#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mj5 s PHE 56 N 0.00 3.29 0.57 -1.42 0.08 -1.26 -5.10 117.98 114.14 3mj5 s PHE 56 Ca 0.00 -2.06 -0.20 0.00 0.12 0.00 0.00 56.93 54.79 3mj5 s PHE 56 Cb 0.00 -2.10 -0.05 0.00 -0.57 0.00 0.00 43.02 40.30 3mj5 s PHE 56 CO 0.00 -0.84 1.12 1.19 -0.10 0.00 0.00 175.22 176.59 3mj5 n PHE 57 N 4.55 1.40 -3.96 0.36 3.72 -1.26 -5.02 117.46 117.25 3mj5 n PHE 57 Ca -0.13 0.45 -0.09 0.00 -0.05 0.00 0.00 57.45 57.63 3mj5 n PHE 57 Cb 0.43 -2.23 -0.08 0.00 -0.94 0.00 0.00 39.48 36.66 3mj5 n PHE 57 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 176.76 176.85 3mj5 s VAL 58 N -1.41 0.11 0.84 -4.37 -7.23 -1.26 -5.16 120.40 101.93 3mj5 s VAL 58 Ca 0.74 -1.43 -0.11 0.00 -1.81 0.00 0.00 61.98 59.37 3mj5 s VAL 58 Cb -0.43 -1.67 0.10 0.00 0.56 0.00 0.00 36.38 34.94 3mj5 s VAL 58 CO 0.48 -0.51 1.10 -0.76 -0.31 0.00 0.00 175.10 175.10 3mj5 s LEU 59 N -2.94 2.68 -0.69 1.32 1.43 -1.26 -4.99 118.68 114.24 3mj5 s LEU 59 Ca 0.13 1.73 -0.10 0.00 -1.03 0.00 0.00 54.13 54.86 3mj5 s LEU 59 Cb 0.05 -4.28 0.18 0.00 0.03 0.00 0.00 46.19 42.17 3mj5 s LEU 59 CO -0.05 -2.41 0.58 -2.16 0.23 0.00 0.00 176.35 172.55 3mj5 s PRO 60 N -4.88 3.07 -0.02 1.29 0.05 -1.26 -4.93 135.00 128.32 3mj5 s PRO 60 Ca 0.63 -2.31 -0.00 0.00 0.05 0.00 0.00 61.00 59.36 3mj5 s PRO 60 Cb -0.18 -4.13 -0.00 0.00 0.05 0.00 0.00 34.50 30.23 3mj5 s PRO 60 CO 0.57 -1.24 -0.00 0.66 0.05 0.00 0.00 177.00 177.03 3mj5 h SER 61 N 7.75 0.00 -4.26 6.66 4.64 -1.94 -3.38 113.55 123.02 3mj5 h SER 61 Ca -0.01 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.79 3mj5 h SER 61 Cb 1.02 0.00 0.15 0.00 -0.31 0.00 0.00 62.40 63.26 3mj5 h SER 61 CO 0.78 0.12 0.31 1.51 -0.87 0.00 0.00 176.83 178.68 3mj5 s ASP 62 N -3.60 4.07 0.13 4.97 -4.77 -1.26 -4.79 116.67 111.43 3mj5 s ASP 62 Ca -0.00 2.04 -0.18 0.00 -3.30 0.00 0.00 52.55 51.10 3mj5 s ASP 62 Cb 0.00 -2.55 -0.02 0.00 -1.09 0.00 0.00 42.92 39.26 3mj5 s ASP 62 CO 0.00 -2.33 1.77 0.44 0.70 0.00 0.00 175.17 175.75 3mj5 h ASP 63 N -1.06 0.18 -0.06 2.11 5.19 -1.99 -2.41 116.42 118.38 3mj5 h ASP 63 Ca -0.44 0.01 0.01 0.00 -0.62 0.00 0.00 57.03 55.98 3mj5 h ASP 63 Cb 1.25 -0.02 -0.01 0.00 0.18 0.00 0.00 39.33 40.73 3mj5 h ASP 63 CO 0.49 0.14 -0.04 0.41 -3.12 0.00 0.00 179.24 177.12 3mj5 n THR 64 N -4.98 -0.04 -0.19 0.35 -1.04 -1.26 -0.38 114.28 106.73 3mj5 n THR 64 Ca -0.02 1.52 0.00 0.00 -2.04 0.00 0.00 64.05 63.51 3mj5 n THR 64 Cb 0.07 -2.01 0.10 0.00 -1.82 0.00 0.00 70.33 66.67 3mj5 n THR 64 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 3mj5 h LEU 65 N 0.00 -0.02 -0.92 -4.42 3.38 -1.89 0.14 115.31 111.58 3mj5 h LEU 65 Ca 0.01 0.11 0.04 0.00 0.09 0.00 0.00 57.88 58.13 3mj5 h LEU 65 