#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3jys s LYS 39 N 0.00 3.38 0.70 -0.67 3.01 -1.26 -5.11 119.74 119.79 3jys s LYS 39 Ca 0.00 -0.64 -0.16 0.00 -1.01 0.00 0.00 55.97 54.16 3jys s LYS 39 Cb 0.00 -2.90 0.02 0.00 -1.01 0.00 0.00 37.83 33.95 3jys s LYS 39 CO 0.00 -0.08 1.20 0.00 0.51 0.00 0.00 175.35 176.98 3jys s ALA 40 N 1.15 2.22 -0.09 5.17 0.00 -1.26 -5.01 121.76 123.94 3jys s ALA 40 Ca 0.02 0.88 -0.16 0.00 0.00 0.00 0.00 51.96 52.70 3jys s ALA 40 Cb -0.14 -3.46 -0.05 0.00 0.00 0.00 0.00 23.12 19.47 3jys s ALA 40 CO -0.02 -1.72 0.41 0.71 0.00 0.00 0.00 175.76 175.15 3jys s TYR 41 N -1.94 3.57 0.00 0.00 2.02 -1.26 -4.96 117.35 114.78 3jys s TYR 41 Ca 0.74 0.86 0.00 0.00 -0.37 0.00 0.00 57.07 58.30 3jys s TYR 41 Cb -0.29 -2.41 0.00 0.00 -0.40 0.00 0.00 41.96 38.86 3jys s TYR 41 CO 0.43 0.34 0.00 0.25 -1.57 0.00 0.00 175.55 175.00 3jys n THR 42 N 3.03 0.00 -2.03 -0.71 -2.24 -1.26 -5.09 114.28 105.98 3jys n THR 42 Ca -0.10 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.40 3jys n THR 42 Cb 0.52 0.00 0.11 0.00 -2.10 0.00 0.00 70.33 68.86 3jys n THR 42 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 3jys s ASP 43 N 1.24 4.26 0.25 3.42 1.47 -1.26 -4.74 116.67 121.31 3jys s ASP 43 Ca 0.00 0.51 -0.04 0.00 1.18 0.00 0.00 52.55 54.20 3jys s ASP 43 Cb 0.00 -0.94 0.47 0.00 -0.34 0.00 0.00 42.92 42.12 3jys s ASP 43 CO 0.00 -2.01 1.69 0.00 0.68 0.00 0.00 175.17 175.53 3jys h ALA 44 N -1.04 0.98 -0.85 2.11 0.00 -1.99 -2.01 119.26 116.47 3jys h ALA 44 Ca -0.45 0.16 0.11 0.00 0.00 0.00 0.00 54.91 54.74 3jys h ALA 44 Cb 1.30 0.21 -0.08 0.00 0.00 0.00 0.00 17.79 19.22 3jys h ALA 44 CO 0.57 -0.33 0.48 0.93 0.00 0.00 0.00 179.25 180.89 3jys h GLU 45 N 0.29 0.73 -0.41 0.00 3.07 -2.00 -2.04 114.58 114.22 3jys h GLU 45 Ca 0.42 -0.04 -0.06 0.00 -0.50 0.00 0.00 59.36 59.18 3jys h GLU 45 Cb 0.72 -0.17 -0.02 0.00 -0.84 0.00 0.00 28.75 28.44 3jys h GLU 45 CO -0.50 0.48 0.01 0.66 -1.40 0.00 0.00 179.01 178.26 3jys h SER 46 N 0.75 0.61 -0.21 1.42 4.64 -1.73 0.38 113.55 119.42 3jys h SER 46 Ca 0.43 -0.13 -0.08 0.00 -0.47 0.00 0.00 61.79 61.54 3jys h SER 46 Cb 0.47 -0.16 -0.00 0.00 -0.31 0.00 0.00 62.40 62.40 3jys h SER 46 CO -0.29 0.68 -0.19 1.88 -0.87 0.00 0.00 176.83 178.04 3jys h TYR 47 N 0.62 0.60 -0.61 4.77 0.05 -1.33 0.76 116.97 121.82 3jys h TYR 47 Ca 0.13 -0.17 0.01 0.00 0.05 0.00 0.00 58.73 58.74 3jys h TYR 47 Cb 0.37 -0.13 -0.03 0.00 1.01 0.00 0.00 36.73 37.96 3jys h TYR 47 CO 0.02 0.84 0.40 1.15 -1.05 0.00 0.00 178.16 179.52 3jys h THR 48 N 0.18 1.14 -0.17 -2.88 2.02 -1.15 -1.48 112.91 110.57 3jys h THR 48 Ca 0.04 -0.28 -0.10 0.00 0.77 0.00 0.00 66.41 66.83 3jys h THR 48 Cb 0.73 0.26 -0.01 0.00 -1.74 0.00 0.00 68.15 67.38 3jys h THR 48 CO 0.05 0.15 -0.34 0.11 0.37 0.00 0.00 175.52 175.86 3jys h LYS 49 N 0.82 0.35 -0.42 6.66 6.56 -0.92 -1.86 116.57 127.76 3jys h LYS 49 Ca 0.23 -0.15 -0.04 0.00 -1.06 0.00 0.00 60.65 59.63 3jys h LYS 49 Cb -0.08 -0.01 -0.02 0.00 -0.57 0.00 0.00 32.23 31.55 3jys h LYS 49 CO -0.06 0.66 0.12 0.78 -2.06 0.00 0.00 179.45 178.89 3jys h GLY 50 N 1.10 0.72 0.93 3.86 0.00 -0.43 0.34 103.07 109.59 3jys h GLY 50 Ca 0.04 -0.44 -0.00 0.00 0.00 0.00 0.00 47.33 46.93 3jys h GLY 50 CO 0.06 0.41 0.08 -2.00 0.00 0.00 0.00 176.54 175.09 3jys h LEU 51 N 0.54 0.19 -0.96 3.11 5.85 -1.16 -2.47 115.31 120.41 3jys h LEU 51 Ca 0.13 -0.09 0.05 0.00 0.84 0.00 0.00 57.88 58.81 3jys h LEU 51 Cb 0.29 -0.05 -0.06 0.00 0.37 0.00 0.00 40.66 41.21 3jys h LEU 51 CO -0.00 0.23 0.62 -0.74 -0.34 0.00 0.00 178.44 178.20 3jys h HIS 52 N 0.14 1.16 -0.72 1.25 2.76 -1.21 -1.74 115.15 116.79 3jys h HIS 52 Ca 0.05 0.03 0.07 0.00 -2.20 0.00 0.00 60.37 58.32 3jys h HIS 52 Cb 0.08 -0.38 -0.06 0.00 1.55 0.00 0.00 27.41 28.60 3jys h HIS 52 CO -0.04 0.64 0.40 -0.22 -1.30 0.00 0.00 177.93 177.41 3jys h LYS 53 N 1.17 0.71 0.30 5.26 3.64 -0.73 -0.24 116.57 126.68 3jys h LYS 53 Ca 0.40 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.73 3jys h LYS 53 Cb 0.08 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 31.73 3jys h LYS 53 CO -0.15 0.47 -0.18 0.82 -2.27 0.00 0.00 179.45 178.14 3jys h ILE 54 N 0.73 0.62 -0.67 2.00 2.04 -0.90 -2.04 117.51 119.29 3jys h ILE 54 Ca 0.33 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.27 3jys h ILE 54 Cb 0.22 0.62 -0.04 0.00 -0.74 0.00 0.00 36.82 36.88 3jys h ILE 54 CO -0.20 0.00 0.44 1.88 0.00 0.00 0.00 178.15 180.27 3jys h TYR 55 N -0.46 0.60 0.00 1.37 0.05 -1.16 -3.01 116.97 114.36 3jys h TYR 55 Ca -0.03 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.77 3jys h TYR 55 Cb 0.38 -0.19 0.00 0.00 1.01 0.00 0.00 36.73 37.93 3jys h TYR 55 CO -0.09 0.29 0.00 0.43 -1.05 0.00 0.00 178.16 177.74 3jys n SER 56 N -4.48 0.47 0.04 3.88 7.64 -0.12 -3.65 113.62 117.41 3jys n SER 56 Ca 0.10 0.56 0.09 0.00 1.01 0.00 0.00 58.87 60.64 3jys n SER 56 Cb 0.31 -0.68 0.53 0.00 -1.01 0.00 0.00 64.21 63.37 3jys n SER 56 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 3jys h VAL 57 N 0.00 0.97 -0.79 0.44 2.07 -1.35 -1.44 116.25 116.15 3jys h VAL 57 Ca 0.00 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.42 3jys h VAL 57 Cb 0.57 0.64 -0.04 0.00 -1.52 0.00 0.00 31.29 30.94 3jys h VAL 57 CO 0.00 0.05 0.52 -0.50 0.02 0.00 0.00 177.57 177.66 3jys h TRP 58 N 0.30 1.01 0.00 1.57 4.06 -1.81 -3.05 115.95 118.03 3jys h TRP 58 Ca 0.16 0.02 0.00 0.00 2.06 0.00 0.00 58.89 61.13 3jys h TRP 58 Cb 0.26 -0.34 0.00 0.00 -1.00 0.00 0.00 29.16 28.08 3jys h TRP 58 CO -0.00 0.65 -0.57 0.00 -3.56 0.00 0.00 178.44 174.96 3jys h ALA 59 N 1.28 0.68 -2.73 1.49 0.00 -1.55 -2.87 119.26 115.56 3jys h ALA 59 Ca 0.29 0.00 -0.52 0.00 0.00 0.00 0.00 54.91 54.68 3jys h ALA 59 Cb -0.10 0.00 0.03 0.00 0.00 0.00 0.00 17.79 17.71 3jys h ALA 59 CO -0.06 0.00 0.57 -1.17 0.00 0.00 0.00 179.25 178.59 3jys s LEU 60 N -5.03 4.46 0.00 0.00 2.96 -0.70 -4.09 118.68 116.28 3jys s LEU 60 Ca 0.05 2.35 0.00 0.00 -0.22 0.00 0.00 54.13 56.31 3jys s LEU 60 Cb 0.10 -3.62 0.00 0.00 0.50 0.00 0.00 46.19 43.17 3jys s LEU 60 CO 0.72 -0.38 0.00 -1.54 -1.32 0.00 0.00 176.35 173.83 3jys n SER 61 N 1.97 0.00 0.00 3.68 3.41 -1.26 -4.08 113.62 117.33 3jys n SER 61 Ca 0.03 0.30 0.00 0.00 -0.26 0.00 0.00 58.87 58.94 3jys n SER 61 Cb 0.44 -0.43 0.00 0.00 -0.26 0.00 0.00 64.21 63.96 3jys n SER 61 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3jys n GLY 62 N 1.95 2.35 0.00 5.00 0.00 -1.26 -4.26 105.19 108.97 3jys n GLY 62 Ca 0.00 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.29 3jys n GLY 62 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3jys n THR 79 N 0.00 0.00 -2.37 2.61 -2.24 -1.26 -5.21 114.28 105.81 3jys n THR 79 Ca 0.00 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.37 3jys n THR 79 Cb 0.00 -0.22 -0.03 0.00 -2.10 0.00 0.00 70.33 67.98 3jys n THR 79 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3jys s ALA 80 N -2.78 3.44 0.15 6.98 0.00 -1.26 -4.90 121.76 123.38 3jys s ALA 80 Ca 0.00 0.95 -0.18 0.00 0.00 0.00 0.00 51.96 52.73 3jys s ALA 80 Cb 0.00 -3.42 0.03 0.00 0.00 0.00 0.00 23.12 19.73 3jys s ALA 80 CO 0.00 -0.39 1.71 1.25 0.00 0.00 0.00 175.76 178.33 3jys h LEU 81 N 5.44 -0.10 -0.47 0.00 5.85 -1.73 -1.56 115.31 122.75 3jys h LEU 81 Ca -0.44 0.06 0.05 0.00 0.84 0.00 0.00 57.88 58.39 3jys h LEU 81 Cb 1.21 0.11 -0.05 0.00 0.37 0.00 0.00 40.66 42.31 3jys h LEU 81 CO 0.76 -0.02 0.21 0.25 -0.34 0.00 0.00 178.44 179.30 3jys h LEU 82 N 0.10 0.28 -0.10 2.25 5.85 -1.80 -0.02 115.31 121.86 3jys h LEU 82 Ca 0.14 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.89 3jys h LEU 82 Cb 0.18 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.20 3jys h LEU 82 CO -0.23 0.20 0.03 -0.09 -0.34 0.00 0.00 178.44 178.01 3jys h ARG 83 N 0.42 0.15 -0.03 1.25 2.43 -1.72 -0.05 114.38 116.84 3jys h ARG 83 Ca 0.21 -0.03 0.01 0.00 -0.81 0.00 0.00 59.98 59.36 3jys h ARG 83 Cb 0.16 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.68 3jys h ARG 83 CO -0.18 0.31 -0.01 0.00 -1.51 0.00 0.00 179.97 178.58 3jys h TRP 85 N -0.00 -0.04 -0.46 0.00 7.01 -0.97 -0.90 115.95 120.59 3jys h TRP 85 Ca 0.02 0.01 0.03 0.00 2.11 0.00 0.00 58.89 61.06 3jys h TRP 85 Cb 0.03 0.04 -0.04 0.00 -2.10 0.00 0.00 29.16 27.09 3jys h TRP 85 CO -0.10 -0.04 0.25 2.35 -2.79 0.00 0.00 178.44 178.11 3jys h TRP 86 N 0.02 0.46 -0.41 2.65 7.01 -0.83 -1.29 115.95 123.57 3jys h TRP 86 Ca 0.06 0.02 0.05 0.00 2.11 0.00 0.00 58.89 61.12 3jys h TRP 86 Cb 0.08 -0.14 -0.04 0.00 -2.10 0.00 0.00 29.16 26.96 3jys h TRP 86 CO -0.15 0.25 0.16 1.15 -2.79 0.00 0.00 178.44 177.05 3jys h THR 87 N 0.50 0.90 0.00 2.65 2.02 -0.60 -1.70 112.91 116.67 3jys h THR 87 Ca 0.19 -0.11 -0.00 0.00 0.77 0.00 0.00 66.41 67.26 3jys h THR 87 Cb 0.07 0.53 -0.00 0.00 -1.74 0.00 0.00 68.15 67.01 3jys h THR 87 CO -0.12 0.06 -0.01 -0.07 0.37 0.00 0.00 175.52 175.76 3jys h LEU 88 N 0.33 0.00 0.00 2.58 3.38 -0.67 0.11 115.31 121.04 3jys h LEU 88 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.16 3jys h LEU 88 Cb 0.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.91 3jys h LEU 88 CO -0.18 0.01 -0.78 0.00 0.09 0.00 0.00 178.44 177.57 3jys n GLN 89 N -3.10 0.20 -0.00 1.13 1.13 -0.53 -4.61 117.38 111.59 3jys n GLN 89 Ca 0.01 0.02 -0.01 0.00 -1.94 0.00 0.00 57.00 55.08 3jys n GLN 89 Cb 0.32 -1.59 -0.00 0.00 0.11 0.00 0.00 30.24 29.08 3jys n GLN 89 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 3jys n GLU 90 N -1.85 0.01 -0.00 -1.09 -0.58 -0.70 -1.31 120.64 115.12 3jys n GLU 90 Ca 0.03 0.00 0.04 0.00 -0.42 0.00 0.00 57.16 56.81 3jys n GLU 90 Cb 0.40 -0.71 0.41 0.00 -0.57 0.00 0.00 31.44 30.97 3jys n GLU 90 CO 0.00 0.00 0.00 0.37 -0.48 0.00 0.00 177.13 177.02 3jys h GLN 91 N -0.01 0.55 -0.00 3.49 4.15 -1.00 -1.48 115.11 120.80 3jys h GLN 91 Ca -0.02 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.37 3jys h GLN 91 Cb 1.02 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 28.59 3jys h GLN 91 CO -0.01 0.38 -0.01 -0.35 -1.93 0.00 0.00 178.83 176.91 3jys n PRO 92 N -4.46 1.04 -2.06 -2.39 -0.04 -1.21 -4.17 135.00 121.71 3jys n PRO 92 Ca 0.03 -0.18 -0.15 0.00 -0.04 0.00 0.00 63.50 63.16 3jys n PRO 92 Cb 0.07 -1.50 0.07 0.00 -0.04 0.00 0.00 33.50 32.11 3jys n PRO 92 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 3jys n THR 93 N -0.82 0.00 1.35 0.52 -2.24 -0.56 -4.92 114.28 107.62 3jys n THR 93 Ca 0.22 -1.14 0.08 0.00 -2.27 0.00 0.00 64.05 60.94 3jys n THR 93 Cb 0.17 -0.94 0.49 0.00 -2.10 0.00 0.00 70.33 67.95 3jys n THR 93 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3jys n ASP 94 N -2.83 0.00 -0.90 3.42 5.75 -1.26 -4.83 116.55 115.91 3jys n ASP 94 Ca 0.11 -0.84 0.12 0.00 -0.01 0.00 0.00 54.79 54.17 3jys n ASP 94 Cb 0.40 0.00 0.16 0.00 -1.03 0.00 0.00 41.12 40.65 3jys n ASP 94 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 3jys n GLU 95 N -0.88 2.25 -3.63 0.11 1.02 -1.26 -3.65 120.64 114.59 3jys n GLU 95 Ca 0.12 -1.81 -0.12 0.00 -0.02 0.00 0.00 57.16 55.33 3jys n GLU 95 Cb 0.06 -1.46 -0.07 0.00 -0.02 0.00 0.00 31.44 29.94 3jys n GLU 95 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 3jys s LYS 97 N -1.99 0.70 -0.23 3.49 -0.14 0.00 -4.08 119.74 117.48 3jys s LYS 97 Ca 0.29 0.84 -0.10 0.00 -1.36 0.00 0.00 55.97 55.64 3jys s LYS 97 Cb 0.20 0.34 -0.05 0.00 -1.68 0.00 0.00 37.83 36.64 3jys s LYS 97 CO 0.30 -0.08 0.13 1.21 -0.76 0.00 0.00 175.35 176.15 3jys s ASN 98 N 0.33 5.94 0.00 2.83 3.84 -1.26 -1.86 114.94 124.76 3jys s ASN 98 Ca 0.01 0.08 0.30 0.00 0.21 0.00 0.00 52.86 53.46 3jys s ASN 98 Cb -0.05 -2.06 1.47 0.00 -0.55 0.00 0.00 41.25 40.06 3jys s ASN 98 CO -0.02 0.07 2.01 0.00 -2.79 0.00 0.00 177.10 176.37 3jys n ALA 99 N 4.22 2.61 -1.76 1.71 0.00 0.31 -4.49 120.51 123.10 3jys n ALA 99 Ca -0.15 -0.20 -0.37 0.00 0.00 0.00 0.00 53.44 52.71 3jys n ALA 99 Cb 0.52 -1.44 0.01 0.00 0.00 0.00 0.00 19.45 18.55 3jys n ALA 99 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 3jys s TRP 100 N -2.44 2.61 -1.90 0.00 0.51 -1.26 -1.98 118.94 114.47 3jys s TRP 100 Ca 0.32 1.48 0.27 0.00 -2.12 0.00 0.00 56.10 56.04 3jys s TRP 100 Cb 0.20 -3.54 0.81 0.00 -0.81 0.00 0.00 33.47 30.14 3jys s TRP 100 CO 0.45 -2.08 1.60 -1.71 -0.51 0.00 0.00 176.95 174.70 3jys n ASN 101 N -0.82 1.12 -4.59 2.95 5.15 -1.26 -4.69 115.26 113.12 3jys n ASN 101 Ca 0.09 -1.01 -0.44 0.00 -0.60 0.00 0.00 54.58 52.62 3jys n ASN 101 Cb 0.47 0.11 -0.01 0.00 -0.53 0.00 0.00 39.78 39.82 3jys n ASN 101 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 3jys n ASP 102 N -0.49 1.25 -0.26 1.20 9.92 -1.26 -4.85 116.55 122.07 3jys n ASP 102 Ca 0.13 1.16 0.01 0.00 -0.53 0.00 0.00 54.79 55.57 3jys n ASP 102 Cb 0.35 -1.29 0.23 0.00 -0.64 0.00 0.00 41.12 39.77 3jys n ASP 102 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3jys h ALA 103 N 1.93 1.46 -0.20 2.24 0.00 -2.02 -0.78 119.26 121.89 3jys h ALA 103 Ca -0.40 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.45 3jys h ALA 103 Cb 1.34 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 3jys h ALA 103 CO 0.60 0.47 0.08 0.11 0.00 0.00 0.00 179.25 180.51 3jys h TRP 104 N 1.06 0.27 -0.57 0.00 5.08 -1.93 -2.80 115.95 117.05 3jys h TRP 104 Ca 0.32 -0.00 -0.05 0.00 1.08 0.00 0.00 58.89 60.23 3jys h TRP 104 Cb -0.03 -0.09 -0.02 0.00 -3.00 0.00 0.00 29.16 26.02 3jys h TRP 104 CO -0.00 0.22 0.14 0.00 -1.28 0.00 0.00 178.44 177.52 3jys h THR 106 N 0.81 1.03 -0.25 0.00 2.02 -1.47 0.55 112.91 115.61 3jys h THR 106 Ca 0.18 -0.08 0.04 0.00 0.77 0.00 0.00 66.41 67.32 3jys h THR 106 Cb 0.34 0.99 -0.03 0.00 -1.74 0.00 0.00 68.15 67.70 3jys h THR 106 CO 0.00 0.03 0.03 -0.33 0.37 0.00 0.00 175.52 175.62 3jys h GLU 107 N 0.05 0.11 -0.23 6.66 5.08 -1.28 0.41 114.58 125.38 3jys h GLU 107 Ca 0.02 -0.01 -0.11 0.00 -1.00 0.00 0.00 59.36 58.26 3jys h GLU 107 Cb 0.02 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.24 3jys h GLU 107 CO -0.00 0.07 -0.30 0.28 -1.00 0.00 0.00 179.01 178.06 3jys h VAL 108 N 0.11 1.32 -0.76 3.13 2.07 -0.94 -1.82 116.25 119.37 3jys h VAL 108 Ca 0.12 -1.50 0.17 0.00 0.82 0.00 0.00 66.70 66.31 3jys h VAL 108 Cb 0.13 1.74 -0.12 0.00 -1.52 0.00 0.00 31.29 31.51 3jys h VAL 108 CO -0.17 0.47 0.10 0.78 0.02 0.00 0.00 177.57 178.76 3jys h ASN 109 N 0.32 -0.17 0.00 0.57 2.35 0.42 -3.21 115.58 115.86 3jys h ASN 109 Ca 0.03 0.18 0.00 0.00 -0.55 0.00 0.00 56.30 55.95 3jys h ASN 109 Cb 0.88 0.28 0.00 0.00 0.05 0.00 0.00 38.32 39.53 3jys h ASN 109 CO 0.07 -0.12 0.00 -1.22 -1.65 0.00 0.00 177.43 174.51 3jys n TYR 110 N -5.26 0.00 0.00 1.19 4.01 0.11 -4.55 117.16 112.65 3jys n TYR 110 Ca 0.15 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.89 3jys n TYR 110 Cb 0.49 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.52 3jys n TYR 110 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 3jys n THR 112 N -1.26 0.00 -0.98 -0.72 -2.24 -0.70 -1.12 114.28 107.26 3jys n THR 112 Ca 0.00 0.00 -0.31 0.00 -2.27 0.00 0.00 64.05 61.47 3jys n THR 112 Cb 0.00 0.00 0.13 0.00 -2.10 0.00 0.00 70.33 68.36 3jys n THR 112 CO 0.00 0.00 0.00 -1.66 -0.57 0.00 0.00 175.07 172.84 3jys s TRP 113 N 0.00 2.09 0.00 4.78 -2.14 -1.25 -4.94 118.94 117.48 3jys s TRP 113 Ca 0.00 1.68 0.00 0.00 2.66 0.00 0.00 56.10 60.44 3jys s TRP 113 Cb 0.00 -3.20 0.00 0.00 -3.10 0.00 0.00 33.47 27.17 3jys s TRP 113 CO 0.00 -2.31 0.00 0.25 -2.66 0.00 0.00 176.95 172.23 3jys n THR 114 N -3.86 0.00 1.63 0.66 -2.24 -1.26 -5.01 114.28 104.20 3jys n THR 114 Ca 0.11 0.00 0.15 0.00 -2.27 0.00 0.00 64.05 62.03 3jys n THR 114 Cb 0.52 0.00 0.65 0.00 -2.10 0.00 0.00 70.33 69.40 3jys n THR 114 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3jys n THR 115 N 0.00 0.00 -1.70 4.28 -2.24 -1.26 -4.84 114.28 108.52 3jys n THR 115 Ca 0.00 -0.16 -0.42 0.00 -2.27 0.00 0.00 64.05 61.19 3jys n THR 115 Cb 0.00 0.17 -0.01 0.00 -2.10 0.00 0.00 70.33 68.40 3jys n THR 115 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3jys n ASN 116 N -0.26 2.82 -4.68 3.42 3.02 -1.26 -4.68 115.26 113.64 3jys n ASN 116 Ca 0.20 1.21 -0.45 0.00 -0.03 0.00 0.00 54.58 55.51 3jys n ASN 116 Cb 0.28 -1.49 -0.04 0.00 -0.61 0.00 0.00 39.78 37.92 3jys n ASN 116 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 