.28 0.64 -0.19 0.00 0.33 0.00 0.00 56.93 57.98 3jzi s PHE 102 Cb -0.16 -2.82 0.07 0.00 -1.31 0.00 0.00 43.02 38.81 3jzi s PHE 102 CO 0.11 -0.35 1.62 0.42 1.83 0.00 0.00 175.22 178.86 3jzi s ILE 103 N 2.42 4.13 -1.53 3.12 1.01 -0.10 -4.77 121.20 125.48 3jzi s ILE 103 Ca 0.23 -1.61 0.00 0.00 0.00 0.00 0.00 60.65 59.27 3jzi s ILE 103 Cb -0.15 -5.13 0.00 0.00 0.01 0.00 0.00 42.46 37.19 3jzi s ILE 103 CO 0.10 -1.97 0.00 0.61 0.00 0.00 0.00 174.94 173.68 3jzi n GLY 104 N 5.77 -1.27 3.87 6.18 0.00 -1.26 -4.45 105.19 114.03 3jzi n GLY 104 Ca 0.43 -0.93 -0.30 0.00 0.00 0.00 0.00 46.02 45.22 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 -0.61 0.54 0.51 1.61 0.04 -1.14 -4.61 135.00 131.33 3jzi s PRO 105 Ca 0.00 -0.28 -0.21 0.00 0.04 0.00 0.00 61.00 60.55 3jzi s PRO 105 Cb 0.00 -1.82 -0.06 0.00 0.04 0.00 0.00 34.50 32.66 3jzi s PRO 105 CO 0.00 -2.51 1.20 0.15 0.04 0.00 0.00 177.00 175.88 3jzi s LYS 106 N -5.76 3.44 0.33 4.56 -0.14 -1.26 -4.87 119.74 116.03 3jzi s LYS 106 Ca 0.72 1.83 0.07 0.00 -1.36 0.00 0.00 55.97 57.22 3jzi s LYS 106 Cb -0.06 -2.22 0.75 0.00 -1.68 0.00 0.00 37.83 34.62 3jzi s LYS 106 CO 0.53 -0.83 1.84 0.00 -0.76 0.00 0.00 175.35 176.13 3jzi h ALA 107 N 1.58 1.74 -0.80 5.17 0.00 -1.88 -1.32 119.26 123.75 3jzi h ALA 107 Ca -0.50 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 3jzi h ALA 107 Cb 1.27 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.89 3jzi h ALA 107 CO 0.58 -0.01 0.47 0.93 0.00 0.00 0.00 179.25 181.22 3jzi h GLU 108 N 0.78 1.08 -0.23 0.00 3.07 -1.91 -1.43 114.58 115.94 3jzi h GLU 108 Ca 0.49 -0.10 -0.14 0.00 -0.50 0.00 0.00 59.36 59.11 3jzi h GLU 108 Cb 0.73 -0.23 -0.01 0.00 -0.84 0.00 0.00 28.75 28.41 3jzi h GLU 108 CO -0.26 0.77 -0.45 1.15 -1.40 0.00 0.00 179.01 178.82 3jzi h THR 109 N 1.10 1.30 -0.38 1.13 2.02 -1.58 -0.69 112.91 115.81 3jzi h THR 109 Ca 0.29 -1.65 -0.03 0.00 0.77 0.00 0.00 66.41 65.79 3jzi h THR 109 Cb -0.03 1.61 -0.02 0.00 -1.74 0.00 0.00 68.15 67.97 3jzi h THR 109 CO -0.05 0.52 0.13 0.40 0.37 0.00 0.00 175.52 176.89 3jzi h ILE 110 N 0.47 1.20 -0.32 3.11 2.04 -1.07 -1.15 117.51 121.80 3jzi h ILE 110 Ca 0.03 -0.65 -0.02 0.00 1.00 0.00 0.00 64.86 65.22 3jzi h ILE 110 Cb 0.97 0.91 -0.01 0.00 -0.74 0.00 0.00 36.82 37.95 3jzi h ILE 110 CO 0.09 0.23 0.12 0.03 0.00 0.00 0.00 178.15 178.62 3jzi h ARG 111 N 0.47 0.49 0.24 2.37 3.08 -1.14 0.21 114.38 120.11 3jzi h ARG 111 Ca 0.13 -0.09 -0.00 0.00 0.07 0.00 0.00 59.98 60.08 3jzi h ARG 111 Cb 0.23 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.19 3jzi h ARG 111 CO -0.01 0.50 -0.20 1.25 -1.07 0.00 0.00 179.97 180.44 3jzi h LEU 112 N 0.37 -0.54 -0.38 3.04 5.85 -0.96 -2.32 115.31 120.38 3jzi h LEU 112 Ca 0.11 0.05 -0.08 0.00 0.84 0.00 0.00 57.88 58.80 3jzi h LEU 112 Cb 0.20 0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.40 3jzi h LEU 112 CO -0.01 -0.31 -0.36 0.24 -0.34 0.00 0.00 178.44 177.66 3jzi h MET 113 N -0.46 0.00 -0.33 1.25 2.86 -1.22 -3.14 114.93 113.89 3jzi h MET 113 Ca -0.01 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.52 3jzi h MET 113 Cb 0.42 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.06 3jzi h MET 113 CO -0.02 0.36 -0.27 0.78 1.06 0.00 0.00 176.91 178.82 3jzi h GLY 114 N 3.05 0.72 -7.09 8.32 0.00 -0.40 -3.39 103.07 104.28 3jzi h GLY 114 Ca -0.00 -0.63 -0.62 0.00 0.00 0.00 0.00 47.33 46.07 3jzi h GLY 114 CO 0.05 0.57 0.47 -0.35 0.00 0.00 0.00 176.54 177.28 3jzi s ASP 115 N -6.79 6.35 0.43 0.19 -1.08 -0.89 -4.72 116.67 110.17 3jzi s ASP 115 Ca -0.08 -0.35 0.12 0.00 -0.52 0.00 0.00 52.55 51.72 3jzi s ASP 115 Cb 0.13 -2.41 0.99 0.00 -1.46 0.00 0.00 42.92 40.17 3jzi s ASP 115 CO 0.82 -1.12 2.01 0.11 0.52 0.00 0.00 175.17 177.51 3jzi h LYS 116 N 9.20 0.42 0.34 4.34 1.79 -1.06 -1.81 116.57 129.80 3jzi h LYS 116 Ca -0.26 -0.03 -0.02 0.00 -2.18 0.00 0.00 60.65 58.17 3jzi h LYS 116 Cb 1.08 -0.10 0.00 0.00 -1.58 0.00 0.00 32.23 31.64 3jzi h LYS 116 CO 1.05 0.28 -0.17 0.28 -1.08 0.00 0.00 179.45 179.81 3jzi h VAL 117 N 0.44 0.67 0.00 0.50 2.07 -1.92 -2.67 116.25 115.33 3jzi h VAL 117 Ca 0.24 -0.39 -0.08 0.00 0.82 0.00 0.00 66.70 67.29 3jzi h VAL 117 Cb 0.37 0.87 -0.01 0.00 -1.52 0.00 0.00 31.29 30.99 3jzi h VAL 117 CO -0.06 0.08 -0.39 0.77 0.02 0.00 0.00 177.57 177.99 3jzi h SER 118 N -0.68 0.00 -0.30 0.57 4.64 -1.79 -2.64 113.55 113.35 3jzi h SER 118 Ca -0.05 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.26 3jzi h SER 118 Cb 0.48 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.55 3jzi h SER 118 CO 0.08 0.39 0.15 0.00 -0.87 0.00 0.00 176.83 176.57 3jzi h ALA 119 N 1.61 0.38 -0.45 5.18 0.00 -1.27 0.86 119.26 125.56 3jzi h ALA 119 Ca -0.00 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.76 3jzi h ALA 119 Cb 0.70 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 3jzi h ALA 119 CO 0.05 -0.06 0.06 0.82 0.00 0.00 0.00 179.25 180.12 3jzi h ILE 120 N 0.35 1.25 -0.45 0.00 2.04 -1.35 -0.89 117.51 118.46 3jzi h ILE 120 Ca 0.10 -0.92 0.02 0.00 1.00 0.00 0.00 64.86 65.06 3jzi h ILE 120 Cb 0.11 0.97 -0.03 0.00 -0.74 0.00 0.00 36.82 37.13 3jzi h ILE 120 CO -0.01 0.32 0.28 0.00 0.00 0.00 0.00 178.15 178.74 3jzi h ALA 121 N 0.94 0.58 -0.78 1.87 0.00 -1.27 0.68 119.26 121.28 3jzi h ALA 121 Ca 0.14 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 3jzi h ALA 121 Cb 0.40 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 3jzi h ALA 121 CO 0.01 -0.03 0.43 0.00 0.00 0.00 0.00 179.25 179.66 3jzi h ALA 122 N 1.19 1.00 -0.36 0.00 0.00 -0.60 -1.73 119.26 118.76 3jzi h ALA 122 Ca 0.18 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.85 3jzi h ALA 122 Cb -0.01 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 3jzi h ALA 122 CO -0.07 0.51 -0.25 0.52 0.00 0.00 0.00 179.25 179.95 3jzi h MET 123 N 1.08 0.81 -0.38 0.00 2.07 -0.67 -0.86 114.93 116.97 3jzi h MET 123 Ca 0.27 -0.39 0.00 0.00 -2.07 0.00 0.00 59.70 57.52 3jzi h MET 123 Cb 0.03 -0.00 -0.02 0.00 -1.87 0.00 0.00 31.60 29.74 3jzi h MET 123 CO -0.04 1.02 0.25 0.87 1.07 0.00 0.00 176.91 180.08 3jzi h LYS 124 N 0.60 0.51 -0.51 1.72 1.57 -0.77 0.25 116.57 119.93 3jzi h LYS 124 Ca 0.07 -0.03 0.01 0.00 -1.87 0.00 0.00 60.65 58.82 3jzi h LYS 124 Cb 0.82 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.99 3jzi h LYS 124 CO 0.07 0.34 0.34 -0.22 -0.57 0.00 0.00 179.45 179.41 3jzi h LYS 125 N 0.52 0.67 0.00 3.15 3.64 -1.23 -2.66 116.57 120.65 3jzi h LYS 125 Ca 0.14 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.47 3jzi h LYS 125 Cb -0.05 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 31.61 3jzi h LYS 125 CO -0.03 0.44 -0.07 0.00 -2.27 0.00 0.00 179.45 177.53 3jzi h ALA 126 N 1.19 1.09 0.00 5.00 0.00 -0.80 -3.46 119.26 122.28 3jzi h ALA 126 Ca 0.19 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3jzi h ALA 126 Cb -0.07 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.71 3jzi h ALA 126 CO -0.04 0.08 0.00 0.41 0.00 0.00 0.00 179.25 179.70 3jzi n GLY 127 N -0.41 1.03 3.62 0.00 0.00 -0.56 -4.69 105.19 104.18 3jzi n GLY 127 Ca -0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.61 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 5.08 0.14 1.61 1.01 0.78 -4.99 120.40 122.03 3jzi s VAL 128 Ca 0.00 0.85 -0.31 0.00 0.00 0.00 0.00 61.98 62.52 3jzi s VAL 128 Cb 0.00 -3.81 -0.10 0.00 0.00 0.00 0.00 36.38 32.47 3jzi s VAL 128 CO 0.00 0.10 1.61 -2.16 0.00 0.00 0.00 175.10 174.65 3jzi s PRO 129 N 2.25 4.20 0.40 2.72 0.04 -1.26 -3.90 135.00 139.45 3jzi s PRO 129 Ca 0.21 2.37 0.08 0.00 0.04 0.00 0.00 61.00 63.69 3jzi s PRO 129 Cb -0.16 -3.31 -0.04 0.00 0.04 0.00 0.00 34.50 31.04 3jzi s PRO 129 CO 0.09 -0.66 0.25 0.00 0.04 0.00 0.00 177.00 176.72 3jzi s VAL 131 N -2.52 4.34 0.24 0.00 1.01 -1.20 -4.61 120.40 117.66 3jzi s VAL 131 Ca 0.43 1.67 -0.31 0.00 0.00 0.00 0.00 61.98 63.77 3jzi s VAL 131 Cb 0.00 -4.07 -0.13 0.00 0.00 0.00 0.00 36.38 32.18 3jzi s VAL 131 CO 0.25 0.08 1.44 -2.65 0.00 0.00 0.00 175.10 174.22 3jzi n PRO 132 N 4.40 2.12 -0.62 2.72 -0.02 -1.26 -4.75 135.00 137.60 3jzi n PRO 132 Ca 0.09 0.76 0.00 0.00 -2.02 0.00 0.00 63.50 62.33 3jzi n PRO 132 Cb 0.47 -2.44 0.00 0.00 -0.02 0.00 0.00 33.50 31.52 3jzi n PRO 132 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3jzi n GLY 133 N 2.25 2.04 0.34 -1.23 0.00 -1.26 -1.10 105.19 106.23 3jzi n GLY 133 Ca 0.12 -0.84 0.17 0.00 0.00 0.00 0.00 46.02 45.47 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 -5.26 1.61 4.64 -0.75 -3.47 113.55 110.32 3jzi h SER 134 Ca 0.00 0.00 -0.40 0.00 -0.47 0.00 0.00 61.79 60.92 3jzi h SER 134 Cb 0.00 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.07 3jzi h SER 134 CO 0.00 0.00 -0.60 0.47 -0.87 0.00 0.00 176.83 175.83 3jzi n ASP 135 N -3.86 -4.71 0.00 4.97 10.43 -1.26 -4.86 116.55 117.25 3jzi n ASP 135 Ca 0.03 -0.41 0.00 0.00 2.57 0.00 0.00 54.79 56.97 3jzi n ASP 135 Cb 0.36 -3.84 0.00 0.00 1.84 0.00 0.00 41.12 39.49 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 -1.38 0.76 3.75 0.44 0.00 -1.26 -5.03 105.19 102.47 3jzi n GLY 136 Ca -0.04 -1.15 -0.31 0.00 0.00 0.00 0.00 46.02 44.52 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 -2.00 1.97 -0.13 1.61 0.04 -1.26 -4.66 135.00 130.57 3jzi s PRO 137 Ca 0.00 1.22 -0.08 0.00 0.04 0.00 0.00 61.00 62.18 3jzi s PRO 137 Cb 0.00 -1.86 -0.04 0.00 0.04 0.00 0.00 34.50 32.64 3jzi s PRO 137 CO 0.00 -1.86 0.14 -0.51 0.04 0.00 0.00 177.00 174.81 3jzi s LEU 138 N -6.06 4.36 0.00 -3.56 1.43 -0.70 -4.98 118.68 109.17 3jzi s LEU 138 Ca 0.62 0.44 0.00 0.00 -1.03 0.00 0.00 54.13 54.16 3jzi s LEU 138 Cb -0.18 -2.08 0.00 0.00 0.03 0.00 0.00 46.19 43.96 3jzi s LEU 138 CO 0.56 0.37 0.00 0.61 0.23 0.00 0.00 176.35 178.13 3jzi n GLY 139 N 2.22 1.26 0.03 -3.19 0.00 -1.26 -4.76 105.19 99.49 3jzi n GLY 139 Ca -0.19 -2.02 0.12 0.00 0.00 0.00 0.00 46.02 43.93 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 -2.64 0.53 -4.58 1.61 10.43 -1.26 -4.82 116.55 115.82 3jzi n ASP 140 Ca 0.00 0.05 -0.42 0.00 2.57 0.00 0.00 54.79 56.99 3jzi n ASP 140 Cb 0.00 0.05 -0.02 0.00 1.84 0.00 0.00 41.12 42.98 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 -3.58 6.34 0.40 -2.24 2.15 -1.26 -4.92 116.67 113.56 3jzi s ASP 141 Ca 0.09 0.22 0.14 0.00 0.43 0.00 0.00 52.55 53.43 3jzi s ASP 141 Cb 0.16 -2.55 0.83 0.00 -0.30 0.00 0.00 42.92 41.06 3jzi s ASP 141 CO 0.68 -1.55 1.88 0.00 -0.17 0.00 0.00 175.17 176.01 3jzi h MET 142 N 10.12 0.00 -0.43 4.34 3.00 -1.99 -2.89 114.93 127.08 3jzi h MET 142 Ca -0.26 0.00 -0.08 0.00 0.00 0.00 0.00 59.70 59.36 3jzi h MET 142 Cb 1.07 0.00 -0.02 0.00 0.00 0.00 0.00 31.60 32.65 3jzi h MET 142 CO 1.18 0.31 -0.08 0.38 0.00 0.00 0.00 176.91 178.69 3jzi h ASP 143 N 0.00 0.72 0.03 -0.10 3.04 -1.99 -0.63 116.42 117.49 3jzi h ASP 143 Ca -0.00 -0.20 -0.23 0.00 -3.24 0.00 0.00 57.03 53.35 3jzi h ASP 143 Cb 0.55 -0.19 0.01 0.00 -1.04 0.00 0.00 39.33 38.66 3jzi h ASP 143 CO 0.04 0.84 -0.89 0.11 -2.04 0.00 0.00 179.24 177.30 3jzi h LYS 144 N 0.68 0.66 -0.51 4.15 6.56 -1.95 -2.78 116.57 123.37 3jzi h LYS 144 Ca 0.12 -0.61 -0.12 0.00 -1.06 0.00 0.00 60.65 58.98 3jzi h LYS 144 Cb 0.53 0.15 -0.02 0.00 -0.57 0.00 0.00 32.23 32.33 3jzi h LYS 144 CO 0.03 1.22 -0.14 -0.91 -2.06 0.00 0.00 179.45 177.59 3jzi h ASN 145 N 0.41 0.99 -0.26 0.86 2.35 -1.37 -2.17 115.58 116.39 3jzi h ASN 145 Ca -0.08 -0.34 -0.17 0.00 -0.55 0.00 0.00 56.30 55.16 3jzi h ASN 145 Cb 1.52 -0.27 -0.00 0.00 