Cb 0.03 0.16 -0.06 0.00 0.09 0.00 0.00 40.66 40.87 3mj5 h LEU 65 CO -0.06 0.00 0.59 -0.09 0.09 0.00 0.00 178.44 178.98 3mj5 h ARG 66 N 0.24 1.09 -0.13 1.13 2.43 -0.84 0.39 114.38 118.70 3mj5 h ARG 66 Ca 0.30 -0.07 -0.16 0.00 -0.81 0.00 0.00 59.98 59.25 3mj5 h ARG 66 Cb 0.45 -0.25 -0.01 0.00 -0.42 0.00 0.00 29.97 29.74 3mj5 h ARG 66 CO -0.40 0.72 -0.59 1.03 -1.51 0.00 0.00 179.97 179.22 3mj5 h SER 67 N 1.13 0.50 -0.40 -3.80 0.87 0.62 -2.66 113.55 109.81 3mj5 h SER 67 Ca 0.38 -0.28 -0.04 0.00 -1.23 0.00 0.00 61.79 60.62 3mj5 h SER 67 Cb 0.06 -0.14 -0.02 0.00 -0.44 0.00 0.00 62.40 61.86 3mj5 h SER 67 CO -0.14 0.98 0.09 -0.33 -0.53 0.00 0.00 176.83 176.90 3mj5 h GLU 68 N 0.33 0.64 0.28 2.24 5.08 0.45 -2.60 114.58 121.00 3mj5 h GLU 68 Ca -0.00 -0.16 -0.01 0.00 -1.00 0.00 0.00 59.36 58.19 3mj5 h GLU 68 Cb 1.13 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.30 3mj5 h GLU 68 CO 0.10 0.67 -0.13 0.00 -1.00 0.00 0.00 179.01 178.65 3mj5 h ALA 69 N 0.94 -0.37 -0.77 3.43 0.00 -0.98 -1.76 119.26 119.75 3mj5 h ALA 69 Ca 0.12 -0.12 0.13 0.00 0.00 0.00 0.00 54.91 55.05 3mj5 h ALA 69 Cb 0.32 0.14 -0.05 0.00 0.00 0.00 0.00 17.79 18.20 3mj5 h ALA 69 CO 0.00 -0.66 0.51 0.35 0.00 0.00 0.00 179.25 179.45 3mj5 h PHE 70 N -0.47 0.60 -0.15 0.00 3.57 -1.51 0.27 116.94 119.26 3mj5 h PHE 70 Ca -0.04 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.40 3mj5 h PHE 70 Cb 0.36 -0.19 -0.00 0.00 2.79 0.00 0.00 35.95 38.90 3mj5 h PHE 70 CO -0.03 0.24 -0.21 1.49 -2.23 0.00 0.00 178.31 177.57 3mj5 h GLU 71 N 0.53 0.41 -0.12 1.11 4.57 -1.19 0.35 114.58 120.24 3mj5 h GLU 71 Ca 0.38 -0.24 -0.03 0.00 -1.18 0.00 0.00 59.36 58.28 3mj5 h GLU 71 Cb 0.71 0.02 -0.00 0.00 -0.16 0.00 0.00 28.75 29.32 3mj5 h GLU 71 CO -0.14 0.82 -0.06 -0.92 -1.18 0.00 0.00 179.01 177.54 3mj5 h TYR 72 N 0.04 0.29 0.00 0.92 3.20 -0.72 -3.38 116.97 117.32 3mj5 h TYR 72 Ca 0.02 -0.07 -0.09 0.00 3.14 0.00 0.00 58.73 61.73 3mj5 h TYR 72 Cb 0.77 -0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.96 3mj5 h TYR 72 CO 0.09 0.59 -2.01 0.66 -1.64 0.00 0.00 178.16 175.85 3mj5 n TYR 73 N -4.69 0.00 -3.28 -3.82 4.01 0.91 -0.70 117.16 109.59 3mj5 n TYR 73 Ca -0.06 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 57.53 3mj5 n TYR 73 Cb 0.28 -0.58 0.08 0.00 -0.31 0.00 0.00 39.34 38.81 3mj5 n TYR 73 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 3mj5 n HIS 74 N -2.32 -2.06 -3.75 -0.72 8.25 0.12 -4.95 115.22 109.79 3mj5 n HIS 74 Ca -0.11 0.85 -0.13 0.00 -0.26 0.00 0.00 57.72 58.07 3mj5 n HIS 74 Cb 0.68 -4.70 -0.09 0.00 1.12 0.00 0.00 29.99 27.00 3mj5 n HIS 74 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 3mj5 s THR 75 N -3.34 0.05 -1.25 1.59 -1.32 -1.26 -5.03 