3jys n LYS 117 N 0.56 2.31 -3.95 3.52 4.81 -1.26 -4.99 118.16 119.16 3jys n LYS 117 Ca 0.05 0.83 -0.29 0.00 -0.87 0.00 0.00 58.31 58.03 3jys n LYS 117 Cb 0.36 -2.61 -0.17 0.00 0.02 0.00 0.00 35.03 32.63 3jys n LYS 117 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 3jys s VAL 118 N 0.87 1.29 0.26 3.15 1.01 -1.26 -4.98 120.40 120.74 3jys s VAL 118 Ca 0.77 -0.58 -0.02 0.00 0.00 0.00 0.00 61.98 62.15 3jys s VAL 118 Cb -0.63 -1.32 0.24 0.00 0.00 0.00 0.00 36.38 34.66 3jys s VAL 118 CO 0.38 0.31 1.76 -0.08 0.00 0.00 0.00 175.10 177.46 3jys h GLU 119 N 8.10 0.58 0.00 2.72 4.81 -1.96 0.30 114.58 129.13 3jys h GLU 119 Ca -0.31 -0.04 -0.11 0.00 -0.13 0.00 0.00 59.36 58.78 3jys h GLU 119 Cb 1.12 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 30.36 3jys h GLU 119 CO 0.45 0.39 -0.50 -1.00 -0.73 0.00 0.00 179.01 177.62 3jys h PRO 120 N 0.60 0.00 0.01 0.92 0.13 -1.97 -1.04 132.00 130.65 3jys h PRO 120 Ca 0.45 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.58 3jys h PRO 120 Cb 0.63 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.76 3jys h PRO 120 CO -0.36 0.50 -0.00 0.82 -0.23 0.00 0.00 178.00 178.72 3jys h ILE 121 N 0.00 1.07 -0.31 -3.56 2.04 -1.31 -1.47 117.51 113.97 3jys h ILE 121 Ca -0.01 -0.24 0.03 0.00 1.00 0.00 0.00 64.86 65.65 3jys h ILE 121 Cb 0.89 1.23 -0.03 0.00 -0.74 0.00 0.00 36.82 38.17 3jys h ILE 121 CO 0.07 0.06 0.11 -0.33 0.00 0.00 0.00 178.15 178.06 3jys h GLU 122 N -0.12 0.24 -0.36 2.37 4.39 -1.31 -2.44 114.58 117.36 3jys h GLU 122 Ca -0.00 -0.01 0.08 0.00 0.34 0.00 0.00 59.36 59.76 3jys h GLU 122 Cb 0.11 -0.05 -0.08 0.00 -0.10 0.00 0.00 28.75 28.63 3jys h GLU 122 CO 0.00 0.16 -0.18 0.78 -1.16 0.00 0.00 179.01 178.61 3jys h GLY 123 N 0.25 0.08 0.81 -3.84 0.00 -1.02 0.06 103.07 99.41 3jys h GLY 123 Ca 0.14 0.23 -0.03 0.00 0.00 0.00 0.00 47.33 47.68 3jys h GLY 123 CO -0.14 -0.19 0.01 -2.08 0.00 0.00 0.00 176.54 174.14 3jys h VAL 124 N -0.12 1.25 0.31 4.60 2.07 -1.13 -1.40 116.25 121.82 3jys h VAL 124 Ca 0.18 -0.82 -0.02 0.00 0.82 0.00 0.00 66.70 66.86 3jys h VAL 124 Cb 0.40 1.46 0.00 0.00 -1.52 0.00 0.00 31.29 31.63 3jys h VAL 124 CO -0.44 0.25 -0.15 0.22 0.02 0.00 0.00 177.57 177.47 3jys h TYR 125 N 0.06 -0.39 -0.70 1.57 3.20 -1.33 -0.70 116.97 118.67 3jys h TYR 125 Ca 0.05 -0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.85 3jys h TYR 125 Cb 0.37 0.13 -0.03 0.00 1.54 0.00 0.00 36.73 38.74 3jys h TYR 125 CO 0.03 -0.20 0.18 1.96 -1.64 0.00 0.00 178.16 178.50 3jys h GLN 126 N -0.49 1.11 -0.22 1.82 1.08 -0.97 -3.17 115.11 114.27 3jys h GLN 126 Ca -0.04 -0.25 -0.08 0.00 -1.45 0.00 0.00 58.65 56.82 3jys h GLN 126 Cb 0.37 -0.15 -0.00 0.00 -0.05 0.00 0.00 27.48 27.64 3jys h GLN 126 CO 0.07 0.97 -0.19 0.00 -0.95 0.00 0.00 178.83 178.73 3jys h ARG 127 N 1.06 0.51 -0.82 1.46 2.47 -1.21 -0.38 114.38 117.46 3jys h ARG 127 Ca 0.22 -0.26 0.00 0.00 -1.26 0.00 0.00 59.98 58.69 3jys h ARG 127 Cb 0.35 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.67 3jys h ARG 127 CO -0.00 0.83 0.00 0.00 0.56 0.00 0.00 179.97 181.36 3jys n TYR 130 N 0.66 0.00 -0.02 0.00 9.36 -0.15 -1.90 117.16 125.11 3jys n TYR 130 Ca 0.00 0.00 -0.09 0.00 3.32 0.00 0.00 57.90 61.13 3jys n TYR 130 Cb 0.00 0.00 -0.04 0.00 -0.63 0.00 0.00 39.34 38.67 3jys n TYR 130 CO 0.00 0.00 0.00 0.82 0.22 0.00 0.00 176.86 177.90 3jys h ILE 131 N 0.00 0.88 -0.23 2.97 2.04 -1.54 -0.32 117.51 121.32 3jys h ILE 131 Ca 0.00 -0.01 0.05 0.00 1.00 0.00 0.00 64.86 65.90 3jys h ILE 131 Cb 0.00 0.85 -0.05 0.00 -0.74 0.00 0.00 36.82 36.88 3jys h ILE 131 CO 0.00 0.01 -0.10 0.58 0.00 0.00 0.00 178.15 178.64 3jys h VAL 132 N 0.03 0.67 -0.43 1.67 2.07 -1.66 -0.28 116.25 118.33 3jys h VAL 132 Ca 0.07 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.66 3jys h VAL 132 Cb 0.09 0.67 -0.06 0.00 -1.52 0.00 0.00 31.29 30.47 3jys h VAL 132 CO -0.13 0.00 0.05 0.00 0.02 0.00 0.00 177.57 177.51 3jys h ALA 133 N 1.14 0.44 -0.36 1.67 0.00 -1.74 -0.65 119.26 119.75 3jys h ALA 133 Ca 0.12 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 3jys h ALA 133 Cb 0.25 0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 3jys h ALA 133 CO -0.27 -0.35 0.19 -0.07 0.00 0.00 0.00 179.25 178.75 3jys h LEU 134 N 0.17 0.46 -0.83 0.00 3.38 -0.63 -1.37 115.31 116.48 3jys h LEU 134 Ca 0.21 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 3jys h LEU 134 Cb 0.28 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.87 3jys h LEU 134 CO -0.30 0.43 0.45 0.58 0.09 0.00 0.00 178.44 179.68 3jys h VAL 135 N 0.46 1.25 -0.60 1.22 2.07 -0.76 -0.47 116.25 119.41 3jys h VAL 135 Ca 0.13 -0.63 -0.09 0.00 0.82 0.00 0.00 66.70 66.94 3jys h VAL 135 Cb 0.07 0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 29.97 3jys h VAL 135 CO -0.02 0.28 0.04 0.78 0.02 0.00 0.00 177.57 178.67 3jys h ASN 136 N 1.16 1.01 -0.48 0.57 2.35 -0.74 0.73 115.58 120.18 3jys h ASN 136 Ca 0.29 -0.29 -0.11 0.00 -0.55 0.00 0.00 56.30 55.64 3jys h ASN 136 Cb 0.05 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.13 3jys h ASN 136 CO -0.05 1.05 -0.13 -0.08 -1.65 0.00 0.00 177.43 176.58 3jys h GLU 137 N 0.94 0.93 -0.08 0.81 4.57 -1.02 -2.21 114.58 118.52 3jys h GLU 137 Ca 0.18 -0.36 0.02 0.00 -1.18 0.00 0.00 59.36 58.02 3jys h GLU 137 Cb 0.51 -0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 29.02 3jys h GLU 137 CO 0.02 1.02 -0.07 0.35 -1.18 0.00 0.00 179.01 179.15 3jys h PHE 138 N 0.78 -0.17 -0.21 0.92 3.57 -0.68 -1.85 116.94 119.29 3jys h PHE 138 Ca 0.12 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.59 3jys h PHE 138 Cb 0.68 0.09 -0.01 0.00 2.79 0.00 0.00 35.95 39.50 3jys h PHE 138 CO 0.05 -0.11 -0.03 -0.07 -2.23 0.00 0.00 178.31 175.92 3jys h LEU 139 N -0.09 0.29 -1.09 0.59 3.38 -0.80 0.61 115.31 118.21 3jys h LEU 139 Ca 0.06 -0.04 -0.09 0.00 0.09 0.00 0.00 57.88 57.89 3jys h LEU 139 Cb 0.17 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 3jys h LEU 139 CO -0.13 0.37 -0.30 0.50 0.09 0.00 0.00 178.44 178.97 3jys h LYS 140 N 0.31 0.27 0.00 1.13 3.64 -0.97 -3.28 116.57 117.67 3jys h LYS 140 Ca 0.07 -0.10 -0.30 0.00 -1.27 0.00 0.00 60.65 59.05 3jys h LYS 140 Cb 0.26 -0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 32.01 3jys h LYS 140 CO 0.01 0.55 -1.82 0.09 -2.27 0.00 0.00 179.45 176.01 3jys n ASN 141 N -4.11 0.75 -0.03 4.20 3.02 -0.52 -4.54 115.26 114.03 3jys n ASN 141 Ca -0.01 0.35 0.22 0.00 -0.03 0.00 0.00 54.58 55.11 3jys n ASN 141 Cb 0.40 0.09 0.70 0.00 -0.61 0.00 0.00 39.78 40.37 3jys n ASN 141 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 3jys h ILE 142 N 0.00 0.68 0.00 2.41 6.09 -0.99 -0.12 117.51 125.59 3jys h ILE 142 Ca -0.33 0.00 -0.01 0.00 -1.37 0.00 0.00 64.86 63.15 3jys h ILE 142 Cb 2.05 0.70 -0.00 0.00 0.47 0.00 0.00 36.82 40.04 3jys h ILE 142 CO 0.07 0.00 -0.07 -0.65 -3.07 0.00 0.00 178.15 174.43 3jys h PRO 143 N 0.00 0.00 -0.07 2.19 0.11 -1.80 -2.00 132.00 130.43 3jys h PRO 143 Ca 0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.39 3jys h PRO 143 Cb 1.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.25 3jys h PRO 143 CO -0.00 0.07 0.00 0.09 -0.21 0.00 0.00 178.00 177.94 3jys n ASN 144 N -3.74 0.75 -4.76 -2.05 3.02 -0.06 -4.94 115.26 103.48 3jys n ASN 144 Ca -0.02 -1.51 -0.40 0.00 -0.03 0.00 0.00 54.58 52.62 3jys n ASN 144 Cb 0.17 -0.04 0.02 0.00 -0.61 0.00 0.00 39.78 39.31 3jys n ASN 144 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3jys s ALA 145 N -1.92 3.19 1.09 5.41 0.00 -0.76 -4.99 121.76 123.79 3jys s ALA 145 Ca 0.31 1.43 -0.13 0.00 0.00 0.00 0.00 51.96 53.57 3jys s ALA 145 Cb 0.16 -3.58 0.20 0.00 0.00 0.00 0.00 23.12 19.90 3jys s ALA 145 CO 0.25 -1.18 0.79 -2.30 0.00 0.00 0.00 175.76 173.32 3jys n PRO 146 N -0.28 -1.67 0.21 0.00 -0.02 -1.26 -4.91 135.00 127.07 3jys n PRO 146 Ca 0.06 -0.45 0.07 0.00 -2.02 0.00 0.00 63.50 61.15 3jys n PRO 146 Cb 0.42 -2.09 0.45 0.00 -0.02 0.00 0.00 33.50 32.26 3jys n PRO 146 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 3jys h GLU 147 N -2.30 0.00 0.00 -0.52 4.57 -2.00 -2.59 114.58 111.74 3jys h GLU 147 Ca -0.54 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.64 3jys h GLU 147 Cb 1.32 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.91 3jys h GLU 147 CO 0.44 0.31 0.00 0.66 -1.18 0.00 0.00 179.01 179.23 3jys h SER 148 N 0.00 0.00 -3.27 1.04 4.64 -2.02 -3.43 113.55 110.51 3jys h SER 148 Ca -0.00 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.74 3jys h SER 148 Cb 0.68 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.70 3jys h SER 148 CO 0.04 0.00 -0.07 -0.63 -0.87 0.00 0.00 176.83 175.30 3jys s ILE 149 N -3.61 5.01 -1.08 0.95 -1.09 -0.98 -5.00 121.20 115.40 3jys s ILE 149 Ca -0.01 1.11 -0.20 0.00 -2.23 0.00 0.00 60.65 59.32 3jys s ILE 149 Cb 0.08 -3.87 0.08 0.00 -1.58 0.00 0.00 42.46 37.18 3jys s ILE 149 CO 0.32 0.41 1.45 -0.62 -1.23 0.00 0.00 174.94 175.27 3jys s ASP 150 N -0.05 6.66 0.19 3.58 -1.08 -1.26 -4.85 116.67 119.85 3jys s ASP 150 Ca 0.29 -1.94 -0.12 0.00 -0.52 0.00 0.00 52.55 50.26 3jys s ASP 150 Cb -0.17 -2.52 0.17 0.00 -1.46 0.00 0.00 42.92 38.94 3jys s ASP 150 CO 0.15 -1.28 1.80 0.11 0.52 0.00 0.00 175.17 176.47 3jys h LYS 151 N 8.86 0.59 -0.80 4.34 1.57 -1.93 -0.64 116.57 128.56 3jys h LYS 151 Ca 0.26 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.99 3jys h LYS 151 Cb 0.97 -0.13 -0.04 0.00 0.08 0.00 0.00 32.23 33.11 3jys h LYS 151 CO 1.36 0.39 0.46 0.93 -0.57 0.00 0.00 179.45 182.01 3jys h GLU 152 N 0.61 1.10 -0.25 3.15 3.07 -1.96 0.37 114.58 120.66 3jys h GLU 152 Ca 0.25 -0.12 -0.09 0.00 -0.50 0.00 0.00 59.36 58.90 3jys h GLU 152 Cb 0.13 -0.22 -0.01 0.00 -0.84 0.00 0.00 28.75 27.81 3jys h GLU 152 CO -0.15 0.80 -0.20 1.03 -1.40 0.00 0.00 179.01 179.08 3jys h SER 153 N 1.10 0.62 -0.54 1.42 0.87 -1.60 -2.32 113.55 113.09 3jys h SER 153 Ca 0.28 -0.45 -0.07 0.00 -1.23 0.00 0.00 61.79 60.33 3jys h SER 153 Cb 0.00 -0.17 -0.03 0.00 -0.44 0.00 0.00 62.40 61.76 3jys h SER 153 CO -0.05 0.94 0.10 1.88 -0.53 0.00 0.00 176.83 179.17 3jys h TYR 154 N 0.30 0.99 -0.38 2.24 -1.99 -0.84 -1.63 116.97 115.65 3jys h TYR 154 Ca 0.05 -0.12 -0.07 0.00 2.00 0.00 0.00 58.73 60.59 3jys h TYR 154 Cb 0.74 -0.28 -0.01 0.00 2.00 0.00 0.00 36.73 39.18 3jys h TYR 154 CO 0.07 0.84 -0.04 0.82 -0.00 0.00 0.00 178.16 179.85 3jys h ILE 155 N 0.89 1.27 -0.87 -2.88 2.04 -0.91 -0.08 117.51 116.97 3jys h ILE 155 Ca 0.18 -1.08 -0.01 0.00 1.00 0.00 0.00 64.86 64.95 3jys h ILE 155 Cb 0.38 1.20 -0.04 0.00 -0.74 0.00 0.00 36.82 37.63 3jys h ILE 155 CO 0.01 0.36 0.49 0.00 0.00 0.00 0.00 178.15 179.01 3jys h ALA 156 N 0.85 1.22 0.07 1.87 0.00 -1.18 -0.51 119.26 121.59 3jys h ALA 156 Ca 0.10 -0.12 -0.20 0.00 0.00 0.00 0.00 54.91 54.69 3jys h ALA 156 Cb 0.53 -0.35 0.02 0.00 0.00 0.00 0.00 17.79 17.99 3jys h ALA 156 CO 0.03 0.64 -0.83 1.96 0.00 0.00 0.00 179.25 181.04 3jys h GLN 157 N 1.21 0.43 -0.41 0.00 4.20 -1.12 -1.08 115.11 118.34 3jys h GLN 157 Ca 0.31 -0.56 0.07 0.00 0.06 0.00 0.00 58.65 58.52 3jys h GLN 157 Cb 0.01 0.18 -0.06 0.00 0.30 0.00 0.00 27.48 27.91 3jys h GLN 157 CO -0.05 1.22 0.04 0.00 -0.67 0.00 0.00 178.83 179.37 3jys h ALA 158 N 0.24 0.41 -0.67 3.87 0.00 -0.93 -2.28 119.26 119.90 3jys h ALA 158 Ca -0.12 0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.90 3jys h ALA 158 Cb 1.57 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 19.48 3jys h ALA 158 CO 0.16 -0.36 0.44 0.00 0.00 0.00 0.00 179.25 179.49 3jys h ARG 159 N 0.15 0.86 -0.31 0.00 3.08 -1.02 -1.67 114.38 115.48 3jys h ARG 159 Ca 0.20 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.20 3jys h ARG 159 Cb 0.27 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 30.11 3jys h ARG 159 CO -0.30 0.57 0.20 0.35 -1.07 0.00 0.00 179.97 179.72 3jys h PHE 160 N 0.89 0.39 -0.53 3.04 3.57 -0.66 0.31 116.94 123.95 3jys h PHE 160 Ca 0.25 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.76 3jys h PHE 160 Cb -0.07 -0.13 -0.03 0.00 2.79 0.00 0.00 35.95 38.52 3jys h PHE 160 CO -0.00 0.25 0.33 -0.91 -2.23 0.00 0.00 178.31 175.74 3jys h ASN 161 N 0.41 0.63 -0.32 0.41 2.35 -0.81 -0.12 115.58 118.11 3jys h ASN 161 Ca 0.11 -0.05 -0.02 0.00 -0.55 0.00 0.00 56.30 55.80 3jys h ASN 161 Cb -0.04 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.16 3jys h ASN 161 CO -0.02 0.49 0.14 -0.09 -1.65 0.00 0.00 177.43 176.29 3jys h ARG 162 N 0.71 0.48 -0.92 0.81 2.43 -1.19 -0.75 114.38 115.95 3jys h ARG 162 Ca 0.19 -0.08 0.07 0.00 -0.81 0.00 0.00 59.98 59.35 3jys h ARG 162 Cb -0.03 -0.08 -0.07 0.00 -0.42 0.00 0.00 29.97 29.37 3jys h ARG 162 CO -0.04 0.47 0.58 0.00 -1.51 0.00 0.00 179.97 179.48 3jys h ALA 163 N 0.98 1.29 -0.35 2.80 0.00 -0.51 -0.79 119.26 122.68 3jys h ALA 163 Ca 0.11 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.84 3jys h ALA 163 Cb 0.17 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 3jys h ALA 163 CO -0.01 0.32 -0.43 0.35 0.00 0.00 0.00 179.25 179.47 3jys h PHE 164 N 1.03 1.11 -0.68 0.00 3.57 -0.80 0.05 116.94 121.22 3jys h PHE 164 Ca 0.41 -0.35 -0.04 0.00 3.53 0.00 0.00 57.97 61.52 3jys h PHE 164 Cb 0.22 -0.23 -0.03 0.00 2.79 0.00 0.00 35.95 38.70 3jys h PHE 164 CO -0.02 1.18 0.28 0.00 -2.23 0.00 0.00 178.31 177.52 3jys h ALA 165 N 0.76 0.88 -0.12 2.41 0.00 -0.83 -0.51 119.26 121.85 3jys h ALA 165 Ca 0.05 -0.17 -0.11 0.00 0.00 0.00 0.00 54.91 54.68 3jys h ALA 165 Cb 1.03 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 3jys h ALA 165 CO 0.10 0.49 -0.40 1.88 0.00 0.00 0.00 179.25 181.32 3jys h TYR 166 N 0.96 0.31 -0.12 0.00 0.05 -1.05 -1.87 116.97 115.25 3jys h TYR 166 Ca 0.23 -0.08 0.00 0.00 0.05 0.00 0.00 58.73 58.92 3jys h TYR 166 Cb 0.19 -0.07 -0.01 0.00 1.01 0.00 0.00 36.73 37.86 3jys h TYR 166 CO 0.01 0.64 0.08 -0.92 -1.05 0.00 0.00 178.16 176.91 3jys h TYR 167 N 0.22 0.15 -0.41 4.88 3.20 -0.21 -3.04 116.97 121.76 3jys h TYR 167 Ca 0.02 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.87 3jys h TYR 167 Cb 0.82 -0.05 -0.02 0.00 1.54 0.00 0.00 36.73 39.02 3jys h TYR 167 CO 0.02 0.11 0.17 0.28 -1.64 0.00 0.00 178.16 177.09 3jys h VAL 168 N 0.15 1.20 0.00 1.81 2.07 -0.94 -0.06 116.25 120.48 3jys h VAL 168 Ca 0.04 -0.60 0.00 0.00 0.82 0.00 0.00 66.70 66.96 3jys h VAL 168 Cb -0.00 0.82 0.00 0.00 -1.52 0.00 0.00 31.29 30.59 3jys h VAL 168 CO -0.01 0.22 0.00 0.18 0.02 0.00 0.00 177.57 177.98 3jys n LEU 169 N -4.64 0.00 0.00 2.57 4.77 -0.72 -4.38 117.00 114.60 3jys n LEU 169 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 3jys n LEU 169 Cb 0.14 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 3jys n LEU 169 CO 0.37 0.00 0.00 -0.67 -1.33 0.00 0.00 177.39 175.76 3jys n ASP 171 N 0.57 0.00 0.01 -1.43 2.03 -0.04 -2.14 116.55 115.54 3jys n ASP 171 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 3jys n ASP 171 Cb 0.00 -0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 3jys n ASP 171 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 3jys n PHE 173 N 0.00 0.00 0.00 -0.67 3.72 -1.26 -4.91 117.46 114.34 3jys n PHE 173 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 3jys n PHE 173 Cb 0.00 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.54 3jys n PHE 173 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3jys n ALA 174 N -0.19 0.00 -2.89 4.37 0.00 -0.91 -4.56 120.51 116.33 3jys n ALA 174 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.23 3jys n ALA 174 Cb 0.04 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.47 3jys n ALA 174 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3jys n LEU 175 N 0.00 2.86 -4.76 0.00 4.77 -1.26 -4.28 117.00 114.34 3jys n LEU 175 Ca 0.00 -5.06 -0.31 0.00 -0.03 0.00 0.00 56.01 50.61 3jys n LEU 175 Cb 0.00 0.03 0.10 0.00 -2.33 0.00 0.00 43.42 41.22 3jys n LEU 175 CO 0.00 2.18 0.69 -2.16 -1.33 0.00 0.00 177.39 176.78 3jys s PRO 176 N -3.10 2.07 0.34 3.23 0.04 -1.26 -4.79 135.00 131.53 3jys s PRO 176 Ca 0.42 1.14 -0.29 0.00 0.04 0.00 0.00 61.00 62.31 3jys s PRO 176 Cb 0.35 -1.88 -0.11 0.00 0.04 0.00 0.00 34.50 32.90 3jys s PRO 176 CO -0.10 -1.76 1.54 -0.35 0.04 0.00 0.00 177.00 176.36 3jys n PRO 177 N -3.60 2.69 -3.54 0.56 -0.04 -1.26 -4.16 