0.05 0.00 0.00 38.32 39.61 3jzi h ASN 145 CO 0.17 1.12 -0.46 0.03 -1.65 0.00 0.00 177.43 176.64 3jzi h ARG 146 N 0.87 0.83 -0.27 0.81 -0.00 -1.19 -2.09 114.38 113.34 3jzi h ARG 146 Ca 0.13 -0.48 -0.07 0.00 -0.50 0.00 0.00 59.98 59.06 3jzi h ARG 146 Cb 0.71 0.04 -0.02 0.00 0.00 0.00 0.00 29.97 30.70 3jzi h ARG 146 CO 0.05 1.11 -0.14 0.00 0.00 0.00 0.00 179.97 181.00 3jzi h ALA 147 N 0.81 1.26 -0.23 0.04 0.00 -1.45 -2.61 119.26 117.09 3jzi h ALA 147 Ca 0.04 -0.27 -0.11 0.00 0.00 0.00 0.00 54.91 54.56 3jzi h ALA 147 Cb 1.05 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.71 3jzi h ALA 147 CO 0.10 0.49 -0.30 -0.84 0.00 0.00 0.00 179.25 178.70 3jzi h ILE 148 N 0.43 1.32 -0.71 0.00 3.07 -1.30 -2.69 117.51 117.64 3jzi h ILE 148 Ca 0.08 -1.49 0.02 0.00 1.55 0.00 0.00 64.86 65.02 3jzi h ILE 148 Cb 0.50 1.75 -0.04 0.00 -0.27 0.00 0.00 36.82 38.76 3jzi h ILE 148 CO 0.03 0.46 0.47 0.00 -1.05 0.00 0.00 178.15 178.06 3jzi h ALA 149 N 0.64 1.54 0.00 0.16 0.00 -1.16 -1.95 119.26 118.50 3jzi h ALA 149 Ca 0.03 -0.04 -0.17 0.00 0.00 0.00 0.00 54.91 54.73 3jzi h ALA 149 Cb 0.87 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 3jzi h ALA 149 CO 0.07 0.40 -0.79 1.57 0.00 0.00 0.00 179.25 180.50 3jzi h LYS 150 N 0.91 0.00 -0.33 0.00 5.09 -1.50 -3.11 116.57 117.63 3jzi h LYS 150 Ca 0.27 0.00 -0.07 0.00 0.09 0.00 0.00 60.65 60.94 3jzi h LYS 150 Cb -0.03 0.00 -0.01 0.00 0.10 0.00 0.00 32.23 32.29 3jzi h LYS 150 CO -0.07 0.79 -0.06 -0.09 -2.09 0.00 0.00 179.45 177.94 3jzi h ARG 151 N 0.00 0.62 0.12 0.07 1.12 -1.02 -3.36 114.38 111.92 3jzi h ARG 151 Ca -0.01 -0.22 -0.01 0.00 -1.11 0.00 0.00 59.98 58.63 3jzi h ARG 151 Cb 1.50 -0.04 0.00 0.00 -0.01 0.00 0.00 29.97 31.42 3jzi h ARG 151 CO 0.10 0.78 -0.06 0.82 -3.11 0.00 0.00 179.97 178.50 3jzi h ILE 152 N 0.40 0.00 0.00 1.20 2.04 -1.49 -3.50 117.51 116.15 3jzi h ILE 152 Ca 0.09 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.82 3jzi h ILE 152 Cb 0.54 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.62 3jzi h ILE 152 CO 0.03 0.00 0.00 0.61 0.00 0.00 0.00 178.15 178.79 3jzi n GLY 153 N 0.40 2.66 3.69 5.37 0.00 -1.18 -5.05 105.19 111.08 3jzi n GLY 153 Ca -0.02 -0.38 -0.41 0.00 0.00 0.00 0.00 46.02 45.21 3jzi n GLY 153 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3jzi n TYR 154 N 0.00 1.99 -1.77 1.61 4.02 -1.25 -4.56 117.16 117.19 3jzi n TYR 154 Ca 0.00 0.51 -0.32 0.00 -0.01 0.00 0.00 57.90 58.08 3jzi n TYR 154 Cb 0.00 -2.35 0.04 0.00 -0.02 0.00 0.00 39.34 37.00 3jzi n TYR 154 CO 0.00 0.00 0.00 -2.14 -1.01 0.00 0.00 176.86 173.71 3jzi s PRO 155 N -2.17 3.02 0.31 -0.72 0.02 -1.26 -5.03 135.00 129.16 3jzi s PRO 155 Ca 0.61 1.14 0.07 0.00 0.02 0.00 0.00 61.00 62.84 3jzi s PRO 155 Cb -0.52 -1.99 -0.06 0.00 0.02 0.00 0.00 34.50 31.95 3jzi s PRO 155 CO 0.58 -1.05 -0.05 0.14 -0.33 0.00 0.00 177.00 176.29 3jzi s VAL 156 N -2.69 1.78 -0.03 3.83 -7.23 -0.54 -1.98 120.40 113.55 3jzi s VAL 156 Ca 0.62 -2.12 0.03 0.00 -1.81 0.00 0.00 61.98 58.70 3jzi s VAL 156 Cb -0.16 -2.59 0.00 0.00 0.56 0.00 0.00 36.38 34.19 3jzi s VAL 156 CO 0.45 -0.21 -0.10 -0.51 -0.31 0.00 0.00 175.10 174.42 3jzi s ILE 157 N -2.91 0.86 -0.35 -0.62 2.07 0.13 0.41 121.20 120.79 3jzi s ILE 157 Ca 0.32 -0.40 -0.15 0.00 -1.41 0.00 0.00 60.65 59.01 3jzi s ILE 157 Cb 0.05 -0.76 -0.01 0.00 0.13 0.00 0.00 42.46 41.87 3jzi s ILE 157 CO 0.14 0.26 0.34 -0.63 -1.91 0.00 0.00 174.94 173.14 3jzi s ILE 158 N 0.16 5.19 -0.06 2.00 -1.09 0.66 -1.22 121.20 126.84 3jzi s ILE 158 Ca -0.03 -0.06 0.05 0.00 -2.23 0.00 0.00 60.65 58.38 3jzi s ILE 158 Cb -0.09 -3.81 -0.02 0.00 -1.58 0.00 0.00 42.46 36.96 3jzi s ILE 158 CO 0.01 -0.10 -0.22 -0.54 -1.23 0.00 0.00 174.94 172.86 3jzi s LYS 159 N 1.95 2.55 -0.01 2.79 1.02 -0.14 -1.68 119.74 126.22 3jzi s LYS 159 Ca 0.10 -0.84 -0.30 0.00 0.02 0.00 0.00 55.97 54.95 3jzi s LYS 159 Cb -0.17 -2.23 -0.04 0.00 -0.52 0.00 0.00 37.83 34.86 3jzi s LYS 159 CO 0.11 0.44 1.24 0.00 -0.92 0.00 0.00 175.35 176.23 3jzi s ALA 160 N -0.30 3.49 0.43 5.17 0.00 -0.05 -1.06 121.76 129.43 3jzi s ALA 160 Ca 0.01 0.74 0.11 0.00 0.00 0.00 0.00 51.96 52.82 3jzi s ALA 160 Cb -0.13 -3.51 0.95 0.00 0.00 0.00 0.00 23.12 20.43 3jzi s ALA 160 CO 0.02 -0.71 2.02 1.03 0.00 0.00 0.00 175.76 178.13 3jzi h SER 161 N 7.36 0.22 -0.12 0.00 0.87 -1.54 -0.90 113.55 119.44 3jzi h SER 161 Ca -0.37 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.17 3jzi h SER 161 Cb 1.18 -0.06 0.00 0.00 -0.44 0.00 0.00 62.40 63.08 3jzi h SER 161 CO 0.87 0.25 0.00 0.61 -0.53 0.00 0.00 176.83 178.03 3jzi n GLY 162 N -1.23 0.55 3.97 5.77 0.00 -1.26 -0.63 105.19 112.37 3jzi n GLY 162 Ca -0.00 -0.53 -0.27 0.00 0.00 0.00 0.00 46.02 45.22 3jzi n GLY 162 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3jzi s GLY 163 N -1.79 1.78 0.00 -0.02 0.00 -0.34 -4.90 107.32 102.04 3jzi s GLY 163 Ca 0.34 -1.62 0.00 0.00 0.00 0.00 0.00 44.72 43.44 3jzi s GLY 163 CO 0.30 -0.89 0.00 0.61 0.00 0.00 0.00 173.10 173.12 3jzi n GLY 164 N -3.36 1.18 7.00 0.20 0.00 -0.97 -4.78 105.19 104.45 3jzi n GLY 164 Ca 0.17 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.42 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 -0.28 2.60 1.18 -0.02 0.00 -1.26 -1.84 105.19 105.57 3jzi n GLY 165 Ca 0.00 0.25 -0.02 0.00 0.00 0.00 0.00 46.02 46.24 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 4.64 3.02 -0.02 0.00 -1.26 -4.99 105.19 106.58 3jzi n GLY 166 Ca 0.00 -1.17 -0.22 0.00 0.00 0.00 0.00 46.02 44.64 3jzi n GLY 166 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3jzi s ARG 167 N -3.14 1.15 0.00 1.61 3.52 -0.77 -4.83 118.95 116.49 3jzi s ARG 167 Ca 0.45 -0.36 0.00 0.00 -0.13 0.00 0.00 55.73 55.69 3jzi s ARG 167 Cb 0.40 -1.05 0.00 0.00 -1.56 0.00 0.00 34.95 32.74 3jzi s ARG 167 CO 0.03 0.12 0.00 0.41 -0.81 0.00 0.00 175.30 175.05 3jzi n GLY 168 N 3.34 1.19 3.31 8.12 0.00 -1.26 -2.30 105.19 117.58 3jzi n GLY 168 Ca -0.19 -0.30 -0.26 0.00 0.00 0.00 0.00 46.02 45.27 3jzi n GLY 168 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3jzi s MET 169 N -2.03 1.26 -0.21 1.61 -1.94 -1.26 -0.87 119.30 115.85 3jzi s MET 169 Ca 0.00 -1.17 -0.08 0.00 -1.71 0.00 0.00 55.69 52.73 3jzi s MET 169 Cb 0.00 -1.56 0.09 0.00 2.01 0.00 0.00 34.83 35.38 3jzi s MET 169 CO 0.00 0.37 0.46 0.50 -0.01 0.00 0.00 175.02 176.34 3jzi s ARG 170 N -1.80 0.37 0.24 2.03 3.52 -0.68 -4.99 118.95 117.64 3jzi s ARG 170 Ca 0.09 1.08 -0.28 0.00 -0.13 0.00 0.00 55.73 56.49 3jzi s ARG 170 Cb -0.10 0.39 -0.09 0.00 -1.56 0.00 0.00 34.95 33.59 3jzi s ARG 170 CO 0.04 -0.24 0.90 0.08 -0.81 0.00 0.00 175.30 175.27 3jzi s VAL 171 N 2.56 4.18 -0.19 7.11 1.01 -1.26 -0.25 120.40 133.56 3jzi s VAL 171 Ca -0.03 1.92 0.01 0.00 0.00 0.00 0.00 61.98 63.89 3jzi s VAL 171 Cb -0.12 -4.21 0.03 0.00 0.00 0.00 0.00 36.38 32.09 3jzi s VAL 171 CO -0.14 0.42 -0.14 -0.69 0.00 0.00 0.00 175.10 174.55 3jzi s VAL 172 N -1.28 1.84 -0.02 2.92 1.01 0.17 -4.95 120.40 120.10 3jzi s VAL 172 Ca 0.42 -1.02 -0.07 0.00 0.00 0.00 0.00 61.98 61.32 3jzi s VAL 172 Cb -0.24 -1.80 -0.29 0.00 0.00 0.00 0.00 36.38 34.05 3jzi s VAL 172 CO 0.29 0.30 0.79 0.08 0.00 0.00 0.00 175.10 176.56 3jzi h ARG 173 N 7.95 0.32 -3.50 2.72 0.11 -1.97 -1.44 114.38 118.56 3jzi h ARG 173 Ca -0.34 -0.54 -0.04 0.00 0.10 0.00 0.00 59.98 59.16 3jzi h ARG 173 Cb 1.11 0.20 -0.09 0.00 1.11 0.00 0.00 29.97 32.30 3jzi h ARG 173 CO 0.53 1.20 -0.06 0.20 0.10 0.00 0.00 179.97 181.95 3jzi s GLY 174 N -5.00 0.26 0.54 0.08 0.00 -1.26 -4.72 107.32 97.21 3jzi s GLY 174 Ca -0.12 -0.61 0.27 0.00 0.00 0.00 0.00 44.72 44.27 3jzi s GLY 174 CO 0.86 -0.48 1.98 -0.55 0.00 0.00 0.00 173.10 174.90 3jzi h ASP 175 N 2.25 0.00 -0.53 1.64 3.45 -1.99 -2.41 116.42 118.82 3jzi h ASP 175 Ca -0.27 0.00 -0.05 0.00 0.43 0.00 0.00 57.03 57.14 3jzi h ASP 175 Cb 1.25 0.00 -0.03 0.00 -0.56 0.00 0.00 39.33 39.99 3jzi h ASP 175 CO 0.36 0.00 0.15 0.00 -1.57 0.00 0.00 179.24 178.19 3jzi h ALA 176 N 1.68 1.19 0.00 3.45 0.00 -2.03 -3.03 119.26 120.53 3jzi h ALA 176 Ca 0.27 -0.20 -0.20 0.00 0.00 0.00 0.00 54.91 54.78 3jzi h ALA 176 Cb 1.12 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.64 3jzi h ALA 176 CO -0.00 0.56 -1.25 0.93 0.00 0.00 0.00 179.25 179.49 3jzi h GLU 177 N 0.85 0.00 -1.00 0.00 3.07 -1.87 -3.41 114.58 112.22 3jzi h GLU 177 Ca 0.19 0.00 0.16 0.00 -0.50 0.00 0.00 59.36 59.21 3jzi h GLU 177 Cb 0.29 0.00 -0.16 0.00 -0.84 0.00 0.00 28.75 28.03 3jzi h GLU 177 CO -0.00 0.52 -0.38 1.37 -1.40 0.00 0.00 179.01 179.12 3jzi h LEU 178 N 0.00 -1.39 -0.11 1.33 8.10 -1.37 -1.42 115.31 120.45 3jzi h LEU 178 Ca -0.14 0.31 -0.01 0.00 0.11 0.00 0.00 57.88 58.15 3jzi h LEU 178 Cb 1.70 0.75 -0.00 0.00 -0.44 0.00 0.00 40.66 42.66 3jzi h LEU 178 CO 0.07 -0.29 0.04 0.00 -4.11 0.00 0.00 178.44 174.15 3jzi h ALA 179 N 1.43 0.14 -0.68 0.17 0.00 -1.80 -1.67 119.26 116.86 3jzi h ALA 179 Ca 0.36 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.13 3jzi h ALA 179 Cb 0.61 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 3jzi h ALA 179 CO -0.99 -0.26 0.28 0.37 0.00 0.00 0.00 179.25 178.65 3jzi h GLN 180 N 0.00 0.98 -0.24 0.00 4.15 -1.79 -2.88 115.11 115.34 3jzi h GLN 180 Ca 0.04 -0.15 -0.09 0.00 0.77 0.00 0.00 58.65 59.21 3jzi h GLN 180 Cb 0.19 -0.17 -0.00 0.00 0.21 0.00 0.00 27.48 27.70 3jzi h GLN 180 CO -0.00 0.79 -0.22 0.77 -1.93 0.00 0.00 178.83 178.24 3jzi h SER 181 N 0.97 0.60 0.41 -0.69 0.02 -1.18 -1.87 113.55 111.81 3jzi h SER 181 Ca 0.23 -0.46 -0.05 0.00 -0.84 0.00 0.00 61.79 60.66 3jzi h SER 181 Cb 0.16 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 3jzi h SER 181 CO -0.02 0.94 -0.25 0.40 -1.14 0.00 0.00 176.83 176.76 3jzi h ILE 182 N 0.27 0.94 0.19 3.27 2.04 -1.27 -2.86 117.51 120.09 3jzi h ILE 182 Ca 0.04 -0.94 -0.26 0.00 1.00 0.00 0.00 64.86 64.71 3jzi h ILE 182 Cb 0.76 1.54 0.03 0.00 -0.74 0.00 0.00 36.82 38.41 3jzi h ILE 182 CO 0.05 0.25 -1.13 0.28 0.00 0.00 0.00 178.15 177.60 3jzi h SER 183 N 0.00 0.63 -0.58 1.72 0.02 -1.45 -3.16 113.55 110.72 3jzi h SER 183 Ca -0.00 -0.94 -0.08 0.00 -0.84 0.00 0.00 61.79 59.93 3jzi h SER 183 Cb 0.52 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.84 3jzi h SER 183 CO 0.03 1.54 0.05 0.24 -1.14 0.00 0.00 176.83 177.56 3jzi h MET 184 N -0.15 1.00 -0.44 3.45 2.86 -1.32 -2.60 114.93 117.73 3jzi h MET 184 Ca -0.20 -0.29 -0.06 0.00 -2.06 0.00 0.00 59.70 57.09 3jzi h MET 184 Cb 1.88 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 33.42 3jzi h MET 184 CO 0.20 0.97 0.06 1.15 1.06 0.00 0.00 176.91 180.35 3jzi h THR 185 N 0.89 1.25 -0.83 2.22 2.02 -1.65 -1.64 112.91 115.16 3jzi h THR 185 Ca 0.17 -0.93 -0.01 0.00 0.77 0.00 0.00 66.41 66.41 3jzi h THR 185 Cb 0.49 0.99 -0.04 0.00 -1.74 0.00 0.00 68.15 67.85 3jzi h THR 185 CO 0.02 0.32 0.47 0.03 0.37 0.00 0.00 175.52 176.74 3jzi h ARG 186 N 0.60 1.15 -0.37 6.66 3.08 -1.51 0.13 114.38 124.11 3jzi h ARG 186 Ca 0.13 -0.12 -0.11 0.00 0.07 0.00 0.00 59.98 59.94 3jzi h ARG 186 Cb 0.41 -0.23 -0.01 0.00 0.08 0.00 0.00 29.97 30.22 3jzi h ARG 186 CO 0.01 0.83 -0.22 0.00 -1.07 0.00 0.00 179.97 179.53 3jzi h ALA 187 N 1.25 0.53 -0.36 0.04 0.00 -1.35 -2.05 119.26 117.32 3jzi h ALA 187 Ca 0.30 -0.38 -0.12 0.00 0.00 0.00 0.00 54.91 54.71 3jzi h ALA 187 Cb 0.00 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3jzi h ALA 187 CO -0.05 0.50 -0.25 0.93 0.00 0.00 0.00 179.25 180.38 3jzi h GLU 188 N 0.60 0.80 -0.55 0.00 5.08 -1.10 -2.62 114.58 116.79 3jzi h GLU 188 Ca 0.08 -0.38 -0.04 0.00 -1.00 0.00 0.00 59.36 58.01 3jzi h GLU 188 Cb 0.77 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.99 3jzi h GLU 188 CO 0.06 1.01 0.18 0.00 -1.00 0.00 0.00 179.01 179.26 3jzi h ALA 189 N 0.77 0.72 0.00 3.43 0.00 -0.75 0.35 119.26 123.78 3jzi h ALA 189 Ca 0.07 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.71 3jzi h ALA 189 Cb 0.81 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 3jzi h ALA 189 CO 0.07 0.38 -0.37 1.57 0.00 0.00 0.00 179.25 180.89 3jzi h LYS 190 N 0.76 0.00 0.17 0.00 -0.00 -1.35 0.15 116.57 116.31 3jzi h LYS 190 Ca 0.18 0.00 -0.33 0.00 -0.00 0.00 0.00 60.65 60.50 3jzi h LYS 190 Cb 0.27 0.00 0.01 0.00 -0.00 0.00 0.00 32.23 32.51 3jzi h LYS 190 CO -0.01 0.37 -1.62 0.00 -0.00 0.00 0.00 179.45 178.20 3jzi h ALA 191 N 1.63 0.16 0.09 0.07 0.00 -1.22 -3.18 119.26 116.80 3jzi h ALA 191 Ca -0.00 -1.09 -0.36 0.00 0.00 0.00 0.00 54.91 53.46 3jzi h ALA 191 Cb 0.70 0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.80 3jzi h ALA 191 CO 0.05 1.02 -2.02 0.00 0.00 0.00 0.00 179.25 178.30 3jzi n ALA 192 N -2.76 1.07 0.16 0.00 0.00 0.09 -4.58 120.51 114.48 3jzi n ALA 192 Ca -0.20 -0.70 0.03 0.00 0.00 0.00 0.00 53.44 52.57 3jzi n ALA 192 Cb 1.07 -0.63 0.04 0.00 0.00 0.00 0.00 19.45 19.93 3jzi n ALA 192 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3jzi n PHE 193 N -3.36 0.05 -3.08 0.00 3.01 0.51 -5.01 117.46 109.57 3jzi n PHE 193 Ca -0.31 -0.12 -0.22 0.00 1.01 0.00 0.00 57.45 57.81 3jzi n PHE 193 Cb 1.05 -0.01 0.02 0.00 -0.01 0.00 0.00 39.48 40.52 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 0.24 -5.03 -3.54 4.37 7.64 -1.07 -4.97 113.62 111.27 3jzi n SER 194 Ca 0.04 -0.28 -0.07 0.00 1.01 0.00 0.00 58.87 59.57 3jzi n SER 194 Cb 0.18 -4.11 -0.08 0.00 -1.01 0.00 0.00 64.21 59.20 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 -2.63 -0.32 0.00 6.43 2.47 -1.22 -4.96 114.94 114.71 3jzi s ASN 195 Ca 0.31 0.85 0.16 0.00 0.42 0.00 0.00 52.86 54.60 3jzi s ASN 195 Cb -0.15 1.47 0.57 0.00 -1.45 0.00 0.00 41.25 41.69 3jzi s ASN 195 CO 0.38 -0.25 1.43 -0.90 -3.72 0.00 0.00 177.10 174.04 3jzi n ASP 196 N 5.39 1.67 -4.71 -4.21 3.85 -1.26 -3.26 116.55 114.03 3jzi n ASP 196 Ca -0.07 -1.82 -0.42 0.00 -0.71 0.00 0.00 54.79 51.77 3jzi n ASP 196 Cb 0.50 -0.15 -0.03 0.00 -1.35 0.00 0.00 41.12 40.08 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 -1.70 4.35 0.26 0.11 1.75 -1.26 -4.73 119.30 118.09 3jzi s MET 197 Ca 0.28 1.98 0.05 0.00 -1.25 0.00 0.00 55.69 56.75 3jzi s MET 197 Cb 0.15 -3.30 -0.06 0.00 2.84 0.00 0.00 34.83 34.46 3jzi s MET 197 CO 0.22 -0.39 -0.02 0.14 -0.65 0.00 0.00 175.02 174.31 3jzi s VAL 198 N 1.19 1.34 0.13 10.11 -7.23 -1.26 -1.34 120.40 123.33 3jzi s VAL 198 Ca 0.63 -2.07 -0.09 0.00 -1.81 0.00 0.00 61.98 58.64 3jzi s VAL 198 Cb -0.34 -2.44 -0.00 0.00 0.56 0.00 0.00 36.38 34.15 3jzi s VAL 198 CO 0.30 -0.28 0.25 -0.72 -0.31 0.00 0.00 175.10 174.33 3jzi s TYR 199 N -3.21 0.26 -0.04 2.82 -0.85 -0.22 -1.72 117.35 114.38 3jzi s TYR 199 Ca 0.30 -0.65 0.02 0.00 -0.52 0.00 0.00 57.07 56.22 3jzi s TYR 199 Cb 0.05 -0.04 -0.03 0.00 0.38 0.00 0.00 41.96 42.32 3jzi s TYR 199 CO 0.11 -0.64 -0.06 1.41 -1.52 0.00 0.00 175.55 174.85 3jzi s MET 200 N -3.91 2.68 0.01 -3.49 -2.45 -1.26 -0.96 119.30 109.92 3jzi s MET 200 Ca 0.11 -0.61 -0.07 0.00 -1.25 0.00 0.00 55.69 53.87 3jzi s MET 200 Cb 0.04 -2.57 -0.00 0.00 1.25 0.00 0.00 34.83 33.55 3jzi s MET 200 CO -0.06 0.64 0.12 -2.00 1.05 0.00 0.00 175.02 174.77 3jzi s GLU 201 N -1.07 0.49 0.07 4.11 2.12 -0.36 0.04 118.70 124.09 3jzi s GLU 201 Ca 0.14 -0.46 -0.31 0.00 0.36 0.00 0.00 54.97 54.70 3jzi s GLU 201 Cb -0.11 0.20 -0.07 0.00 0.26 0.00 0.00 34.13 34.40 3jzi s GLU 201 CO 0.04 -0.12 1.47 0.21 -0.54 0.00 0.00 175.26 176.32 3jzi s LYS 202 N -1.55 4.27 -0.46 4.30 2.20 -0.25 0.19 119.74 128.44 3jzi s LYS 202 Ca -0.14 2.12 -0.26 0.00 -0.36 0.00 0.00 55.97 57.33 3jzi s LYS 202 Cb -0.07 -3.43 0.03 0.00 -1.51 0.00 0.00 37.83 32.85 3jzi s LYS 202 CO 0.01 -0.57 0.98 -0.47 -0.36 0.00 0.00 175.35 174.94 3jzi s TYR 203 N 1.89 2.91 -0.04 4.03 6.14 -0.84 -4.81 117.35 126.64 3jzi s TYR 203 Ca 0.67 0.51 -0.30 0.00 0.64 0.00 0.00 57.07 58.59 3jzi s TYR 203 Cb -0.36 -4.06 -0.03 0.00 0.42 0.00 0.00 41.96 37.93 3jzi s TYR 203 CO 0.29 -1.12 1.04 -0.51 0.64 0.00 0.00 175.55 175.90 3jzi s LEU 204 N 3.91 4.31 0.00 6.97 1.43 -1.26 -4.64 118.68 129.41 3jzi s LEU 204 Ca 0.40 1.67 -0.24 0.00 -1.03 0.00 0.00 54.13 54.93 3jzi s LEU 204 Cb -0.09 -3.56 -0.14 0.00 0.03 0.00 0.00 46.19 42.42 3jzi s LEU 204 CO 0.27 -0.39 1.06 -0.33 0.23 0.00 0.00 176.35 177.18 3jzi h GLU 205 N 6.99 -0.67 -1.73 1.70 4.39 -1.97 -3.39 114.58 119.90 3jzi h GLU 205 Ca -0.36 0.05 -0.62 0.00 0.34 0.00 0.00 59.36 58.77 3jzi h GLU 205 Cb 1.18 0.15 -0.40 0.00 -0.10 0.00 0.00 28.75 29.59 3jzi h GLU 205 CO 0.81 -0.38 -0.47 -1.71 -1.16 0.00 0.00 179.01 176.11 3jzi n ASN 206 N -5.26 5.06 -4.92 1.42 5.15 -1.26 -4.97 115.26 110.47 3jzi n ASN 206 Ca -0.10 -3.73 -0.26 0.00 -0.60 0.00 0.00 54.58 49.90 3jzi n ASN 206 Cb 0.31 -0.56 -0.01 0.00 -0.53 0.00 0.00 39.78 38.99 3jzi n ASN 206 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 3jzi s PRO 207 N -3.61 3.52 0.08 1.20 0.04 -1.26 -4.79 135.00 130.18 3jzi s PRO 207 Ca 0.48 -0.09 0.03 0.00 0.04 0.00 0.00 61.00 61.46 3jzi s PRO 207 Cb 0.38 -2.54 -0.04 0.00 0.04 0.00 0.00 34.50 32.34 3jzi s PRO 207 CO -0.20 0.00 0.10 1.03 0.04 0.00 0.00 177.00 177.97 3jzi s ARG 208 N -4.45 2.95 -0.45 4.56 0.52 0.67 -1.48 118.95 121.28 3jzi s ARG 208 Ca 0.43 -0.67 -0.18 0.00 -0.52 0.00 0.00 55.73 54.79 3jzi s ARG 208 Cb -0.10 -2.76 0.03 0.00 0.52 0.00 0.00 34.95 32.65 3jzi s ARG 208 CO 0.39 0.57 0.53 -1.58 0.02 0.00 0.00 175.30 175.22 3jzi s HIS 209 N -1.43 3.12 -0.10 -0.53 5.65 -1.26 -0.42 115.29 120.33 3jzi s HIS 209 Ca 0.30 -0.39 0.03 0.00 0.25 0.00 0.00 55.06 55.25 3jzi s HIS 209 Cb -0.12 -3.17 0.01 0.00 -1.18 0.00 0.00 32.58 28.11 3jzi s HIS 209 CO 0.23 -0.83 -0.20 0.08 -0.65 0.00 0.00 174.74 173.37 3jzi s VAL 210 N 2.38 1.80 0.07 0.89 1.01 -0.95 -1.04 120.40 124.56 3jzi s VAL 210 Ca 0.15 -0.86 0.06 0.00 0.00 0.00 0.00 61.98 61.32 3jzi s VAL 210 Cb -0.17 -1.58 -0.03 0.00 0.00 0.00 0.00 36.38 34.59 3jzi s VAL 210 CO 0.14 0.50 -0.15 -1.83 0.00 0.00 0.00 175.10 173.76 3jzi s GLU 211 N 0.55 0.91 -0.18 2.72 -1.05 -0.26 -1.05 118.70 120.34 3jzi s GLU 211 Ca -0.15 -0.95 -0.03 0.00 -0.15 0.00 0.00 54.97 53.69 3jzi s GLU 211 Cb -0.17 -0.96 -0.02 0.00 -0.44 0.00 0.00 34.13 32.54 3jzi s GLU 211 CO 0.05 0.22 -0.04 0.42 0.95 0.00 0.00 175.26 176.86 3jzi s ILE 212 N -1.15 3.64 -0.05 1.83 -1.09 0.15 -0.78 121.20 123.74 3jzi s ILE 212 Ca 0.00 -0.43 -0.26 0.00 -2.23 0.00 0.00 60.65 57.73 3jzi s ILE 212 Cb -0.09 -2.61 -0.03 0.00 -1.58 0.00 0.00 42.46 38.14 3jzi s ILE 212 CO 0.02 0.46 0.81 -1.58 -1.23 0.00 0.00 174.94 173.42 3jzi s GLN 213 N 0.80 4.46 0.24 2.79 2.00 -1.12 -1.54 119.66 127.29 3jzi s GLN 213 Ca -0.01 1.07 0.09 0.00 -2.00 0.00 0.00 55.36 54.51 3jzi s GLN 213 Cb -0.15 -3.46 -0.05 0.00 0.80 0.00 0.00 33.01 30.15 3jzi s GLN 213 CO 0.02 -0.01 -0.16 0.14 -0.50 0.00 0.00 175.29 174.77 3jzi s VAL 214 N 1.00 2.05 -0.03 1.34 -7.23 -0.18 -0.31 120.40 117.04 3jzi s VAL 214 Ca 0.42 -2.29 -0.01 0.00 -1.81 0.00 0.00 61.98 58.29 3jzi s VAL 214 Cb -0.19 -2.17 0.03 0.00 0.56 0.00 0.00 36.38 34.62 3jzi s VAL 214 CO 0.21 -0.50 0.05 -0.76 -0.31 0.00 0.00 175.10 173.78 3jzi s LEU 215 N -3.40 0.54 -0.03 1.32 1.43 -0.64 -2.32 118.68 115.59 3jzi s LEU 215 Ca 0.26 0.07 0.01 0.00 -1.03 0.00 0.00 54.13 53.44 3jzi s LEU 215 Cb -0.02 -0.10 0.01 0.00 0.03 0.00 0.00 46.19 46.11 3jzi s LEU 215 CO 0.10 -0.20 -0.03 0.00 0.23 0.00 0.00 176.35 176.45 3jzi s ALA 216 N 1.70 0.48 -0.78 4.21 0.00 -0.14 -0.62 121.76 126.61 3jzi s ALA 216 Ca -0.01 -0.05 0.27 0.00 0.00 0.00 0.00 51.96 52.17 3jzi s ALA 216 Cb -0.12 -0.28 0.90 0.00 0.00 0.00 0.00 23.12 23.62 3jzi s ALA 216 CO -0.03 0.02 1.80 -0.40 0.00 0.00 0.00 175.76 177.15 3jzi n ASP 217 N 3.67 0.64 -0.18 0.00 3.85 -0.93 0.13 116.55 123.73 3jzi n ASP 217 Ca -0.22 0.56 -0.02 0.00 -0.71 0.00 0.00 54.79 54.40 3jzi n ASP 217 Cb 0.53 -0.73 -0.01 0.00 -1.35 0.00 0.00 41.12 39.56 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 1.31 0.57 0.00 6.12 0.00 -1.22 -4.78 105.19 107.19 3jzi n GLY 218 Ca 0.06 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.67 1.05 0.00 1.61 6.02 -1.26 -4.99 117.38 117.14 3jzi n GLN 219 Ca -0.02 -1.00 0.00 0.00 -0.01 0.00 0.00 57.00 55.97 3jzi n GLN 219 Cb 0.11 -0.99 0.00 0.00 1.02 0.00 0.00 30.24 30.38 3jzi n GLN 219 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3jzi n GLY 220 N -0.25 0.87 3.74 1.08 0.00 -1.26 -5.11 105.19 104.25 3jzi n GLY 220 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 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 -1.87 5.87 -0.12 1.61 0.01 -1.26 -4.95 114.94 114.23 3jzi s ASN 221 Ca 0.00 0.24 -0.06 0.00 -0.71 0.00 0.00 52.86 52.34 3jzi s ASN 221 Cb 0.00 -1.91 0.05 0.00 0.41 0.00 0.00 41.25 39.80 3jzi s ASN 221 CO 0.00 0.30 0.28 0.00 -1.51 0.00 0.00 177.10 176.17 3jzi s ALA 222 N -0.37 -0.66 0.16 0.60 0.00 -1.26 -2.19 121.76 118.04 3jzi s ALA 222 Ca 0.10 1.10 0.09 0.00 0.00 0.00 0.00 51.96 53.25 3jzi s ALA 222 Cb -0.12 -0.75 -0.04 0.00 0.00 0.00 0.00 23.12 22.21 3jzi s ALA 222 CO 0.02 -0.27 -0.20 0.96 0.00 0.00 0.00 175.76 176.26 3jzi s ILE 223 N 1.45 1.94 -0.07 0.00 -4.36 0.21 -4.87 121.20 115.50 3jzi s ILE 223 Ca -0.08 -1.89 0.01 0.00 -0.26 0.00 0.00 60.65 58.43 3jzi s ILE 223 Cb -0.10 -1.87 -0.03 0.00 1.25 0.00 0.00 42.46 41.71 3jzi s ILE 223 CO -0.09 -0.22 -0.07 -0.72 0.24 0.00 0.00 174.94 174.07 3jzi s TYR 224 N -1.81 2.92 -0.61 1.37 1.13 -1.26 -1.62 117.35 117.47 3jzi s TYR 224 Ca 0.15 -0.02 0.06 0.00 -1.41 0.00 0.00 57.07 55.86 3jzi s TYR 224 Cb -0.07 -1.72 0.27 0.00 -1.10 0.00 0.00 41.96 39.34 3jzi s TYR 224 CO 0.07 0.30 0.78 1.28 -2.51 0.00 0.00 175.55 175.46 3jzi n LEU 225 N 2.31 3.69 0.00 -3.49 4.32 0.57 -4.98 117.00 119.43 3jzi n LEU 225 Ca -0.18 -5.45 0.00 0.00 -0.02 0.00 0.00 56.01 50.36 3jzi n LEU 225 Cb 0.53 -0.56 0.00 0.00 -1.62 0.00 0.00 43.42 41.77 3jzi n LEU 225 CO 0.27 2.13 0.00 0.00 -1.22 0.00 0.00 177.39 178.57 3jzi n ALA 226 N 0.64 0.00 -2.51 -1.18 0.00 -1.26 -4.41 120.51 111.79 3jzi n ALA 226 Ca 0.30 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.50 3jzi n ALA 226 Cb 0.42 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.76 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 1.76 -0.00 0.00 1.03 -1.26 -2.80 118.70 117.43 3jzi s GLU 227 Ca 0.00 -2.00 0.02 0.00 0.03 0.00 0.00 54.97 53.03 3jzi s GLU 227 Cb 0.00 -1.07 -0.01 0.00 -0.80 0.00 0.00 34.13 32.25 3jzi s GLU 227 CO 0.00 -0.17 -0.08 1.03 -1.33 0.00 0.00 175.26 174.71 3jzi s ARG 228 N -3.84 0.60 -0.30 -4.83 0.52 0.04 -4.12 118.95 107.03 3jzi s ARG 228 Ca 0.34 -0.28 -0.10 0.00 -0.52 0.00 0.00 55.73 55.17 3jzi s ARG 228 Cb 0.09 -0.58 -0.02 0.00 0.52 0.00 0.00 34.95 34.95 3jzi s ARG 228 CO 0.16 0.16 0.17 0.34 0.02 0.00 0.00 175.30 176.15 3jzi s ASP 229 N -0.21 5.72 -0.28 0.23 3.68 0.49 -1.10 116.67 125.20 3jzi s ASP 229 Ca 0.03 -0.32 0.08 0.00 2.13 0.00 0.00 52.55 54.46 3jzi s ASP 229 Cb -0.03 -2.05 0.45 0.00 -1.45 0.00 0.00 42.92 39.84 3jzi s ASP 229 CO -0.00 -0.14 1.26 0.00 0.13 0.00 0.00 175.17 176.42 3jzi h SER 231 N 1.66 0.22 -1.72 