115.64 105.09 3mj5 s THR 75 Ca 0.07 -0.40 0.18 0.00 -1.21 0.00 0.00 61.69 60.33 3mj5 s THR 75 Cb -0.01 -0.61 -0.09 0.00 -1.51 0.00 0.00 72.50 70.27 3mj5 s THR 75 CO 0.67 -0.22 0.83 0.18 -2.21 0.00 0.00 174.62 173.88 3mj5 n LEU 76 N 1.46 1.30 -4.62 9.08 4.77 -1.26 -4.61 117.00 123.12 3mj5 n LEU 76 Ca -0.20 -0.63 -0.43 0.00 -0.03 0.00 0.00 56.01 54.71 3mj5 n LEU 76 Cb 0.56 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.62 3mj5 n LEU 76 CO 0.21 0.27 1.65 -0.62 -1.33 0.00 0.00 177.39 177.57 3mj5 s ASP 77 N -2.35 5.95 0.49 -1.43 -1.08 -1.26 -4.87 116.67 112.12 3mj5 s ASP 77 Ca 0.11 1.97 0.21 0.00 -0.52 0.00 0.00 52.55 54.32 3mj5 s ASP 77 Cb 0.14 -2.52 1.27 0.00 -1.46 0.00 0.00 42.92 40.35 3mj5 s ASP 77 CO 0.58 -1.55 2.06 -0.33 0.52 0.00 0.00 175.17 176.45 3mj5 h GLU 78 N 12.76 0.00 0.00 4.34 5.08 -2.05 -1.91 114.58 132.80 3mj5 h GLU 78 Ca -0.41 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.95 3mj5 h GLU 78 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 3mj5 h GLU 78 CO 0.97 0.13 0.00 0.66 -1.00 0.00 0.00 179.01 179.77 3mj5 h SER 79 N 0.00 0.00 -0.04 1.42 4.64 -2.02 -3.40 113.55 114.15 3mj5 h SER 79 Ca -0.00 0.00 0.03 0.00 -0.47 0.00 0.00 61.79 61.35 3mj5 h SER 79 Cb 0.27 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.30 3mj5 h SER 79 CO 0.02 0.00 -0.42 0.15 -0.87 0.00 0.00 176.83 175.71 3mj5 h PHE 80 N 0.00 -1.19 -0.19 4.77 3.04 -1.73 -1.63 116.94 120.01 3mj5 h PHE 80 Ca 0.00 0.04 0.05 0.00 3.98 0.00 0.00 57.97 62.05 3mj5 h PHE 80 Cb 0.78 0.53 -0.07 0.00 2.56 0.00 0.00 35.95 39.75 3mj5 h PHE 80 CO 0.00 -0.49 -0.27 1.25 -2.02 0.00 0.00 178.31 176.78 3mj5 h LEU 81 N -0.55 -0.84 -1.84 0.59 5.85 -1.77 -0.62 115.31 116.13 3mj5 h LEU 81 Ca 0.06 0.14 0.04 0.00 0.84 0.00 0.00 57.88 58.96 3mj5 h LEU 81 Cb 0.64 0.38 -0.01 0.00 0.37 0.00 0.00 40.66 42.04 3mj5 h LEU 81 CO -0.34 -0.31 0.19 1.23 -0.34 0.00 0.00 178.44 178.87 3mj5 h GLY 82 N -0.31 0.23 2.00 3.75 0.00 -1.75 -1.72 103.07 105.27 3mj5 h GLY 82 Ca 0.12 -0.08 -0.14 0.00 0.00 0.00 0.00 47.33 47.23 3mj5 h GLY 82 CO -0.36 0.07 -0.65 3.21 0.00 0.00 0.00 176.54 178.81 3mj5 h ARG 83 N 0.20 0.00 0.14 4.80 3.08 -0.20 -1.98 114.38 120.43 3mj5 h ARG 83 Ca 0.12 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.17 3mj5 h ARG 83 Cb 0.24 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.29 3mj5 h ARG 83 CO -0.02 0.65 -0.07 -0.92 -1.07 0.00 0.00 179.97 178.54 3mj5 h TYR 84 N 0.00 -0.18 -0.79 3.04 3.20 -0.53 -1.76 116.97 119.96 3mj5 h TYR 84 Ca -0.01 -0.00 0.19 0.00 3.14 0.00 0.00 58.73 62.05 3mj5 h TYR 84 Cb 1.22 0.06 -0.13 0.00 1.54 0.00 0.00 36.73 39.42 3mj5 h TYR 84 CO 0.00 0.19 0.05 0.52 -1.64 0.00 0.00 178.16 177.29 3mj5 h MET 85 N -0.96 