135.00 125.64 3jys n PRO 177 Ca 0.09 0.95 -0.41 0.00 -0.04 0.00 0.00 63.50 64.08 3jys n PRO 177 Cb 0.53 -2.70 -0.09 0.00 -0.04 0.00 0.00 33.50 31.20 3jys n PRO 177 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 3jys s PHE 178 N -0.59 3.31 -0.09 0.54 5.36 -0.46 -4.90 117.98 121.14 3jys s PHE 178 Ca 0.58 -1.34 -0.01 0.00 -0.96 0.00 0.00 56.93 55.20 3jys s PHE 178 Cb -0.49 -3.01 0.03 0.00 -0.34 0.00 0.00 43.02 39.21 3jys s PHE 178 CO 0.57 -0.83 -0.03 -1.50 -1.46 0.00 0.00 175.22 171.97 3jys s ILE 179 N 1.49 0.64 0.50 3.12 1.10 -1.26 -4.57 121.20 122.22 3jys s ILE 179 Ca 0.03 -0.06 0.00 0.00 -0.51 0.00 0.00 60.65 60.12 3jys s ILE 179 Cb -0.23 -0.75 -0.00 0.00 0.15 0.00 0.00 42.46 41.62 3jys s ILE 179 CO 0.03 0.29 0.02 0.35 -2.11 0.00 0.00 174.94 173.52 3jys n THR 180 N 5.06 0.00 0.42 4.00 -2.24 -1.26 -4.94 114.28 115.33 3jys n THR 180 Ca -0.09 -2.42 0.09 0.00 -2.27 0.00 0.00 64.05 59.35 3jys n THR 180 Cb 0.50 0.53 0.38 0.00 -2.10 0.00 0.00 70.33 69.63 3jys n THR 180 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 3jys n GLU 181 N -1.24 0.08 -0.00 -0.78 0.00 -1.26 -3.30 120.64 114.13 3jys n GLU 181 Ca -0.20 0.35 0.09 0.00 0.00 0.00 0.00 57.16 57.40 3jys n GLU 181 Cb 0.65 -1.66 -0.13 0.00 0.00 0.00 0.00 31.44 30.30 3jys n GLU 181 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 3jys n LYS 182 N -1.82 0.62 -0.82 3.44 5.02 -1.26 -4.53 118.16 118.81 3jys n LYS 182 Ca 0.03 -0.07 0.05 0.00 -2.02 0.00 0.00 58.31 56.30 3jys n LYS 182 Cb 0.18 -1.43 0.12 0.00 -0.02 0.00 0.00 35.03 33.88 3jys n LYS 182 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 3jys n ASN 183 N -1.73 1.42 -4.30 4.39 0.23 -1.21 -5.10 115.26 108.97 3jys n ASN 183 Ca 0.01 -3.04 -0.52 0.00 -0.53 0.00 0.00 54.58 50.49 3jys n ASN 183 Cb 0.38 -0.42 -0.06 0.00 -2.08 0.00 0.00 39.78 37.61 3jys n ASN 183 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3jys n TYR 184 N -0.55 0.15 -3.62 -2.53 9.36 -1.24 -4.80 117.16 113.93 3jys n TYR 184 Ca 0.13 0.99 -0.13 0.00 3.32 0.00 0.00 57.90 62.20 3jys n TYR 184 Cb 0.83 -1.96 -0.07 0.00 -0.63 0.00 0.00 39.34 37.51 3jys n TYR 184 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 3jys s SER 185 N -0.41 -0.68 0.36 2.98 0.15 -1.26 -5.05 113.70 109.79 3jys s SER 185 Ca 0.77 1.25 0.10 0.00 0.70 0.00 0.00 55.95 58.77 3jys s SER 185 Cb -1.08 1.25 0.70 0.00 -1.71 0.00 0.00 66.02 65.17 3jys s SER 185 CO 0.55 -0.27 1.84 0.40 1.20 0.00 0.00 173.24 176.95 3jys h ILE 186 N 3.80 1.24 -2.28 6.45 2.04 -2.01 -3.37 117.51 123.36 3jys h ILE 186 Ca -0.28 -1.12 -0.59 0.00 1.00 0.00 0.00 64.86 63.87 3jys h ILE 186 Cb 1.16 1.50 -0.40 0.00 -0.74 0.00 0.00 36.82 38.34 3jys h ILE 186 CO 0.10 0.33 -0.85 -0.62 0.00 0.00 0.00 178.15 177.12 3jys n GLU 187 N -4.16 1.36 -2.21 2.37 1.02 -1.26 -4.94 120.64 112.82 3jys n GLU 187 Ca -0.01 -3.85 -0.38 0.00 -0.02 0.00 0.00 57.16 52.89 3jys n GLU 187 Cb 0.36 -1.78 -0.01 0.00 -0.02 0.00 0.00 31.44 30.00 3jys n GLU 187 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 3jys s PRO 188 N -1.42 3.93 0.44 3.49 0.04 -1.26 -4.65 135.00 135.57 3jys s PRO 188 Ca 0.35 1.92 -0.13 0.00 0.04 0.00 0.00 61.00 63.18 3jys s PRO 188 Cb 0.11 -2.62 -0.07 0.00 0.04 0.00 0.00 34.50 31.95 3jys s PRO 188 CO -0.10 -0.44 0.84 0.00 0.04 0.00 0.00 177.00 177.33 3jys s ALA 189 N -1.40 3.25 0.44 8.56 0.00 -1.26 -4.57 121.76 126.78 3jys s ALA 189 Ca 0.59 -0.05 -0.21 0.00 0.00 0.00 0.00 51.96 52.29 3jys s ALA 189 Cb -0.32 -2.85 -0.11 0.00 0.00 0.00 0.00 23.12 19.84 3jys s ALA 189 CO 0.41 -0.06 0.95 -1.25 0.00 0.00 0.00 175.76 175.81 3jys s PRO 190 N -3.86 4.20 0.72 0.00 0.04 -1.26 -1.36 135.00 133.48 3jys s PRO 190 Ca 0.54 1.10 -0.10 0.00 0.04 0.00 0.00 61.00 62.58 3jys s PRO 190 Cb -0.10 -2.17 0.04 0.00 0.04 0.00 0.00 34.50 32.30 3jys s PRO 190 CO 0.30 -0.06 1.08 -0.51 0.04 0.00 0.00 177.00 177.86 3jys s LEU 191 N -3.27 2.83 0.77 -3.56 1.43 -1.26 -4.88 118.68 110.74 3jys s LEU 191 Ca 0.62 0.91 -0.14 0.00 -1.03 0.00 0.00 54.13 54.49 3jys s LEU 191 Cb -0.09 -3.62 0.06 0.00 0.03 0.00 0.00 46.19 42.57 3jys s LEU 191 CO 0.15 -1.48 1.18 -0.94 0.23 0.00 0.00 176.35 175.49 3jys s SER 192 N -4.43 4.01 0.30 2.29 1.04 -1.26 -4.80 113.70 110.86 3jys s SER 192 Ca 0.59 2.26 0.02 0.00 0.48 0.00 0.00 55.95 59.30 3jys s SER 192 Cb -0.11 -2.58 0.58 0.00 0.10 0.00 0.00 66.02 64.02 3jys s SER 192 CO 0.49 -2.38 1.88 -0.09 0.98 0.00 0.00 173.24 174.13 3jys h ARG 193 N -0.66 0.94 -0.34 4.02 2.43 -1.86 -0.94 114.38 117.96 3jys h ARG 193 Ca -0.46 -0.06 -0.10 0.00 -0.81 0.00 0.00 59.98 58.55 3jys h ARG 193 Cb 1.28 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 30.61 3jys h ARG 193 CO 0.48 0.62 -0.17 1.49 -1.51 0.00 0.00 179.97 180.88 3jys h GLU 194 N 0.97 0.72 -0.54 0.20 4.81 -1.91 -1.68 114.58 117.16 3jys h GLU 194 Ca 0.43 -0.32 -0.06 0.00 -0.13 0.00 0.00 59.36 59.29 3jys h GLU 194 Cb 0.38 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.71 3jys h GLU 194 CO -0.19 0.93 0.10 -0.44 -0.73 0.00 0.00 179.01 178.68 3jys h ASP 195 N 0.50 0.79 -0.13 1.04 3.32 -1.76 -0.67 116.42 119.50 3jys h ASP 195 Ca 0.08 -0.15 -0.01 0.00 0.02 0.00 0.00 57.03 56.97 3jys h ASP 195 Cb 0.72 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.05 3jys h ASP 195 CO 0.05 0.79 0.05 0.25 -1.72 0.00 0.00 179.24 178.66 3jys h LEU 196 N 0.80 0.17 -0.45 1.55 5.85 -1.09 -0.79 115.31 121.35 3jys h LEU 196 Ca 0.17 -0.16 0.09 0.00 0.84 0.00 0.00 57.88 58.83 3jys h LEU 196 Cb 0.33 -0.04 -0.09 0.00 0.37 0.00 0.00 40.66 41.23 3jys h LEU 196 CO 0.00 0.28 -0.20 0.15 -0.34 0.00 0.00 178.44 178.33 3jys h PHE 197 N 0.05 -0.50 -0.98 1.25 3.04 -1.02 -0.27 116.94 118.51 3jys h PHE 197 Ca 0.04 0.05 0.00 0.00 3.98 0.00 0.00 57.97 62.04 3jys h PHE 197 Cb 0.16 0.29 -0.05 0.00 2.56 0.00 0.00 35.95 38.91 3jys h PHE 197 CO -0.02 -0.28 0.62 -0.91 -2.02 0.00 0.00 178.31 175.70 3jys h ASN 198 N -0.11 1.15 -0.26 0.41 2.35 -0.83 -0.45 115.58 117.85 3jys h ASN 198 Ca 0.21 -0.05 -0.04 0.00 -0.55 0.00 0.00 56.30 55.88 3jys h ASN 198 Cb 0.44 -0.29 -0.01 0.00 0.05 0.00 0.00 38.32 38.51 3jys h ASN 198 CO -0.52 0.85 0.02 -0.25 -1.65 0.00 0.00 177.43 175.89 3jys h TRP 199 N 1.34 0.47 -0.45 1.19 7.01 -0.44 -1.99 115.95 123.09 3jys h TRP 199 Ca 0.36 -0.07 0.02 0.00 2.11 0.00 0.00 58.89 61.30 3jys h TRP 199 Cb -0.11 -0.13 -0.03 0.00 -2.10 0.00 0.00 29.16 26.79 3jys h TRP 199 CO 0.00 0.58 0.27 0.82 -2.79 0.00 0.00 178.44 177.32 3jys h ILE 200 N 0.23 1.06 -0.77 2.65 2.04 -0.71 -0.20 117.51 121.82 3jys h ILE 200 Ca 0.08 -0.19 0.03 0.00 1.00 0.00 0.00 64.86 65.78 3jys h ILE 200 Cb 0.38 0.46 -0.05 0.00 -0.74 0.00 0.00 36.82 36.87 3jys h ILE 200 CO 0.01 0.10 0.49 -0.08 0.00 0.00 0.00 178.15 178.67 3jys h GLU 201 N 0.55 0.93 -0.15 2.37 4.81 -1.02 -1.30 114.58 120.77 3jys h GLU 201 Ca 0.18 -0.06 -0.14 0.00 -0.13 0.00 0.00 59.36 59.21 3jys h GLU 201 Cb -0.01 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.15 3jys h GLU 201 CO -0.07 0.62 -0.49 0.00 -0.73 0.00 0.00 179.01 178.33 3jys h ALA 202 N 1.32 0.87 0.25 2.92 0.00 -0.80 -0.55 119.26 123.27 3jys h ALA 202 Ca 0.31 -0.48 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 3jys h ALA 202 Cb 0.01 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 3jys h ALA 202 CO -0.11 0.67 -0.22 0.93 0.00 0.00 0.00 179.25 180.52 3jys h GLU 203 N 0.32 -0.47 -0.52 0.00 4.39 -0.51 -1.56 114.58 116.24 3jys h GLU 203 Ca 0.01 0.03 -0.05 0.00 0.34 0.00 0.00 59.36 59.70 3jys h GLU 203 Cb 0.99 0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 29.72 3jys h GLU 203 CO 0.09 -0.31 0.15 -0.07 -1.16 0.00 0.00 179.01 177.70 3jys h LEU 204 N -0.49 0.77 -0.84 1.33 3.38 -0.93 -0.75 115.31 117.79 3jys h LEU 204 Ca -0.01 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 57.73 3jys h LEU 204 Cb 0.44 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.95 3jys h LEU 204 CO -0.03 0.79 0.46 0.78 0.09 0.00 0.00 178.44 180.52 3jys h ASN 205 N 0.72 1.05 -0.23 -0.43 2.35 -1.13 -2.26 115.58 115.64 3jys h ASN 205 Ca 0.17 -0.10 -0.16 0.00 -0.55 0.00 0.00 56.30 55.66 3jys h ASN 205 Cb 0.30 -0.27 0.00 0.00 0.05 0.00 0.00 38.32 38.41 3jys h ASN 205 CO -0.00 0.85 -0.48 -0.08 -1.65 0.00 0.00 177.43 176.06 3jys h GLU 206 N 1.16 0.73 0.00 0.81 4.81 -0.93 -3.30 114.58 117.86 3jys h GLU 206 Ca 0.29 -0.48 0.00 0.00 -0.13 0.00 0.00 59.36 59.04 3jys h GLU 206 Cb 0.03 0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.48 3jys h GLU 206 CO -0.05 1.10 0.00 -0.84 -0.73 0.00 0.00 179.01 178.50 3jys h ILE 207 N 0.45 0.00 -0.54 2.32 3.07 -1.05 -3.38 117.51 118.38 3jys h ILE 207 Ca 0.00 -0.73 0.02 0.00 1.55 0.00 0.00 64.86 65.70 3jys h ILE 207 Cb 1.09 1.72 -0.03 0.00 -0.27 0.00 0.00 36.82 39.33 3jys h ILE 207 CO 0.11 0.00 0.34 0.50 -1.05 0.00 0.00 178.15 178.04 3jys h LYS 208 N 0.00 0.65 0.00 0.16 3.64 -1.49 0.00 116.57 119.54 3jys h LYS 208 Ca 0.00 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 3jys h LYS 208 Cb 0.83 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.51 3jys h LYS 208 CO 0.00 0.43 0.00 -0.35 -2.27 0.00 0.00 179.45 177.26 3jys n PRO 209 N -4.75 0.03 -0.00 1.90 -0.04 -1.26 -2.29 135.00 128.58 3jys n PRO 209 Ca 0.04 0.33 0.11 0.00 -0.04 0.00 0.00 63.50 63.94 3jys n PRO 209 Cb 0.06 -1.56 0.09 0.00 -0.04 0.00 0.00 33.50 32.05 3jys n PRO 209 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3jys n ASN 210 N -1.61 2.80 -4.88 3.54 4.13 -0.04 -4.97 115.26 114.23 3jys n ASN 210 Ca 0.02 -1.90 -0.30 0.00 1.68 0.00 0.00 54.58 54.09 3jys n ASN 210 Cb 0.14 -0.00 -0.02 0.00 -1.54 0.00 0.00 39.78 38.36 3jys n ASN 210 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 3jys s LEU 211 N -1.79 3.66 0.81 3.41 1.43 -0.97 -4.41 118.68 120.82 3jys s LEU 211 Ca 0.25 1.16 -0.14 0.00 -1.03 0.00 0.00 54.13 54.38 3jys s LEU 211 Cb 0.18 -4.10 0.05 0.00 0.03 0.00 0.00 46.19 42.36 3jys s LEU 211 CO 0.27 -0.55 0.96 -2.65 0.23 0.00 0.00 176.35 174.62 3jys n PRO 212 N -1.84 0.13 -1.71 1.29 -0.02 -1.26 -4.54 135.00 127.05 3jys n PRO 212 Ca 0.03 0.11 -0.33 0.00 -2.02 0.00 0.00 63.50 61.29 3jys n PRO 212 Cb 0.54 -2.24 0.05 0.00 -0.02 0.00 0.00 33.50 31.83 3jys n PRO 212 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3jys s SER 213 N -1.99 5.08 0.30 2.55 1.04 -1.26 -1.04 113.70 118.38 3jys s SER 213 Ca 0.69 1.95 -0.30 0.00 0.48 0.00 0.00 55.95 58.78 3jys s SER 213 Cb -0.29 -2.54 -0.12 0.00 0.10 0.00 0.00 66.02 63.16 3jys s SER 213 CO 0.55 -1.65 1.46 -2.65 0.98 0.00 0.00 173.24 171.93 3jys n PRO 214 N -2.56 2.37 -1.13 4.02 -0.02 -1.26 -2.21 135.00 134.21 3jys n PRO 214 Ca 0.10 0.84 -0.05 0.00 -2.02 0.00 0.00 63.50 62.37 3jys n PRO 214 Cb 0.52 -2.54 -0.02 0.00 -0.02 0.00 0.00 33.50 31.45 3jys n PRO 214 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3jys n ARG 215 N 1.60 -1.08 0.01 -0.52 1.74 -1.26 -4.87 116.66 112.28 3jys n ARG 215 Ca 0.08 0.54 0.11 0.00 -0.77 0.00 0.00 57.85 57.81 3jys n ARG 215 Cb 0.35 -4.48 0.48 0.00 -1.02 0.00 0.00 32.46 27.79 3jys n ARG 215 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 3jys n SER 216 N -0.39 0.07 -3.28 0.55 3.41 -0.94 -4.64 113.62 108.39 3jys n SER 216 Ca -0.05 0.51 0.03 0.00 -0.26 0.00 0.00 58.87 59.11 3jys n SER 216 Cb 0.34 -0.53 -0.03 0.00 -0.26 0.00 0.00 64.21 63.74 3jys n SER 216 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 3jys s GLU 217 N -3.02 0.36 0.07 4.33 2.12 -1.26 -5.07 118.70 116.23 3jys s GLU 217 Ca 0.11 0.75 -0.31 0.00 0.36 0.00 0.00 54.97 55.88 3jys s GLU 217 Cb 0.15 0.43 -0.09 0.00 0.26 0.00 0.00 34.13 34.88 3jys s GLU 217 CO 0.42 -0.27 1.71 -0.47 -0.54 0.00 0.00 175.26 176.11 3jys s TYR 218 N 2.76 2.27 0.00 5.30 5.04 -1.26 -1.60 117.35 129.85 3jys s TYR 218 Ca 0.03 0.19 0.00 0.00 -2.44 0.00 0.00 57.07 54.86 3jys s TYR 218 Cb -0.10 -4.03 0.00 0.00 0.35 0.00 0.00 41.96 38.18 3jys s TYR 218 CO -0.16 -4.19 0.00 0.41 -1.34 0.00 0.00 175.55 170.27 3jys n GLY 219 N 4.09 3.09 3.82 8.97 0.00 -1.26 -5.05 105.19 118.84 3jys n GLY 219 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 3jys n GLY 219 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3jys s VAL 220 N -2.73 4.49 -0.81 1.61 1.01 -0.63 -4.86 120.40 118.48 3jys s VAL 220 Ca 0.00 1.35 -0.26 0.00 0.00 0.00 0.00 61.98 63.08 3jys s VAL 220 Cb 0.00 -3.78 0.02 0.00 0.00 0.00 0.00 36.38 32.62 3jys s VAL 220 CO 0.00 -0.01 1.45 0.00 0.00 0.00 0.00 175.10 176.55 3jys s ALA 221 N -1.79 2.58 0.64 5.51 0.00 -1.26 -4.93 121.76 122.51 3jys s ALA 221 Ca 0.51 -1.52 0.02 0.00 0.00 0.00 0.00 51.96 50.97 3jys s ALA 221 Cb -0.14 -4.36 0.11 0.00 0.00 0.00 0.00 23.12 18.73 3jys s ALA 221 CO 0.19 -3.57 0.82 -0.40 0.00 0.00 0.00 175.76 172.80 3jys n ASP 222 N 10.04 1.39 -0.33 0.00 5.68 -1.26 -4.36 116.55 127.70 3jys n ASP 222 Ca 0.16 -2.10 0.06 0.00 -0.50 0.00 0.00 54.79 52.41 3jys n ASP 222 Cb 0.50 -0.51 0.25 0.00 -1.14 0.00 0.00 41.12 40.22 3jys n ASP 222 CO 0.00 0.00 0.00 1.56 -1.33 0.00 0.00 177.20 177.43 3jys h GLN 223 N 0.00 0.97 -0.10 0.11 4.20 -1.33 -1.72 115.11 117.24 3jys h GLN 223 Ca -0.27 -0.06 -0.12 0.00 0.06 0.00 0.00 58.65 58.26 3jys h GLN 223 Cb 1.08 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 28.63 3jys h GLN 223 CO 0.32 0.64 -0.46 0.00 -0.67 0.00 0.00 178.83 178.66 3jys h ALA 224 N 1.53 1.03 -0.42 3.87 0.00 -1.92 -2.13 119.26 121.22 3jys h ALA 224 Ca 0.45 -0.45 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 3jys h ALA 224 Cb 0.38 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 3jys h ALA 224 CO -0.21 0.63 0.16 0.28 0.00 0.00 0.00 179.25 180.11 3jys h VAL 225 N 0.20 1.21 -0.95 0.00 2.07 -1.63 0.74 116.25 117.88 3jys h VAL 225 Ca 0.01 -0.65 0.00 0.00 0.82 0.00 0.00 66.70 66.89 3jys h VAL 225 Cb 0.90 0.84 -0.05 0.00 -1.52 0.00 0.00 31.29 31.47 3jys h VAL 225 CO 0.07 0.23 0.61 0.00 0.02 0.00 0.00 177.57 178.51 3jys h ALA 226 N 1.00 1.21 -0.23 1.67 0.00 -1.28 -1.12 119.26 120.51 3jys h ALA 226 Ca 0.14 -0.08 -0.14 0.00 0.00 0.00 0.00 54.91 54.83 3jys h ALA 226 Cb 0.21 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 3jys h ALA 226 CO -0.01 0.63 -0.43 0.77 0.00 0.00 0.00 179.25 180.21 3jys h SER 227 N 1.30 0.61 -0.62 0.00 0.02 -1.02 -1.39 113.55 112.44 3jys h SER 227 Ca 0.35 -0.28 -0.06 0.00 -0.84 0.00 0.00 61.79 60.95 3jys h SER 227 Cb -0.12 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.22 3jys h SER 227 CO -0.07 0.96 0.15 0.00 -1.14 0.00 0.00 176.83 176.73 3jys h ALA 228 N 1.06 1.05 -0.30 3.77 0.00 -0.25 -0.34 119.26 124.25 3jys h ALA 228 Ca 0.03 -0.24 -0.11 0.00 0.00 0.00 0.00 54.91 54.60 3jys h ALA 228 Cb 0.94 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 3jys h ALA 228 CO 0.08 0.63 -0.23 1.25 0.00 0.00 0.00 179.25 180.98 3jys h LEU 229 N 0.97 0.72 -0.87 0.00 5.85 -1.02 -2.15 115.31 118.81 3jys h LEU 229 Ca 0.20 -0.45 0.02 0.00 0.84 0.00 0.00 57.88 58.50 3jys h LEU 229 Cb 0.35 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 41.13 3jys h LEU 229 CO 0.00 1.02 0.57 -0.07 -0.34 0.00 0.00 178.44 179.62 3jys h LEU 230 N 0.44 0.96 -0.74 2.25 3.38 -1.04 -2.52 115.31 118.03 3jys h LEU 230 Ca 0.06 -0.01 0.05 0.00 0.09 0.00 0.00 57.88 58.07 3jys h LEU 230 Cb 0.79 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 41.26 3jys h LEU 230 CO 0.06 0.68 0.44 0.00 0.09 0.00 0.00 178.44 179.71 3jys h ALA 231 N 1.34 1.00 0.00 1.53 0.00 -0.77 0.18 119.26 122.54 3jys h ALA 231 Ca 0.34 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.25 3jys h ALA 231 Cb -0.05 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.55 3jys h ALA 231 CO -0.10 0.17 0.00 -2.13 0.00 0.00 0.00 179.25 177.19 3jys n ARG 232 N -4.70 0.53 0.00 0.00 0.63 -0.83 -1.06 116.66 111.23 3jys n ARG 232 Ca 0.10 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.03 3jys n ARG 232 Cb 0.16 -1.24 0.00 0.00 0.45 0.00 0.00 32.46 31.82 3jys n ARG 232 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 3jys n TYR 234 N 0.58 0.00 -0.31 -0.14 4.01 0.63 -3.08 117.16 118.84 3jys n TYR 234 Ca 0.00 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 57.85 3jys n TYR 234 Cb 0.22 0.00 0.28 0.00 -0.31 0.00 0.00 39.34 39.53 3jys n TYR 234 CO 0.00 0.00 0.00 1.25 -0.46 0.00 0.00 176.86 177.65 3jys h LEU 235 N 0.00 