0.00 0.02 -1.77 -3.41 113.55 108.55 3jzi h SER 231 Ca 0.24 -0.08 -0.46 0.00 -0.84 0.00 0.00 61.79 60.66 3jzi h SER 231 Cb 1.34 -0.06 -0.03 0.00 0.14 0.00 0.00 62.40 63.78 3jzi h SER 231 CO 0.50 0.53 1.25 -0.04 -1.14 0.00 0.00 176.83 177.93 3jzi s MET 232 N -4.34 2.58 0.08 3.45 -1.94 -1.26 -4.17 119.30 113.70 3jzi s MET 232 Ca -0.05 0.48 0.03 0.00 -1.71 0.00 0.00 55.69 54.45 3jzi s MET 232 Cb 0.14 -4.52 -0.03 0.00 2.01 0.00 0.00 34.83 32.43 3jzi s MET 232 CO 0.75 -2.89 -0.09 -0.65 -0.01 0.00 0.00 175.02 172.13 3jzi s GLN 233 N 7.12 0.77 -0.07 2.03 -0.21 -1.26 -0.91 119.66 127.12 3jzi s GLN 233 Ca 0.69 -1.10 -0.03 0.00 0.02 0.00 0.00 55.36 54.94 3jzi s GLN 233 Cb -0.12 -0.41 0.04 0.00 1.00 0.00 0.00 33.01 33.52 3jzi s GLN 233 CO 0.17 0.05 0.16 1.03 -2.12 0.00 0.00 175.29 174.58 3jzi s ARG 234 N -2.73 0.08 -1.49 2.91 1.81 -0.64 -4.17 118.95 114.72 3jzi s ARG 234 Ca 0.03 0.45 -0.11 0.00 -1.72 0.00 0.00 55.73 54.38 3jzi s ARG 234 Cb -0.03 -0.21 0.07 0.00 -0.45 0.00 0.00 34.95 34.33 3jzi s ARG 234 CO -0.01 -0.21 0.89 0.54 -0.68 0.00 0.00 175.30 175.83 3jzi n ARG 235 N 4.60 -5.19 -2.79 3.54 1.74 -1.26 -1.64 116.66 115.67 3jzi n ARG 235 Ca -0.19 0.58 -0.21 0.00 -0.77 0.00 0.00 57.85 57.27 3jzi n ARG 235 Cb 0.51 -5.36 0.01 0.00 -1.02 0.00 0.00 32.46 26.60 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 -4.58 -1.57 -4.18 -1.55 8.25 -1.26 -4.97 115.22 105.36 3jzi n HIS 236 Ca -0.04 0.28 -0.28 0.00 -0.26 0.00 0.00 57.72 57.41 3jzi n HIS 236 Cb 0.56 -3.94 -0.17 0.00 1.12 0.00 0.00 29.99 27.57 3jzi n HIS 236 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 3jzi s GLN 237 N -5.44 2.05 0.36 -0.41 2.00 -0.65 -4.33 119.66 113.23 3jzi s GLN 237 Ca 0.18 -0.48 -0.28 0.00 -2.00 0.00 0.00 55.36 52.78 3jzi s GLN 237 Cb -0.08 -1.86 -0.11 0.00 0.80 0.00 0.00 33.01 31.76 3jzi s GLN 237 CO 0.22 -0.17 1.48 0.15 -0.50 0.00 0.00 175.29 176.47 3jzi s LYS 238 N 1.31 4.14 -0.05 1.67 1.02 -1.26 -1.62 119.74 124.95 3jzi s LYS 238 Ca -0.00 2.53 -0.02 0.00 0.02 0.00 0.00 55.97 58.49 3jzi s LYS 238 Cb -0.14 -2.99 -0.02 0.00 -0.52 0.00 0.00 37.83 34.16 3jzi s LYS 238 CO -0.06 -0.50 -0.06 0.28 -0.92 0.00 0.00 175.35 174.08 3jzi n VAL 239 N 0.74 0.29 -4.80 3.17 0.31 -0.09 -4.91 118.33 113.04 3jzi n VAL 239 Ca 0.02 -0.08 -0.25 0.00 -0.01 0.00 0.00 64.34 64.02 3jzi n VAL 239 Cb 0.39 -1.40 -0.16 0.00 -0.91 0.00 0.00 33.84 31.77 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 -2.10 1.35 0.08 2.52 1.01 -1.19 -2.23 120.40 119.84 3jzi s VAL 240 Ca -0.07 -0.71 0.05 0.00 0.00 0.00 0.00 61.98 61.26 3jzi s VAL 240 Cb 0.03 -1.14 -0.03 0.00 0.00 0.00 0.00 36.38 35.23 3jzi s VAL 240 CO 0.10 0.39 -0.14 -1.61 0.00 0.00 0.00 175.10 173.83 3jzi s GLU 241 N -0.20 0.85 0.04 2.72 8.01 -0.59 -4.15 118.70 125.38 3jzi s GLU 241 Ca 0.02 -1.00 -0.10 0.00 0.01 0.00 0.00 54.97 53.90 3jzi s GLU 241 Cb -0.09 -0.85 0.01 0.00 -4.31 0.00 0.00 34.13 28.89 3jzi s GLU 241 CO 0.00 0.19 0.20 -1.83 0.01 0.00 0.00 175.26 173.83 3jzi s GLU 242 N -1.88 0.69 -0.08 1.61 -1.05 -0.38 0.00 118.70 117.62 3jzi s GLU 242 Ca -0.00 -0.60 -0.06 0.00 -0.15 0.00 0.00 54.97 54.16 3jzi s GLU 242 Cb -0.09 0.29 0.03 0.00 -0.44 0.00 0.00 34.13 33.91 3jzi s GLU 242 CO 0.02 -0.20 0.20 0.00 0.95 0.00 0.00 175.26 176.23 3jzi s ALA 243 N -2.49 -0.46 1.10 -0.84 0.00 -0.47 -0.38 121.76 118.23 3jzi s ALA 243 Ca -0.06 0.67 -0.16 0.00 0.00 0.00 0.00 51.96 52.41 3jzi s ALA 243 Cb -0.01 -0.41 0.24 0.00 0.00 0.00 0.00 23.12 22.93 3jzi s ALA 243 CO -0.03 -0.13 1.13 -1.25 0.00 0.00 0.00 175.76 175.48 3jzi s PRO 244 N 0.56 -0.38 0.02 0.00 0.04 -1.26 -0.54 135.00 133.44 3jzi s PRO 244 Ca -0.04 0.09 -0.30 0.00 0.04 0.00 0.00 61.00 60.79 3jzi s PRO 244 Cb -0.05 -1.68 -0.04 0.00 0.04 0.00 0.00 34.50 32.77 3jzi s PRO 244 CO -0.03 -3.18 0.96 0.00 0.04 0.00 0.00 177.00 174.79 3jzi s ALA 245 N -3.11 3.19 0.45 8.56 0.00 -1.26 -4.71 121.76 124.88 3jzi s ALA 245 Ca 0.69 0.53 -0.25 0.00 0.00 0.00 0.00 51.96 52.93 3jzi s ALA 245 Cb -0.12 -3.31 -0.08 0.00 0.00 0.00 0.00 23.12 19.61 3jzi s ALA 245 CO 0.56 -0.18 1.42 -2.14 0.00 0.00 0.00 175.76 175.41 3jzi s PRO 246 N 0.78 3.70 0.00 0.00 0.02 -1.26 -2.73 135.00 135.51 3jzi s PRO 246 Ca 0.50 2.39 0.00 0.00 0.02 0.00 0.00 61.00 63.91 3jzi s PRO 246 Cb -0.21 -2.66 0.00 0.00 0.02 0.00 0.00 34.50 31.65 3jzi s PRO 246 CO 0.28 -0.80 0.00 0.41 -0.33 0.00 0.00 177.00 176.56 3jzi n GLY 247 N 0.59 2.12 3.64 0.52 0.00 -1.26 -4.80 105.19 106.00 3jzi n GLY 247 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.86 4.77 0.62 -0.61 -1.09 -1.10 -5.05 121.20 115.88 3jzi s ILE 248 Ca 0.00 1.63 -0.10 0.00 -2.23 0.00 0.00 60.65 59.95 3jzi s ILE 248 Cb 0.00 -4.18 -0.02 0.00 -1.58 0.00 0.00 42.46 36.67 3jzi s ILE 248 CO 0.00 -0.15 1.00 0.42 -1.23 0.00 0.00 174.94 174.98 3jzi s THR 249 N 3.00 4.35 0.52 2.92 -4.23 -1.26 -4.89 115.64 116.04 3jzi s THR 249 Ca 0.37 0.62 0.17 0.00 -1.18 0.00 0.00 61.69 61.67 3jzi s THR 249 Cb -0.15 -3.74 0.29 0.00 1.34 0.00 0.00 72.50 70.24 3jzi s THR 249 CO 0.08 -0.93 2.12 -0.65 -0.54 0.00 0.00 174.62 174.71 3jzi h PRO 250 N -0.31 0.03 -0.32 3.99 0.11 -1.99 -0.96 132.00 132.54 3jzi h PRO 250 Ca -0.45 -0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.54 3jzi h PRO 250 Cb 1.21 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 3jzi h PRO 250 CO 0.62 0.02 -0.29 0.93 -0.21 0.00 0.00 178.00 179.07 3jzi h GLU 251 N 0.03 0.76 -0.41 1.05 3.07 -1.99 -1.38 114.58 115.70 3jzi h GLU 251 Ca 0.05 -0.39 -0.14 0.00 -0.50 0.00 0.00 59.36 58.38 3jzi h GLU 251 Cb 0.17 0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.08 3jzi h GLU 251 CO -0.00 1.01 -0.29 -0.07 -1.40 0.00 0.00 179.01 178.25 3jzi h LEU 252 N 0.52 0.93 -0.03 1.33 3.38 -1.74 -1.94 115.31 117.76 3jzi h LEU 252 Ca 0.05 -0.38 0.00 0.00 0.09 0.00 0.00 57.88 57.64 3jzi h LEU 252 Cb 0.86 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 41.35 3jzi h LEU 252 CO 0.07 1.15 0.02 -0.09 0.09 0.00 0.00 178.44 179.68 3jzi h ARG 253 N 0.75 0.04 -0.57 1.13 2.43 -1.15 -2.42 114.38 114.58 3jzi h ARG 253 Ca 0.08 -0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.25 3jzi h ARG 253 Cb 0.86 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.37 3jzi h ARG 253 CO 0.08 0.03 0.35 -0.09 -1.51 0.00 0.00 179.97 178.83 3jzi h ARG 254 N 0.03 0.77 0.89 0.20 2.43 -1.24 -0.54 114.38 116.92 3jzi h ARG 254 Ca 0.01 -0.07 -0.04 0.00 -0.81 0.00 0.00 59.98 59.07 3jzi h ARG 254 Cb 0.01 -0.16 0.01 0.00 -0.42 0.00 0.00 29.97 29.40 3jzi h ARG 254 CO -0.00 0.55 -0.46 -0.92 -1.51 0.00 0.00 179.97 177.62 3jzi h TYR 255 N 0.77 -1.21 -0.44 2.20 5.03 -1.21 -2.16 116.97 119.94 3jzi h TYR 255 Ca 0.20 -0.02 -0.12 0.00 2.58 0.00 0.00 58.73 61.38 3jzi h TYR 255 Cb -0.03 0.41 -0.02 0.00 1.55 0.00 0.00 36.73 38.65 3jzi h TYR 255 CO -0.02 -0.73 -0.18 0.97 -1.32 0.00 0.00 178.16 176.87 3jzi h ILE 256 N -1.24 1.27 0.30 1.81 6.09 -1.47 -3.13 117.51 121.13 3jzi h ILE 256 Ca -0.12 -1.31 -0.01 0.00 -1.37 0.00 0.00 64.86 62.05 3jzi h ILE 256 Cb 0.97 1.12 0.00 0.00 0.47 0.00 0.00 36.82 39.38 3jzi h ILE 256 CO 0.18 0.45 -0.14 1.23 -3.07 0.00 0.00 178.15 176.79 3jzi h GLY 257 N 0.95 -0.41 0.73 8.18 0.00 -1.10 -1.61 103.07 109.81 3jzi h GLY 257 Ca 0.11 0.15 0.08 0.00 0.00 0.00 0.00 47.33 47.67 3jzi h GLY 257 CO 0.05 -0.15 0.63 0.83 0.00 0.00 0.00 176.54 177.90 3jzi h GLU 258 N -0.41 1.07 -0.71 4.80 5.08 -1.47 0.12 114.58 123.06 3jzi h GLU 258 Ca -0.04 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 58.20 3jzi h GLU 258 Cb 0.31 -0.24 -0.03 0.00 0.50 0.00 0.00 28.75 29.29 3jzi h GLU 258 CO 0.07 0.71 0.22 0.00 -1.00 0.00 0.00 179.01 179.00 3jzi h ARG 259 N 1.10 1.10 -0.42 2.33 3.08 -1.45 -0.46 114.38 119.66 3jzi h ARG 259 Ca 0.43 -0.24 -0.10 0.00 0.07 0.00 0.00 59.98 60.14 3jzi h ARG 259 Cb 0.24 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 3jzi h ARG 259 CO -0.18 0.95 -0.12 0.00 -1.07 0.00 0.00 179.97 179.55 3jzi h ALA 261 N 0.85 0.56 -0.57 0.00 0.00 -0.61 -2.10 119.26 117.38 3jzi h ALA 261 Ca 0.10 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 3jzi h ALA 261 Cb 0.66 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 3jzi h ALA 261 CO 0.05 0.10 0.20 -0.22 0.00 0.00 0.00 179.25 179.37 3jzi h LYS 262 N 0.57 0.88 -0.64 0.00 3.64 -1.02 -2.67 116.57 117.33 3jzi h LYS 262 Ca 0.15 -0.18 0.04 0.00 -1.27 0.00 0.00 60.65 59.39 3jzi h LYS 262 Cb 0.08 -0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 31.73 3jzi h LYS 262 CO -0.02 0.78 0.42 0.00 -2.27 0.00 0.00 179.45 178.36 3jzi h ALA 263 N 1.06 1.68 -0.34 5.00 0.00 -0.89 -1.85 119.26 123.92 3jzi h ALA 263 Ca 0.19 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 3jzi h ALA 263 Cb 0.26 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 3jzi h ALA 263 CO -0.01 0.24 0.19 0.00 0.00 0.00 0.00 179.25 179.67 3jzi h VAL 265 N 0.43 0.98 0.00 0.00 2.07 -1.37 0.47 116.25 118.83 3jzi h VAL 265 Ca 0.12 -0.13 -0.01 0.00 0.82 0.00 0.00 66.70 67.50 3jzi h VAL 265 Cb 0.06 1.07 -0.00 0.00 -1.52 0.00 0.00 31.29 30.90 3jzi h VAL 265 CO -0.02 0.03 -0.05 0.44 0.02 0.00 0.00 177.57 177.99 3jzi h ASP 266 N -0.13 0.00 -0.02 0.57 3.45 -1.18 -2.12 116.42 116.99 3jzi h ASP 266 Ca -0.01 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.45 3jzi h ASP 266 Cb 0.11 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.88 3jzi h ASP 266 CO 0.01 0.05 -0.15 2.30 -1.57 0.00 0.00 179.24 179.88 3jzi n ILE 267 N -4.01 0.00 -3.32 0.35 -5.35 -0.59 -4.99 119.36 101.45 3jzi n ILE 267 Ca -0.03 -0.42 -0.18 0.00 -0.27 0.00 0.00 62.75 61.85 3jzi n ILE 267 Cb 0.14 1.31 0.07 0.00 -1.74 0.00 0.00 39.64 39.42 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 1.11 -0.23 3.77 3.28 0.00 -0.39 -4.86 105.19 107.87 3jzi n GLY 268 Ca 0.09 0.05 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 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 -3.26 2.76 -0.04 1.61 6.14 0.15 -4.82 117.35 119.89 3jzi s TYR 269 Ca 0.36 1.32 0.02 0.00 0.64 0.00 0.00 57.07 59.40 3jzi s TYR 269 Cb -0.16 -3.82 0.01 0.00 0.42 0.00 0.00 41.96 38.42 3jzi s TYR 269 CO 0.58 -2.42 -0.08 0.50 0.64 0.00 0.00 175.55 174.78 3jzi s ARG 270 N -2.09 1.05 0.95 4.97 3.52 -1.26 -3.44 118.95 122.65 3jzi s ARG 270 Ca 0.54 -0.24 0.00 0.00 -0.13 0.00 0.00 55.73 55.89 3jzi s ARG 270 Cb -0.42 -0.97 0.00 0.00 -1.56 0.00 0.00 34.95 32.00 3jzi s ARG 270 CO 0.56 0.02 0.00 0.41 -0.81 0.00 0.00 175.30 175.47 3jzi n GLY 271 N 3.70 -1.00 3.81 8.12 0.00 0.34 -2.87 105.19 117.29 3jzi n GLY 271 Ca -0.22 -1.65 -0.38 0.00 0.00 0.00 0.00 46.02 43.77 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 3.64 0.19 4.61 0.00 -1.26 -0.97 121.76 126.35 3jzi s ALA 272 Ca 0.00 -0.16 -0.13 0.00 0.00 0.00 0.00 51.96 51.66 3jzi s ALA 272 Cb 0.00 -2.48 0.01 0.00 0.00 0.00 0.00 23.12 20.65 3jzi s ALA 272 CO 0.00 0.38 0.42 0.20 0.00 0.00 0.00 175.76 176.76 3jzi s GLY 273 N -0.78 0.22 -0.03 0.00 0.00 -0.98 -3.47 107.32 102.27 3jzi s GLY 273 Ca 0.25 -0.57 0.01 0.00 0.00 0.00 0.00 44.72 44.40 3jzi s GLY 273 CO 0.14 -0.54 -0.01 -1.59 0.00 0.00 0.00 173.10 171.10 3jzi s THR 274 N -3.93 0.27 -0.38 0.90 2.01 -0.50 -1.01 115.64 113.01 3jzi s THR 274 Ca 0.14 0.03 -0.16 0.00 0.31 0.00 0.00 61.69 62.01 3jzi s THR 274 Cb 0.01 -0.35 0.01 0.00 0.01 0.00 0.00 72.50 72.17 3jzi s THR 274 CO -0.00 0.17 0.37 -0.36 -0.69 0.00 0.00 174.62 174.11 3jzi s PHE 275 N 0.99 3.20 -0.09 4.92 0.40 -0.59 -0.39 117.98 126.41 3jzi