0.12 0.00 1.82 2.86 -1.45 1.44 114.93 118.76 3mj5 h MET 85 Ca -0.02 -0.01 0.02 0.00 -2.06 0.00 0.00 59.70 57.63 3mj5 h MET 85 Cb 0.45 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 32.05 3mj5 h MET 85 CO 0.03 0.08 -0.13 1.03 1.06 0.00 0.00 176.91 178.98 3mj5 h SER 86 N 0.13 -0.37 -0.12 1.22 0.87 -1.40 -0.78 113.55 113.09 3mj5 h SER 86 Ca 0.45 0.06 -0.01 0.00 -1.23 0.00 0.00 61.79 61.05 3mj5 h SER 86 Cb 0.81 0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.93 3mj5 h SER 86 CO -0.67 -0.18 0.04 0.00 -0.53 0.00 0.00 176.83 175.49 3mj5 h ALA 87 N 0.74 0.15 -0.85 6.23 0.00 -0.51 -3.18 119.26 121.84 3mj5 h ALA 87 Ca 0.05 -0.11 0.11 0.00 0.00 0.00 0.00 54.91 54.95 3mj5 h ALA 87 Cb 0.27 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.96 3mj5 h ALA 87 CO -0.13 -0.25 0.55 1.25 0.00 0.00 0.00 179.25 180.68 3mj5 h LEU 88 N 0.02 0.70 -1.70 0.00 5.85 0.23 -0.96 115.31 119.45 3mj5 h LEU 88 Ca 0.04 0.02 0.10 0.00 0.84 0.00 0.00 57.88 58.88 3mj5 h LEU 88 Cb 0.20 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.08 3mj5 h LEU 88 CO -0.00 0.40 0.38 -1.13 -0.34 0.00 0.00 178.44 177.75 3mj5 h ASN 89 N 0.76 0.30 0.17 1.25 -1.24 -1.13 -1.85 115.58 113.85 3mj5 h ASN 89 Ca 0.40 0.01 -0.36 0.00 0.71 0.00 0.00 56.30 57.06 3mj5 h ASN 89 Cb 0.51 -0.06 -0.00 0.00 0.73 0.00 0.00 38.32 39.50 3mj5 h ASN 89 CO -0.17 0.18 -1.85 0.45 -1.29 0.00 0.00 177.43 174.75 3mj5 h HIS 90 N 0.34 0.61 0.00 0.67 3.86 -1.31 -3.38 115.15 115.94 3mj5 h HIS 90 Ca 0.26 -0.45 -0.00 0.00 -1.16 0.00 0.00 60.37 59.02 3mj5 h HIS 90 Cb 0.59 -0.02 -0.00 0.00 1.06 0.00 0.00 27.41 29.03 3mj5 h HIS 90 CO -0.00 1.71 -0.02 1.79 0.86 0.00 0.00 177.93 182.27 3mj5 h THR 91 N 0.09 0.04 0.00 2.45 1.35 -0.99 -2.35 112.91 113.51 3mj5 h THR 91 Ca -0.38 -0.89 0.00 0.00 -0.55 0.00 0.00 66.41 64.60 3mj5 h THR 91 Cb 2.07 1.85 0.00 0.00 -1.73 0.00 0.00 68.15 70.35 3mj5 h THR 91 CO 0.14 0.02 0.00 2.29 -0.25 0.00 0.00 175.52 177.72 3mj5 n LYS 92 N -3.11 0.25 0.00 4.72 2.85 -0.73 -1.61 118.16 120.54 3mj5 n LYS 92 Ca 0.03 0.12 0.09 0.00 -1.05 0.00 0.00 58.31 57.50 3mj5 n LYS 92 Cb 0.46 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 33.34 3mj5 n LYS 92 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 3mj5 n LYS 93 N -1.25 1.54 -1.51 -1.58 5.02 -0.88 -4.98 118.16 114.52 3mj5 n LYS 93 Ca 0.08 -0.91 -0.29 0.00 -2.02 0.00 0.00 58.31 55.17 3mj5 n LYS 93 Cb 0.11 -1.34 0.14 0.00 -0.02 0.00 0.00 35.03 33.93 3mj5 n LYS 93 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 3mj5 s TRP 94 N -2.05 2.40 -0.12 2.13 0.51 -0.63 -5.07 118.94 116.11 3mj5 s TRP 94 Ca 0.15 0.84 -0.01 0.00 -2.12 0.00 0.00 56.10 54.96 3mj5 s TRP 94 Cb 0.15 -3.40 -0.02 0.00 -0.81 0.00 0.00 33.47 