0.53 -2.25 7.72 5.85 -1.33 -1.96 115.31 123.88 3jys h LEU 235 Ca 0.00 0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.83 3jys h LEU 235 Cb 0.00 0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.06 3jys h LEU 235 CO 0.00 0.16 0.00 0.59 -0.34 0.00 0.00 178.44 178.85 3jys n ASN 236 N -4.90 3.37 0.15 1.25 3.02 -1.18 -4.60 115.26 112.37 3jys n ASN 236 Ca 0.20 -2.21 0.00 0.00 -0.03 0.00 0.00 54.58 52.55 3jys n ASN 236 Cb 0.54 -0.45 0.27 0.00 -0.61 0.00 0.00 39.78 39.53 3jys n ASN 236 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3jys h ALA 237 N 3.83 1.19 -0.65 5.41 0.00 -1.62 -1.69 119.26 125.74 3jys h ALA 237 Ca 0.00 -0.42 -0.03 0.00 0.00 0.00 0.00 54.91 54.46 3jys h ALA 237 Cb 0.98 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.67 3jys h ALA 237 CO 0.11 0.59 0.29 1.49 0.00 0.00 0.00 179.25 181.73 3jys h GLU 238 N 0.05 0.92 0.13 0.00 4.81 -1.78 0.19 114.58 118.90 3jys h GLU 238 Ca 0.00 -0.13 -0.01 0.00 -0.13 0.00 0.00 59.36 59.09 3jys h GLU 238 Cb 0.83 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 30.04 3jys h GLU 238 CO 0.06 0.73 -0.06 0.82 -0.73 0.00 0.00 179.01 179.83 3jys h ILE 239 N 0.92 0.99 0.00 2.32 1.08 -1.67 -0.95 117.51 120.20 3jys h ILE 239 Ca 0.22 -0.46 -0.11 0.00 -0.39 0.00 0.00 64.86 64.13 3jys h ILE 239 Cb 0.12 1.28 -0.02 0.00 -3.07 0.00 0.00 36.82 35.13 3jys h ILE 239 CO -0.03 0.11 -0.51 1.88 -0.69 0.00 0.00 178.15 178.91 3jys h TYR 240 N -0.38 0.00 0.00 1.37 0.05 -0.91 -3.37 116.97 113.73 3jys h TYR 240 Ca -0.02 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.76 3jys h TYR 240 Cb 0.31 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.05 3jys h TYR 240 CO -0.00 0.51 -0.17 0.25 -1.05 0.00 0.00 178.16 177.70 3jys n THR 241 N -3.48 0.00 -0.46 -2.88 -2.24 0.61 -3.60 114.28 102.24 3jys n THR 241 Ca 0.00 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.53 3jys n THR 241 Cb 0.63 0.83 0.00 0.00 -2.10 0.00 0.00 70.33 69.69 3jys n THR 241 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3jys n GLY 242 N 0.92 1.53 2.97 3.38 0.00 -0.36 -4.91 105.19 108.72 3jys n GLY 242 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 3jys n GLY 242 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3jys s LYS 243 N -0.20 1.38 0.51 1.61 1.02 -1.25 -4.90 119.74 117.90 3jys s LYS 243 Ca 0.00 -0.30 -0.20 0.00 0.02 0.00 0.00 55.97 55.49 3jys s LYS 243 Cb 0.00 -1.20 -0.07 0.00 -0.52 0.00 0.00 37.83 36.04 3jys s LYS 243 CO 0.00 -0.02 1.09 0.00 -0.92 0.00 0.00 175.35 175.51 3jys s ALA 244 N 0.76 2.81 -0.32 5.17 0.00 -1.26 -2.86 121.76 126.06 3jys s ALA 244 Ca -0.13 0.74 0.17 0.00 0.00 0.00 0.00 51.96 52.75 3jys s ALA 244 Cb -0.15 -3.32 0.46 0.00 0.00 0.00 0.00 23.12 20.11 3jys s ALA 244 CO 0.02 -0.55 1.07 0.54 0.00 0.00 0.00 175.76 176.84 3jys n ARG 245 N -1.04 1.28 -0.01 0.00 5.12 -1.26 -4.90 116.66 115.84 3jys n ARG 245 Ca 0.10 -3.00 -0.10 0.00 -1.93 0.00 0.00 57.85 52.92 3jys n ARG 245 Cb 0.51 -1.06 0.05 0.00 -1.16 0.00 0.00 32.46 30.80 3jys n ARG 245 CO 0.00 0.00 0.00 1.88 -1.93 0.00 0.00 177.63 177.58 3jys h TYR 246 N 2.69 0.75 -0.32 -1.55 0.05 -1.90 -0.72 116.97 115.96 3jys h TYR 246 Ca -0.15 -0.26 -0.00 0.00 0.05 0.00 0.00 58.73 58.37 3jys h TYR 246 Cb 1.22 -0.15 -0.02 0.00 1.01 0.00 0.00 36.73 38.80 3jys h TYR 246 CO 0.42 1.00 0.19 1.15 -1.05 0.00 0.00 178.16 179.86 3jys h THR 247 N 0.47 1.12 -0.33 -2.88 2.02 -1.89 -1.41 112.91 110.01 3jys h THR 247 Ca 0.02 -0.28 -0.05 0.00 0.77 0.00 0.00 66.41 66.87 3jys h THR 247 Cb 1.06 0.72 -0.02 0.00 -1.74 0.00 0.00 68.15 68.18 3jys h THR 247 CO 0.10 0.12 -0.01 -0.33 0.37 0.00 0.00 175.52 175.77 3jys h GLU 248 N 0.41 0.51 -0.17 6.66 3.07 -1.90 -0.60 114.58 122.56 3jys h GLU 248 Ca 0.11 -0.11 0.03 0.00 -0.50 0.00 0.00 59.36 58.89 3jys h GLU 248 Cb 0.02 -0.07 -0.03 0.00 -0.84 0.00 0.00 28.75 27.83 3jys h GLU 248 CO -0.02 0.54 -0.01 0.00 -1.40 0.00 0.00 179.01 178.12 3jys h ILE 250 N 0.05 1.16 -0.56 0.00 2.04 -0.69 -0.26 117.51 119.25 3jys h ILE 250 Ca 0.08 -0.30 0.02 0.00 1.00 0.00 0.00 64.86 65.66 3jys h ILE 250 Cb 0.10 0.30 -0.04 0.00 -0.74 0.00 0.00 36.82 36.44 3jys h ILE 250 CO -0.14 0.15 0.34 0.78 0.00 0.00 0.00 178.15 179.29 3jys h ASN 251 N 0.80 0.56 -0.56 1.72 2.35 -0.85 0.18 115.58 119.78 3jys h ASN 251 Ca 0.22 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.87 3jys h ASN 251 Cb -0.08 -0.12 -0.02 0.00 0.05 0.00 0.00 38.32 38.16 3jys h ASN 251 CO -0.05 0.39 -0.05 0.00 -1.65 0.00 0.00 177.43 176.08 3jys h ALA 252 N 1.25 0.76 -0.70 -0.83 0.00 -0.91 -2.41 119.26 116.42 3jys h ALA 252 Ca 0.23 -0.33 0.02 0.00 0.00 0.00 0.00 54.91 54.83 3jys h ALA 252 Cb 0.02 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.56 3jys h ALA 252 CO -0.10 0.64 0.45 0.00 0.00 0.00 0.00 179.25 180.24 3jys h ASN 254 N 0.89 0.59 -0.93 0.00 2.35 -0.79 0.27 115.58 117.97 3jys h ASN 254 Ca 0.27 -0.11 -0.00 0.00 -0.55 0.00 0.00 56.30 55.91 3jys h ASN 254 Cb -0.03 -0.15 -0.05 0.00 0.05 0.00 0.00 38.32 38.14 3jys h ASN 254 CO -0.09 0.63 0.58 -0.33 -1.65 0.00 0.00 177.43 176.57 3jys h GLU 255 N 0.61 1.25 0.02 0.81 4.39 -0.93 -0.16 114.58 120.57 3jys h GLU 255 Ca 0.13 -0.10 -0.00 0.00 0.34 0.00 0.00 59.36 59.73 3jys h GLU 255 Cb 0.31 -0.27 0.00 0.00 -0.10 0.00 0.00 28.75 28.69 3jys h GLU 255 CO 0.01 0.86 -0.01 0.28 -1.16 0.00 0.00 179.01 178.99 3jys h VAL 256 N 1.27 1.31 -0.94 3.13 2.07 -1.07 -3.06 116.25 118.96 3jys h VAL 256 Ca 0.34 -1.05 0.04 0.00 0.82 0.00 0.00 66.70 66.85 3jys h VAL 256 Cb -0.08 2.01 -0.06 0.00 -1.52 0.00 0.00 31.29 31.64 3jys h VAL 256 CO -0.07 0.27 0.61 0.40 0.02 0.00 0.00 177.57 178.80 3jys h ILE 257 N -0.48 1.14 0.00 4.57 2.04 -0.75 -0.54 117.51 123.48 3jys h ILE 257 Ca -0.00 -0.40 0.00 0.00 1.00 0.00 0.00 64.86 65.46 3jys h ILE 257 Cb 0.46 -0.13 0.00 0.00 -0.74 0.00 0.00 36.82 36.41 3jys h ILE 257 CO 0.00 0.21 0.00 0.11 0.00 0.00 0.00 178.15 178.48 3jys h LYS 258 N 1.17 0.00 0.00 2.37 6.56 -1.09 -2.99 116.57 122.58 3jys h LYS 258 Ca 0.38 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.97 3jys h LYS 258 Cb 0.04 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.70 3jys h LYS 258 CO -0.13 0.00 0.00 0.00 -2.06 0.00 0.00 179.45 177.26 3jys n ALA 259 N -1.92 2.37 -0.64 3.86 0.00 -0.21 -4.89 120.51 119.08 3jys n ALA 259 Ca 0.02 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.38 3jys n ALA 259 Cb 0.27 -1.20 0.00 0.00 0.00 0.00 0.00 19.45 18.52 3jys n ALA 259 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3jys n GLY 260 N 0.45 0.66 3.74 0.00 0.00 -1.13 -4.99 105.19 103.91 3jys n GLY 260 Ca 0.09 -0.14 -0.34 0.00 0.00 0.00 0.00 46.02 45.63 3jys n GLY 260 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3jys s TYR 261 N -2.00 2.27 0.06 1.61 2.02 -1.26 -5.05 117.35 114.99 3jys s TYR 261 Ca 0.00 1.58 -0.06 0.00 -0.37 0.00 0.00 57.07 58.22 3jys s TYR 261 Cb 0.00 -3.37 -0.01 0.00 -0.40 0.00 0.00 41.96 38.18 3jys s TYR 261 CO 0.00 -2.26 0.10 -0.65 -1.57 0.00 0.00 175.55 171.17 3jys s GLN 262 N -3.92 0.68 0.25 -0.62 -1.52 -0.27 -5.00 119.66 109.26 3jys s GLN 262 Ca 0.72 -0.93 -0.30 0.00 -1.95 0.00 0.00 55.36 52.90 3jys s GLN 262 Cb -0.26 0.26 -0.10 0.00 -0.22 0.00 0.00 33.01 32.69 3jys s GLN 262 CO 0.43 -0.18 1.50 -0.51 -0.25 0.00 0.00 175.29 176.28 3jys s LEU 263 N -2.55 4.37 0.51 2.90 1.43 -1.26 -2.66 118.68 121.42 3jys s LEU 263 Ca 0.01 2.73 -0.22 0.00 -1.03 0.00 0.00 54.13 55.62 3jys s LEU 263 Cb 0.03 -3.62 -0.07 0.00 0.03 0.00 0.00 46.19 42.56 3jys s LEU 263 CO -0.08 -0.77 1.22 0.00 0.23 0.00 0.00 176.35 176.95 3jys n ALA 264 N 2.51 1.10 -0.22 4.21 0.00 -1.26 -4.92 120.51 121.93 3jys n ALA 264 Ca 0.08 0.15 -0.08 0.00 0.00 0.00 0.00 53.44 53.58 3jys n ALA 264 Cb 0.39 -2.26 0.03 0.00 0.00 0.00 0.00 19.45 17.61 3jys n ALA 264 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3jys h ASP 265 N 1.42 0.97 -3.64 0.00 3.32 -1.94 -3.41 116.42 113.15 3jys h ASP 265 Ca -0.49 -0.26 -0.69 0.00 0.02 0.00 0.00 57.03 55.61 3jys h ASP 265 Cb 1.32 -0.26 -0.28 0.00 0.22 0.00 0.00 39.33 40.33 3jys h ASP 265 CO 0.56 0.99 -0.62 0.21 -1.72 0.00 0.00 179.24 178.66 3jys s ASN 266 N -6.40 5.19 0.13 6.45 3.84 -1.26 -5.00 114.94 117.89 3jys s ASN 266 Ca -0.12 -0.97 -0.19 0.00 0.21 0.00 0.00 52.86 51.79 3jys s ASN 266 Cb 0.13 -1.86 -0.03 0.00 -0.55 0.00 0.00 41.25 38.94 3jys s ASN 266 CO 0.84 -0.27 1.74 0.22 -2.79 0.00 0.00 177.10 176.84 3jys h TYR 267 N 8.21 0.09 -0.60 0.43 3.20 -1.90 -2.99 116.97 123.41 3jys h TYR 267 Ca -0.27 0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.63 3jys h TYR 267 Cb 1.10 -0.01 -0.03 0.00 1.54 0.00 0.00 36.73 39.33 3jys h TYR 267 CO 0.60 0.04 0.39 0.00 -1.64 0.00 0.00 178.16 177.55 3jys h ALA 268 N 1.15 1.59 0.00 1.82 0.00 -1.94 -2.24 119.26 119.63 3jys h ALA 268 Ca 0.10 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 3jys h ALA 268 Cb 0.08 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 3jys h ALA 268 CO -0.12 0.37 -0.05 -0.44 0.00 0.00 0.00 179.25 179.02 3jys h ASP 269 N 0.79 0.00 -0.48 0.00 3.32 -1.93 -1.95 116.42 116.18 3jys h ASP 269 Ca 0.22 0.00 0.14 0.00 0.02 0.00 0.00 57.03 57.41 3jys h ASP 269 Cb -0.07 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 3jys h ASP 269 CO -0.05 0.05 0.54 -0.07 -1.72 0.00 0.00 179.24 177.99 3jys h LEU 270 N 0.00 0.00 -2.77 1.55 3.38 -1.48 -2.53 115.31 113.46 3jys h LEU 270 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3jys h LEU 270 Cb 0.34 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.09 3jys h LEU 270 CO 0.01 0.00 -0.05 0.49 0.09 0.00 0.00 178.44 178.97 3jys n PHE 271 N -3.64 0.00 -2.62 1.13 3.72 -0.73 -4.83 117.46 110.49 3jys n PHE 271 Ca 0.09 -0.68 -0.22 0.00 -0.05 0.00 0.00 57.45 56.59 3jys n PHE 271 Cb 0.73 -0.10 0.06 0.00 -0.94 0.00 0.00 39.48 39.23 3jys n PHE 271 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 3jys s LYS 272 N -1.82 2.23 0.30 -1.08 1.02 -0.95 -1.71 119.74 117.73 3jys s LYS 272 Ca 0.17 -0.91 0.04 0.00 0.02 0.00 0.00 55.97 55.29 3jys s LYS 272 Cb 0.15 -2.43 0.65 0.00 -0.52 0.00 0.00 37.83 35.68 3jys s LYS 272 CO 0.02 -0.98 1.82 0.00 -0.92 0.00 0.00 175.35 175.28 3jys h ALA 273 N -0.15 1.62 -0.82 5.17 0.00 -0.87 -2.28 119.26 121.93 3jys h ALA 273 Ca -0.40 0.04 -0.38 0.00 0.00 0.00 0.00 54.91 54.17 3jys h ALA 273 Cb 1.29 -0.16 -0.23 0.00 0.00 0.00 0.00 17.79 18.69 3jys h ALA 273 CO 0.48 0.10 0.43 -0.40 0.00 0.00 0.00 179.25 179.86 3jys n ASP 274 N -4.66 3.86 0.17 0.00 5.75 -1.26 -2.94 116.55 117.47 3jys n ASP 274 Ca 0.20 -3.52 0.04 0.00 -0.01 0.00 0.00 54.79 51.50 3jys n ASP 274 Cb 0.44 -0.78 0.46 0.00 -1.03 0.00 0.00 41.12 40.21 3jys n ASP 274 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 3jys h ASN 275 N 1.47 0.13 1.63 -1.12 -1.07 -1.61 0.25 115.58 115.25 3jys h ASN 275 Ca 0.47 -0.02 0.00 0.00 0.07 0.00 0.00 56.30 56.81 3jys h ASN 275 Cb 2.53 -0.03 0.00 0.00 -2.07 0.00 0.00 38.32 38.74 3jys h ASN 275 CO 0.89 0.26 0.00 1.23 0.07 0.00 0.00 177.43 179.88 3jys h GLY 276 N 0.58 0.00 0.00 9.14 0.00 -1.85 -3.31 103.07 107.63 3jys h GLY 276 Ca 0.03 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.34 3jys h GLY 276 CO 0.02 0.00 -1.55 1.18 0.00 0.00 0.00 176.54 176.19 3jys n GLU 277 N -2.71 0.51 -2.28 4.80 4.71 -0.74 -4.90 120.64 120.04 3jys n GLU 277 Ca 0.04 -0.10 -0.42 0.00 -0.01 0.00 0.00 57.16 56.67 3jys n GLU 277 Cb 0.45 -1.28 -0.03 0.00 -1.01 0.00 0.00 31.44 29.58 3jys n GLU 277 CO 0.00 0.00 0.00 1.21 0.09 0.00 0.00 177.13 178.43 3jys s ASN 278 N -3.42 6.87 0.51 1.62 3.84 -0.00 -4.91 114.94 119.45 3jys s ASN 278 Ca -0.04 1.96 0.21 0.00 0.21 0.00 0.00 52.86 55.19 3jys s ASN 278 Cb 0.07 -2.55 1.32 0.00 -0.55 0.00 0.00 41.25 39.54 3jys s ASN 278 CO 0.48 -0.76 2.09 -0.65 -2.79 0.00 0.00 177.10 175.47 3jys h PRO 279 N 8.24 0.00 -0.51 0.43 0.11 -1.91 -1.82 132.00 136.55 3jys h PRO 279 Ca -0.34 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.72 3jys h PRO 279 Cb 1.15 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.24 3jys h PRO 279 CO 0.93 0.10 0.12 0.22 -0.21 0.00 0.00 178.00 179.17 3jys h ASP 280 N 0.00 0.78 0.60 -2.05 3.58 -1.94 -2.62 116.42 114.77 3jys h ASP 280 Ca -0.00 -0.24 -0.28 0.00 0.42 0.00 0.00 57.03 56.93 3jys h ASP 280 Cb 0.21 -0.20 -0.02 0.00 1.72 0.00 0.00 39.33 41.04 3jys h ASP 280 CO 0.01 0.81 -1.41 0.71 -2.88 0.00 0.00 179.24 176.48 3jys h THR 281 N 0.71 1.26 -0.40 2.25 1.35 -1.76 -3.26 112.91 113.06 3jys h THR 281 Ca 0.16 -2.95 0.12 0.00 -0.55 0.00 0.00 66.41 63.19 3jys h THR 281 Cb 0.34 2.74 -0.02 0.00 -1.73 0.00 0.00 68.15 69.49 3jys h THR 281 CO 0.00 0.81 0.31 0.11 -0.25 0.00 0.00 175.52 176.50 3jys h LYS 282 N 0.04 0.00 -0.34 4.72 1.57 -1.33 -1.41 116.57 119.82 3jys h LYS 282 Ca -0.19 0.00 0.10 0.00 -1.87 0.00 0.00 60.65 58.69 3jys h LYS 282 Cb 1.95 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 34.25 3jys h LYS 282 CO 0.15 0.00 0.30 0.87 -0.57 0.00 0.00 179.45 180.19 3jys h LYS 283 N 0.00 0.00 0.00 3.15 1.57 -1.50 -3.30 116.57 116.49 3jys h LYS 283 Ca 0.19 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.74 3jys h LYS 283 Cb 0.81 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.08 3jys h LYS 283 CO -0.00 0.00 -1.86 -1.91 -0.57 0.00 0.00 179.45 175.11 3jys n GLU 284 N -4.08 1.48 -2.21 3.15 2.13 -0.57 -1.11 120.64 119.43 3jys n GLU 284 Ca 0.05 0.03 -0.43 0.00 0.66 0.00 0.00 57.16 57.47 3jys n GLU 284 Cb 0.47 -1.31 -0.02 0.00 0.27 0.00 0.00 31.44 30.84 3jys n GLU 284 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 3jys s ILE 285 N -2.30 3.79 -0.13 6.31 1.01 -0.97 -1.56 121.20 127.35 3jys s ILE 285 Ca -0.11 0.85 -0.20 0.00 0.00 0.00 0.00 60.65 61.19 3jys s ILE 285 Cb 0.04 -3.92 -0.26 0.00 0.01 0.00 0.00 42.46 38.34 3jys s ILE 285 CO 0.46 -0.48 0.56 0.40 0.00 0.00 0.00 174.94 175.88 3jys h ILE 286 N 6.33 1.22 -3.16 2.92 2.04 -1.33 -3.46 117.51 122.08 3jys h ILE 286 Ca -0.31 -2.36 -0.44 0.00 1.00 0.00 0.00 64.86 62.76 3jys h ILE 286 Cb 1.13 2.80 -0.40 0.00 -0.74 0.00 0.00 36.82 39.61 3jys h ILE 286 CO 1.04 0.60 -0.75 -0.47 0.00 0.00 0.00 178.15 178.57 3jys s TYR 287 N -2.39 0.30 0.18 1.37 5.04 -0.78 -4.77 117.35 116.30 3jys s TYR 287 Ca -0.21 -0.21 0.01 0.00 -2.44 0.00 0.00 57.07 54.22 3jys s TYR 287 Cb 0.03 -0.68 -0.04 0.00 0.35 0.00 0.00 41.96 41.62 3jys s TYR 287 CO 0.72 -0.42 0.34 -1.25 -1.34 0.00 0.00 175.55 173.59 3jys s PRO 288 N 2.10 3.47 -0.35 4.97 0.04 -1.26 -2.30 135.00 141.67 3jys s PRO 288 Ca 0.03 -0.51 -0.15 0.00 0.04 0.00 0.00 61.00 60.41 3jys s PRO 288 Cb -0.15 -2.90 -0.01 0.00 0.04 0.00 0.00 34.50 31.48 3jys s PRO 288 CO -0.07 0.46 0.34 0.42 0.04 0.00 0.00 177.00 178.19 3jys s ILE 289 N -1.83 5.19 0.11 0.56 -1.09 0.26 -4.74 121.20 119.66 3jys s ILE 289 Ca 0.36 -0.07 -0.27 0.00 -2.23 0.00 0.00 60.65 58.44 3jys s ILE 289 Cb -0.11 -3.82 -0.06 0.00 -1.58 0.00 0.00 42.46 36.89 3jys s ILE 289 CO 0.29 -0.11 0.84 -0.63 -1.23 0.00 0.00 174.94 174.10 3jys s ILE 290 N 1.95 4.53 0.08 2.92 1.01 -1.26 -1.45 121.20 128.98 3jys s ILE 290 Ca 0.10 1.80 0.06 0.00 0.00 0.00 0.00 60.65 62.61 3jys s ILE 290 Cb -0.17 -4.19 -0.03 0.00 0.01 0.00 0.00 42.46 38.08 3jys s ILE 290 CO 0.11 0.40 -0.16 -0.36 0.00 0.00 0.00 174.94 174.94 3jys s PHE 291 N -0.37 1.34 -0.24 3.97 0.08 -1.26 -4.89 117.98 116.61 3jys s PHE 291 Ca 0.40 -0.45 -0.16 0.00 0.12 0.00 0.00 56.93 56.84 3jys s PHE 291 Cb -0.22 -0.75 0.07 0.00 -0.57 0.00 0.00 43.02 41.55 3jys s PHE 291 CO 0.26 0.09 0.60 0.34 -0.10 0.00 0.00 175.22 176.42 3jys s ASP 292 N -1.80 -0.76 0.63 1.36 2.15 -1.20 -4.49 116.67 112.56 3jys s ASP 292 Ca 0.00 1.29 0.32 0.00 0.43 0.00 0.00 52.55 54.59 3jys s ASP 292 Cb -0.10 1.20 1.77 0.00 -0.30 0.00 0.00 42.92 45.50 3jys s ASP 292 CO 0.03 -0.22 2.07 1.23 -0.17 0.00 0.00 175.17 178.10 3jys h GLY 293 N 6.49 0.00 -6.18 2.66 0.00 -1.63 -3.46 103.07 100.95 3jys h GLY 293 Ca -0.31 0.00 -0.66 0.00 0.00 0.00 0.00 47.33 46.36 3jys h GLY 293 CO 0.18 0.00 -0.18 1.22 0.00 0.00 0.00 176.54 177.75 3jys n ASP 294 N -3.37 4.75 0.00 0.19 8.00 -1.26 -4.83 116.55 120.03 3jys n ASP 294 Ca 0.00 -3.51 0.00 0.00 0.71 0.00 0.00 54.79 52.00 3jys n ASP 294 Cb 0.34 -0.81 0.00 0.00 -0.02 0.00 0.00 41.12 40.62 3jys n ASP 294 