s PHE 275 Ca -0.10 -0.26 -0.17 0.00 -0.60 0.00 0.00 56.93 55.80 3jzi s PHE 275 Cb -0.14 -2.73 -0.05 0.00 0.51 0.00 0.00 43.02 40.62 3jzi s PHE 275 CO -0.01 -0.56 0.43 -1.21 0.70 0.00 0.00 175.22 174.57 3jzi s GLU 276 N 1.99 4.21 0.18 0.44 2.02 0.47 -0.67 118.70 127.34 3jzi s GLU 276 Ca 0.10 0.38 0.05 0.00 0.02 0.00 0.00 54.97 55.53 3jzi s GLU 276 Cb -0.17 -3.37 -0.05 0.00 0.10 0.00 0.00 34.13 30.64 3jzi s GLU 276 CO 0.12 0.32 -0.10 -0.06 0.02 0.00 0.00 175.26 175.57 3jzi s PHE 277 N 0.11 1.46 -0.22 1.61 0.40 -0.22 -1.44 117.98 119.69 3jzi s PHE 277 Ca 0.24 -0.73 -0.05 0.00 -0.60 0.00 0.00 56.93 55.79 3jzi s PHE 277 Cb -0.15 -0.74 -0.02 0.00 0.51 0.00 0.00 43.02 42.61 3jzi s PHE 277 CO 0.10 0.15 0.01 -0.51 0.70 0.00 0.00 175.22 175.67 3jzi s LEU 278 N -3.24 3.22 -0.26 -0.37 1.43 -0.02 -2.24 118.68 117.20 3jzi s LEU 278 Ca 0.20 -0.24 -0.05 0.00 -1.03 0.00 0.00 54.13 53.01 3jzi s LEU 278 Cb 0.02 -1.83 0.00 0.00 0.03 0.00 0.00 46.19 44.41 3jzi s LEU 278 CO 0.04 0.02 0.03 0.12 0.23 0.00 0.00 176.35 176.79 3jzi s PHE 279 N 1.24 3.08 -0.12 0.29 2.19 0.44 -1.10 117.98 124.01 3jzi s PHE 279 Ca 0.04 -0.97 -0.07 0.00 0.33 0.00 0.00 56.93 56.26 3jzi s PHE 279 Cb -0.15 -2.18 0.05 0.00 -1.31 0.00 0.00 43.02 39.43 3jzi s PHE 279 CO 0.01 -0.56 0.28 -2.00 1.83 0.00 0.00 175.22 174.79 3jzi s GLU 280 N 1.48 0.26 -1.37 10.12 2.12 -0.75 -0.23 118.70 130.34 3jzi s GLU 280 Ca 0.04 0.56 -0.04 0.00 0.36 0.00 0.00 54.97 55.88 3jzi s GLU 280 Cb -0.16 -0.06 0.02 0.00 0.26 0.00 0.00 34.13 34.20 3jzi s GLU 280 CO 0.00 -0.14 0.82 0.09 -0.54 0.00 0.00 175.26 175.49 3jzi n ASN 281 N 4.02 -2.52 -0.18 -1.70 3.02 -1.26 -2.04 115.26 114.60 3jzi n ASN 281 Ca -0.23 -0.78 -0.02 0.00 -0.03 0.00 0.00 54.58 53.52 3jzi n ASN 281 Cb 0.54 -4.13 -0.01 0.00 -0.61 0.00 0.00 39.78 35.57 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 -1.61 0.41 3.26 7.41 0.00 -1.26 -5.00 105.19 108.39 3jzi n GLY 282 Ca -0.19 -0.08 -0.29 0.00 0.00 0.00 0.00 46.02 45.46 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 -1.55 1.97 -0.05 1.61 2.02 -0.86 -5.14 118.70 116.70 3jzi s GLU 283 Ca 0.00 -0.83 -0.12 0.00 0.02 0.00 0.00 54.97 54.04 3jzi s GLU 283 Cb 0.00 -1.85 -0.05 0.00 0.10 0.00 0.00 34.13 32.33 3jzi s GLU 283 CO 0.00 0.47 0.32 -0.06 0.02 0.00 0.00 175.26 176.01 3jzi s PHE 284 N -0.46 3.66 -0.17 1.61 0.40 -1.26 -1.81 117.98 119.96 3jzi s PHE 284 Ca 0.06 0.82 -0.02 0.00 -0.60 0.00 0.00 56.93 57.19 3jzi s PHE 284 Cb -0.10 -2.20 0.05 0.00 0.51 0.00 0.00 43.02 41.29 3jzi s PHE 284 CO -0.00 0.62 0.02 0.71 0.70 0.00 0.00 175.22 177.28 3jzi s TYR 285 N -0.88 1.01 0.30 0.36 1.51 -0.26 -4.65 117.35 114.74 3jzi s TYR 285 Ca 0.20 -0.75 -0.30 0.00 -1.01 0.00 0.00 57.07 55.22 3jzi s TYR 285 Cb -0.15 -1.01 -0.11 0.00 -0.11 0.00 0.00 41.96 40.58 3jzi s TYR 285 CO 0.10 -0.56 1.56 0.12 -1.11 0.00 0.00 175.55 175.66 3jzi s PHE 286 N 1.86 2.76 -0.04 2.71 2.19 0.99 -0.84 117.98 127.62 3jzi s PHE 286 Ca 0.00 0.87 -0.02 0.00 0.33 0.00 0.00 56.93 58.11 3jzi s PHE 286 Cb -0.16 -4.03 -0.02 0.00 -1.31 0.00 0.00 43.02 37.50 3jzi s PHE 286 CO -0.07 -3.39 -0.04 0.44 1.83 0.00 0.00 175.22 173.98 3jzi n ILE 287 N 1.95 0.20 -3.51 3.12 -5.35 -0.52 -3.25 119.36 111.99 3jzi n ILE 287 Ca 0.07 -0.05 -0.10 0.00 -0.27 0.00 0.00 62.75 62.40 3jzi n ILE 287 Cb 0.38 -1.41 -0.02 0.00 -1.74 0.00 0.00 39.64 36.85 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 -2.07 1.20 -0.15 6.28 -1.05 -1.20 -4.97 118.70 116.74 3jzi s GLU 288 Ca -0.05 -0.49 0.02 0.00 -0.15 0.00 0.00 54.97 54.30 3jzi s GLU 288 Cb 0.02 0.52 0.01 0.00 -0.44 0.00 0.00 34.13 34.24 3jzi s GLU 288 CO 0.07 -0.53 -0.21 1.41 0.95 0.00 0.00 175.26 176.94 3jzi s MET 289 N -3.56 3.03 -0.34 -4.83 -2.45 -1.26 -0.39 119.30 109.50 3jzi s MET 289 Ca 0.04 -0.84 -0.22 0.00 -1.25 0.00 0.00 55.69 53.42 3jzi s MET 289 Cb -0.02 -2.48 0.00 0.00 1.25 0.00 0.00 34.83 33.59 3jzi s MET 289 CO -0.09 -0.05 0.71 -0.80 1.05 0.00 0.00 175.02 175.84 3jzi s ASN 290 N 0.90 6.52 -0.86 1.11 0.01 0.47 -4.85 114.94 118.23 3jzi s ASN 290 Ca -0.05 0.36 -0.04 0.00 -0.71 0.00 0.00 52.86 52.42 3jzi s ASN 290 Cb -0.15 -2.36 0.15 0.00 0.41 0.00 0.00 41.25 39.30 3jzi s ASN 290 CO -0.04 -0.62 2.43 0.35 -1.51 0.00 0.00 177.10 177.71 3jzi n THR 291 N 5.60 4.34 -3.87 1.60 -2.24 -1.26 -1.41 114.28 117.04 3jzi n THR 291 Ca 0.01 -3.98 -0.01 0.00 -2.27 0.00 0.00 64.05 57.79 3jzi n THR 291 Cb 0.48 -1.69 0.02 0.00 -2.10 0.00 0.00 70.33 67.04 3jzi n THR 291 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 3jzi n ARG 292 N 0.83 0.46 -2.32 -0.78 1.85 -1.23 -4.55 116.66 110.92 3jzi n ARG 292 Ca 0.54 -1.12 -0.33 0.00 -1.00 0.00 0.00 57.85 55.94 3jzi n ARG 292 Cb 0.37 1.56 -0.01 0.00 -1.05 0.00 0.00 32.46 33.33 3jzi n ARG 292 CO 0.00 0.00 0.00 -1.50 -0.01 0.00 0.00 177.63 176.12 3jzi s ILE 293 N -2.11 3.78 0.21 8.89 1.10 -1.26 -4.11 121.20 127.69 3jzi s ILE 293 Ca 0.21 0.99 0.06 0.00 -0.51 0.00 0.00 60.65 61.40 3jzi s ILE 293 Cb -0.02 -3.42 -0.04 0.00 0.15 0.00 0.00 42.46 39.14 3jzi s ILE 293 CO 0.03 -0.35 0.21 -1.10 -2.11 0.00 0.00 174.94 171.62 3jzi s GLN 294 N -3.59 3.03 0.19 3.50 -0.21 -1.26 -4.60 119.66 116.71 3jzi s GLN 294 Ca 0.66 -0.92 -0.13 0.00 0.02 0.00 0.00 55.36 54.99 3jzi s GLN 294 Cb -0.16 -2.66 0.20 0.00 1.00 0.00 0.00 33.01 31.38 3jzi s GLN 294 CO 0.27 0.44 1.72 0.28 -2.12 0.00 0.00 175.29 175.89 3jzi h VAL 295 N 1.64 0.73 -0.04 1.09 2.07 -2.00 -2.59 116.25 117.14 3jzi h VAL 295 Ca -0.49 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 66.94 3jzi h VAL 295 Cb 1.22 0.45 0.00 0.00 -1.52 0.00 0.00 31.29 31.44 3jzi h VAL 295 CO 0.62 0.05 0.00 -1.84 0.02 0.00 0.00 177.57 176.42 3jzi n GLU 296 N -5.09 1.12 -0.32 1.57 0.00 -1.26 -4.40 120.64 112.25 3jzi n GLU 296 Ca 0.06 -0.19 0.26 0.00 0.00 0.00 0.00 57.16 57.29 3jzi n GLU 296 Cb 0.24 -1.14 0.57 0.00 0.00 0.00 0.00 31.44 31.11 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 0.33 0.51 -0.59 -1.84 2.07 -1.87 -2.83 115.15 110.93 3jzi h HIS 297 Ca 0.00 0.02 0.10 0.00 -2.85 0.00 0.00 60.37 57.63 3jzi h HIS 297 Cb 0.07 -0.15 -0.03 0.00 2.57 0.00 0.00 27.41 29.87 3jzi h HIS 297 CO 0.03 0.03 0.39 -1.35 -3.07 0.00 0.00 177.93 173.97 3jzi h PRO 298 N 0.29 0.38 -0.03 5.12 0.11 -1.87 -1.89 132.00 134.12 3jzi h PRO 298 Ca 0.59 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 66.66 3jzi h PRO 298 Cb 1.70 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.72 3jzi h PRO 298 CO -0.24 0.25 -0.08 -0.39 -0.21 0.00 0.00 178.00 177.34 3jzi h VAL 299 N 0.40 1.07 -0.02 3.15 -1.51 -1.87 -1.83 116.25 115.63 3jzi h VAL 299 Ca 0.27 -0.33 -0.26 0.00 -1.23 0.00 0.00 66.70 65.15 3jzi h VAL 299 Cb 0.54 1.14 0.02 0.00 -2.13 0.00 0.00 31.29 30.85 3jzi h VAL 299 CO -0.07 0.10 -1.00 0.74 -1.23 0.00 0.00 177.57 176.11 3jzi h THR 300 N 0.04 1.29 -0.54 7.19 2.02 -1.53 -3.19 112.91 118.19 3jzi h THR 300 Ca 0.01 -2.22 0.02 0.00 0.77 0.00 0.00 66.41 64.98 3jzi h THR 300 Cb 0.16 2.32 -0.03 0.00 -1.74 0.00 0.00 68.15 68.86 3jzi h THR 300 CO 0.01 0.69 0.34 -0.33 0.37 0.00 0.00 175.52 176.60 3jzi h GLU 301 N 0.40 0.66 -0.77 6.66 5.08 -1.21 -2.21 114.58 123.20 3jzi h GLU 301 Ca -0.11 -0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.21 3jzi h GLU 301 Cb 1.64 -0.15 -0.04 0.00 0.50 0.00 0.00 28.75 30.71 3jzi h GLU 301 CO 0.19 0.44 0.51 0.52 -1.00 0.00 0.00 179.01 179.67 3jzi h MET 302 N 0.68 1.02 0.00 2.33 2.86 -1.39 0.15 114.93 120.58 3jzi h MET 302 Ca 0.21 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.78 3jzi h MET 302 Cb -0.03 -0.23 0.00 0.00 0.06 0.00 0.00 31.60 31.40 3jzi h MET 302 CO -0.07 0.67 -0.46 -0.84 1.06 0.00 0.00 176.91 177.28 3jzi h ILE 303 N 1.05 0.00 0.00 -1.22 3.07 -1.51 -3.37 117.51 115.53 3jzi h ILE 303 Ca 0.28 -0.97 -0.04 0.00 1.55 0.00 0.00 64.86 65.68 3jzi h ILE 303 Cb -0.12 1.73 -0.01 0.00 -0.27 0.00 0.00 36.82 38.16 3jzi h ILE 303 CO -0.06 0.00 -1.49 0.35 -1.05 0.00 0.00 178.15 175.90 3jzi n THR 304 N -2.86 0.17 -0.90 0.16 -2.24 -0.85 -0.70 114.28 107.06 3jzi n THR 304 Ca 0.02 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.54 3jzi n THR 304 Cb 0.53 -0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.76 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 2.08 0.95 3.68 3.38 0.00 0.52 -4.72 105.19 111.08 3jzi n GLY 305 Ca -0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.56 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 -3.79 4.90 -0.57 1.61 1.01 -1.23 -5.01 120.40 117.33 3jzi s VAL 306 Ca 0.00 1.67 -0.26 0.00 0.00 0.00 0.00 61.98 63.39 3jzi s VAL 306 Cb 0.00 -4.15 0.04 0.00 0.00 0.00 0.00 36.38 32.27 3jzi s VAL 306 CO 0.00 0.07 1.05 -0.62 0.00 0.00 0.00 175.10 175.61 3jzi s ASP 307 N 1.08 6.39 0.33 3.32 3.68 -1.26 -4.26 116.67 125.94 3jzi s ASP 307 Ca 0.40 -0.15 0.06 0.00 2.13 0.00 0.00 52.55 54.99 3jzi s ASP 307 Cb -0.17 -2.49 0.57 0.00 -1.45 0.00 0.00 42.92 39.38 3jzi s ASP 307 CO 0.15 -1.34 1.80 -0.07 0.13 0.00 0.00 175.17 175.84 3jzi h LEU 308 N 11.40 0.34 -0.14 -1.34 3.38 -1.95 -2.59 115.31 124.43 3jzi h LEU 308 Ca -0.26 -0.10 -0.11 0.00 0.09 0.00 0.00 57.88 57.51 3jzi h LEU 308 Cb 1.07 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.73 3jzi h LEU 308 CO 1.13 0.57 -0.33 0.40 0.09 0.00 0.00 178.44 180.30 3jzi h ILE 309 N 0.32 1.37 -0.80 1.22 1.08 -1.97 -2.21 117.51 116.52 3jzi h ILE 309 Ca 0.05 -1.61 0.03 0.00 -0.39 0.00 0.00 64.86 62.95 3jzi h ILE 309 Cb 0.56 2.05 -0.05 0.00 -3.07 0.00 0.00 36.82 36.31 3jzi h ILE 309 CO 0.04 0.48 0.53 0.11 -0.69 0.00 0.00 178.15 178.61 3jzi h LYS 310 N 0.07 0.95 -0.36 2.37 1.57 -1.89 -1.35 116.57 117.93 3jzi h LYS 310 Ca -0.00 -0.06 -0.11 0.00 -1.87 0.00 0.00 60.65 58.61 3jzi h LYS 310 Cb 0.93 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 33.01 3jzi h LYS 310 CO 0.07 0.63 -0.22 0.93 -0.57 0.00 0.00 179.45 180.29 3jzi h GLU 311 N 0.98 0.71 -0.76 3.15 4.39 -1.42 -0.30 114.58 121.34 3jzi h GLU 311 Ca 0.32 -0.28 0.01 0.00 0.34 0.00 0.00 59.36 59.75 3jzi h GLU 311 Cb 0.04 -0.04 -0.04 0.00 -0.10 0.00 0.00 28.75 28.62 3jzi h GLU 311 CO -0.09 0.87 0.50 1.96 -1.16 0.00 0.00 179.01 181.09 3jzi h GLN 312 N 0.62 0.98 -0.44 2.33 4.20 -0.62 -1.09 115.11 121.08 3jzi h GLN 312 Ca 0.09 -0.06 -0.10 0.00 0.06 0.00 0.00 58.65 58.64 3jzi h GLN 312 Cb 0.71 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 28.26 3jzi h GLN 312 CO 0.05 0.65 -0.13 -0.07 -0.67 0.00 0.00 178.83 178.66 3jzi h LEU 313 N 1.01 0.87 -0.39 1.46 3.38 -0.95 -1.23 115.31 119.47 3jzi h LEU 313 Ca 0.28 -0.37 -0.06 0.00 0.09 0.00 0.00 57.88 57.82 3jzi h LEU 313 Cb -0.09 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.40 3jzi h LEU 313 CO -0.07 1.05 0.02 0.03 0.09 0.00 0.00 178.44 179.55 3jzi h ARG 314 N 0.69 0.68 -0.10 1.13 3.08 -0.81 -1.81 114.38 117.24 3jzi h ARG 314 Ca 0.11 -0.21 -0.00 0.00 0.07 0.00 0.00 59.98 59.95 3jzi h ARG 314 Cb 0.68 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.66 3jzi h ARG 314 CO 0.05 0.76 0.05 0.82 -1.07 0.00 0.00 179.97 180.58 3jzi h ILE 315 N 0.51 1.11 -0.19 2.04 2.04 -1.18 -2.01 117.51 119.83 3jzi h ILE 315 Ca 0.11 -0.32 0.03 0.00 1.00 0.00 0.00 64.86 65.69 3jzi h ILE 315 Cb 0.45 1.13 -0.01 0.00 -0.74 0.00 0.00 36.82 37.65 3jzi h ILE 315 CO 0.02 0.10 0.13 0.00 0.00 0.00 0.00 178.15 178.40 3jzi h ALA 316 N 0.93 2.03 0.00 1.87 0.00 -1.14 -0.46 119.26 122.49 3jzi h ALA 316 Ca 0.04 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3jzi h ALA 