29.38 3mj5 s TRP 94 CO 0.45 -2.46 -0.08 0.15 -0.51 0.00 0.00 176.95 174.49 3mj5 s LYS 95 N -5.28 3.26 -0.89 4.98 -0.14 -1.26 -5.03 119.74 115.39 3mj5 s LYS 95 Ca 0.64 -0.59 -0.01 0.00 -1.36 0.00 0.00 55.97 54.65 3mj5 s LYS 95 Cb -0.15 -2.70 0.22 0.00 -1.68 0.00 0.00 37.83 33.52 3mj5 s LYS 95 CO 0.54 0.37 0.78 1.19 -0.76 0.00 0.00 175.35 177.46 3mj5 n PHE 96 N 3.10 4.12 -2.44 3.18 3.72 -1.26 -0.71 117.46 127.18 3mj5 n PHE 96 Ca -0.18 -4.13 -0.38 0.00 -0.05 0.00 0.00 57.45 52.72 3mj5 n PHE 96 Cb 0.53 -1.09 -0.03 0.00 -0.94 0.00 0.00 39.48 37.94 3mj5 n PHE 96 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 3mj5 s PRO 97 N -1.44 4.26 -0.15 -1.08 0.04 -1.18 -4.60 135.00 130.84 3mj5 s PRO 97 Ca 0.28 1.70 -0.29 0.00 0.04 0.00 0.00 61.00 62.73 3mj5 s PRO 97 Cb -0.06 -2.76 -0.01 0.00 0.04 0.00 0.00 34.50 31.70 3mj5 s PRO 97 CO -0.13 -0.11 1.20 -0.65 0.04 0.00 0.00 177.00 177.36 3mj5 s GLN 98 N -2.14 4.27 -0.05 4.56 -1.52 -1.26 -1.09 119.66 122.43 3mj5 s GLN 98 Ca 0.54 1.60 0.03 0.00 -1.95 0.00 0.00 55.36 55.58 3mj5 s GLN 98 Cb -0.28 -3.69 0.01 0.00 -0.22 0.00 0.00 33.01 28.83 3mj5 s GLN 98 CO 0.35 -0.62 -0.13 0.08 -0.25 0.00 0.00 175.29 174.72 3mj5 s VAL 99 N 3.09 1.18 -1.24 1.09 1.01 0.87 -4.72 120.40 121.68 3mj5 s VAL 99 Ca 0.53 -0.54 -0.15 0.00 0.00 0.00 0.00 61.98 61.82 3mj5 s VAL 99 Cb -0.21 -1.05 0.15 0.00 0.00 0.00 0.00 36.38 35.27 3mj5 s VAL 99 CO 0.15 0.36 0.41 0.61 0.00 0.00 0.00 175.10 176.62 3mj5 n GLY 100 N 3.52 -0.44 1.92 4.51 0.00 -1.26 0.07 105.19 113.51 3mj5 n GLY 100 Ca -0.21 0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.86 3mj5 n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mj5 n GLY 101 N -0.90 0.63 3.46 -0.02 0.00 -1.26 -5.02 105.19 102.07 3mj5 n GLY 101 Ca 0.07 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.84 3mj5 n GLY 101 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3mj5 s LEU 102 N 0.00 2.55 -0.32 0.99 1.43 0.11 -5.11 118.68 118.34 3mj5 s LEU 102 Ca 0.00 -0.96 -0.26 0.00 -1.03 0.00 0.00 54.13 51.88 3mj5 s LEU 102 Cb 0.00 -1.14 0.01 0.00 0.03 0.00 0.00 46.19 45.09 3mj5 s LEU 102 CO 0.00 0.07 0.92 -0.89 0.23 0.00 0.00 176.35 176.68 3mj5 s THR 103 N -2.21 4.66 0.55 5.49 2.01 -1.26 -0.09 115.64 124.78 3mj5 s THR 103 Ca 0.27 1.42 0.05 0.00 0.31 0.00 0.00 61.69 63.73 3mj5 s THR 103 Cb -0.06 -4.27 0.05 0.00 0.01 0.00 0.00 72.50 68.22 3mj5 s THR 103 CO 0.13 -0.37 0.38 -0.24 -0.69 0.00 0.00 174.62 173.84 3mj5 n SER 104 N 6.52 2.80 -4.05 3.53 2.88 -0.25 -4.56 113.62 120.49 3mj5 n SER 104 Ca 0.07 -2.91 -0.23 0.00 -1.33 0.00 0.00 58.87 54.47 3mj5 n SER 104 Cb 0.48 -0.02 -0.16 0.00 -0.75 0.00 0.00 64.21 63.76 3mj5 n SER 104 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 