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 3jys n SER 298 N 0.67 -1.04 -1.11 -2.24 3.41 -1.26 -5.19 113.62 106.85 3jys n SER 298 Ca 0.31 0.00 0.11 0.00 -0.26 0.00 0.00 58.87 59.02 3jys n SER 298 Cb 0.38 0.60 0.23 0.00 -0.26 0.00 0.00 64.21 65.16 3jys n SER 298 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 3jys n TRP 299 N 0.73 0.64 0.00 7.33 8.01 -1.26 -4.74 117.44 128.15 3jys n TRP 299 Ca 0.00 -0.36 0.00 0.00 -1.31 0.00 0.00 57.50 55.83 3jys n TRP 299 Cb 0.00 -0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.30 3jys n TRP 299 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3jys n GLY 300 N 1.36 -0.09 4.00 6.99 0.00 -1.26 -0.95 105.19 115.24 3jys n GLY 300 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 3jys n GLY 300 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3jys n ALA 302 N -0.92 0.00 -0.25 4.61 0.00 -1.26 -2.97 120.51 119.72 3jys n ALA 302 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.38 3jys n ALA 302 Cb 0.10 0.00 0.07 0.00 0.00 0.00 0.00 19.45 19.62 3jys n ALA 302 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3jys h ALA 303 N 0.00 1.00 -0.77 0.00 0.00 -1.40 0.28 119.26 118.36 3jys h ALA 303 Ca 0.00 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 3jys h ALA 303 Cb 0.00 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.48 3jys h ALA 303 CO 0.00 0.66 0.36 0.82 0.00 0.00 0.00 179.25 181.08 3jys h ILE 304 N 1.07 1.25 0.24 0.00 2.04 -1.80 0.20 117.51 120.51 3jys h ILE 304 Ca 0.23 -0.72 -0.01 0.00 1.00 0.00 0.00 64.86 65.36 3jys h ILE 304 Cb 0.34 0.29 0.00 0.00 -0.74 0.00 0.00 36.82 36.72 3jys h ILE 304 CO -0.00 0.30 -0.12 0.40 0.00 0.00 0.00 178.15 178.73 3jys h ILE 305 N 1.09 0.66 -0.44 -0.67 2.04 -1.82 -3.27 117.51 115.10 3jys h ILE 305 Ca 0.26 -0.92 -0.05 0.00 1.00 0.00 0.00 64.86 65.15 3jys h ILE 305 Cb 0.14 1.07 -0.02 0.00 -0.74 0.00 0.00 36.82 37.27 3jys h ILE 305 CO -0.03 0.16 0.05 0.40 0.00 0.00 0.00 178.15 178.73 3jys h ILE 306 N -0.89 1.21 -0.07 -0.67 2.04 -0.99 -2.03 117.51 116.12 3jys h ILE 306 Ca -0.03 -0.82 0.02 0.00 1.00 0.00 0.00 64.86 65.03 3jys h ILE 306 Cb 0.51 0.82 -0.00 0.00 -0.74 0.00 0.00 36.82 37.41 3jys h ILE 306 CO 0.05 0.29 0.08 1.23 0.00 0.00 0.00 178.15 179.81 3jys h GLY 307 N 0.90 0.00 -2.03 5.37 0.00 -0.70 -1.24 103.07 105.38 3jys h GLY 307 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.47 3jys h GLY 307 CO 0.01 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.55 3jys n ALA 308 N -2.29 2.44 -2.77 3.60 0.00 -0.76 -1.02 120.51 119.71 3jys n ALA 308 Ca -0.01 -0.89 -0.27 0.00 0.00 0.00 0.00 53.44 52.27 3jys n ALA 308 Cb 0.18 -0.91 -0.06 0.00 0.00 0.00 0.00 19.45 18.66 3jys n ALA 308 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3jys s ARG 309 N -1.59 2.79 0.65 0.00 3.00 -0.64 -4.49 118.95 118.67 3jys s ARG 309 Ca 0.37 -0.90 0.04 0.00 0.00 0.00 0.00 55.73 55.24 3jys s ARG 309 Cb 0.22 -2.59 0.11 0.00 0.00 0.00 0.00 34.95 32.68 3jys s ARG 309 CO 0.31 0.49 0.90 0.20 0.00 0.00 0.00 175.30 177.20 3jys s GLY 310 N -2.97 1.75 -1.24 -3.53 0.00 -1.26 0.07 107.32 100.14 3jys s GLY 310 Ca 0.30 -1.90 -0.19 0.00 0.00 0.00 0.00 44.72 42.93 3jys s GLY 310 CO 0.22 -1.39 1.92 0.00 0.00 0.00 0.00 173.10 173.86 3jys n ALA 311 N -2.57 3.59 -2.22 3.20 0.00 -1.25 -3.81 120.51 117.45 3jys n ALA 311 Ca 0.15 -3.60 -0.21 0.00 0.00 0.00 0.00 53.44 49.78 3jys n ALA 311 Cb 0.61 -3.57 -0.03 0.00 0.00 0.00 0.00 19.45 16.46 3jys n ALA 311 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3jys s GLU 312 N 4.60 2.52 0.17 0.00 2.02 -1.26 -5.08 118.70 121.66 3jys s GLU 312 Ca 0.56 -1.56 -0.34 0.00 0.02 0.00 0.00 54.97 53.66 3jys s GLU 312 Cb 0.07 -2.37 -0.14 0.00 0.10 0.00 0.00 34.13 31.79 3jys s GLU 312 CO 0.06 -0.22 1.56 -0.25 0.02 0.00 0.00 175.26 176.43 3jys n ASP 313 N -1.56 3.04 -0.34 -0.19 8.00 -1.26 -4.83 116.55 119.41 3jys n ASP 313 Ca 0.04 1.09 0.08 0.00 0.71 0.00 0.00 54.79 56.70 3jys n ASP 313 Cb 0.62 -1.42 0.17 0.00 -0.02 0.00 0.00 41.12 40.47 3jys n ASP 313 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3jys n LYS 314 N 3.28 -0.08 -0.23 -1.24 5.02 -1.26 -1.01 118.16 122.64 3jys n LYS 314 Ca 0.17 1.47 -0.08 0.00 -2.02 0.00 0.00 58.31 57.85 3jys n LYS 314 Cb 0.29 -2.23 0.03 0.00 -0.02 0.00 0.00 35.03 33.10 3jys n LYS 314 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 3jys h ASP 315 N 0.00 0.98 -0.20 4.39 3.32 -1.91 0.12 116.42 123.12 3jys h ASP 315 Ca 0.49 -0.24 -0.10 0.00 0.02 0.00 0.00 57.03 57.20 3jys h ASP 315 Cb 0.82 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 40.10 3jys h ASP 315 CO -0.96 0.96 -0.21 -0.37 -1.72 0.00 0.00 179.24 176.94 3jys h VAL 316 N 0.95 1.27 -0.56 -1.35 -1.51 -1.45 0.22 116.25 113.82 3jys h VAL 316 Ca 0.20 -1.27 -0.03 0.00 -1.23 0.00 0.00 66.70 64.37 3jys h VAL 316 Cb 0.37 1.23 -0.02 0.00 -2.13 0.00 0.00 31.29 30.73 3jys h VAL 316 CO 0.00 0.42 0.23 -0.07 -1.23 0.00 0.00 177.57 176.92 3jys h LEU 317 N 0.57 0.76 -0.40 4.19 3.38 -0.78 -2.24 115.31 120.79 3jys h LEU 317 Ca 0.09 -0.16 -0.11 0.00 0.09 0.00 0.00 57.88 57.78 3jys h LEU 317 Cb 0.67 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 3jys h LEU 317 CO 0.05 0.72 -0.18 0.25 0.09 0.00 0.00 178.44 179.37 3jys h LEU 318 N 0.76 0.86 -0.36 1.67 5.85 -0.56 0.15 115.31 123.68 3jys h LEU 318 Ca 0.19 -0.40 0.07 0.00 0.84 0.00 0.00 57.88 58.58 3jys h LEU 318 Cb 0.19 -0.24 -0.09 0.00 0.37 0.00 0.00 40.66 40.89 3jys h LEU 318 CO -0.02 1.06 -0.31 0.00 -0.34 0.00 0.00 178.44 178.84 3jys h ALA 319 N 0.82 -0.18 0.00 1.25 0.00 -0.41 -2.19 119.26 118.55 3jys h ALA 319 Ca 0.09 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.10 3jys h ALA 319 Cb 0.73 0.66 0.00 0.00 0.00 0.00 0.00 17.79 19.19 3jys h ALA 319 CO 0.06 -0.72 -1.05 -2.39 0.00 0.00 0.00 179.25 175.14 3jys n HIS 320 N -5.41 0.00 -0.22 0.00 1.44 -0.86 -4.74 115.22 105.44 3jys n HIS 320 Ca 0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.72 3jys n HIS 320 Cb 0.33 -0.04 0.00 0.00 0.12 0.00 0.00 29.99 30.40 3jys n HIS 320 CO 0.00 0.00 0.00 0.43 -2.81 0.00 0.00 176.34 173.96 3jys n SER 321 N -1.55 0.00 -0.90 4.39 7.64 0.51 -4.89 113.62 118.81 3jys n SER 321 Ca 0.03 -0.18 -0.11 0.00 1.01 0.00 0.00 58.87 59.62 3jys n SER 321 Cb 0.35 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.51 3jys n SER 321 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3jys n GLY 322 N 0.00 1.04 3.19 0.23 0.00 -0.83 -1.32 105.19 107.51 3jys n GLY 322 Ca 0.00 -0.51 -0.14 0.00 0.00 0.00 0.00 46.02 45.37 3jys n GLY 322 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3jys s VAL 323 N -2.43 0.99 0.14 1.61 -7.23 -1.25 -4.52 120.40 107.70 3jys s VAL 323 Ca 0.00 -1.73 0.05 0.00 -1.81 0.00 0.00 61.98 58.49 3jys s VAL 323 Cb 0.00 -1.46 -0.19 0.00 0.56 0.00 0.00 36.38 35.29 3jys s VAL 323 CO 0.00 -0.60 1.31 0.44 -0.31 0.00 0.00 175.10 175.95 3jys h ASP 324 N 3.41 0.12 -4.42 4.85 3.32 -1.81 -2.93 116.42 118.96 3jys h ASP 324 Ca -0.37 -0.12 -0.42 0.00 0.02 0.00 0.00 57.03 56.14 3jys h ASP 324 Cb 1.19 -0.04 -0.21 0.00 0.22 0.00 0.00 39.33 40.49 3jys h ASP 324 CO 0.55 1.02 -0.78 -1.10 -1.72 0.00 0.00 179.24 177.21 3jys s GLN 325 N -2.90 0.86 -0.07 3.56 -0.21 -1.26 -4.48 119.66 115.16 3jys s GLN 325 Ca -0.01 -1.00 -0.03 0.00 0.02 0.00 0.00 55.36 54.34 3jys s GLN 325 Cb 0.10 -0.87 0.04 0.00 1.00 0.00 0.00 33.01 33.28 3jys s GLN 325 CO 0.83 0.19 0.13 0.20 -2.12 0.00 0.00 175.29 174.51 3jys s GLY 326 N -1.84 0.09 0.00 3.09 0.00 -1.25 -4.71 107.32 102.70 3jys s GLY 326 Ca -0.00 0.46 0.27 0.00 0.00 0.00 0.00 44.72 45.45 3jys s GLY 326 CO 0.02 1.52 1.62 0.79 0.00 0.00 0.00 173.10 177.05 3jys n TRP 327 N 5.20 0.00 -3.52 1.90 8.01 -0.57 -3.80 117.44 124.66 3jys n TRP 327 Ca -0.07 -0.00 -0.20 0.00 -1.31 0.00 0.00 57.50 55.93 3jys n TRP 327 Cb 0.50 0.00 0.08 0.00 -2.01 0.00 0.00 31.31 29.88 3jys n TRP 327 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 3jys n ALA 328 N 0.47 -1.85 -0.74 6.99 0.00 0.11 -4.94 120.51 120.56 3jys n ALA 328 Ca 0.18 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.64 3jys n ALA 328 Cb 0.42 -3.03 0.00 0.00 0.00 0.00 0.00 19.45 16.84 3jys n ALA 328 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3jys n GLY 329 N -1.39 -0.15 3.70 0.00 0.00 -0.19 -4.29 105.19 102.87 3jys n GLY 329 Ca -0.22 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.39 3jys n GLY 329 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3jys s PHE 330 N -0.26 3.56 0.33 1.61 0.08 -0.43 -0.53 117.98 122.34 3jys s PHE 330 Ca 0.00 1.47 -0.08 0.00 0.12 0.00 0.00 56.93 58.44 3jys s PHE 330 Cb 0.00 -3.03 0.01 0.00 -0.57 0.00 0.00 43.02 39.44 3jys s PHE 330 CO 0.00 -0.07 0.55 -0.98 -0.10 0.00 0.00 175.22 174.63 3jys s ARG 331 N 1.35 1.90 0.54 0.44 1.04 -0.78 -4.31 118.95 119.14 3jys s ARG 331 Ca 0.45 -1.56 -0.10 0.00 -1.04 0.00 0.00 55.73 53.48 3jys s ARG 331 Cb -0.19 0.49 -0.05 0.00 -2.04 0.00 0.00 34.95 33.17 3jys s ARG 331 CO 0.20 -0.82 0.93 0.00 -0.04 0.00 0.00 175.30 175.57 3jys s ALA 332 N -3.11 3.21 0.53 7.88 0.00 -0.37 -0.82 121.76 129.08 3jys s ALA 332 Ca 0.25 -0.17 0.03 0.00 0.00 0.00 0.00 51.96 52.07 3jys s ALA 332 Cb -0.02 -2.91 0.03 0.00 0.00 0.00 0.00 23.12 20.23 3jys s ALA 332 CO 0.15 -0.44 0.74 0.95 0.00 0.00 0.00 175.76 177.16 3jys s THR 333 N -2.88 2.71 0.23 0.00 -4.23 -1.26 -4.20 115.64 106.02 3jys s THR 333 Ca 0.53 -0.74 -0.07 0.00 -1.18 0.00 0.00 61.69 60.22 3jys s THR 333 Cb -0.11 -2.97 0.22 0.00 1.34 0.00 0.00 72.50 70.98 3jys s THR 333 CO 0.45 0.00 1.89 0.77 -0.54 0.00 0.00 174.62 177.20 3jys h SER 334 N 0.18 1.07 -0.62 3.99 4.64 -1.87 -3.12 113.55 117.81 3jys h SER 334 Ca -0.41 -0.05 0.07 0.00 -0.47 0.00 0.00 61.79 60.93 3jys h SER 334 Cb 1.29 -0.27 -0.06 0.00 -0.31 0.00 0.00 62.40 63.05 3jys h SER 334 CO 0.50 0.80 0.31 0.78 -0.87 0.00 0.00 176.83 178.35 3jys h ASN 335 N 1.24 0.41 -0.20 4.97 4.21 -1.90 -0.38 115.58 123.94 3jys h ASN 335 Ca 0.33 0.05 -0.00 0.00 1.21 0.00 0.00 56.30 57.88 3jys h ASN 335 Cb -0.09 -0.03 -0.01 0.00 -1.12 0.00 0.00 38.32 37.07 3jys h ASN 335 CO -0.07 0.26 0.12 0.25 -1.29 0.00 0.00 177.43 176.70 3jys h LEU 336 N 0.56 0.25 -0.47 1.61 5.85 -1.61 -2.38 115.31 119.12 3jys h LEU 336 Ca 0.29 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.96 3jys h LEU 336 Cb 0.25 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.20 3jys h LEU 336 CO -0.22 0.23 0.30 0.58 -0.34 0.00 0.00 178.44 178.99 3jys h VAL 337 N 0.24 1.13 0.00 1.05 2.07 -1.38 -2.31 116.25 117.04 3jys h VAL 337 Ca 0.07 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 67.33 3jys h VAL 337 Cb 0.03 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 30.28 3jys h VAL 337 CO -0.01 0.13 0.00 1.41 0.02 0.00 0.00 177.57 179.12 3jys n HIS 338 N -4.74 0.00 0.24 1.57 8.25 -0.20 -1.90 115.22 118.44 3jys n HIS 338 Ca 0.02 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.60 3jys n HIS 338 Cb 0.04 -0.42 0.55 0.00 1.12 0.00 0.00 29.99 31.28 3jys n HIS 338 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 3jys h LEU 339 N 0.00 0.00 -9.82 2.41 3.38 -0.89 -3.45 115.31 106.94 3jys h LEU 339 Ca 0.00 0.00 -0.62 0.00 0.09 0.00 0.00 57.88 57.35 3jys h LEU 339 Cb 0.21 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.91 3jys h LEU 339 CO 0.00 0.13 -0.42 -0.36 0.09 0.00 0.00 178.44 177.88 3jys s PHE 340 N -3.68 3.55 0.24 1.13 0.08 -0.80 -4.94 117.98 113.57 3jys s PHE 340 Ca 0.01 0.48 -0.30 0.00 0.12 0.00 0.00 56.93 57.24 3jys s PHE 340 Cb 0.10 -1.92 -0.09 0.00 -0.57 0.00 0.00 43.02 40.54 3jys s PHE 340 CO 0.60 0.60 1.01 -0.51 -0.10 0.00 0.00 175.22 176.82 3jys s ASP 341 N -1.94 7.47 0.19 1.36 1.01 -1.26 -4.98 116.67 118.52 3jys s ASP 341 Ca 0.30 2.07 0.08 0.00 0.71 0.00 0.00 52.55 55.71 3jys s ASP 341 Cb -0.13 -2.61 -0.04 0.00 1.01 0.00 0.00 42.92 41.14 3jys s ASP 341 CO 0.19 0.01 -0.16 -0.36 0.21 0.00 0.00 175.17 175.06 3jys s PHE 342 N -1.03 1.75 0.28 4.23 0.40 -1.26 -0.24 117.98 122.11 3jys s PHE 342 Ca 0.43 -0.52 0.01 0.00 -0.60 0.00 0.00 56.93 56.25 3jys s PHE 342 Cb -0.28 -0.84 0.58 0.00 0.51 0.00 0.00 43.02 42.99 3jys s PHE 342 CO 0.35 0.34 1.80 0.37 0.70 0.00 0.00 175.22 178.78 3jys h GLN 343 N 2.90 0.78 -3.81 0.44 4.15 -1.19 -3.31 115.11 115.07 3jys h GLN 343 Ca -0.40 -0.05 -0.63 0.00 0.77 0.00 0.00 58.65 58.35 3jys h GLN 343 Cb 1.21 -0.18 -0.40 0.00 0.21 0.00 0.00 27.48 28.33 3jys h GLN 343 CO 0.57 0.52 -0.71 1.21 -1.93 0.00 0.00 178.83 178.48 3jys s ASN 344 N -5.53 4.28 0.54 -0.69 3.84 -1.26 -4.98 114.94 111.13 3jys s ASN 344 Ca -0.12 -2.30 0.30 0.00 0.21 0.00 0.00 52.86 50.95 3jys s ASN 344 Cb 0.23 -1.33 1.52 0.00 -0.55 0.00 0.00 41.25 41.11 3jys s ASN 344 CO 0.80 -0.34 2.08 0.44 -2.79 0.00 0.00 177.10 177.29 3jys h ASP 345 N 7.32 0.00 0.76 -4.21 3.32 -1.98 -2.10 116.42 119.53 3jys h ASP 345 Ca -0.07 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.87 3jys h ASP 345 Cb 0.97 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.51 3jys h ASP 345 CO 0.54 0.10 -0.53 -0.33 -1.72 0.00 0.00 179.24 177.30 3jys h GLU 346 N 0.00 0.00 -2.54 3.56 4.39 -1.94 -3.37 114.58 114.68 3jys h GLU 346 Ca -0.00 0.00 -0.60 0.00 0.34 0.00 0.00 59.36 59.10 3jys h GLU 346 Cb 0.34 0.00 -0.39 0.00 -0.10 0.00 0.00 28.75 28.60 3jys h GLU 346 CO 0.01 0.53 -0.87 -1.91 -1.16 0.00 0.00 179.01 175.61 3jys n GLU 347 N -3.65 0.64 -1.98 2.33 2.13 -0.80 -5.13 120.64 114.17 3jys n GLU 347 Ca -0.01 -3.53 -0.41 0.00 0.66 0.00 0.00 57.16 53.87 3jys n GLU 347 Cb 0.59 -1.83 -0.01 0.00 0.27 0.00 0.00 31.44 30.45 3jys n GLU 347 CO 0.00 0.00 0.00 -2.14 -0.41 0.00 0.00 177.13 174.58 3jys s PRO 348 N -0.39 4.25 -0.02 5.31 0.02 -1.12 -4.71 135.00 138.34 3jys s PRO 348 Ca 0.31 2.36 0.01 0.00 0.02 0.00 0.00 61.00 63.71 3jys s PRO 348 Cb 0.02 -3.04 0.01 0.00 0.02 0.00 0.00 34.50 31.51 3jys s PRO 348 CO -0.19 -0.37 -0.05 0.15 -0.33 0.00 0.00 177.00 176.22 3jys s LYS 349 N -1.53 0.53 0.41 5.54 3.01 -1.26 -5.05 119.74 121.39 3jys s LYS 349 Ca 0.53 -0.14 0.17 0.00 -1.01 0.00 0.00 55.97 55.51 3jys s LYS 349 Cb -0.43 -0.55 1.05 0.00 -1.01 0.00 0.00 37.83 36.90 3jys s LYS 349 CO 0.54 0.04 1.85 0.00 0.51 0.00 0.00 175.35 178.29 3jys h ALA 350 N 6.46 2.16 0.00 5.17 0.00 -1.95 -0.54 119.26 130.56 3jys h ALA 350 Ca -0.33 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.60 3jys h ALA 350 Cb 1.17 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.93 3jys h ALA 350 CO 0.49 -0.45 0.00 -1.13 0.00 0.00 0.00 179.25 178.17 3jys n SER 351 N -4.52 0.00 -0.49 0.00 3.41 -1.26 -3.10 113.62 107.65 3jys n SER 351 Ca 0.19 0.00 0.06 0.00 -0.26 0.00 0.00 58.87 58.86 3jys n SER 351 Cb 0.68 -0.33 0.14 0.00 -0.26 0.00 0.00 64.21 64.44 3jys n SER 351 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3jys n GLU 352 N -1.33 2.73 -2.15 4.33 1.02 -0.22 -5.03 120.64 119.99 3jys n GLU 352 Ca 0.12 -2.18 -0.41 0.00 -0.02 0.00 0.00 57.16 54.67 3jys n GLU 352 Cb 0.24 -1.37 -0.02 0.00 -0.02 0.00 0.00 31.44 30.27 3jys n GLU 352 CO 0.00 0.00 0.00 -1.50 1.18 0.00 0.00 177.13 176.81 3jys s ILE 353 N -1.66 2.81 -0.23 -3.67 2.07 -1.18 -0.64 121.20 118.71 3jys s ILE 353 Ca 0.24 0.80 0.11 0.00 -1.41 0.00 0.00 60.65 60.39 3jys s ILE 353 Cb 0.17 -3.51 -0.22 0.00 0.13 0.00 0.00 42.46 39.03 3jys s ILE 353 CO 0.09 0.18 -0.06 0.00 -1.91 0.00 0.00 174.94 173.25 3jys n GLN 354 N 1.03 0.67 -2.73 3.50 6.02 0.67 -4.75 117.38 121.79 3jys n GLN 354 Ca 0.01 0.06 -0.42 0.00 -0.01 0.00 0.00 57.00 56.63 3jys n GLN 354 Cb 0.42 -1.52 -0.03 0.00 1.02 0.00 0.00 30.24 30.13 3jys n GLN 354 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 3jys s ASP 355 N -5.93 6.31 0.00 1.08 -1.08 -1.10 -4.55 116.67 111.40 3jys s ASP 355 Ca -0.21 -0.37 0.19 0.00 -0.52 0.00 0.00 52.55 51.65 3jys s ASP 355 Cb 0.07 -2.48 1.03 0.00 -1.46 0.00 0.00 42.92 40.08 3jys s ASP 355 CO 0.73 -1.43 1.58 0.29 0.52 0.00 0.00 175.17 176.86 3jys n LYS 356 N 8.07 0.38 0.25 4.34 4.76 -0.52 -2.81 118.16 132.62 3jys n LYS 356 Ca 0.03 0.07 0.07 0.00 -2.87 0.00 0.00 58.31 55.61 3jys n LYS 356 Cb 0.48 -1.50 0.60 0.00 -1.84 0.00 0.00 35.03 32.77 3jys n LYS 356 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3jys h ARG 357 N 0.00 0.00 -6.52 1.97 3.08 -1.90 -3.41 