316 Cb 0.11 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3jzi h ALA 316 CO -0.00 -0.06 0.00 0.00 0.00 0.00 0.00 179.25 179.18 3jzi n ALA 317 N -2.54 1.93 -0.07 0.00 0.00 -0.69 -4.88 120.51 114.26 3jzi n ALA 317 Ca 0.01 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.38 3jzi n ALA 317 Cb 0.18 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.30 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 0.60 0.80 3.72 0.00 0.00 -0.18 -4.88 105.19 105.25 3jzi n GLY 318 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.93 4.58 0.76 1.61 -0.21 -0.79 -5.01 119.66 119.67 3jzi s GLN 319 Ca 0.00 1.58 -0.11 0.00 0.02 0.00 0.00 55.36 56.86 3jzi s GLN 319 Cb 0.00 -3.36 0.05 0.00 1.00 0.00 0.00 33.01 30.70 3jzi s GLN 319 CO 0.00 0.02 1.08 -2.14 -2.12 0.00 0.00 175.29 172.13 3jzi s PRO 320 N 0.34 2.35 0.07 2.91 0.02 -1.26 -4.19 135.00 135.24 3jzi s PRO 320 Ca 0.51 0.99 -0.31 0.00 0.02 0.00 0.00 61.00 62.21 3jzi s PRO 320 Cb -0.26 -1.92 -0.10 0.00 0.02 0.00 0.00 34.50 32.24 3jzi s PRO 320 CO 0.31 -1.52 1.91 1.28 -0.33 0.00 0.00 177.00 178.65 3jzi n LEU 321 N -3.42 4.07 0.05 -5.54 4.77 -1.26 -4.87 117.00 110.81 3jzi n LEU 321 Ca 0.08 0.94 -0.13 0.00 -0.03 0.00 0.00 56.01 56.87 3jzi n LEU 321 Cb 0.54 -1.52 -0.14 0.00 -2.33 0.00 0.00 43.42 39.97 3jzi n LEU 321 CO 0.55 0.18 -0.23 0.77 -1.33 0.00 0.00 177.39 177.32 3jzi h SER 322 N 9.67 0.25 -3.00 -1.43 4.64 -2.02 -3.45 113.55 118.20 3jzi h SER 322 Ca -0.48 -0.33 -0.55 0.00 -0.47 0.00 0.00 61.79 59.96 3jzi h SER 322 Cb 1.24 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 63.23 3jzi h SER 322 CO 0.94 1.28 0.76 -0.63 -0.87 0.00 0.00 176.83 178.31 3jzi s ILE 323 N -2.64 3.96 0.08 0.95 1.01 -1.26 -5.05 121.20 118.26 3jzi s ILE 323 Ca -0.06 1.33 -0.01 0.00 0.00 0.00 0.00 60.65 61.91 3jzi s ILE 323 Cb 0.08 -3.85 -0.04 0.00 0.01 0.00 0.00 42.46 38.65 3jzi s ILE 323 CO 0.84 0.00 0.26 -0.54 0.00 0.00 0.00 174.94 175.50 3jzi s LYS 324 N 2.23 3.49 0.31 2.79 1.02 -1.26 -4.96 119.74 123.36 3jzi s LYS 324 Ca 0.60 -0.34 0.08 0.00 0.02 0.00 0.00 55.97 56.33 3jzi s LYS 324 Cb -0.28 -2.99 0.83 0.00 -0.52 0.00 0.00 37.83 34.87 3jzi s LYS 324 CO 0.25 0.57 1.74 0.37 -0.92 0.00 0.00 175.35 177.36 3jzi h GLN 325 N 3.02 0.60 0.00 1.68 5.75 -1.95 0.77 115.11 124.98 3jzi h GLN 325 Ca -0.45 -0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.01 3jzi h GLN 325 Cb 1.16 -0.14 0.00 0.00 1.07 0.00 0.00 27.48 29.58 3jzi h GLN 325 CO 0.75 0.40 0.00 -0.85 -2.65 0.00 0.00 178.83 176.48 3jzi n GLU 326 N -4.87 0.17 0.00 1.69 0.00 -1.26 -1.85 120.64 114.52 3jzi n GLU 326 Ca 0.25 0.51 0.12 0.00 0.00 0.00 0.00 57.16 58.04 3jzi n GLU 326 Cb 0.69 -1.90 0.15 0.00 0.00 0.00 0.00 31.44 30.38 3jzi n GLU 326 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 3jzi n GLU 327 N -2.23 0.36 -2.95 3.44 1.02 0.26 -4.85 120.64 115.70 3jzi n GLU 327 Ca 0.01 -0.25 -0.43 0.00 -0.02 0.00 0.00 57.16 56.46 3jzi n GLU 327 Cb 0.15 -1.49 -0.05 0.00 -0.02 0.00 0.00 31.44 30.02 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 -2.81 4.64 -0.08 2.62 1.01 -0.77 -4.99 120.40 120.02 3jzi s VAL 328 Ca 0.14 0.48 0.03 0.00 0.00 0.00 0.00 61.98 62.64 3jzi s VAL 328 Cb 0.18 -4.33 0.01 0.00 0.00 0.00 0.00 36.38 32.23 3jzi s VAL 328 CO 0.68 -0.72 -0.18 -1.00 0.00 0.00 0.00 175.10 173.89 3jzi s HIS 329 N 3.33 1.97 -0.21 5.22 3.76 -1.26 -5.05 115.29 123.05 3jzi s HIS 329 Ca 0.31 -0.75 -0.28 0.00 -0.15 0.00 0.00 55.06 54.19 3jzi s HIS 329 Cb -0.12 -1.36 0.00 0.00 1.11 0.00 0.00 32.58 32.22 3jzi s HIS 329 CO 0.23 -0.32 0.99 0.08 -0.85 0.00 0.00 174.74 174.87 3jzi s VAL 330 N 0.43 4.73 -0.06 -0.90 1.01 -1.26 -4.25 120.40 120.10 3jzi s VAL 330 Ca -0.15 1.94 -0.00 0.00 0.00 0.00 0.00 61.98 63.77 3jzi s VAL 330 Cb -0.16 -4.27 0.03 0.00 0.00 0.00 0.00 36.38 31.97 3jzi s VAL 330 CO 0.06 -0.13 -0.02 -0.60 0.00 0.00 0.00 175.10 174.41 3jzi s ARG 331 N 2.92 0.72 2.48 2.72 3.52 0.12 -5.04 118.95 126.39 3jzi s ARG 331 Ca 0.43 0.01 0.00 0.00 -0.13 0.00 0.00 55.73 56.04 3jzi s ARG 331 Cb -0.16 -0.92 0.00 0.00 -1.56 0.00 0.00 34.95 32.31 3jzi s ARG 331 CO 0.08 -0.21 0.00 0.41 -0.81 0.00 0.00 175.30 174.77 3jzi n GLY 332 N 4.67 -0.50 3.11 8.12 0.00 -1.26 -4.35 105.19 114.98 3jzi n GLY 332 Ca -0.15 -1.11 -0.12 0.00 0.00 0.00 0.00 46.02 44.64 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 -0.04 0.00 1.61 2.46 0.45 -4.52 115.29 115.25 3jzi s HIS 333 Ca 0.00 0.07 0.02 0.00 0.47 0.00 0.00 55.06 55.62 3jzi s HIS 333 Cb 0.00 -0.00 -0.01 0.00 -0.13 0.00 0.00 32.58 32.44 3jzi s HIS 333 CO 0.00 -0.25 -0.06 0.00 -2.47 0.00 0.00 174.74 171.96 3jzi s ALA 334 N -0.99 0.52 -0.02 1.58 0.00 0.30 -1.20 121.76 121.95 3jzi s ALA 334 Ca -0.11 -0.34 0.06 0.00 0.00 0.00 0.00 51.96 51.57 3jzi s ALA 334 Cb -0.06 -0.10 -0.01 0.00 0.00 0.00 0.00 23.12 22.94 3jzi s ALA 334 CO 0.01 0.10 -0.20 0.08 0.00 0.00 0.00 175.76 175.76 3jzi s VAL 335 N -0.33 1.58 -0.11 0.00 1.01 -0.25 -1.36 120.40 120.94 3jzi s VAL 335 Ca 0.01 -0.85 0.03 0.00 0.00 0.00 0.00 61.98 61.17 3jzi s VAL 335 Cb -0.03 -1.31 0.01 0.00 0.00 0.00 0.00 36.38 35.04 3jzi s VAL 335 CO -0.00 0.45 -0.22 -0.70 0.00 0.00 0.00 175.10 174.63 3jzi s GLU 336 N -0.42 2.84 -0.20 2.72 2.12 0.10 -0.99 118.70 124.87 3jzi s GLU 336 Ca 0.07 -0.80 -0.05 0.00 0.36 0.00 0.00 54.97 54.55 3jzi s GLU 336 Cb -0.08 -2.22 -0.02 0.00 0.26 0.00 0.00 34.13 32.07 3jzi s GLU 336 CO -0.00 0.09 -0.01 0.00 -0.54 0.00 0.00 175.26 174.79 3jzi s ARG 338 N 1.03 4.66 -0.30 0.00 0.52 -0.95 -0.92 118.95 123.00 3jzi s ARG 338 Ca 0.02 1.56 -0.08 0.00 -0.52 0.00 0.00 55.73 56.71 3jzi s ARG 338 Cb -0.14 -3.33 -0.00 0.00 0.52 0.00 0.00 34.95 31.99 3jzi s ARG 338 CO 0.01 0.17 0.11 0.42 0.02 0.00 0.00 175.30 176.03 3jzi s ILE 339 N -0.14 4.26 0.01 1.52 -1.09 0.15 -4.92 121.20 120.99 3jzi s ILE 339 Ca 0.48 -0.54 0.06 0.00 -2.23 0.00 0.00 60.65 58.42 3jzi s ILE 339 Cb -0.26 -3.17 -0.03 0.00 -1.58 0.00 0.00 42.46 37.42 3jzi s ILE 339 CO 0.32 0.10 -0.17 0.20 -1.23 0.00 0.00 174.94 174.15 3jzi s ASN 340 N 1.56 3.82 -1.16 3.58 -0.87 -1.26 -1.06 114.94 119.54 3jzi s ASN 340 Ca 0.04 -0.37 -0.14 0.00 -1.57 0.00 0.00 52.86 50.82 3jzi s ASN 340 Cb -0.17 -0.66 0.16 0.00 -0.02 0.00 0.00 41.25 40.57 3jzi s ASN 340 CO 0.04 0.28 1.39 0.00 -2.57 0.00 0.00 177.10 176.24 3jzi s ALA 341 N -0.85 3.91 0.16 0.60 0.00 0.60 -2.76 121.76 123.41 3jzi s ALA 341 Ca 0.14 -3.27 -0.24 0.00 0.00 0.00 0.00 51.96 48.59 3jzi s ALA 341 Cb -0.10 -4.11 0.06 0.00 0.00 0.00 0.00 23.12 18.97 3jzi s ALA 341 CO 0.04 -2.80 0.69 -1.83 0.00 0.00 0.00 175.76 171.86 3jzi s GLU 342 N 1.74 1.31 -0.23 0.00 -1.05 -0.68 -0.24 118.70 119.55 3jzi s GLU 342 Ca 0.41 -0.57 -0.19 0.00 -0.15 0.00 0.00 54.97 54.48 3jzi s GLU 342 Cb -0.03 0.55 -0.03 0.00 -0.44 0.00 0.00 34.13 34.18 3jzi s GLU 342 CO -0.01 -0.58 0.54 0.34 0.95 0.00 0.00 175.26 176.50 3jzi s ASP 343 N -2.76 6.53 0.21 0.83 -1.08 0.10 -2.89 116.67 117.62 3jzi s ASP 343 Ca 0.04 0.64 -0.05 0.00 -0.52 0.00 0.00 52.55 52.66 3jzi s ASP 343 Cb -0.02 -2.30 0.19 0.00 -1.46 0.00 0.00 42.92 39.33 3jzi s ASP 343 CO -0.07 -0.25 1.66 1.55 0.52 0.00 0.00 175.17 178.57 3jzi h PRO 344 N 7.72 0.85 -0.25 4.34 0.13 -1.90 0.13 132.00 143.02 3jzi h PRO 344 Ca -0.31 -0.30 0.00 0.00 -0.87 0.00 0.00 66.00 64.52 3jzi h PRO 344 Cb 1.14 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 32.20 3jzi h PRO 344 CO 0.74 0.93 0.16 -0.91 -0.23 0.00 0.00 178.00 178.69 3jzi h ASN 345 N 0.76 0.28 0.00 1.44 2.35 -1.96 -3.28 115.58 115.17 3jzi h ASN 345 Ca 0.12 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.87 3jzi h ASN 345 Cb 0.64 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 38.94 3jzi h ASN 345 CO 0.04 0.20 -1.44 0.35 -1.65 0.00 0.00 177.43 174.93 3jzi n THR 346 N -4.92 0.00 -1.00 2.81 -2.24 -1.23 -4.98 114.28 102.72 3jzi n THR 346 Ca -0.02 -0.25 -0.00 0.00 -2.27 0.00 0.00 64.05 61.50 3jzi n THR 346 Cb 0.03 0.51 -0.00 0.00 -2.10 0.00 0.00 70.33 68.77 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 -1.84 0.00 -2.29 4.78 3.01 0.43 -4.99 117.46 116.56 3jzi n PHE 347 Ca -0.00 0.00 -0.43 0.00 1.01 0.00 0.00 57.45 58.03 3jzi n PHE 347 Cb 0.42 -0.76 -0.02 0.00 -0.01 0.00 0.00 39.48 39.11 3jzi n PHE 347 CO 0.00 0.00 0.00 -1.17 1.01 0.00 0.00 176.76 176.60 3jzi s LEU 348 N -0.03 4.00 0.50 4.37 2.96 -1.22 -4.77 118.68 124.49 3jzi s LEU 348 Ca 0.00 1.56 -0.23 0.00 -0.22 0.00 0.00 54.13 55.23 3jzi s LEU 348 Cb 0.00 -3.54 -0.06 0.00 0.50 0.00 0.00 46.19 43.09 3jzi s LEU 348 CO 0.00 -1.04 1.38 -2.84 -1.32 0.00 0.00 176.35 172.53 3jzi s PRO 349 N 4.14 3.39 -0.62 0.98 0.02 -1.26 -0.72 135.00 140.93 3jzi s PRO 349 Ca 0.62 2.29 0.06 0.00 0.02 0.00 0.00 61.00 63.98 3jzi s PRO 349 Cb -0.22 -2.43 0.28 0.00 0.02 0.00 0.00 34.50 32.15 3jzi s PRO 349 CO 0.23 -1.01 0.83 0.45 -0.33 0.00 0.00 177.00 177.17 3jzi n SER 350 N -0.66 4.06 -4.73 2.53 2.88 0.66 -4.82 113.62 113.53 3jzi n SER 350 Ca 0.08 -3.53 -0.30 0.00 -1.33 0.00 0.00 58.87 53.79 3jzi n SER 350 Cb 0.44 -0.64 0.12 0.00 -0.75 0.00 0.00 64.21 63.38 3jzi n SER 350 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 3jzi s PRO 351 N -2.84 1.59 0.00 -1.46 0.04 -1.26 -4.52 135.00 126.55 3jzi s PRO 351 Ca 0.43 1.01 0.00 0.00 0.04 0.00 0.00 61.00 62.48 3jzi s PRO 351 Cb 0.19 -1.83 0.00 0.00 0.04 0.00 0.00 34.50 32.90 3jzi s PRO 351 CO -0.05 -2.06 0.00 0.41 0.04 0.00 0.00 177.00 175.34 3jzi n GLY 352 N -1.03 2.07 3.72 0.56 0.00 -0.44 -4.94 105.19 105.11 3jzi n GLY 352 Ca 0.08 -1.75 -0.42 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 -1.62 4.48 -0.48 1.61 2.20 -1.26 -0.60 119.74 124.08 3jzi s LYS 353 Ca 0.00 1.70 -0.25 0.00 -0.36 0.00 0.00 55.97 57.06 3jzi s LYS 353 Cb 0.00 -3.35 0.03 0.00 -1.51 0.00 0.00 37.83 33.00 3jzi s LYS 353 CO 0.00 -0.16 0.90 0.42 -0.36 0.00 0.00 175.35 176.15 3jzi s ILE 354 N 0.81 4.49 -0.11 5.43 1.01 0.34 -4.27 121.20 128.91 3jzi s ILE 354 Ca 0.56 0.57 0.14 0.00 0.00 0.00 0.00 60.65 61.92 3jzi s ILE 354 Cb -0.28 -4.44 -0.04 0.00 0.01 0.00 0.00 42.46 37.72 3jzi s ILE 354 CO 0.30 -0.88 1.23 0.71 0.00 0.00 0.00 174.94 176.30 3jzi h THR 355 N 6.05 0.87 -3.11 2.92 1.35 -1.35 0.31 112.91 119.95 3jzi h THR 355 Ca -0.25 -2.32 -0.21 0.00 -0.55 0.00 0.00 66.41 63.07 3jzi h THR 355 Cb 1.08 2.37 -0.31 0.00 -1.73 0.00 0.00 68.15 69.56 3jzi h THR 355 CO 1.03 0.50 -0.53 -0.60 -0.25 0.00 0.00 175.52 175.66 3jzi s ARG 356 N -2.91 0.16 -0.01 4.72 3.52 -1.23 -4.65 118.95 118.55 3jzi s ARG 356 Ca 0.01 0.47 0.01 0.00 -0.13 0.00 0.00 55.73 56.10 3jzi s ARG 356 Cb 0.08 -0.14 -0.00 0.00 -1.56 0.00 0.00 34.95 33.33 3jzi s ARG 356 CO 0.78 -0.17 -0.04 0.12 -0.81 0.00 0.00 175.30 175.18 3jzi s PHE 357 N 1.26 0.39 -0.21 5.12 2.19 -1.26 -0.85 117.98 124.62 3jzi s PHE 357 Ca -0.09 -0.07 -0.06 0.00 0.33 0.00 0.00 56.93 57.04 3jzi s PHE 357 Cb -0.11 -0.27 0.10 0.00 -1.31 0.00 0.00 43.02 41.43 3jzi s PHE 357 CO -0.08 -0.02 0.40 -1.58 1.83 0.00 0.00 175.22 175.78 3jzi s HIS 358 N 0.02 -0.80 0.17 10.12 2.46 -0.12 -4.78 115.29 122.36 3jzi s HIS 358 Ca 0.00 1.34 -0.20 0.00 0.47 0.00 0.00 55.06 56.67 3jzi s HIS 358 Cb -0.03 0.23 -0.08 0.00 -0.13 0.00 0.00 32.58 32.57 3jzi s HIS 358 CO -0.00 -0.54 0.68 0.00 -2.47 0.00 0.00 174.74 172.41 3jzi s ALA 359 N 2.59 3.48 0.76 1.58 0.00 -1.26 -0.63 121.76 128.28 3jzi s ALA 359 Ca 0.02 0.14 -0.11 0.00 0.00 0.00 0.00 51.96 52.02 3jzi s ALA 359 Cb -0.13 -2.78 0.05 0.00 0.00 0.00 0.00 23.12 