3mj5 s ILE 105 N -2.73 1.10 0.18 2.46 1.01 -1.26 -3.11 121.20 118.84 3mj5 s ILE 105 Ca 0.29 -0.51 -0.30 0.00 0.00 0.00 0.00 60.65 60.13 3mj5 s ILE 105 Cb -0.02 -0.97 -0.08 0.00 0.01 0.00 0.00 42.46 41.39 3mj5 s ILE 105 CO 0.18 0.33 1.20 -0.75 0.00 0.00 0.00 174.94 175.91 3mj5 s LYS 106 N 0.29 4.48 0.10 2.79 2.20 0.11 -3.87 119.74 125.85 3mj5 s LYS 106 Ca -0.07 1.88 -0.36 0.00 -0.36 0.00 0.00 55.97 57.06 3mj5 s LYS 106 Cb -0.12 -3.25 -0.16 0.00 -1.51 0.00 0.00 37.83 32.80 3mj5 s LYS 106 CO 0.02 -0.11 1.41 1.87 -0.36 0.00 0.00 175.35 178.19 3mj5 n TRP 107 N 2.61 1.73 -3.52 4.03 -0.00 -1.26 -4.65 117.44 116.38 3mj5 n TRP 107 Ca 0.05 0.53 -0.12 0.00 -0.00 0.00 0.00 57.50 57.96 3mj5 n TRP 107 Cb 0.45 -2.39 -0.04 0.00 -0.00 0.00 0.00 31.31 29.33 3mj5 n TRP 107 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 3mj5 s ALA 108 N 0.64 -1.81 -1.51 5.87 0.00 -1.26 -5.00 121.76 118.69 3mj5 s ALA 108 Ca 0.83 1.17 -0.16 0.00 0.00 0.00 0.00 51.96 53.81 3mj5 s ALA 108 Cb -0.88 0.06 0.13 0.00 0.00 0.00 0.00 23.12 22.44 3mj5 s ALA 108 CO 0.44 -0.52 0.65 -0.25 0.00 0.00 0.00 175.76 176.09 3mj5 n ASP 109 N 0.27 -3.23 -2.32 0.00 8.00 -1.26 0.03 116.55 118.04 3mj5 n ASP 109 Ca -0.13 -0.77 -0.21 0.00 0.71 0.00 0.00 54.79 54.39 3mj5 n ASP 109 Cb 0.60 -2.67 -0.02 0.00 -0.02 0.00 0.00 41.12 39.02 3mj5 n ASP 109 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3mj5 n ASN 110 N -2.47 -5.88 -0.95 -2.24 3.02 -1.26 -2.53 115.26 102.95 3mj5 n ASN 110 Ca 0.05 0.02 0.03 0.00 -0.03 0.00 0.00 54.58 54.65 3mj5 n ASN 110 Cb 0.50 -4.91 0.14 0.00 -0.61 0.00 0.00 39.78 34.91 3mj5 n ASN 110 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 3mj5 n ASN 111 N -1.94 2.56 0.08 6.41 0.23 0.10 -4.28 115.26 118.43 3mj5 n ASN 111 Ca -0.24 -2.30 0.01 0.00 -0.53 0.00 0.00 54.58 51.52 3mj5 n ASN 111 Cb 0.69 -0.53 0.34 0.00 -2.08 0.00 0.00 39.78 38.20 3mj5 n ASN 111 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3mj5 h TYR 113 N 0.32 0.00 -0.00 0.00 -0.00 -1.86 -2.54 116.97 112.89 3mj5 h TYR 113 Ca 0.06 0.00 -0.14 0.00 -0.00 0.00 0.00 58.73 58.65 3mj5 h TYR 113 Cb 0.40 0.00 -0.02 0.00 -0.00 0.00 0.00 36.73 37.11 3mj5 h TYR 113 CO 0.01 0.69 -0.66 -0.07 -0.00 0.00 0.00 178.16 178.13 3mj5 h LEU 114 N 0.00 0.03 -0.22 0.10 3.38 -1.76 -2.68 115.31 114.16 3mj5 h LEU 114 Ca -0.01 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 3mj5 h LEU 114 Cb 1.36 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 42.09 3mj5 h LEU 114 CO 0.09 0.68 -0.02 -1.28 0.09 0.00 0.00 178.44 177.99 3mj5 h SER 115 N 0.02 0.40 0.26 -0.43 0.87 -0.93 0.18 113.55 113.92 3mj5 h SER 115 Ca -0.01 -0.34 -0.06 0.00 -1.23 0.00 0.00 61.79 60.16 3mj5 h SER 115 Cb 1.17 