114.38 107.60 3jys h ARG 357 Ca 0.00 0.00 -0.57 0.00 0.07 0.00 0.00 59.98 59.48 3jys h ARG 357 Cb 0.12 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.11 3jys h ARG 357 CO 0.00 0.09 0.93 0.20 -1.07 0.00 0.00 179.97 180.12 3jys s GLY 358 N -4.13 1.36 -0.50 0.04 0.00 -1.12 -4.97 107.32 98.00 3jys s GLY 358 Ca -0.04 -0.22 0.02 0.00 0.00 0.00 0.00 44.72 44.48 3jys s GLY 358 CO 0.67 2.45 0.25 -0.42 0.00 0.00 0.00 173.10 176.05 3jys s ILE 359 N 4.34 2.78 0.18 0.90 1.01 -1.26 -5.03 121.20 124.12 3jys s ILE 359 Ca 0.50 -2.98 0.10 0.00 0.00 0.00 0.00 60.65 58.27 3jys s ILE 359 Cb -0.11 -2.92 -0.04 0.00 0.01 0.00 0.00 42.46 39.40 3jys s ILE 359 CO 0.26 -0.77 -0.22 -0.36 0.00 0.00 0.00 174.94 173.85 3jys s PHE 360 N 0.07 2.08 -0.19 3.97 0.08 -1.26 -1.13 117.98 121.60 3jys s PHE 360 Ca 0.15 -0.41 0.01 0.00 0.12 0.00 0.00 56.93 56.81 3jys s PHE 360 Cb -0.23 -1.04 0.04 0.00 -0.57 0.00 0.00 43.02 41.22 3jys s PHE 360 CO -0.03 0.41 -0.12 -0.47 -0.10 0.00 0.00 175.22 174.92 3jys s TYR 361 N -1.79 2.44 -1.04 0.36 5.04 0.07 -4.84 117.35 117.60 3jys s TYR 361 Ca 0.18 -1.56 0.10 0.00 -2.44 0.00 0.00 57.07 53.34 3jys s TYR 361 Cb -0.07 -1.67 0.19 0.00 0.35 0.00 0.00 41.96 40.76 3jys s TYR 361 CO 0.08 -0.74 1.04 -0.40 -1.34 0.00 0.00 175.55 174.19 3jys n ASP 362 N 4.68 2.38 -4.67 4.32 5.75 -1.26 -0.36 116.55 127.39 3jys n ASP 362 Ca -0.16 -1.73 -0.42 0.00 -0.01 0.00 0.00 54.79 52.47 3jys n ASP 362 Cb 0.47 -0.11 -0.03 0.00 -1.03 0.00 0.00 41.12 40.42 3jys n ASP 362 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 3jys s LYS 363 N -0.93 4.19 0.00 0.11 1.02 -1.26 -1.95 119.74 120.92 3jys s LYS 363 Ca 0.17 2.27 0.00 0.00 0.02 0.00 0.00 55.97 58.43 3jys s LYS 363 Cb 0.10 -3.85 0.00 0.00 -0.52 0.00 0.00 37.83 33.56 3jys s LYS 363 CO 0.14 -0.80 0.00 0.41 -0.92 0.00 0.00 175.35 174.17 3jys n GLY 364 N 4.10 0.48 3.51 -3.33 0.00 -1.26 -4.94 105.19 103.75 3jys n GLY 364 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 3jys n GLY 364 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3jys s ARG 365 N -0.45 2.58 0.59 1.61 0.52 -0.82 -4.42 118.95 118.56 3jys s ARG 365 Ca 0.00 -0.65 -0.14 0.00 -0.52 0.00 0.00 55.73 54.42 3jys s ARG 365 Cb 0.00 -2.45 -0.04 0.00 0.52 0.00 0.00 34.95 32.98 3jys s ARG 365 CO 0.00 0.64 1.03 -1.54 0.02 0.00 0.00 175.30 175.45 3jys s SER 366 N -0.78 6.06 0.11 0.23 1.04 -0.70 -4.86 113.70 114.80 3jys s SER 366 Ca 0.12 1.63 -0.15 0.00 0.48 0.00 0.00 55.95 58.03 3jys s SER 366 Cb -0.11 -2.51 -0.05 0.00 0.10 0.00 0.00 66.02 63.45 3jys s SER 366 CO 0.01 -0.98 1.50 0.40 0.98 0.00 0.00 173.24 175.15 3jys h ILE 367 N 0.24 1.28 -3.60 -1.02 2.04 -1.92 0.14 117.51 114.67 3jys h ILE 367 Ca -0.46 -1.20 -0.51 0.00 1.00 0.00 0.00 64.86 63.68 3jys h ILE 367 Cb 1.20 1.34 -0.03 0.00 -0.74 0.00 0.00 36.82 38.59 3jys h ILE 367 CO 0.59 0.39 0.13 -1.81 0.00 0.00 0.00 178.15 177.45 3jys s ASP 368 N -6.34 7.07 -0.39 1.72 1.01 -1.26 -3.10 116.67 115.38 3jys s ASP 368 Ca -0.13 1.45 -0.20 0.00 0.71 0.00 0.00 52.55 54.38 3jys s ASP 368 Cb 0.09 -2.43 0.01 0.00 1.01 0.00 0.00 42.92 41.60 3jys s ASP 368 CO 0.81 0.02 0.59 -0.63 0.21 0.00 0.00 175.17 176.17 3jys s ILE 369 N -1.54 4.91 0.00 0.77 1.01 -1.26 -3.90 121.20 121.20 3jys s ILE 369 Ca 0.44 0.30 -0.01 0.00 0.00 0.00 0.00 60.65 61.38 3jys s ILE 369 Cb -0.17 -4.09 -0.00 0.00 0.01 0.00 0.00 42.46 38.21 3jys s ILE 369 CO 0.21 -0.39 -0.02 0.35 0.00 0.00 0.00 174.94 175.09 3jys n THR 370 N 5.63 0.26 -0.05 2.92 -2.24 -1.26 -4.72 114.28 114.81 3jys n THR 370 Ca -0.03 0.05 -0.13 0.00 -2.27 0.00 0.00 64.05 61.67 3jys n THR 370 Cb 0.48 -1.53 -0.12 0.00 -2.10 0.00 0.00 70.33 67.06 3jys n THR 370 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 3jys h SER 371 N -0.04 -0.01 -4.01 3.42 4.64 -2.00 -3.47 113.55 112.08 3jys h SER 371 Ca -0.03 -0.84 -0.01 0.00 -0.47 0.00 0.00 61.79 60.44 3jys h SER 371 Cb 0.87 0.00 -0.22 0.00 -0.31 0.00 0.00 62.40 62.74 3jys h SER 371 CO -0.02 0.86 0.24 -0.55 -0.87 0.00 0.00 176.83 176.50 3jys s SER 372 N -6.07 -0.64 0.11 4.97 0.15 -1.26 -5.05 113.70 105.91 3jys s SER 372 Ca -0.17 1.11 -0.08 0.00 0.70 0.00 0.00 55.95 57.51 3jys s SER 372 Cb -0.02 1.08 -0.13 0.00 -1.71 0.00 0.00 66.02 65.24 3jys s SER 372 CO 0.65 -0.30 1.28 0.58 1.20 0.00 0.00 173.24 176.65 3jys h VAL 373 N 3.63 1.35 -3.40 4.45 2.07 -1.93 -3.41 116.25 119.01 3jys h VAL 373 Ca -0.28 -2.33 -0.51 0.00 0.82 0.00 0.00 66.70 64.41 3jys h VAL 373 Cb 1.16 2.35 -0.00 0.00 -1.52 0.00 0.00 31.29 33.28 3jys h VAL 373 CO 0.14 0.71 -0.04 -0.94 0.02 0.00 0.00 177.57 177.46 3jys s SER 374 N -7.15 6.48 0.00 0.57 1.04 -1.26 -3.98 113.70 109.40 3jys s SER 374 Ca -0.07 0.88 0.00 0.00 0.48 0.00 0.00 55.95 57.24 3jys s SER 374 Cb 0.08 -2.22 0.00 0.00 0.10 0.00 0.00 66.02 63.99 3jys s SER 374 CO 0.89 -0.27 0.00 0.61 0.98 0.00 0.00 173.24 175.45 3jys n GLY 375 N -1.05 0.38 0.37 7.32 0.00 -0.84 -4.88 105.19 106.49 3jys n GLY 375 Ca -0.00 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.09 3jys n GLY 375 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3jys n THR 376 N -2.46 1.68 -0.35 2.61 -2.24 -1.26 -4.80 114.28 107.48 3jys n THR 376 Ca 0.00 -2.27 0.03 0.00 -2.27 0.00 0.00 64.05 59.54 3jys n THR 376 Cb 0.15 -0.09 0.18 0.00 -2.10 0.00 0.00 70.33 68.46 3jys n THR 376 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 3jys h PHE 377 N 0.38 1.10 0.00 4.78 3.04 -1.84 0.15 116.94 124.54 3jys h PHE 377 Ca -0.01 0.03 0.00 0.00 3.98 0.00 0.00 57.97 61.97 3jys h PHE 377 Cb 1.10 -0.36 0.00 0.00 2.56 0.00 0.00 35.95 39.25 3jys h PHE 377 CO 0.26 0.53 0.00 0.39 -2.02 0.00 0.00 178.31 177.47 3jys n GLU 378 N -4.58 0.15 0.00 1.11 -0.58 -1.26 -4.36 120.64 111.12 3jys n GLU 378 Ca 0.15 0.17 0.00 0.00 -0.42 0.00 0.00 57.16 57.06 3jys n GLU 378 Cb 0.22 -1.69 0.00 0.00 -0.57 0.00 0.00 31.44 29.41 3jys n GLU 378 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 3jys n THR 379 N -1.94 0.00 -3.70 2.62 -2.24 -0.59 -4.37 114.28 104.06 3jys n THR 379 Ca 0.05 -0.08 -0.24 0.00 -2.27 0.00 0.00 64.05 61.51 3jys n THR 379 Cb 0.35 0.52 -0.17 0.00 -2.10 0.00 0.00 70.33 68.93 3jys n THR 379 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3jys s GLU 380 N -0.72 0.30 0.00 -0.78 2.02 0.42 -1.72 118.70 118.21 3jys s GLU 380 Ca 0.00 0.02 0.00 0.00 0.02 0.00 0.00 54.97 55.01 3jys s GLU 380 Cb 0.00 -1.30 0.00 0.00 0.10 0.00 0.00 34.13 32.93 3jys s GLU 380 CO 0.00 -0.47 0.00 0.41 0.02 0.00 0.00 175.26 175.22 3jys n GLY 381 N 5.20 1.68 3.77 -1.39 0.00 0.48 -4.62 105.19 110.32 3jys n GLY 381 Ca -0.06 -1.32 -0.37 0.00 0.00 0.00 0.00 46.02 44.27 3jys n GLY 381 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3jys s TRP 382 N 0.00 2.74 0.47 1.61 0.52 -1.25 -4.75 118.94 118.29 3jys s TRP 382 Ca 0.00 1.52 -0.17 0.00 0.02 0.00 0.00 56.10 57.47 3jys s TRP 382 Cb 0.00 -3.42 -0.09 0.00 -1.15 0.00 0.00 33.47 28.82 3jys s TRP 382 CO 0.00 -1.71 0.94 -1.12 0.02 0.00 0.00 176.95 175.08 3jys s SER 383 N -1.40 6.70 -0.23 2.95 0.01 0.51 -1.24 113.70 121.00 3jys s SER 383 Ca 0.67 1.54 -0.01 0.00 1.31 0.00 0.00 55.95 59.46 3jys s SER 383 Cb -0.29 -2.49 0.02 0.00 0.21 0.00 0.00 66.02 63.47 3jys s SER 383 CO 0.35 -0.49 -0.09 -0.69 0.41 0.00 0.00 173.24 172.72 3jys s VAL 384 N -2.46 2.75 -0.23 3.43 1.01 -1.26 -0.75 120.40 122.90 3jys s VAL 384 Ca 0.59 -0.91 0.14 0.00 0.00 0.00 0.00 61.98 61.79 3jys s VAL 384 Cb -0.10 -2.32 0.56 0.00 0.00 0.00 0.00 36.38 34.52 3jys s VAL 384 CO 0.26 0.32 1.49 0.49 0.00 0.00 0.00 175.10 177.66 3jys n PHE 385 N 4.67 1.20 -0.17 5.22 3.01 -0.28 -4.75 117.46 126.36 3jys n PHE 385 Ca -0.18 -1.10 -0.01 0.00 1.01 0.00 0.00 57.45 57.17 3jys n PHE 385 Cb 0.48 -0.41 0.08 0.00 -0.01 0.00 0.00 39.48 39.62 3jys n PHE 385 CO 0.00 0.00 0.00 -0.22 1.01 0.00 0.00 176.76 177.55 3jys h LYS 386 N 1.73 0.20 -5.80 -1.08 3.64 -1.94 -3.37 116.57 109.95 3jys h LYS 386 Ca 0.09 -0.01 -0.58 0.00 -1.27 0.00 0.00 60.65 58.88 3jys h LYS 386 Cb 1.63 -0.05 -0.08 0.00 -0.41 0.00 0.00 32.23 33.33 3jys h LYS 386 CO 0.34 0.13 0.06 -0.06 -2.27 0.00 0.00 179.45 177.66 3jys s PHE 387 N -6.14 3.47 0.01 1.91 0.08 -1.26 -4.67 117.98 111.38 3jys s PHE 387 Ca -0.13 1.03 0.01 0.00 0.12 0.00 0.00 56.93 57.95 3jys s PHE 387 Cb 0.16 -2.76 -0.01 0.00 -0.57 0.00 0.00 43.02 39.85 3jys s PHE 387 CO 0.73 -0.02 -0.03 0.45 -0.10 0.00 0.00 175.22 176.25 3jys s SER 388 N 0.95 0.27 -0.17 1.36 0.15 -0.69 -4.88 113.70 110.68 3jys s SER 388 Ca 0.31 -0.23 0.16 0.00 0.70 0.00 0.00 55.95 56.89 3jys s SER 388 Cb -0.16 0.02 0.73 0.00 -1.71 0.00 0.00 66.02 64.90 3jys s SER 388 CO 0.13 -0.11 1.64 -3.20 1.20 0.00 0.00 173.24 172.91 3jys n ASN 389 N 2.42 5.02 -4.80 5.45 5.15 -0.43 -2.40 115.26 125.68 3jys n ASN 389 Ca -0.17 -2.73 -0.37 0.00 -0.60 0.00 0.00 54.58 50.71 3jys n ASN 389 Cb 0.58 -0.61 -0.06 0.00 -0.53 0.00 0.00 39.78 39.15 3jys n ASN 389 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 3jys s LEU 390 N -2.37 4.36 0.82 1.20 1.43 -1.21 -0.26 118.68 122.63 3jys s LEU 390 Ca 0.51 1.64 -0.12 0.00 -1.03 0.00 0.00 54.13 55.13 3jys s LEU 390 Cb 0.36 -3.78 0.10 0.00 0.03 0.00 0.00 46.19 42.90 3jys s LEU 390 CO 0.18 -0.01 1.17 0.54 0.23 0.00 0.00 176.35 178.47 3jys s ASN 391 N -1.61 4.31 0.24 2.29 4.22 0.17 -1.42 114.94 123.14 3jys s ASN 391 Ca 0.46 0.62 0.19 0.00 -2.14 0.00 0.00 52.86 51.99 3jys s ASN 391 Cb -0.18 -1.05 0.93 0.00 1.28 0.00 0.00 41.25 42.23 3jys s ASN 391 CO 0.23 -2.00 1.57 -1.54 -2.04 0.00 0.00 177.10 173.32 3jys n SER 392 N -3.32 0.48 -1.15 3.54 3.41 -1.26 -1.06 113.62 114.26 3jys n SER 392 Ca 0.09 0.69 0.10 0.00 -0.26 0.00 0.00 58.87 59.49 3jys n SER 392 Cb 0.61 -0.76 0.28 0.00 -0.26 0.00 0.00 64.21 64.07 3jys n SER 392 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 3jys n ASN 393 N -2.11 3.34 0.00 4.04 0.23 -1.26 -4.95 115.26 114.56 3jys n ASN 393 Ca -0.00 -1.99 0.00 0.00 -0.53 0.00 0.00 54.58 52.06 3jys n ASN 393 Cb 0.08 -0.40 0.00 0.00 -2.08 0.00 0.00 39.78 37.38 3jys n ASN 393 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3jys n GLY 394 N 1.50 1.26 3.83 4.83 0.00 -0.22 -5.04 105.19 111.34 3jys n GLY 394 Ca 0.21 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.89 3jys n GLY 394 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3jys s GLN 395 N -0.38 4.13 0.47 1.61 -1.52 -1.26 -4.71 119.66 117.99 3jys s GLN 395 Ca 0.00 0.84 -0.23 0.00 -1.95 0.00 0.00 55.36 54.02 3jys s GLN 395 Cb 0.00 -2.48 -0.07 0.00 -0.22 0.00 0.00 33.01 30.24 3jys s GLN 395 CO 0.00 0.17 1.22 -2.14 -0.25 0.00 0.00 175.29 174.29 3jys s PRO 396 N -2.79 3.67 1.04 2.91 0.02 -1.26 0.43 135.00 139.02 3jys s PRO 396 Ca 0.54 1.92 -0.13 0.00 0.02 0.00 0.00 61.00 63.34 3jys s PRO 396 Cb -0.12 -2.43 0.16 0.00 0.02 0.00 0.00 34.50 32.13 3jys s PRO 396 CO 0.17 -0.66 0.74 0.41 -0.33 0.00 0.00 177.00 177.33 3jys n GLY 397 N 0.54 -1.63 0.10 0.52 0.00 0.64 -4.73 105.19 100.63 3jys n GLY 397 Ca 0.07 -0.88 0.11 0.00 0.00 0.00 0.00 46.02 45.33 3jys n GLY 397 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3jys n LYS 398 N -3.53 0.17 -4.57 1.61 2.85 -1.26 -4.60 118.16 108.83 3jys n LYS 398 Ca 0.06 0.34 -0.21 0.00 -1.05 0.00 0.00 58.31 57.44 3jys n LYS 398 Cb 0.55 -1.79 -0.15 0.00 -0.65 0.00 0.00 35.03 32.99 3jys n LYS 398 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 177.40 178.56 3jys s ASN 399 N -4.05 1.50 0.49 -5.58 3.84 -1.26 -5.04 114.94 104.85 3jys s ASN 399 Ca 0.06 -0.23 0.29 0.00 0.21 0.00 0.00 52.86 53.19 3jys s ASN 399 Cb 0.10 -0.21 0.94 0.00 -0.55 0.00 0.00 41.25 41.53 3jys s ASN 399 CO 0.42 0.15 1.83 0.71 -2.79 0.00 0.00 177.10 177.41 3jys h THR 400 N 4.91 0.09 0.00 -5.21 1.35 -1.81 -3.39 112.91 108.85 3jys h THR 400 Ca -0.33 -0.79 0.00 0.00 -0.55 0.00 0.00 66.41 64.73 3jys h THR 400 Cb 1.17 1.73 0.00 0.00 -1.73 0.00 0.00 68.15 69.32 3jys h THR 400 CO 0.49 0.04 -0.12 -0.11 -0.25 0.00 0.00 175.52 175.57 3jys n LEU 401 N -3.13 0.45 -4.55 3.87 7.94 -1.26 -2.69 117.00 117.62 3jys n LEU 401 Ca 0.02 0.07 -0.35 0.00 -1.11 0.00 0.00 56.01 54.64 3jys n LEU 401 Cb 0.41 -0.28 -0.04 0.00 0.53 0.00 0.00 43.42 44.04 3jys n LEU 401 CO 0.31 -0.53 1.50 0.26 -1.11 0.00 0.00 177.39 177.82 3jys s TRP 402 N -1.42 1.75 0.67 1.96 0.52 -1.26 -4.70 118.94 116.46 3jys s TRP 402 Ca -0.03 0.67 -0.13 0.00 0.02 0.00 0.00 56.10 56.62 3jys s TRP 402 Cb 0.00 -4.11 0.00 0.00 -1.15 0.00 0.00 33.47 28.22 3jys s TRP 402 CO 0.05 -2.10 1.07 0.14 0.02 0.00 0.00 176.95 176.13 3jys s VAL 403 N 9.21 3.67 -0.23 4.03 -7.23 -1.26 -3.69 120.40 124.90 3jys s VAL 403 Ca 0.66 0.66 0.20 0.00 -1.81 0.00 0.00 61.98 61.69 3jys s VAL 403 Cb -0.10 -3.24 0.04 0.00 0.56 0.00 0.00 36.38 33.64 3jys s VAL 403 CO 0.13 -0.59 1.16 0.44 -0.31 0.00 0.00 175.10 175.92 3jys h ASP 404 N -0.29 0.00 -2.36 4.85 3.32 -1.82 -3.18 116.42 116.94 3jys h ASP 404 Ca -0.45 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.03 3jys h ASP 404 Cb 1.22 0.00 0.05 0.00 0.22 0.00 0.00 39.33 40.83 3jys h ASP 404 CO 0.55 0.25 0.90 0.41 -1.72 0.00 0.00 179.24 179.63 3jys n THR 405 N -2.91 0.08 -3.54 0.35 -1.04 -1.15 -4.32 114.28 101.75 3jys n THR 405 Ca -0.02 -0.01 -0.34 0.00 -2.04 0.00 0.00 64.05 61.64 3jys n THR 405 Cb 0.66 -1.72 -0.05 0.00 -1.82 0.00 0.00 70.33 67.39 3jys n THR 405 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 3jys s ASP 406 N 1.39 6.64 -0.17 8.00 1.01 -1.26 -4.26 116.67 128.01 3jys s ASP 406 Ca 0.79 0.81 -0.25 0.00 0.71 0.00 0.00 52.55 54.61 3jys s ASP 406 Cb -0.62 -2.18 -0.01 0.00 1.01 0.00 0.00 42.92 41.11 3jys s ASP 406 CO 0.38 0.11 0.83 0.12 0.21 0.00 0.00 175.17 176.82 3jys s PHE 407 N -1.51 3.42 0.58 4.23 5.36 -0.53 -4.92 117.98 124.61 3jys s PHE 407 Ca 0.37 1.25 -0.07 0.00 -0.96 0.00 0.00 56.93 57.53 3jys s PHE 407 Cb -0.13 -3.01 -0.00 0.00 -0.34 0.00 0.00 43.02 39.53 3jys s PHE 407 CO 0.20 -0.24 0.90 -1.25 -1.46 0.00 0.00 175.22 173.37 3jys s PRO 408 N 2.14 3.07 0.14 10.12 0.04 -1.26 -0.58 135.00 148.68 3jys s PRO 408 Ca 0.38 0.12 -0.34 0.00 0.04 0.00 0.00 61.00 61.21 3jys s PRO 408 Cb -0.17 -2.26 -0.17 0.00 0.04 0.00 0.00 34.50 31.95 3jys s PRO 408 CO 0.12 -0.63 1.05 1.19 0.04 0.00 0.00 177.00 178.78 3jys n PHE 410 N -2.57 0.89 -3.95 0.56 3.72 -0.97 -4.98 117.46 110.15 3jys n PHE 410 Ca 0.04 0.80 -0.09 0.00 -0.05 0.00 0.00 57.45 58.16 3jys n PHE 410 Cb 0.57 -2.19 -0.08 0.00 -0.94 0.00 0.00 39.48 36.84 3jys n PHE 410 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 176.76 175.73 3jys s ARG 411 N -0.36 0.90 0.44 -1.08 1.70 -1.26 -0.86 118.95 118.43 3jys s ARG 411 Ca 0.76 -1.11 0.17 0.00 -0.47 0.00 0.00 55.73 55.08 3jys s ARG 411 Cb -0.96 0.32 1.02 0.00 -0.57 0.00 0.00 34.95 34.76 3jys s ARG 411 CO 0.54 -0.28 1.96 1.25 -1.08 0.00 0.00 175.30 177.69 3jys h LEU 412 N 2.77 0.00 -0.88 -1.89 5.85 -1.66 -2.11 115.31 117.39 3jys h LEU 412 Ca -0.34 0.00 0.07 0.00 0.84 0.00 0.00 57.88 58.45 3jys h LEU 412 Cb 1.20 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 42.16 3jys h LEU 412 CO 0.56 0.22 0.54 1.23 -0.34 0.00 0.00 178.44 180.65 3jys h GLY 413 N 0.76 1.34 0.86 3.75 0.00 -1.96 -0.07 103.07 107.74 3jys h GLY 413 Ca -0.00 -0.39 -0.03 0.00 0.00 0.00 0.00 47.33 46.91 3jys h GLY 413 CO 0.03 0.25 0.03 -1.80 0.00 0.00 0.00 176.54 175.05 3jys h ASP 414 N 0.98 0.39 -0.55 0.19 3.58 -1.80 -2.64 116.42 116.57 3jys h ASP 414 Ca 0.39 -0.27 0.09 0.00 0.42 0.00 0.00 57.03 57.66 3jys h ASP 414 Cb 0.20 -0.10 -0.07 0.00 1.72 0.00 0.00 39.33 41.08 3jys h ASP 414 CO -0.19 0.56 0.13 0.40 -2.88 0.00 0.00 179.24 177.27 3jys h ILE 415 N 0.20 0.71 -0.21 2.25 1.08 -1.23 -2.14 117.51 118.17 3jys h ILE 415 Ca 0.07 -0.09 0.05 0.00 -0.39 0.00 0.00 64.86 64.50 3jys h ILE 415 Cb 0.34 0.41 -0.06 0.00 -3.07 0.00 0.00 36.82 34.45 3jys h ILE 415 CO 0.01 0.05 -0.16 1.88 -0.69 0.00 0.00 178.15 179.23 3jys h TYR 416 N 0.27 -0.41 0.00 1.37 -1.99 -0.95 -0.20 116.97 115.06 3jys h TYR 416 Ca 0.28 0.03 0.00 0.00 2.00 0.00 0.00 58.73 61.04 3jys h TYR 416 Cb 0.38 0.21 0.00 0.00 2.00 0.00 0.00 36.73 39.32 3jys h TYR 416 CO -0.22 -0.23 0.00 1.28 -0.00 0.00 0.00 178.16 178.98 3jys n LEU 417 N -5.32 0.93 0.00 3.88 4.77 -0.81 -1.68 117.00 118.78 3jys n LEU 417 Ca -0.01 -0.46 0.00 0.00 -0.03 0.00 