20.26 3jzi s ALA 359 CO -0.13 0.35 1.08 -1.25 0.00 0.00 0.00 175.76 175.81 3jzi s PRO 360 N -1.63 2.38 0.04 0.00 0.04 -1.26 -4.87 135.00 129.70 3jzi s PRO 360 Ca 0.38 0.92 0.01 0.00 0.04 0.00 0.00 61.00 62.35 3jzi s PRO 360 Cb -0.18 -1.93 -0.00 0.00 0.04 0.00 0.00 34.50 32.42 3jzi s PRO 360 CO 0.21 -1.48 0.03 0.41 0.04 0.00 0.00 177.00 176.21 3jzi n GLY 361 N -1.72 3.94 0.00 0.56 0.00 -1.26 -4.85 105.19 101.85 3jzi n GLY 361 Ca 0.08 -1.78 0.00 0.00 0.00 0.00 0.00 46.02 44.32 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 0.64 1.53 3.69 -0.02 0.00 -1.26 -4.81 105.19 104.95 3jzi n GLY 362 Ca 0.00 -2.15 -0.42 0.00 0.00 0.00 0.00 46.02 43.46 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 -1.62 2.49 -0.02 1.61 5.36 -1.26 -2.55 117.98 121.99 3jzi s PHE 363 Ca 0.00 0.40 0.00 0.00 -0.96 0.00 0.00 56.93 56.37 3jzi s PHE 363 Cb 0.00 -3.91 0.00 0.00 -0.34 0.00 0.00 43.02 38.77 3jzi s PHE 363 CO 0.00 -3.63 0.00 0.41 -1.46 0.00 0.00 175.22 170.54 3jzi n GLY 364 N 3.94 0.46 3.51 13.12 0.00 -1.26 -4.90 105.19 120.06 3jzi n GLY 364 Ca 0.15 -0.11 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.93 4.64 -0.17 1.61 1.01 -1.06 0.08 120.40 124.59 3jzi s VAL 365 Ca 0.00 -0.06 0.01 0.00 0.00 0.00 0.00 61.98 61.93 3jzi s VAL 365 Cb 0.00 -3.17 0.02 0.00 0.00 0.00 0.00 36.38 33.23 3jzi s VAL 365 CO 0.00 0.33 -0.17 -0.60 0.00 0.00 0.00 175.10 174.67 3jzi s ARG 366 N 1.48 2.62 -0.24 2.72 3.52 0.89 -4.76 118.95 125.18 3jzi s ARG 366 Ca 0.06 -0.75 -0.06 0.00 -0.13 0.00 0.00 55.73 54.84 3jzi s ARG 366 Cb -0.15 -2.40 -0.02 0.00 -1.56 0.00 0.00 34.95 30.82 3jzi s ARG 366 CO 0.05 -0.25 0.04 -0.46 -0.81 0.00 0.00 175.30 173.87 3jzi s TRP 367 N 1.36 3.05 -0.48 5.12 -0.11 -1.26 -0.54 118.94 126.08 3jzi s TRP 367 Ca 0.04 -0.58 0.01 0.00 1.22 0.00 0.00 56.10 56.79 3jzi s TRP 367 Cb -0.14 -2.20 0.13 0.00 -1.50 0.00 0.00 33.47 29.76 3jzi s TRP 367 CO -0.11 -0.42 0.25 -1.21 -4.62 0.00 0.00 176.95 170.83 3jzi s GLU 368 N 1.57 2.02 -0.18 5.86 0.41 -0.10 -5.02 118.70 123.26 3jzi s GLU 368 Ca 0.06 -2.25 -0.28 0.00 -0.41 0.00 0.00 54.97 52.10 3jzi s GLU 368 Cb -0.15 -3.46 0.08 0.00 -1.78 0.00 0.00 34.13 28.82 3jzi s GLU 368 CO 0.02 -1.08 0.75 0.45 -0.49 0.00 0.00 175.26 174.91 3jzi s SER 369 N 0.71 -0.66 0.10 -0.19 0.15 -1.26 -0.59 113.70 111.96 3jzi s SER 369 Ca 0.14 1.05 0.26 0.00 0.70 0.00 0.00 55.95 58.09 3jzi s SER 369 Cb -0.22 0.98 0.63 0.00 -1.71 0.00 0.00 66.02 65.70 3jzi s SER 369 CO -0.04 -0.38 1.55 0.00 1.20 0.00 0.00 173.24 175.57 3jzi n HIS 370 N 1.84 0.47 -1.97 3.44 1.44 -1.26 -4.97 115.22 114.21 3jzi n HIS 370 Ca -0.15 0.14 -0.36 0.00 -2.01 0.00 0.00 57.72 55.33 3jzi n HIS 370 Cb 0.56 -0.63 0.04 0.00 0.12 0.00 0.00 29.99 30.07 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 -3.09 2.51 0.17 0.61 -4.36 -1.26 -4.22 121.20 111.56 3jzi s ILE 371 Ca 0.09 0.33 -0.16 0.00 -0.26 0.00 0.00 60.65 60.66 3jzi s ILE 371 Cb 0.15 -3.14 0.02 0.00 1.25 0.00 0.00 42.46 40.74 3jzi s ILE 371 CO 0.66 -0.06 0.46 -0.72 0.24 0.00 0.00 174.94 175.52 3jzi s TYR 372 N -1.52 -0.07 0.10 1.37 1.13 -1.26 -5.09 117.35 112.01 3jzi s TYR 372 Ca 0.76 -0.27 -0.31 0.00 -1.41 0.00 0.00 57.07 55.84 3jzi s TYR 372 Cb -0.33 0.29 -0.09 0.00 -1.10 0.00 0.00 41.96 40.74 3jzi s TYR 372 CO 0.36 -0.83 1.61 0.00 -2.51 0.00 0.00 175.55 174.18 3jzi s ALA 373 N -3.87 3.71 0.00 9.51 0.00 -1.26 -2.06 121.76 127.78 3jzi s ALA 373 Ca 0.09 1.24 0.00 0.00 0.00 0.00 0.00 51.96 53.29 3jzi s ALA 373 Cb 0.00 -3.67 0.00 0.00 0.00 0.00 0.00 23.12 19.46 3jzi s ALA 373 CO -0.05 -0.99 0.00 0.41 0.00 0.00 0.00 175.76 175.14 3jzi n GLY 374 N 3.90 2.58 3.77 0.00 0.00 0.11 -5.02 105.19 110.52 3jzi n GLY 374 Ca 0.15 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 -2.62 3.18 -0.22 1.61 5.04 -0.88 -4.69 117.35 118.77 3jzi s TYR 375 Ca 0.00 1.48 -0.09 0.00 -2.44 0.00 0.00 57.07 56.03 3jzi s TYR 375 Cb 0.00 -3.58 -0.04 0.00 0.35 0.00 0.00 41.96 38.69 3jzi s TYR 375 CO 0.00 -1.54 0.10 0.99 -1.34 0.00 0.00 175.55 173.76 3jzi s THR 376 N -1.14 4.87 -0.43 4.34 2.01 -1.26 -0.50 115.64 123.53 3jzi s THR 376 Ca 0.48 0.01 -0.29 0.00 0.31 0.00 0.00 61.69 62.20 3jzi s THR 376 Cb -0.38 -3.25 0.02 0.00 0.01 0.00 0.00 72.50 68.91 3jzi s THR 376 CO 0.50 0.38 1.17 -0.69 -0.69 0.00 0.00 174.62 175.29 3jzi s VAL 377 N 0.97 4.23 0.54 3.82 1.01 0.23 -4.90 120.40 126.29 3jzi s VAL 377 Ca 0.05 1.30 -0.20 0.00 0.00 0.00 0.00 61.98 63.13 3jzi s VAL 377 Cb -0.14 -4.50 -0.06 0.00 0.00 0.00 0.00 36.38 31.69 3jzi s VAL 377 CO 0.03 -0.85 1.17 -2.84 0.00 0.00 0.00 175.10 172.62 3jzi s PRO 378 N 4.33 3.34 0.02 2.72 0.02 -1.26 -1.33 135.00 142.84 3jzi s PRO 378 Ca 0.49 1.75 0.23 0.00 0.02 0.00 0.00 61.00 63.49 3jzi s PRO 378 Cb -0.09 -2.10 0.96 0.00 0.02 0.00 0.00 34.50 33.28 3jzi s PRO 378 CO 0.28 -0.89 1.72 -0.35 -0.33 0.00 0.00 177.00 177.44 3jzi n PRO 379 N -1.15 0.02 0.14 5.54 -0.04 -1.26 -3.72 135.00 134.53 3jzi n PRO 379 Ca 0.11 0.13 0.13 0.00 -0.04 0.00 0.00 63.50 63.83 3jzi n PRO 379 Cb 0.49 -1.53 0.41 0.00 -0.04 0.00 0.00 33.50 32.83 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 0.00 0.00 -0.74 0.54 -1.99 -1.94 -3.47 116.97 109.37 3jzi h TYR 380 Ca 0.00 0.00 -0.66 0.00 2.00 0.00 0.00 58.73 60.07 3jzi h TYR 380 Cb 0.41 0.00 -0.13 0.00 2.00 0.00 0.00 36.73 39.01 3jzi h TYR 380 CO 0.00 0.00 -0.52 0.71 -0.00 0.00 0.00 178.16 178.35 3jzi s TYR 381 N -3.20 1.92 0.85 4.88 1.51 -1.24 -4.80 117.35 117.26 3jzi s TYR 381 Ca 0.08 -0.96 -0.12 0.00 -1.01 0.00 0.00 57.07 55.06 3jzi s TYR 381 Cb 0.10 -1.58 0.10 0.00 -0.11 0.00 0.00 41.96 40.47 3jzi s TYR 381 CO 0.56 0.20 1.14 -0.40 -1.11 0.00 0.00 175.55 175.94 3jzi n ASP 382 N -1.24 0.65 0.24 2.29 5.68 -1.26 -4.94 116.55 117.97 3jzi n ASP 382 Ca -0.16 0.52 0.12 0.00 -0.50 0.00 0.00 54.79 54.77 3jzi n ASP 382 Cb 0.67 -1.48 0.48 0.00 -1.14 0.00 0.00 41.12 39.65 3jzi n ASP 382 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 3jzi h SER 383 N -1.24 0.00 -2.39 -1.12 4.64 -1.96 -3.45 113.55 108.03 3jzi h SER 383 Ca -0.45 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.30 3jzi h SER 383 Cb 1.29 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.36 3jzi h SER 383 CO 0.44 0.14 1.35 -0.32 -0.87 0.00 0.00 176.83 177.57 3jzi s MET 384 N -3.58 3.16 -0.02 4.77 0.00 -1.26 -0.29 119.30 122.08 3jzi s MET 384 Ca 0.02 1.51 0.19 0.00 0.00 0.00 0.00 55.69 57.41 3jzi s MET 384 Cb 0.09 -4.28 -0.27 0.00 0.00 0.00 0.00 34.83 30.37 3jzi s MET 384 CO 0.61 -2.07 0.53 0.44 0.00 0.00 0.00 175.02 174.53 3jzi n ILE 385 N 7.52 0.00 -3.77 10.11 -5.35 -0.22 -4.83 119.36 122.82 3jzi n ILE 385 Ca 0.25 -0.33 0.01 0.00 -0.27 0.00 0.00 62.75 62.40 3jzi n ILE 385 Cb 0.47 0.32 0.00 0.00 -1.74 0.00 0.00 39.64 38.70 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 -3.81 -0.24 -0.03 3.28 0.00 -0.95 -4.19 107.32 101.38 3jzi s GLY 386 Ca -0.03 0.30 -0.01 0.00 0.00 0.00 0.00 44.72 44.98 3jzi s GLY 386 CO 0.79 1.85 0.06 0.54 0.00 0.00 0.00 173.10 176.35 3jzi s LYS 387 N -2.39 0.01 -0.27 2.90 1.02 0.25 0.31 119.74 121.57 3jzi s LYS 387 Ca 0.19 0.20 -0.06 0.00 0.02 0.00 0.00 55.97 56.32 3jzi s LYS 387 Cb 0.02 -0.17 -0.00 0.00 -0.52 0.00 0.00 37.83 37.16 3jzi s LYS 387 CO -0.01 -0.13 0.05 -1.17 -0.92 0.00 0.00 175.35 173.17 3jzi s LEU 388 N 0.84 3.58 -0.18 3.17 2.96 -0.10 -0.92 118.68 128.03 3jzi s LEU 388 Ca -0.07 -0.57 -0.00 0.00 -0.22 0.00 0.00 54.13 53.27 3jzi s LEU 388 Cb -0.09 -1.85 0.00 0.00 0.50 0.00 0.00 46.19 44.74 3jzi s LEU 388 CO -0.03 -0.13 -0.14 -0.63 -1.32 0.00 0.00 176.35 174.10 3jzi s ILE 389 N 1.51 2.63 -0.07 6.68 1.09 0.30 -0.66 121.20 132.67 3jzi s ILE 389 Ca 0.04 -0.76 0.05 0.00 -1.10 0.00 0.00 60.65 58.88 3jzi s ILE 389 Cb -0.16 -2.13 -0.01 0.00 -1.06 0.00 0.00 42.46 39.10 3jzi s ILE 389 CO 0.01 0.50 -0.25 0.00 -0.10 0.00 0.00 174.94 175.11 3jzi s TYR 391 N 0.01 2.56 0.23 0.00 6.14 0.11 -1.09 117.35 125.32 3jzi s TYR 391 Ca -0.09 -0.25 -0.16 0.00 0.64 0.00 0.00 57.07 57.21 3jzi s TYR 391 Cb -0.15 -1.38 0.01 0.00 0.42 0.00 0.00 41.96 40.85 3jzi s TYR 391 CO 0.06 0.35 0.54 0.20 0.64 0.00 0.00 175.55 177.33 3jzi s GLY 392 N -1.95 0.21 0.56 8.97 0.00 -0.34 -4.50 107.32 110.26 3jzi s GLY 392 Ca 0.17 -0.56 0.33 0.00 0.00 0.00 0.00 44.72 44.66 3jzi s GLY 392 CO 0.09 -0.41 2.13 1.05 0.00 0.00 0.00 173.10 175.96 3jzi h GLU 393 N 2.19 0.00 -4.22 2.90 9.09 -1.94 0.13 114.58 122.74 3jzi h GLU 393 Ca -0.26 0.00 -0.17 0.00 0.05 0.00 0.00 59.36 58.99 3jzi h GLU 393 Cb 1.25 0.00 -0.13 0.00 -1.65 0.00 0.00 28.75 28.22 3jzi h GLU 393 CO 0.34 0.06 -0.43 0.54 0.05 0.00 0.00 179.01 179.57 3jzi s ASN 394 N -5.82 0.07 0.25 3.06 2.20 -1.26 -4.12 114.94 109.32 3jzi s ASN 394 Ca -0.02 -1.19 -0.04 0.00 -0.94 0.00 0.00 52.86 50.67 3jzi s ASN 394 Cb 0.12 0.45 0.40 0.00 -2.00 0.00 0.00 41.25 40.22 3jzi s ASN 394 CO 0.53 -0.94 1.84 -0.09 -2.94 0.00 0.00 177.10 175.50 3jzi h ARG 395 N 2.50 0.91 -0.69 3.55 2.43 -1.89 -2.84 114.38 118.35 3jzi h ARG 395 Ca -0.32 -0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 58.75 3jzi h ARG 395 Cb 1.25 -0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 30.56 3jzi h ARG 395 CO 0.47 0.60 0.27 -0.44 -1.51 0.00 0.00 179.97 179.36 3jzi h ASP 396 N 0.94 0.93 -0.30 -3.80 3.45 -1.97 -2.03 116.42 113.64 3jzi h ASP 396 Ca 0.41 -0.13 -0.10 0.00 0.43 0.00 0.00 57.03 57.64 3jzi h ASP 396 Cb 0.29 -0.24 -0.01 0.00 -0.56 0.00 0.00 39.33 38.81 3jzi h ASP 396 CO -0.21 0.83 -0.19 0.58 -1.57 0.00 0.00 179.24 178.68 3jzi h VAL 397 N 1.00 1.30 -0.71 -1.35 2.07 -1.89 -1.19 116.25 115.48 3jzi h VAL 397 Ca 0.23 -1.31 -0.01 0.00 0.82 0.00 0.00 66.70 66.43 3jzi h VAL 397 Cb 0.19 1.49 -0.03 0.00 -1.52 0.00 0.00 31.29 31.42 3jzi h VAL 397 CO -0.02 0.42 0.40 0.00 0.02 0.00 0.00 177.57 178.39 3jzi h ALA 398 N 0.74 0.90 -0.26 1.67 0.00 -1.35 -0.32 119.26 120.64 3jzi h ALA 398 Ca 0.06 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 3jzi h ALA 398 Cb 0.73 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 3jzi h ALA 398 CO 0.05 0.40 0.01 0.82 0.00 0.00 0.00 179.25 180.54 3jzi h ILE 399 N 0.97 1.25 -0.60 0.00 2.04 -1.32 -1.23 117.51 118.61 3jzi h ILE 399 Ca 0.25 -0.87 0.05 0.00 1.00 0.00 0.00 64.86 65.28 3jzi h ILE 399 Cb 0.02 1.30 -0.05 0.00 -0.74 0.00 0.00 36.82 37.36 3jzi h ILE 399 CO -0.04 0.28 0.33 0.00 0.00 0.00 0.00 178.15 178.72 3jzi h ALA 400 N 0.83 0.79 -0.36 1.87 0.00 -0.90 -0.71 119.26 120.78 3jzi h ALA 400 Ca 0.08 0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 3jzi h ALA 400 Cb 0.39 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 3jzi h ALA 400 CO 0.01 0.02 -0.13 0.00 0.00 0.00 0.00 179.25 179.15 3jzi h ARG 401 N 0.64 0.64 -0.45 0.00 3.08 -0.96 -2.60 114.38 114.72 3jzi h ARG 401 Ca 0.26 -0.20 -0.10 0.00 0.07 0.00 0.00 59.98 60.00 3jzi h ARG 401 Cb 0.13 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.11 3jzi h ARG 401 CO -0.15 0.75 -0.13 1.98 -1.07 0.00 0.00 179.97 181.35 3jzi h MET 402 N 0.58 0.89 -0.61 0.04 4.05 -0.60 0.03 114.93 119.31 3jzi h MET 402 Ca 0.10 -0.35 0.00 0.00 -0.28 0.00 0.00 59.70 59.18 3jzi h MET 402 Cb 0.56 -0.05 -0.03 0.00 -0.80 0.00 0.00 31.60 31.28 3jzi h MET 402 CO 0.04 0.99 0.38 0.87 0.23 0.00 0.00 176.91 179.42 3jzi h LYS 403 N 0.72 0.81 -0.35 0.39 1.57 -0.96 -0.32 116.57 118.43 3jzi h LYS 403 Ca 0.11 -0.06 -0.12 0.00 -1.87 0.00 0.00 60.65 58.71 3jzi h LYS 403 Cb 0.68 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.80 