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 63.01 3mj5 h SER 115 CO 0.09 0.65 -0.26 0.28 -0.53 0.00 0.00 176.83 177.05 3mj5 h SER 116 N 0.15 0.00 0.28 6.23 0.02 -1.45 0.28 113.55 119.06 3mj5 h SER 116 Ca 0.06 -0.00 -0.21 0.00 -0.84 0.00 0.00 61.79 60.80 3mj5 h SER 116 Cb 0.45 -0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.99 3mj5 h SER 116 CO 0.02 0.26 -0.86 0.58 -1.14 0.00 0.00 176.83 175.69 3mj5 h VAL 117 N 0.00 1.39 -0.09 2.27 2.07 -1.10 -1.53 116.25 119.26 3mj5 h VAL 117 Ca -0.00 -2.32 -0.21 0.00 0.82 0.00 0.00 66.70 64.99 3mj5 h VAL 117 Cb 0.46 2.29 0.00 0.00 -1.52 0.00 0.00 31.29 32.53 3mj5 h VAL 117 CO 0.03 0.70 -0.78 0.25 0.02 0.00 0.00 177.57 177.79 3mj5 h LEU 118 N 0.26 0.66 -0.25 2.57 5.85 0.19 -2.49 115.31 122.10 3mj5 h LEU 118 Ca -0.06 -0.45 -0.15 0.00 0.84 0.00 0.00 57.88 58.06 3mj5 h LEU 118 Cb 1.48 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 42.31 3mj5 h LEU 118 CO 0.15 1.22 -0.43 -0.07 -0.34 0.00 0.00 178.44 178.97 3mj5 h LEU 119 N 0.36 0.81 -0.29 2.25 3.38 -0.94 -2.94 115.31 117.95 3mj5 h LEU 119 Ca -0.05 -0.53 -0.01 0.00 0.09 0.00 0.00 57.88 57.39 3mj5 h LEU 119 Cb 1.39 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.89 3mj5 h LEU 119 CO 0.14 1.18 0.16 0.00 0.09 0.00 0.00 178.44 180.01 3mj5 h ALA 120 N 0.65 0.38 0.00 1.53 0.00 -1.30 -2.70 119.26 117.82 3mj5 h ALA 120 Ca 0.02 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 3mj5 h ALA 120 Cb 1.03 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.70 3mj5 h ALA 120 CO 0.10 -0.09 -0.03 -0.07 0.00 0.00 0.00 179.25 179.16 3mj5 h LEU 121 N 0.35 0.00 -0.01 0.00 3.38 -1.39 -1.11 115.31 116.54 3mj5 h LEU 121 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 3mj5 h LEU 121 Cb 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 3mj5 h LEU 121 CO -0.02 0.03 0.00 0.00 0.09 0.00 0.00 178.44 178.54 3mj5 n GLN 122 N -3.95 0.01 0.00 1.13 6.02 -1.02 -2.75 117.38 116.82 3mj5 n GLN 122 Ca -0.03 0.13 0.03 0.00 -0.01 0.00 0.00 57.00 57.13 3mj5 n GLN 122 Cb 0.11 -1.51 0.03 0.00 1.02 0.00 0.00 30.24 29.89 3mj5 n GLN 122 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 3mj5 n GLN 123 N -1.52 0.12 -4.10 -1.09 6.02 -0.44 -4.96 117.38 111.41 3mj5 n GLN 123 Ca 0.05 -0.88 -0.36 0.00 -0.01 0.00 0.00 57.00 55.81 3mj5 n GLN 123 Cb 0.26 -1.12 -0.08 0.00 1.02 0.00 0.00 30.24 30.32 3mj5 n GLN 123 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3mj5 s LEU 124 N -0.63 3.93 -0.95 1.08 1.43 -1.11 -5.02 118.68 117.41 3mj5 s LEU 124 Ca 0.08 0.24 -0.23 0.00 -1.03 0.00 0.00 54.13 53.19 3mj5 s LEU 124 Cb 0.06 -1.95 0.06 0.00 0.03 0.00 0.00 46.19 44.39 3mj5 s LEU 124 CO 0.09 0.34 1.36 -1.61 0.23 0.00 0.00 176.35 176.75 3mj5 s