0.00 56.01 55.51 3jys n LEU 417 Cb 0.23 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 3jys n LEU 417 CO 0.19 0.16 0.00 0.00 -1.33 0.00 0.00 177.39 176.41 3jys n TYR 419 N 0.96 0.00 -0.15 -1.77 4.19 -0.09 -1.36 117.16 118.95 3jys n TYR 419 Ca 0.00 0.00 -0.08 0.00 3.31 0.00 0.00 57.90 61.13 3jys n TYR 419 Cb 0.14 0.00 0.01 0.00 0.49 0.00 0.00 39.34 39.98 3jys n TYR 419 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 3jys h ALA 420 N 0.00 0.56 -0.32 2.98 0.00 -1.58 -2.02 119.26 118.89 3jys h ALA 420 Ca 0.00 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 3jys h ALA 420 Cb 0.00 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 3jys h ALA 420 CO 0.00 0.06 0.00 1.49 0.00 0.00 0.00 179.25 180.81 3jys h GLU 421 N 0.58 0.56 -0.92 0.00 4.81 -1.50 -0.09 114.58 118.02 3jys h GLU 421 Ca 0.16 -0.18 0.01 0.00 -0.13 0.00 0.00 59.36 59.22 3jys h GLU 421 Cb 0.02 -0.05 -0.05 0.00 0.63 0.00 0.00 28.75 29.30 3jys h GLU 421 CO -0.03 0.69 0.61 0.00 -0.73 0.00 0.00 179.01 179.55 3jys h ALA 422 N 0.85 1.35 -0.17 2.92 0.00 -1.78 -0.22 119.26 122.20 3jys h ALA 422 Ca 0.09 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 3jys h ALA 422 Cb 0.44 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 3jys h ALA 422 CO 0.02 0.61 -0.22 0.28 0.00 0.00 0.00 179.25 179.93 3jys h VAL 423 N 1.24 1.35 -0.79 0.00 2.07 -1.26 -0.32 116.25 118.55 3jys h VAL 423 Ca 0.34 -1.43 0.10 0.00 0.82 0.00 0.00 66.70 66.54 3jys h VAL 423 Cb -0.14 1.89 -0.08 0.00 -1.52 0.00 0.00 31.29 31.44 3jys h VAL 423 CO -0.07 0.43 0.42 0.00 0.02 0.00 0.00 177.57 178.37 3jys h ALA 424 N 0.60 1.13 -0.06 1.67 0.00 -0.62 -1.71 119.26 120.27 3jys h ALA 424 Ca 0.02 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3jys h ALA 424 Cb 0.79 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.50 3jys h ALA 424 CO 0.05 0.01 0.00 0.54 0.00 0.00 0.00 179.25 179.85 3jys n ARG 425 N -4.81 1.27 0.00 0.00 1.74 -0.13 -4.89 116.66 109.84 3jys n ARG 425 Ca 0.13 -0.41 0.00 0.00 -0.77 0.00 0.00 57.85 56.81 3jys n ARG 425 Cb 0.31 -1.33 0.00 0.00 -1.02 0.00 0.00 32.46 30.41 3jys n ARG 425 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3jys n GLY 426 N 0.92 1.19 3.77 -0.13 0.00 -0.64 -5.05 105.19 105.26 3jys n GLY 426 Ca 0.15 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 3jys n GLY 426 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3jys s GLY 427 N -2.00 1.90 -0.58 -0.02 0.00 -0.15 -4.88 107.32 101.60 3jys s GLY 427 Ca 0.00 0.39 -0.27 0.00 0.00 0.00 0.00 44.72 44.84 3jys s GLY 427 CO 0.00 0.73 1.74 1.85 0.00 0.00 0.00 173.10 177.43 3jys s GLU 428 N -4.53 2.86 0.05 2.90 2.56 -1.26 -4.59 118.70 116.69 3jys s GLU 428 Ca 0.64 0.64 -0.13 0.00 0.00 0.00 0.00 54.97 56.11 3jys s GLU 428 Cb -0.18 -4.31 0.04 0.00 2.00 0.00 0.00 34.13 31.68 3jys s GLU 428 CO 0.49 -2.46 0.61 0.41 -0.56 0.00 0.00 175.26 173.75 3jys n GLY 429 N 5.57 0.69 3.49 -1.50 0.00 -1.26 -4.87 105.19 107.33 3jys n GLY 429 Ca 0.18 -1.00 -0.36 0.00 0.00 0.00 0.00 46.02 44.85 3jys n GLY 429 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3jys s SER 430 N -2.40 5.22 0.18 1.61 0.15 -1.26 -4.98 113.70 112.22 3jys s SER 430 Ca 0.14 -0.13 -0.10 0.00 0.70 0.00 0.00 55.95 56.56 3jys s SER 430 Cb -0.01 -1.92 0.08 0.00 -1.71 0.00 0.00 66.02 62.46 3jys s SER 430 CO 0.01 0.03 1.68 0.11 1.20 0.00 0.00 173.24 176.28 3jys h LYS 431 N 7.74 1.03 -0.27 5.44 1.57 -1.98 -0.97 116.57 129.12 3jys h LYS 431 Ca -0.37 -0.27 0.04 0.00 -1.87 0.00 0.00 60.65 58.18 3jys h LYS 431 Cb 1.18 -0.12 -0.04 0.00 0.08 0.00 0.00 32.23 33.32 3jys h LYS 431 CO 0.61 0.95 0.04 0.00 -0.57 0.00 0.00 179.45 180.47 3jys h ALA 432 N 1.04 0.27 -0.36 3.86 0.00 -1.99 -0.13 119.26 121.94 3jys h ALA 432 Ca 0.19 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 3jys h ALA 432 Cb 0.41 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 3jys h ALA 432 CO 0.01 -0.38 0.15 0.77 0.00 0.00 0.00 179.25 179.80 3jys h SER 433 N 0.13 0.50 -0.39 0.00 0.02 -1.95 -0.83 113.55 111.03 3jys h SER 433 Ca 0.13 -0.16 0.08 0.00 -0.84 0.00 0.00 61.79 61.00 3jys h SER 433 Cb 0.15 -0.13 -0.08 0.00 0.14 0.00 0.00 62.40 62.47 3jys h SER 433 CO -0.19 0.53 -0.16 0.00 -1.14 0.00 0.00 176.83 175.87 3jys h ALA 434 N 0.99 0.15 -0.80 3.77 0.00 -0.87 0.39 119.26 122.89 3jys h ALA 434 Ca 0.12 0.14 0.04 0.00 0.00 0.00 0.00 54.91 55.21 3jys h ALA 434 Cb 0.18 0.41 -0.05 0.00 0.00 0.00 0.00 17.79 18.33 3jys h ALA 434 CO -0.01 -0.52 0.50 0.28 0.00 0.00 0.00 179.25 179.50 3jys h VAL 435 N -0.08 1.11 -0.63 0.00 2.07 -0.75 -2.11 116.25 115.85 3jys h VAL 435 Ca 0.19 -0.33 0.01 0.00 0.82 0.00 0.00 66.70 67.39 3jys h VAL 435 Cb 0.38 0.05 -0.03 0.00 -1.52 0.00 0.00 31.29 30.16 3jys h VAL 435 CO -0.45 0.18 0.41 -0.33 0.02 0.00 0.00 177.57 177.40 3jys h GLU 436 N 0.98 0.80 -0.35 1.57 5.08 -0.45 -1.21 114.58 121.00 3jys h GLU 436 Ca 0.32 -0.05 -0.07 0.00 -1.00 0.00 0.00 59.36 58.56 3jys h GLU 436 Cb 0.03 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.09 3jys h GLU 436 CO -0.12 0.53 -0.07 1.88 -1.00 0.00 0.00 179.01 180.23 3jys h TYR 437 N 0.82 0.74 -0.42 4.33 0.05 -0.67 -0.97 116.97 120.85 3jys h TYR 437 Ca 0.24 -0.15 -0.02 0.00 0.05 0.00 0.00 58.73 58.85 3jys h TYR 437 Cb -0.05 -0.18 -0.02 0.00 1.01 0.00 0.00 36.73 37.49 3jys h TYR 437 CO -0.04 0.81 0.19 0.82 -1.05 0.00 0.00 178.16 178.89 3jys h ILE 438 N 0.45 1.19 -0.34 -2.88 1.08 -1.32 -2.49 117.51 113.19 3jys h ILE 438 Ca 0.09 -0.55 -0.03 0.00 -0.39 0.00 0.00 64.86 63.99 3jys h ILE 438 Cb 0.56 0.77 -0.02 0.00 -3.07 0.00 0.00 36.82 35.07 3jys h ILE 438 CO 0.03 0.20 0.10 0.78 -0.69 0.00 0.00 178.15 178.57 3jys h ASN 439 N 0.53 0.45 -0.54 1.72 2.35 -1.13 -0.01 115.58 118.95 3jys h ASN 439 Ca 0.14 -0.05 -0.01 0.00 -0.55 0.00 0.00 56.30 55.83 3jys h ASN 439 Cb 0.15 -0.12 -0.03 0.00 0.05 0.00 0.00 38.32 38.38 3jys h ASN 439 CO -0.02 0.45 0.32 0.00 -1.65 0.00 0.00 177.43 176.53 3jys h ALA 440 N 1.62 0.69 -0.70 -0.83 0.00 -0.92 0.25 119.26 119.37 3jys h ALA 440 Ca 0.12 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 3jys h ALA 440 Cb 0.17 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 3jys h ALA 440 CO -0.01 0.18 0.17 -0.07 0.00 0.00 0.00 179.25 179.53 3jys h LEU 441 N 0.72 1.06 -0.31 0.00 3.38 -0.89 -2.19 115.31 117.08 3jys h LEU 441 Ca 0.19 -0.23 -0.19 0.00 0.09 0.00 0.00 57.88 57.74 3jys h LEU 441 Cb 0.00 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 3jys h LEU 441 CO -0.03 1.02 -0.86 0.03 0.09 0.00 0.00 178.44 178.69 3jys h ARG 442 N 1.05 0.13 -0.43 1.13 3.08 -0.66 -1.82 114.38 116.85 3jys h ARG 442 Ca 0.22 -0.14 -0.02 0.00 0.07 0.00 0.00 59.98 60.10 3jys h ARG 442 Cb 0.37 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.45 3jys h ARG 442 CO 0.00 0.90 0.17 -0.22 -1.07 0.00 0.00 179.97 179.76 3jys h LYS 443 N 0.07 0.65 -0.55 0.04 3.64 -0.49 -1.06 116.57 118.87 3jys h LYS 443 Ca -0.03 -0.12 0.03 0.00 -1.27 0.00 0.00 60.65 59.26 3jys h LYS 443 Cb 1.48 -0.11 -0.04 0.00 -0.41 0.00 0.00 32.23 33.16 3jys h LYS 443 CO 0.12 0.60 0.32 -0.09 -2.27 0.00 0.00 179.45 178.13 3jys h ARG 444 N 0.56 0.62 -0.21 1.90 2.43 -1.32 0.89 114.38 119.25 3jys h ARG 444 Ca 0.15 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.28 3jys h ARG 444 Cb 0.19 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.59 3jys h ARG 444 CO -0.01 0.41 0.13 0.00 -1.51 0.00 0.00 179.97 178.99 3jys h ALA 445 N 1.26 0.26 0.00 2.80 0.00 -1.07 -3.29 119.26 119.22 3jys h ALA 445 Ca 0.23 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.13 3jys h ALA 445 Cb 0.05 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.76 3jys h ALA 445 CO -0.11 -0.27 -1.49 0.66 0.00 0.00 0.00 179.25 178.03 3jys n TYR 446 N -4.95 0.14 -1.18 0.00 4.02 -0.43 -1.44 117.16 113.32 3jys n TYR 446 Ca -0.03 0.04 -0.06 0.00 -0.01 0.00 0.00 57.90 57.84 3jys n TYR 446 Cb 0.03 -0.42 -0.03 0.00 -0.02 0.00 0.00 39.34 38.90 3jys n TYR 446 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3jys n GLY 447 N 1.33 0.86 3.30 2.72 0.00 0.30 -4.96 105.19 108.73 3jys n GLY 447 Ca -0.01 -0.77 -0.09 0.00 0.00 0.00 0.00 46.02 45.15 3jys n GLY 447 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3jys n ASP 448 N 0.99 -1.86 -1.66 1.61 5.68 -1.23 -5.05 116.55 115.02 3jys n ASP 448 Ca -0.06 -2.50 0.07 0.00 -0.50 0.00 0.00 54.79 51.80 3jys n ASP 448 Cb 0.20 3.16 0.37 0.00 -1.14 0.00 0.00 41.12 43.72 3jys n ASP 448 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 3jys n ASP 449 N -1.52 5.30 -1.31 -1.12 8.00 -1.26 -4.38 116.55 120.26 3jys n ASP 449 Ca -0.06 -2.92 0.12 0.00 0.71 0.00 0.00 54.79 52.64 3jys n ASP 449 Cb 0.53 -0.65 0.31 0.00 -0.02 0.00 0.00 41.12 41.29 3jys n ASP 449 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3jys n LYS 450 N 0.42 2.65 -0.97 -1.24 5.02 -1.26 -4.24 118.16 118.53 3jys n LYS 450 Ca 0.26 -2.55 0.05 0.00 -2.02 0.00 0.00 58.31 54.05 3jys n LYS 450 Cb 1.12 -1.55 0.12 0.00 -0.02 0.00 0.00 35.03 34.70 3jys n LYS 450 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 3jys n HIS 451 N 1.59 0.00 -2.34 2.13 8.25 -1.26 -5.07 115.22 118.52 3jys n HIS 451 Ca 0.24 -1.03 -0.35 0.00 -0.26 0.00 0.00 57.72 56.32 3jys n HIS 451 Cb 0.61 -0.20 -0.01 0.00 1.12 0.00 0.00 29.99 31.51 3jys n HIS 451 CO 0.00 0.00 0.00 -0.80 0.64 0.00 0.00 176.34 176.18 3jys s ASN 452 N -2.66 5.90 0.51 0.41 0.01 -1.26 -4.89 114.94 112.97 3jys s ASN 452 Ca 0.35 2.11 0.06 0.00 -0.71 0.00 0.00 52.86 54.68 3jys s ASN 452 Cb 0.37 -2.58 0.02 0.00 0.41 0.00 0.00 41.25 39.48 3jys s ASN 452 CO -0.11 -1.09 0.39 0.27 -1.51 0.00 0.00 177.10 175.05 3jys s ILE 453 N -1.82 1.88 0.36 0.60 -5.25 -1.26 -5.12 121.20 110.59 3jys s ILE 453 Ca 0.71 -1.47 0.03 0.00 -0.99 0.00 0.00 60.65 58.93 3jys s ILE 453 Cb -0.22 -2.35 -0.01 0.00 2.95 0.00 0.00 42.46 42.83 3jys s ILE 453 CO 0.25 0.00 0.10 -1.54 -1.79 0.00 0.00 174.94 171.96 3jys n SER 454 N -1.70 1.58 -0.22 4.36 3.41 -1.26 -4.96 113.62 114.82 3jys n SER 454 Ca -0.00 -2.85 -0.06 0.00 -0.26 0.00 0.00 58.87 55.69 3jys n SER 454 Cb 0.64 0.76 0.04 0.00 -0.26 0.00 0.00 64.21 65.39 3jys n SER 454 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 3jys h GLU 455 N 0.00 0.83 -0.46 4.33 5.08 -1.99 -1.93 114.58 120.45 3jys h GLU 455 Ca -0.29 -0.07 0.13 0.00 -1.00 0.00 0.00 59.36 58.14 3jys h GLU 455 Cb 1.04 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 30.10 3jys h GLU 455 CO 0.46 0.58 0.35 -0.91 -1.00 0.00 0.00 179.01 178.49 3jys h ASN 456 N 0.84 0.00 0.28 1.42 2.35 -2.00 -0.72 115.58 117.74 3jys h ASN 456 Ca 0.22 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.94 3jys h ASN 456 Cb -0.04 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.32 3jys h ASN 456 CO -0.04 0.00 -0.13 -0.25 -1.65 0.00 0.00 177.43 175.36 3jys h TRP 457 N 0.00 0.00 -0.30 1.19 7.01 -1.75 -2.44 115.95 119.66 3jys h TRP 457 Ca 0.22 0.00 -0.09 0.00 2.11 0.00 0.00 58.89 61.13 3jys h TRP 457 Cb 0.91 0.00 -0.02 0.00 -2.10 0.00 0.00 29.16 27.96 3jys h TRP 457 CO 0.00 0.13 -0.18 -0.07 -2.79 0.00 0.00 178.44 175.53 3jys h LEU 458 N 0.00 0.53 0.00 0.65 3.38 -1.24 -3.32 115.31 115.32 3jys h LEU 458 Ca -0.00 -0.16 -0.06 0.00 0.09 0.00 0.00 57.88 57.75 3jys h LEU 458 Cb 0.31 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 3jys h LEU 458 CO 0.02 0.72 -1.93 -0.62 0.09 0.00 0.00 178.44 176.72 3jys n GLU 459 N -4.16 0.67 -1.91 1.13 1.02 -1.03 -4.47 120.64 111.89 3jys n GLU 459 Ca 0.00 -0.14 -0.35 0.00 -0.02 0.00 0.00 57.16 56.65 3jys n GLU 459 Cb 0.37 -1.45 0.04 0.00 -0.02 0.00 0.00 31.44 30.37 3jys n GLU 459 CO 0.00 0.00 0.00 -1.83 1.18 0.00 0.00 177.13 176.48 3jys s GLU 460 N -3.16 2.88 -1.30 3.49 -1.05 -0.95 -2.84 118.70 115.77 3jys s GLU 460 Ca -0.07 1.67 -0.18 0.00 -0.15 0.00 0.00 54.97 56.24 3jys s GLU 460 Cb 0.11 -1.93 0.01 0.00 -0.44 0.00 0.00 34.13 31.88 3jys s GLU 460 CO 0.78 -1.24 0.53 -1.71 0.95 0.00 0.00 175.26 174.57 3jys n ASN 461 N -1.90 -2.68 -4.03 0.83 5.15 -1.26 -2.48 115.26 108.89 3jys n ASN 461 Ca 0.12 -1.16 -0.28 0.00 -0.60 0.00 0.00 54.58 52.66 3jys n ASN 461 Cb 0.51 -2.39 -0.04 0.00 -0.53 0.00 0.00 39.78 37.33 3jys n ASN 461 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 3jys n ASN 462 N -2.60 -0.38 -0.01 1.20 5.15 -1.20 -1.69 115.26 115.74 3jys n ASN 462 Ca -0.19 -1.09 -0.00 0.00 -0.60 0.00 0.00 54.58 52.70 3jys n ASN 462 Cb 0.62 -2.65 -0.00 0.00 -0.53 0.00 0.00 39.78 37.22 3jys n ASN 462 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 3jys n PHE 463 N -4.46 0.00 0.24 1.20 3.72 -1.03 -4.88 117.46 112.24 3jys n PHE 463 Ca -0.30 0.00 0.09 0.00 -0.05 0.00 0.00 57.45 57.19 3jys n PHE 463 Cb 0.68 -1.08 0.58 0.00 -0.94 0.00 0.00 39.48 38.73 3jys n PHE 463 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3jys h ARG 464 N 0.46 0.00 -0.27 -1.08 2.47 -1.38 -1.10 114.38 113.48 3jys h ARG 464 Ca -0.00 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.71 3jys h ARG 464 Cb 0.53 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.84 3jys h ARG 464 CO 0.00 0.20 0.14 -0.91 0.56 0.00 0.00 179.97 179.96 3jys h ASN 465 N 0.00 0.32 0.20 7.04 2.35 -1.82 -0.43 115.58 123.24 3jys h ASN 465 Ca -0.00 -0.02 -0.19 0.00 -0.55 0.00 0.00 56.30 55.54 3jys h ASN 465 Cb 0.45 -0.08 -0.00 0.00 0.05 0.00 0.00 38.32 38.74 3jys h ASN 465 CO 0.03 0.26 -0.76 -0.07 -1.65 0.00 0.00 177.43 175.24 3jys h LEU 466 N 0.37 0.56 -0.36 1.61 3.38 -1.49 -0.12 115.31 119.27 3jys h LEU 466 Ca 0.10 -0.38 -0.04 0.00 0.09 0.00 0.00 57.88 57.65 3jys h LEU 466 Cb 0.02 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 3jys h LEU 466 CO -0.02 1.13 0.07 0.25 0.09 0.00 0.00 178.44 179.96 3jys h LEU 467 N 0.31 0.56 -0.58 1.67 5.85 -1.25 -0.84 115.31 121.04 3jys h LEU 467 Ca -0.04 -0.25 0.02 0.00 0.84 0.00 0.00 57.88 58.45 3jys h LEU 467 Cb 1.35 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 42.19 3jys h LEU 467 CO 0.13 0.67 0.36 0.44 -0.34 0.00 0.00 178.44 179.71 3jys h ASP 468 N 0.43 0.61 0.49 1.25 5.19 -0.97 -1.77 116.42 121.65 3jys h ASP 468 Ca 0.11 -0.00 -0.12 0.00 -0.62 0.00 0.00 57.03 56.40 3jys h ASP 468 Cb 0.34 -0.14 -0.02 0.00 0.18 0.00 0.00 39.33 39.70 3jys h ASP 468 CO 0.01 0.43 -0.53 -0.08 -3.12 0.00 0.00 179.24 175.94 3jys h GLU 469 N 0.73 0.05 0.00 3.56 4.57 -0.85 -0.12 114.58 122.51 3jys h GLU 469 Ca 0.23 -0.03 -0.08 0.00 -1.18 0.00 0.00 59.36 58.30 3jys h GLU 469 Cb -0.02 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.56 3jys h GLU 469 CO -0.08 0.57 -0.38 0.00 -1.18 0.00 0.00 179.01 177.94 3jys h ARG 470 N 0.04 0.00 0.11 1.92 3.08 -0.86 -0.11 114.38 118.55 3jys h ARG 470 Ca -0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 3jys h ARG 470 Cb 0.96 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.01 3jys h ARG 470 CO 0.07 0.38 -0.05 0.78 -1.07 0.00 0.00 179.97 180.07 3jys h GLY 471 N 2.04 -0.15 1.01 0.04 0.00 -0.50 0.09 103.07 105.59 3jys h GLY 471 Ca -0.00 0.06 -0.01 0.00 0.00 0.00 0.00 47.33 47.37 3jys h GLY 471 CO 0.05 -0.06 0.45 3.21 0.00 0.00 0.00 176.54 180.20 3jys h ARG 472 N -0.52 1.07 0.14 4.80 3.08 -0.79 -1.88 114.38 120.28 3jys h ARG 472 Ca -0.01 -0.11 -0.22 0.00 0.07 0.00 0.00 59.98 59.71 3jys h ARG 472 Cb 0.42 -0.22 0.02 0.00 0.08 0.00 0.00 29.97 30.28 3jys h ARG 472 CO 0.02 0.77 -0.95 1.49 -1.07 0.00 0.00 179.97 180.23 3jys h GLU 473 N 1.07 0.39 -0.19 0.04 4.57 -1.08 -3.40 114.58 115.99 3jys h GLU 473 Ca 0.28 -0.61 0.00 0.00 -1.18 0.00 0.00 59.36 57.84 3jys h GLU 473 Cb -0.01 0.22 0.00 0.00 -0.16 0.00 0.00 28.75 28.80 3jys h GLU 473 CO -0.05 1.28 0.00 1.28 -1.18 0.00 0.00 179.01 180.34 3jys n LEU 474 N -4.03 2.41 -4.62 1.64 4.77 0.02 -5.04 117.00 112.15 3jys n LEU 474 Ca -0.14 -1.70 -0.45 0.00 -0.03 0.00 0.00 56.01 53.68 3jys n LEU 474 Cb 0.87 -0.12 -0.02 0.00 -2.33 0.00 0.00 43.42 41.82 3jys n LEU 474 CO 0.52 0.58 0.74 0.00 -1.33 0.00 0.00 177.39 177.89 3jys n TYR 475 N 0.33 1.59 -1.24 -1.77 4.11 -0.71 -1.20 117.16 118.27 3jys n TYR 475 Ca 0.08 0.62 -0.08 0.00 -0.00 0.00 0.00 57.90 58.52 3jys n TYR 475 Cb 0.33 -2.32 -0.04 0.00 -0.00 0.00 0.00 39.34 37.32 3jys n TYR 475 CO 0.00 0.00 0.00 0.91 -0.00 0.00 0.00 176.86 177.77 3jys n TRP 476 N 0.89 0.00 -0.79 -3.48 7.02 -1.26 -4.88 117.44 