3jzi h LYS 403 CO 0.05 0.56 -0.25 -0.91 -0.57 0.00 0.00 179.45 178.33 3jzi h ASN 404 N 0.82 0.83 -0.53 0.86 -0.26 -1.35 -2.82 115.58 113.12 3jzi h ASN 404 Ca 0.22 -0.43 -0.12 0.00 -0.56 0.00 0.00 56.30 55.41 3jzi h ASN 404 Cb -0.06 -0.23 -0.02 0.00 -1.06 0.00 0.00 38.32 36.95 3jzi h ASN 404 CO -0.04 1.09 -0.13 0.00 -1.06 0.00 0.00 177.43 177.28 3jzi h ALA 405 N 0.77 0.75 -0.20 -0.83 0.00 -0.78 -3.00 119.26 115.97 3jzi h ALA 405 Ca 0.07 -0.36 -0.05 0.00 0.00 0.00 0.00 54.91 54.57 3jzi h ALA 405 Cb 0.81 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 3jzi h ALA 405 CO 0.07 0.68 -0.08 -0.07 0.00 0.00 0.00 179.25 179.84 3jzi h LEU 406 N 0.91 0.29 -1.23 0.00 3.38 -1.05 -2.16 115.31 115.46 3jzi h LEU 406 Ca 0.14 -0.06 -0.06 0.00 0.09 0.00 0.00 57.88 57.99 3jzi h LEU 406 Cb 0.70 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 3jzi h LEU 406 CO 0.05 0.42 -0.28 1.56 0.09 0.00 0.00 178.44 180.28 3jzi h GLN 407 N 0.30 0.00 0.00 1.13 4.20 -1.37 -3.17 115.11 116.20 3jzi h GLN 407 Ca 0.06 0.00 -0.15 0.00 0.06 0.00 0.00 58.65 58.63 3jzi h GLN 407 Cb 0.34 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.10 3jzi h GLN 407 CO 0.02 0.28 -1.36 0.39 -0.67 0.00 0.00 178.83 177.49 3jzi n GLU 408 N -3.59 0.62 -1.99 1.46 1.02 -0.86 -4.90 120.64 112.40 3jzi n GLU 408 Ca -0.01 0.21 -0.43 0.00 -0.02 0.00 0.00 57.16 56.91 3jzi n GLU 408 Cb 0.42 -1.81 -0.03 0.00 -0.02 0.00 0.00 31.44 30.00 3jzi n GLU 408 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 3jzi s LEU 409 N -5.72 3.72 -0.21 -4.62 2.96 -0.90 -4.54 118.68 109.37 3jzi s LEU 409 Ca -0.03 1.59 -0.04 0.00 -0.22 0.00 0.00 54.13 55.43 3jzi s LEU 409 Cb 0.09 -3.53 -0.01 0.00 0.50 0.00 0.00 46.19 43.24 3jzi s LEU 409 CO 0.81 -1.50 -0.03 -0.63 -1.32 0.00 0.00 176.35 173.68 3jzi s ILE 410 N 6.14 3.58 -0.31 6.68 1.01 0.20 -4.97 121.20 133.54 3jzi s ILE 410 Ca 0.79 -0.43 -0.02 0.00 0.00 0.00 0.00 60.65 60.99 3jzi s ILE 410 Cb -0.26 -2.62 0.11 0.00 0.01 0.00 0.00 42.46 39.69 3jzi s ILE 410 CO 0.32 0.43 0.13 -0.63 0.00 0.00 0.00 174.94 175.19 3jzi s ILE 411 N 1.26 0.34 0.20 2.92 1.01 -1.25 -0.94 121.20 124.73 3jzi s ILE 411 Ca 0.03 -1.16 0.07 0.00 0.00 0.00 0.00 60.65 59.59 3jzi s ILE 411 Cb -0.14 -1.27 -0.04 0.00 0.01 0.00 0.00 42.46 41.01 3jzi s ILE 411 CO -0.01 -0.75 0.07 -1.81 0.00 0.00 0.00 174.94 172.45 3jzi s ASP 412 N 1.75 5.09 0.00 3.58 -0.00 -0.03 -4.62 116.67 122.44 3jzi s ASP 412 Ca 0.11 -0.32 0.00 0.00 -0.00 0.00 0.00 52.55 52.33 3jzi s ASP 412 Cb -0.18 -1.18 0.00 0.00 -0.00 0.00 0.00 42.92 41.56 3jzi s ASP 412 CO -0.27 0.05 0.00 0.61 -0.00 0.00 0.00 175.17 175.56 3jzi n GLY 413 N -0.46 2.93 3.10 0.21 0.00 -1.26 -0.94 105.19 108.77 3jzi n GLY 413 Ca -0.09 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.86 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 -2.78 0.21 0.14 -0.61 -4.36 -1.26 -4.62 121.20 107.92 3jzi s ILE 414 Ca 0.00 -1.75 -0.25 0.00 -0.26 0.00 0.00 60.65 58.39 3jzi s ILE 414 Cb 0.00 -1.50 -0.07 0.00 1.25 0.00 0.00 42.46 42.13 3jzi s ILE 414 CO 0.00 -0.96 0.77 -0.54 0.24 0.00 0.00 174.94 174.44 3jzi s LYS 415 N -3.91 4.54 0.32 0.37 -0.14 -1.26 -5.01 119.74 114.65 3jzi s LYS 415 Ca 0.07 1.13 0.03 0.00 -1.36 0.00 0.00 55.97 55.83 3jzi s LYS 415 Cb 0.08 -3.28 -0.04 0.00 -1.68 0.00 0.00 37.83 32.90 3jzi s LYS 415 CO -0.10 0.52 0.12 0.95 -0.76 0.00 0.00 175.35 176.08 3jzi s THR 416 N -0.95 0.64 -1.21 2.17 -4.23 -1.14 -1.69 115.64 109.23 3jzi s THR 416 Ca 0.36 -2.00 0.15 0.00 -1.18 0.00 0.00 61.69 59.02 3jzi s THR 416 Cb -0.23 -2.57 0.60 0.00 1.34 0.00 0.00 72.50 71.65 3jzi s THR 416 CO 0.25 0.00 1.48 -0.46 -0.54 0.00 0.00 174.62 175.36 3jzi n ASN 417 N -0.85 4.05 -0.12 3.99 6.94 -1.11 -4.48 115.26 123.67 3jzi n ASN 417 Ca -0.02 -2.37 -0.04 0.00 -0.02 0.00 0.00 54.58 52.13 3jzi n ASN 417 Cb 0.66 -0.53 0.03 0.00 -2.36 0.00 0.00 39.78 37.58 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 3.41 0.69 -0.71 3.53 2.07 -1.91 -1.57 116.25 121.75 3jzi h VAL 418 Ca 0.00 -0.03 -0.02 0.00 0.82 0.00 0.00 66.70 67.46 3jzi h VAL 418 Cb 1.26 0.58 -0.03 0.00 -1.52 0.00 0.00 31.29 31.57 3jzi h VAL 418 CO 0.20 0.02 0.35 0.44 0.02 0.00 0.00 177.57 178.60 3jzi h ASP 419 N 0.10 0.91 -0.58 0.57 3.32 -1.96 -2.00 116.42 116.78 3jzi h ASP 419 Ca 0.20 -0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.14 3jzi h ASP 419 Cb 0.28 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.57 3jzi h ASP 419 CO -0.33 0.76 0.31 0.25 -1.72 0.00 0.00 179.24 178.51 3jzi h LEU 420 N 1.01 0.74 -0.93 1.55 5.85 -1.73 -2.18 115.31 119.62 3jzi h LEU 420 Ca 0.25 -0.10 -0.00 0.00 0.84 0.00 0.00 57.88 58.86 3jzi h LEU 420 Cb 0.09 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 40.88 3jzi h LEU 420 CO -0.03 0.63 0.57 1.56 -0.34 0.00 0.00 178.44 180.82 3jzi h GLN 421 N 0.79 1.26 -0.65 1.25 1.08 -0.80 -0.81 115.11 117.23 3jzi h GLN 421 Ca 0.20 -0.11 -0.02 0.00 -1.45 0.00 0.00 58.65 57.27 3jzi h GLN 421 Cb 0.06 -0.27 -0.03 0.00 -0.05 0.00 0.00 27.48 27.20 3jzi h GLN 421 CO -0.03 0.88 0.33 0.82 -0.95 0.00 0.00 178.83 179.87 3jzi h ILE 422 N 1.28 1.22 -0.62 2.54 2.04 -1.14 -1.04 117.51 121.78 3jzi h ILE 422 Ca 0.33 -0.59 -0.01 0.00 1.00 0.00 0.00 64.86 65.60 3jzi h ILE 422 Cb -0.06 0.41 -0.03 0.00 -0.74 0.00 0.00 36.82 36.40 3jzi h ILE 422 CO -0.06 0.25 0.37 0.03 0.00 0.00 0.00 178.15 178.73 3jzi h ARG 423 N 0.89 0.85 -0.45 2.37 3.08 -0.73 -1.81 114.38 118.59 3jzi h ARG 423 Ca 0.23 -0.08 -0.06 0.00 0.07 0.00 0.00 59.98 60.14 3jzi h ARG 423 Cb 0.09 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 29.95 3jzi h ARG 423 CO -0.03 0.62 0.06 0.82 -1.07 0.00 0.00 179.97 180.37 3jzi h ILE 424 N 0.84 1.25 -0.29 2.04 2.04 -0.83 -1.93 117.51 120.63 3jzi h ILE 424 Ca 0.22 -0.93 -0.04 0.00 1.00 0.00 0.00 64.86 65.12 3jzi h ILE 424 Cb -0.01 0.97 -0.02 0.00 -0.74 0.00 0.00 36.82 37.03 3jzi h ILE 424 CO -0.04 0.32 0.01 0.24 0.00 0.00 0.00 178.15 178.69 3jzi h MET 425 N 0.62 0.43 -0.00 2.37 2.86 -1.00 -2.44 114.93 117.76 3jzi h MET 425 Ca 0.14 -0.08 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 3jzi h MET 425 Cb 0.40 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 31.99 3jzi h MET 425 CO 0.01 0.45 -0.11 0.09 1.06 0.00 0.00 176.91 178.42 3jzi n ASN 426 N -4.32 0.16 -4.66 1.22 3.02 -0.70 -4.72 115.26 105.26 3jzi n ASN 426 Ca 0.01 0.11 -0.43 0.00 -0.03 0.00 0.00 54.58 54.25 3jzi n ASN 426 Cb 0.21 -0.27 -0.02 0.00 -0.61 0.00 0.00 39.78 39.09 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 -2.86 6.74 0.48 6.41 2.15 -0.75 -4.93 116.67 123.91 3jzi s ASP 427 Ca 0.18 1.98 0.14 0.00 0.43 0.00 0.00 52.55 55.28 3jzi s ASP 427 Cb 0.19 -2.53 1.13 0.00 -0.30 0.00 0.00 42.92 41.40 3jzi s ASP 427 CO 0.54 -0.90 2.08 1.05 -0.17 0.00 0.00 175.17 177.77 3jzi h GLU 428 N 9.19 0.22 -0.07 4.34 4.11 -1.89 0.11 114.58 130.58 3jzi h GLU 428 Ca -0.34 -0.01 -0.11 0.00 0.07 0.00 0.00 59.36 58.96 3jzi h GLU 428 Cb 1.15 -0.05 0.01 0.00 0.50 0.00 0.00 28.75 30.36 3jzi h GLU 428 CO 0.96 0.14 -0.40 -0.91 0.07 0.00 0.00 179.01 178.88 3jzi h ASN 429 N 0.22 0.48 -0.57 3.06 2.35 -1.95 -1.70 115.58 117.47 3jzi h ASN 429 Ca 0.11 -0.66 0.00 0.00 -0.55 0.00 0.00 56.30 55.21 3jzi h ASN 429 Cb 0.16 -0.14 -0.03 0.00 0.05 0.00 0.00 38.32 38.36 3jzi h ASN 429 CO -0.02 1.06 0.37 0.15 -1.65 0.00 0.00 177.43 177.34 3jzi h PHE 430 N -0.06 0.72 -0.63 1.19 3.04 -1.73 0.86 116.94 120.33 3jzi h PHE 430 Ca -0.03 0.01 -0.00 0.00 3.98 0.00 0.00 57.97 61.93 3jzi h PHE 430 Cb 1.06 -0.24 -0.03 0.00 2.56 0.00 0.00 35.95 39.29 3jzi h PHE 430 CO 0.13 0.47 0.39 1.96 -2.02 0.00 0.00 178.31 179.24 3jzi h GLN 431 N 0.77 0.85 -0.26 1.11 4.20 -0.80 -1.99 115.11 118.98 3jzi h GLN 431 Ca 0.21 -0.07 -0.10 0.00 0.06 0.00 0.00 58.65 58.75 3jzi h GLN 431 Cb -0.07 -0.18 -0.00 0.00 0.30 0.00 0.00 27.48 27.53 3jzi h GLN 431 CO -0.04 0.59 -0.22 1.25 -0.67 0.00 0.00 178.83 179.73 3jzi h HIS 432 N 0.87 0.73 0.00 2.96 2.76 -0.78 -3.49 115.15 118.20 3jzi h HIS 432 Ca 0.23 -0.21 0.00 0.00 -2.20 0.00 0.00 60.37 58.19 3jzi h HIS 432 Cb -0.05 -0.16 0.00 0.00 1.55 0.00 0.00 27.41 28.75 3jzi h HIS 432 CO 0.00 0.92 0.00 0.41 -1.30 0.00 0.00 177.93 177.96 3jzi n GLY 433 N 0.12 1.26 2.12 5.26 0.00 0.25 -5.04 105.19 109.16 3jzi n GLY 433 Ca -0.04 -1.91 -0.02 0.00 0.00 0.00 0.00 46.02 44.05 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 1.55 0.54 3.77 -0.02 0.00 -1.26 -4.89 105.19 104.88 3jzi n GLY 434 Ca 0.00 -0.53 -0.39 0.00 0.00 0.00 0.00 46.02 45.09 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 -2.00 2.41 0.98 2.61 -4.23 -1.26 -4.99 115.64 109.15 3jzi s THR 435 Ca 0.00 0.37 -0.16 0.00 -1.18 0.00 0.00 61.69 60.72 3jzi s THR 435 Cb 0.00 -3.21 0.20 0.00 1.34 0.00 0.00 72.50 70.83 3jzi s THR 435 CO 0.00 0.05 1.29 0.54 -0.54 0.00 0.00 174.62 175.96 3jzi s ASN 436 N -0.68 2.98 0.43 3.99 2.20 -1.26 -4.83 114.94 117.78 3jzi s ASN 436 Ca 0.59 0.36 0.30 0.00 -0.94 0.00 0.00 52.86 53.17 3jzi s ASN 436 Cb -0.40 -0.46 1.41 0.00 -2.00 0.00 0.00 41.25 39.80 3jzi s ASN 436 CO 0.51 -2.82 1.91 0.16 -2.94 0.00 0.00 177.10 173.92 3jzi h ILE 437 N -1.70 0.00 -0.01 0.54 3.07 -1.42 -2.87 117.51 115.12 3jzi h ILE 437 Ca -0.45 -0.23 0.00 0.00 1.55 0.00 0.00 64.86 65.74 3jzi h ILE 437 Cb 1.25 1.04 0.00 0.00 -0.27 0.00 0.00 36.82 38.84 3jzi h ILE 437 CO 0.40 0.00 -0.69 1.41 -1.05 0.00 0.00 178.15 178.22 3jzi n HIS 438 N -2.65 0.00 0.05 0.16 8.25 -1.26 -4.52 115.22 115.25 3jzi n HIS 438 Ca 0.00 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.35 3jzi n HIS 438 Cb 0.18 -0.01 -0.04 0.00 1.12 0.00 0.00 29.99 31.24 3jzi n HIS 438 CO 0.00 0.00 0.00 -0.92 0.64 0.00 0.00 176.34 176.06 3jzi h TYR 439 N 1.28 -0.49 -0.89 4.41 3.20 -1.83 -2.67 116.97 119.99 3jzi h TYR 439 Ca 0.00 0.02 0.04 0.00 3.14 0.00 0.00 58.73 61.93 3jzi h TYR 439 Cb 0.63 0.22 -0.06 0.00 1.54 0.00 0.00 36.73 39.06 3jzi h TYR 439 CO 0.00 -0.27 0.58 1.25 -1.64 0.00 0.00 178.16 178.08 3jzi h LEU 440 N -0.29 0.95 -0.48 2.82 5.85 -1.81 0.17 115.31 122.51 3jzi h LEU 440 Ca 0.06 -0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.67 3jzi h LEU 440 Cb 0.37 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 3jzi h LEU 440 CO -0.18 0.64 -0.14 -0.33 -0.34 0.00 0.00 178.44 178.08 3jzi h GLU 441 N 1.10 0.94 -0.30 1.25 5.08 -1.71 -2.00 114.58 118.94 3jzi h GLU 441 Ca 0.36 -0.37 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 3jzi h GLU 441 Cb 0.04 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 3jzi h GLU 441 CO -0.13 1.03 0.14 0.87 -1.00 0.00 0.00 179.01 179.92 3jzi h LYS 442 N 0.79 0.44 -0.56 2.33 6.56 -1.11 -0.86 116.57 124.16 3jzi h LYS 442 Ca 0.12 -0.07 0.02 0.00 -1.06 0.00 0.00 60.65 59.66 3jzi h LYS 442 Cb 0.70 -0.08 -0.04 0.00 -0.57 0.00 0.00 32.23 32.25 3jzi h LYS 442 CO 0.05 0.43 0.35 -0.22 -2.06 0.00 0.00 179.45 178.00 3jzi h LYS 443 N 0.34 0.67 0.00 3.15 3.64 -0.91 -2.71 116.57 120.75 3jzi h LYS 443 Ca 0.10 -0.04 -0.05 0.00 -1.27 0.00 0.00 60.65 59.39 3jzi h LYS 443 Cb 0.14 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.81 3jzi h LYS 443 CO -0.01 0.44 -0.24 -0.07 -2.27 0.00 0.00 179.45 177.30 3jzi h LEU 444 N 0.69 0.00 0.00 5.20 3.38 -1.21 -3.51 115.31 119.85 3jzi h LEU 444 Ca 0.22 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.19 3jzi h LEU 444 Cb 0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.76 3jzi h LEU 444 CO -0.09 0.24 0.00 0.61 0.09 0.00 0.00 178.44 179.29