114.94 3jys n TRP 476 Ca 0.11 0.00 0.08 0.00 -1.02 0.00 0.00 57.50 56.67 3jys n TRP 476 Cb 0.31 -1.89 0.35 0.00 -2.42 0.00 0.00 31.31 27.66 3jys n TRP 476 CO 0.00 0.00 0.00 0.39 -2.02 0.00 0.00 177.69 176.06 3jys n GLU 477 N -2.05 4.06 -0.74 -0.99 1.02 -0.34 -4.97 120.64 116.62 3jys n GLU 477 Ca -0.08 -2.97 0.00 0.00 -0.02 0.00 0.00 57.16 54.09 3jys n GLU 477 Cb 0.36 -2.02 0.00 0.00 -0.02 0.00 0.00 31.44 29.77 3jys n GLU 477 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3jys n GLY 478 N 0.61 0.55 0.00 0.62 0.00 -1.26 -4.91 105.19 100.80 3jys n GLY 478 Ca 0.25 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.53 3jys n GLY 478 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 3jys n ILE 479 N -2.74 0.00 -0.20 -0.61 0.13 -1.26 -4.81 119.36 109.86 3jys n ILE 479 Ca 0.00 -0.46 -0.07 0.00 -1.10 0.00 0.00 62.75 61.12 3jys n ILE 479 Cb 0.00 1.01 0.03 0.00 -0.84 0.00 0.00 39.64 39.84 3jys n ILE 479 CO 0.00 0.00 0.00 -0.09 2.80 0.00 0.00 176.55 179.26 3jys h ARG 480 N 0.00 0.80 -0.17 9.51 9.65 -1.90 -2.15 114.38 130.12 3jys h ARG 480 Ca 0.00 -0.08 0.03 0.00 -1.10 0.00 0.00 59.98 58.83 3jys h ARG 480 Cb 0.01 -0.16 -0.03 0.00 -1.39 0.00 0.00 29.97 28.39 3jys h ARG 480 CO 0.00 0.59 -0.02 -0.09 2.80 0.00 0.00 179.97 183.24 3jys h ARG 481 N 0.78 0.02 -0.62 0.20 2.43 -1.51 -0.31 114.38 115.37 3jys h ARG 481 Ca 0.21 -0.00 0.09 0.00 -0.81 0.00 0.00 59.98 59.46 3jys h ARG 481 Cb 0.00 -0.01 -0.07 0.00 -0.42 0.00 0.00 29.97 29.48 3jys h ARG 481 CO -0.04 0.02 0.26 1.15 -1.51 0.00 0.00 179.97 179.85 3jys h THR 482 N 0.02 0.81 -0.51 0.20 2.02 -1.76 -1.06 112.91 112.63 3jys h THR 482 Ca 0.08 -0.16 -0.06 0.00 0.77 0.00 0.00 66.41 67.04 3jys h THR 482 Cb 0.11 0.30 -0.02 0.00 -1.74 0.00 0.00 68.15 66.81 3jys h THR 482 CO -0.16 0.08 0.07 0.44 0.37 0.00 0.00 175.52 176.33 3jys h ASP 483 N 0.46 0.81 -0.77 4.18 3.32 -0.76 -1.14 116.42 122.53 3jys h ASP 483 Ca 0.31 -0.27 -0.03 0.00 0.02 0.00 0.00 57.03 57.06 3jys h ASP 483 Cb 0.35 -0.22 -0.04 0.00 0.22 0.00 0.00 39.33 39.65 3jys h ASP 483 CO -0.28 0.87 0.35 -0.07 -1.72 0.00 0.00 179.24 178.40 3jys h LEU 484 N 0.72 1.03 -1.01 1.55 3.38 -0.66 -2.15 115.31 118.18 3jys h LEU 484 Ca 0.15 -0.13 -0.06 0.00 0.09 0.00 0.00 57.88 57.93 3jys h LEU 484 Cb 0.41 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 3jys h LEU 484 CO 0.01 0.88 0.08 0.58 0.09 0.00 0.00 178.44 180.09 3jys h VAL 485 N 1.12 1.23 -0.45 1.22 2.07 -0.82 0.61 116.25 121.22 3jys h VAL 485 Ca 0.27 -0.87 -0.08 0.00 0.82 0.00 0.00 66.70 66.84 3jys h VAL 485 Cb 0.14 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 30.64 3jys h VAL 485 CO -0.03 0.32 -0.05 -0.09 0.02 0.00 0.00 177.57 177.74 3jys h ARG 486 N 0.76 0.78 -0.03 1.57 2.43 -0.69 0.20 114.38 119.41 3jys h ARG 486 Ca 0.16 -0.23 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 3jys h ARG 486 Cb 0.34 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.81 3jys h ARG 486 CO 0.01 0.82 0.00 1.19 -1.51 0.00 0.00 179.97 180.47 3jys n PHE 487 N -4.19 0.03 -4.15 2.20 3.01 -0.86 -4.92 117.46 108.59 3jys n PHE 487 Ca 0.02 -0.02 -0.34 0.00 1.01 0.00 0.00 57.45 58.12 3jys n PHE 487 Cb 0.33 0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 39.78 3jys n PHE 487 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 3jys n ASP 488 N -0.43 -3.10 -0.26 4.37 2.03 0.06 -4.87 116.55 114.34 3jys n ASP 488 Ca 0.19 -0.98 0.03 0.00 0.52 0.00 0.00 54.79 54.55 3jys n ASP 488 Cb 0.20 -2.95 0.03 0.00 -0.72 0.00 0.00 41.12 37.68 3jys n ASP 488 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 3jys n LEU 489 N -4.43 1.56 0.21 -2.67 4.77 0.11 -4.28 117.00 112.27 3jys n LEU 489 Ca 0.02 -1.02 -0.15 0.00 -0.03 0.00 0.00 56.01 54.83 3jys n LEU 489 Cb 0.52 -0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.53 3jys n LEU 489 CO 0.83 0.32 0.69 0.25 -1.33 0.00 0.00 177.39 178.15 3jys h LEU 490 N 1.29 -0.42 0.00 2.23 5.85 -1.83 -3.35 115.31 119.07 3jys h LEU 490 Ca 0.00 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.67 3jys h LEU 490 Cb 0.28 0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.42 3jys h LEU 490 CO 0.00 -0.22 -1.54 0.35 -0.34 0.00 0.00 178.44 176.69 3jys n THR 491 N -5.26 0.15 -1.85 1.05 -2.24 -1.26 -4.87 114.28 100.00 3jys n THR 491 Ca -0.10 -0.42 -0.36 0.00 -2.27 0.00 0.00 64.05 60.90 3jys n THR 491 Cb 0.24 0.06 0.05 0.00 -2.10 0.00 0.00 70.33 68.59 3jys n THR 491 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3jys s SER 492 N -4.44 4.86 0.00 3.42 0.15 -1.26 -0.87 113.70 115.56 3jys s SER 492 Ca -0.03 2.48 0.27 0.00 0.70 0.00 0.00 55.95 59.37 3jys s SER 492 Cb 0.13 -2.61 1.27 0.00 -1.71 0.00 0.00 66.02 63.11 3jys s SER 492 CO 0.86 -1.82 1.90 0.61 1.20 0.00 0.00 173.24 175.99 3jys n GLY 493 N 0.64 -1.28 0.23 9.45 0.00 -1.26 -4.04 105.19 108.93 3jys n GLY 493 Ca 0.14 -0.11 0.14 0.00 0.00 0.00 0.00 46.02 46.19 3jys n GLY 493 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3jys h SER 494 N 0.00 0.00 -3.28 1.61 4.64 -1.95 -3.42 113.55 111.16 3jys h SER 494 Ca 0.00 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 60.82 3jys h SER 494 Cb 0.34 0.00 -0.39 0.00 -0.31 0.00 0.00 62.40 62.04 3jys h SER 494 CO 0.00 0.00 -0.77 -0.47 -0.87 0.00 0.00 176.83 174.72 3jys s TYR 495 N -3.34 1.12 0.31 4.77 5.04 -1.26 -5.14 117.35 118.85 3jys s TYR 495 Ca 0.05 -0.71 0.10 0.00 -2.44 0.00 0.00 57.07 54.07 3jys s TYR 495 Cb 0.06 -1.04 -0.06 0.00 0.35 0.00 0.00 41.96 41.27 3jys s TYR 495 CO 0.63 -0.53 -0.12 0.95 -1.34 0.00 0.00 175.55 175.14 3jys s THR 496 N 1.83 2.21 0.28 4.34 -4.23 -1.26 -4.84 115.64 113.96 3jys s THR 496 Ca 0.01 -2.25 -0.05 0.00 -1.18 0.00 0.00 61.69 58.23 3jys s THR 496 Cb -0.15 -2.50 -0.01 0.00 1.34 0.00 0.00 72.50 71.18 3jys s THR 496 CO -0.07 -0.28 0.39 -1.66 -0.54 0.00 0.00 174.62 172.45 3jys s TRP 497 N -2.65 0.91 -0.18 3.99 -2.14 -1.26 -5.02 118.94 112.60 3jys s TRP 497 Ca 0.31 -1.16 -0.35 0.00 2.66 0.00 0.00 56.10 57.56 3jys s TRP 497 Cb 0.00 -0.15 -0.12 0.00 -3.10 0.00 0.00 33.47 30.11 3jys s TRP 497 CO 0.15 -0.96 1.96 -0.25 -2.66 0.00 0.00 176.95 175.18 3jys n ASP 498 N -0.85 3.04 -1.16 -2.66 9.92 -1.26 -1.52 116.55 122.07 3jys n ASP 498 Ca 0.01 0.81 -0.15 0.00 -0.53 0.00 0.00 54.79 54.93 3jys n ASP 498 Cb 0.63 -1.33 -0.06 0.00 -0.64 0.00 0.00 41.12 39.71 3jys n ASP 498 CO 0.00 0.00 0.00 0.49 0.13 0.00 0.00 177.20 177.82 3jys n PHE 499 N 7.58 -0.06 -1.84 1.24 3.72 -0.65 -4.96 117.46 122.49 3jys n PHE 499 Ca 0.27 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.25 3jys n PHE 499 Cb 0.27 -2.61 -0.03 0.00 -0.94 0.00 0.00 39.48 36.17 3jys n PHE 499 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 3jys s LYS 500 N -3.35 4.18 0.00 -1.08 2.20 -0.57 -1.73 119.74 119.38 3jys s LYS 500 Ca 0.00 2.46 0.00 0.00 -0.36 0.00 0.00 55.97 58.07 3jys s LYS 500 Cb 0.00 -3.32 0.00 0.00 -1.51 0.00 0.00 37.83 33.00 3jys s LYS 500 CO 0.00 -0.71 0.00 0.41 -0.36 0.00 0.00 175.35 174.69 3jys n GLY 501 N 3.95 0.48 1.45 5.54 0.00 -0.27 -1.30 105.19 115.03 3jys n GLY 501 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 3jys n GLY 501 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3jys n GLY 502 N -1.77 0.76 3.61 -0.02 0.00 -0.71 -4.90 105.19 102.16 3jys n GLY 502 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 3jys n GLY 502 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3jys s ILE 503 N -2.78 4.16 0.20 -0.61 -1.09 -1.21 -4.98 121.20 114.89 3jys s ILE 503 Ca 0.00 -0.28 -0.11 0.00 -2.23 0.00 0.00 60.65 58.03 3jys s ILE 503 Cb 0.00 -2.78 0.12 0.00 -1.58 0.00 0.00 42.46 38.21 3jys s ILE 503 CO 0.00 0.55 1.76 -0.55 -1.23 0.00 0.00 174.94 175.48 3jys h ASN 504 N 5.84 0.30 0.81 3.58 7.08 -1.90 0.94 115.58 132.22 3jys h ASN 504 Ca -0.43 0.06 0.00 0.00 -3.08 0.00 0.00 56.30 52.85 3jys h ASN 504 Cb 1.19 0.01 0.00 0.00 -2.08 0.00 0.00 38.32 37.44 3jys h ASN 504 CO 0.59 0.20 0.00 0.35 -2.08 0.00 0.00 177.43 176.48 3jys n THR 505 N -4.94 0.17 0.00 6.14 -2.24 -1.26 -1.64 114.28 110.51 3jys n THR 505 Ca 0.07 0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.89 3jys n THR 505 Cb 0.21 -0.59 0.00 0.00 -2.10 0.00 0.00 70.33 67.85 3jys n THR 505 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3jys n GLY 506 N 1.17 0.06 3.16 3.38 0.00 0.31 -4.53 105.19 108.74 3jys n GLY 506 Ca 0.08 -1.38 -0.08 0.00 0.00 0.00 0.00 46.02 44.63 3jys n GLY 506 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3jys s VAL 507 N -1.25 0.17 0.83 1.61 -7.23 -0.42 -4.89 120.40 109.21 3jys s VAL 507 Ca 0.00 -1.49 -0.11 0.00 -1.81 0.00 0.00 61.98 58.56 3jys s VAL 507 Cb 0.00 -1.48 0.09 0.00 0.56 0.00 0.00 36.38 35.54 3jys s VAL 507 CO 0.00 -0.76 1.09 -0.83 -0.31 0.00 0.00 175.10 174.29 3jys s GLY 508 N -2.90 1.63 0.27 2.32 0.00 -1.26 -3.77 107.32 103.61 3jys s GLY 508 Ca 0.08 -0.12 0.03 0.00 0.00 0.00 0.00 44.72 44.71 3jys s GLY 508 CO -0.09 0.32 0.04 -1.34 0.00 0.00 0.00 173.10 172.03 3jys s VAL 509 N -3.06 0.99 0.16 1.40 -7.23 -0.05 -4.84 120.40 107.77 3jys s VAL 509 Ca 0.62 -2.02 -0.34 0.00 -1.81 0.00 0.00 61.98 58.43 3jys s VAL 509 Cb -0.16 -2.59 -0.15 0.00 0.56 0.00 0.00 36.38 34.05 3jys s VAL 509 CO 0.55 -0.12 1.34 -3.20 -0.31 0.00 0.00 175.10 173.36 3jys n ASN 510 N -0.53 2.07 0.25 4.85 4.05 -1.26 -4.58 115.26 120.10 3jys n ASN 510 Ca -0.03 1.13 0.16 0.00 0.45 0.00 0.00 54.58 56.29 3jys n ASN 510 Cb 0.65 -1.30 0.87 0.00 1.23 0.00 0.00 39.78 41.24 3jys n ASN 510 CO 0.00 0.00 0.00 0.07 -3.05 0.00 0.00 177.26 174.28 3jys h LYS 511 N 4.34 0.00 -0.76 1.20 2.10 -2.00 -1.55 116.57 119.90 3jys h LYS 511 Ca -0.45 0.00 0.22 0.00 -2.00 0.00 0.00 60.65 58.42 3jys h LYS 511 Cb 1.31 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 32.61 3jys h LYS 511 CO 0.77 0.00 0.59 0.07 -2.00 0.00 0.00 179.45 178.88 3jys h ARG 512 N 0.00 0.00 0.00 0.07 0.11 -1.91 -2.44 114.38 110.22 3jys h ARG 512 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3jys h ARG 512 Cb 0.07 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.15 3jys h ARG 512 CO 0.00 0.00 0.00 0.66 0.10 0.00 0.00 179.97 180.73 3jys n TYR 513 N -4.14 0.00 0.26 4.08 4.01 -0.58 -2.36 117.16 118.42 3jys n TYR 513 Ca 0.15 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 58.01 3jys n TYR 513 Cb 0.87 -0.34 0.58 0.00 -0.31 0.00 0.00 39.34 40.14 3jys n TYR 513 CO 0.00 0.00 0.00 -0.91 -0.46 0.00 0.00 176.86 175.49 3jys h ASN 514 N 0.00 0.00 -4.23 7.72 2.35 -1.67 -3.43 115.58 116.32 3jys h ASN 514 Ca 0.00 0.00 -0.29 0.00 -0.55 0.00 0.00 56.30 55.46 3jys h ASN 514 Cb 0.22 0.00 -0.15 0.00 0.05 0.00 0.00 38.32 38.45 3jys h ASN 514 CO 0.00 0.00 -0.71 0.68 -1.65 0.00 0.00 177.43 175.75 3jys s VAL 515 N -3.50 0.97 0.34 2.81 -7.23 -1.00 -4.99 120.40 107.81 3jys s VAL 515 Ca -0.00 -1.99 -0.06 0.00 -1.81 0.00 0.00 61.98 58.12 3jys s VAL 515 Cb 0.08 -1.76 -0.05 0.00 0.56 0.00 0.00 36.38 35.20 3jys s VAL 515 CO 0.29 -0.79 0.63 -0.31 -0.31 0.00 0.00 175.10 174.61 3jys s TYR 516 N -3.40 3.49 0.30 2.82 1.51 -1.26 -4.98 117.35 115.83 3jys s TYR 516 Ca 0.14 0.72 -0.27 0.00 -1.01 0.00 0.00 57.07 56.65 3jys s TYR 516 Cb 0.03 -2.18 -0.10 0.00 -0.11 0.00 0.00 41.96 39.61 3jys s TYR 516 CO -0.02 0.05 0.95 -1.25 -1.11 0.00 0.00 175.55 174.18 3jys s PRO 517 N -3.85 4.64 0.26 -1.71 0.04 -1.26 -4.55 135.00 128.56 3jys s PRO 517 Ca 0.45 1.39 -0.30 0.00 0.04 0.00 0.00 61.00 62.59 3jys s PRO 517 Cb -0.10 -2.92 -0.10 0.00 0.04 0.00 0.00 34.50 31.41 3jys s PRO 517 CO 0.33 0.32 1.44 0.42 0.04 0.00 0.00 177.00 179.55 3jys s ILE 518 N -1.50 2.62 0.13 0.56 -1.09 -1.26 -4.90 121.20 115.76 3jys s ILE 518 Ca 0.48 0.53 -0.33 0.00 -2.23 0.00 0.00 60.65 59.09 3jys s ILE 518 Cb -0.21 -3.34 -0.13 0.00 -1.58 0.00 0.00 42.46 37.20 3jys s ILE 518 CO 0.26 0.09 1.65 -2.65 -1.23 0.00 0.00 174.94 173.06 3jys n PRO 519 N 2.20 2.28 -0.36 2.79 -0.02 -1.26 -4.85 135.00 135.79 3jys n PRO 519 Ca 0.06 0.83 0.08 0.00 -2.02 0.00 0.00 63.50 62.45 3jys n PRO 519 Cb 0.40 -2.62 0.25 0.00 -0.02 0.00 0.00 33.50 31.51 3jys n PRO 519 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3jys h VAL 520 N 3.94 0.91 -0.51 -1.45 2.07 -1.91 0.32 116.25 119.62 3jys h VAL 520 Ca -0.45 -0.33 0.06 0.00 0.82 0.00 0.00 66.70 66.79 3jys h VAL 520 Cb 1.25 -0.15 -0.07 0.00 -1.52 0.00 0.00 31.29 30.80 3jys h VAL 520 CO 0.91 0.18 -0.27 0.41 0.02 0.00 0.00 177.57 178.82 3jys n THR 521 N -4.62 -0.32 0.11 2.57 -1.04 -1.26 -0.30 114.28 109.42 3jys n THR 521 Ca 0.19 1.23 -0.17 0.00 -2.04 0.00 0.00 64.05 63.26 3jys n THR 521 Cb 0.37 -1.55 -0.14 0.00 -1.82 0.00 0.00 70.33 67.19 3jys n THR 521 CO 0.00 0.00 0.00 -0.78 -0.64 0.00 0.00 175.07 173.65 3jys h ASP 522 N 0.00 0.49 -0.61 8.00 3.58 -1.35 -3.29 116.42 123.25 3jys h ASP 522 Ca 0.11 -0.52 0.01 0.00 0.42 0.00 0.00 57.03 57.05 3jys h ASP 522 Cb 0.24 -0.16 -0.03 0.00 1.72 0.00 0.00 39.33 41.10 3jys h ASP 522 CO -0.49 1.40 0.40 -0.07 -2.88 0.00 0.00 179.24 177.60 3jys h LEU 523 N 0.09 0.70 -0.47 2.28 3.38 -0.43 -0.77 115.31 120.08 3jys h LEU 523 Ca -0.15 -0.02 0.03 0.00 0.09 0.00 0.00 57.88 57.84 3jys h LEU 523 Cb 1.99 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 42.53 3jys h LEU 523 CO 0.21 0.50 0.26 0.74 0.09 0.00 0.00 178.44 180.25 3jys h THR 524 N 0.82 1.00 0.00 0.22 2.02 -0.72 -3.20 112.91 113.05 3jys h THR 524 Ca 0.22 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 67.23 3jys h THR 524 Cb -0.10 0.44 0.00 0.00 -1.74 0.00 0.00 68.15 66.76 3jys h THR 524 CO -0.05 0.09 -1.00 1.33 0.37 0.00 0.00 175.52 176.27 3jys n VAL 525 N -4.86 0.36 -3.98 3.16 0.24 -1.09 -4.76 118.33 107.39 3jys n VAL 525 Ca 0.03 -0.38 -0.32 0.00 -2.04 0.00 0.00 64.34 61.63 3jys n VAL 525 Cb 0.10 -0.08 -0.14 0.00 -1.47 0.00 0.00 33.84 32.25 3jys n VAL 525 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 3jys s ASN 526 N -4.54 4.81 0.39 -1.34 3.84 -0.31 -4.90 114.94 112.88 3jys s ASN 526 Ca 0.02 -2.00 0.28 0.00 0.21 0.00 0.00 52.86 51.37 3jys s ASN 526 Cb 0.12 -1.65 1.25 0.00 -0.55 0.00 0.00 41.25 40.42 3jys s ASN 526 CO 0.79 -0.38 1.84 1.23 -2.79 0.00 0.00 177.10 177.79 3jys h GLY 527 N 7.72 0.00 1.31 1.21 0.00 -1.86 -2.83 103.07 108.61 3jys h GLY 527 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.25 3jys h GLY 527 CO 0.54 0.00 -0.35 0.70 0.00 0.00 0.00 176.54 177.43 3jys n ASN 528 N -2.56 0.36 -4.83 0.19 3.02 -1.26 -4.89 115.26 105.29 3jys n ASN 528 Ca 0.01 -0.01 -0.37 0.00 -0.03 0.00 0.00 54.58 54.18 3jys n ASN 528 Cb 0.21 0.02 -0.06 0.00 -0.61 0.00 0.00 39.78 39.34 3jys n ASN 528 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 3jys s LEU 529 N -3.05 4.41 0.12 3.41 2.96 -1.07 -4.41 118.68 121.05 3jys s LEU 529 Ca 0.12 1.22 0.06 0.00 -0.22 0.00 0.00 54.13 55.31 3jys s LEU 529 Cb 0.18 -3.19 -0.04 0.00 0.50 0.00 0.00 46.19 43.64 3jys s LEU 529 CO 0.65 0.15 -0.15 -1.10 -1.32 0.00 0.00 176.35 174.58 3jys s GLN 530 N -1.64 1.04 0.55 1.98 -1.52 -1.26 -4.98 119.66 113.82 3jys s GLN 530 Ca 0.35 -1.22 -0.19 0.00 -1.95 0.00 0.00 55.36 52.36 3jys s GLN 530 Cb -0.17 -0.98 -0.06 0.00 -0.22 0.00 0.00 33.01 31.59 3jys s GLN 530 CO 0.20 0.20 1.08 -1.14 -0.25 0.00 0.00 175.29 175.37 3jys s GLN 531 N -2.53 3.43 0.48 2.91 2.00 -1.26 -4.90 119.66 119.80 3jys s GLN 531 Ca 0.08 1.43 -0.23 0.00 -2.00 0.00 0.00 55.36 54.64 3jys s GLN 531 Cb -0.06 -2.03 -0.07 0.00 0.80 0.00 0.00 33.01 31.65 3jys s GLN 531 CO 0.03 -0.75 1.29 -0.80 -0.50 0.00 0.00 175.29 174.56 3jys s ASN 532 N -2.12 5.84 0.29 6.67 0.01 -1.26 -4.92 114.94 119.45 3jys s ASN 532 Ca 0.69 2.60 -0.30 0.00 -0.71 0.00 0.00 52.86 55.13 3jys s ASN 532 Cb -0.20 -2.63 -0.11 0.00 0.41 0.00 0.00 41.25 38.73 3jys s ASN 532 CO 0.28 -1.17 1.59 -0.70 -1.51 0.00 0.00 177.10 175.59 3jys s GLU 533 N -2.66 4.13 0.00 -0.60 2.12 -1.26 -2.67 118.70 117.75 3jys s GLU 533 Ca 0.65 2.57 0.00 0.00 0.36 0.00 0.00 54.97 58.55 3jys s GLU 533 Cb -0.36 -3.03 0.00 0.00 0.26 0.00 0.00 34.13 31.00 3jys s GLU 533 CO 0.44 -0.63 0.00 0.41 -0.54 0.00 0.00 175.26 174.95 3jys n GLY 534 N 2.18 1.07 0.79 -1.50 0.00 -1.26 -4.70 105.19 101.78 3jys n GLY 534 Ca 0.08 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.20 3jys n GLY 534 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60