GLU 125 N -0.61 3.51 -0.02 1.70 2.02 -1.26 -4.94 118.70 119.09 3mj5 s GLU 125 Ca 0.11 -1.05 0.02 0.00 0.02 0.00 0.00 54.97 54.07 3mj5 s GLU 125 Cb -0.12 -5.06 0.00 0.00 0.10 0.00 0.00 34.13 29.06 3mj5 s GLU 125 CO 0.02 -2.12 -0.09 0.14 0.02 0.00 0.00 175.26 173.23 3mj5 s VAL 126 N 4.74 0.75 0.03 2.63 -7.23 -1.26 -4.83 120.40 115.23 3mj5 s VAL 126 Ca 0.41 -0.34 0.03 0.00 -1.81 0.00 0.00 61.98 60.27 3mj5 s VAL 126 Cb -0.03 -0.67 -0.04 0.00 0.56 0.00 0.00 36.38 36.21 3mj5 s VAL 126 CO -0.05 0.24 -0.02 -1.59 -0.31 0.00 0.00 175.10 173.37 3mj5 s LYS 127 N 0.19 2.65 0.12 4.82 -2.85 -1.26 -5.06 119.74 118.35 3mj5 s LYS 127 Ca -0.03 -0.71 -0.03 0.00 -1.00 0.00 0.00 55.97 54.20 3mj5 s LYS 127 Cb -0.08 -2.58 -0.05 0.00 -2.06 0.00 0.00 37.83 33.05 3mj5 s LYS 127 CO 0.00 0.59 0.33 -0.06 0.10 0.00 0.00 175.35 176.31 3mj5 s PHE 128 N -1.14 3.49 0.09 1.78 0.08 -1.26 -1.33 117.98 119.69 3mj5 s PHE 128 Ca 0.21 0.44 0.08 0.00 0.12 0.00 0.00 56.93 57.78 3mj5 s PHE 128 Cb -0.11 -1.91 -0.18 0.00 -0.57 0.00 0.00 43.02 40.24 3mj5 s PHE 128 CO 0.12 0.48 1.29 -0.91 -0.10 0.00 0.00 175.22 176.10 3mj5 h ASN 129 N 2.82 0.00 -3.57 1.36 2.35 -1.27 -3.43 115.58 113.83 3mj5 h ASN 129 Ca -0.46 0.00 -0.62 0.00 -0.55 0.00 0.00 56.30 54.67 3mj5 h ASN 129 Cb 1.17 0.00 -0.12 0.00 0.05 0.00 0.00 38.32 39.41 3mj5 h ASN 129 CO 0.73 0.94 0.35 0.00 -1.65 0.00 0.00 177.43 177.81 3mj5 s ALA 130 N -2.74 3.37 0.34 -0.83 0.00 -1.26 -4.94 121.76 115.71 3mj5 s ALA 130 Ca 0.01 -0.82 0.15 0.00 0.00 0.00 0.00 51.96 51.31 3mj5 s ALA 130 Cb 0.10 -3.39 1.13 0.00 0.00 0.00 0.00 23.12 20.95 3mj5 s ALA 130 CO 0.81 -1.66 1.64 -1.35 0.00 0.00 0.00 175.76 175.20 3mj5 h PRO 131 N 8.69 0.21 0.06 0.00 0.11 -1.69 0.31 132.00 139.70 3mj5 h PRO 131 Ca -0.25 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.85 3mj5 h PRO 131 Cb 1.09 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 3mj5 h PRO 131 CO 0.93 0.14 -0.07 0.00 -0.21 0.00 0.00 178.00 178.79 3mj5 h ALA 132 N 1.89 -0.13 -0.07 -0.75 0.00 -1.25 -1.17 119.26 117.79 3mj5 h ALA 132 Ca 0.75 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.67 3mj5 h ALA 132 Cb 1.79 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 19.65 3mj5 h ALA 132 CO -0.67 -0.58 -0.08 -0.07 0.00 0.00 0.00 179.25 177.85 3mj5 h LEU 133 N -0.15 -0.25 -1.49 0.00 3.38 -0.67 -0.22 115.31 115.91 3mj5 h LEU 133 Ca 0.01 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 3mj5 h LEU 133 Cb 0.15 0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 3mj5 h LEU 133 CO -0.02 -0.11 0.12 -0.61 0.09 0.00 0.00 178.44 177.90 3mj5 h GLN 134 N -0.11 0.46 0.04 1.13 5.75 -1.07 -0.35 115.11 120.96 3mj5 h GLN 134 Ca 0.06 -0.06 -0.19 0.00 -0.15 0.00 0.00 58.65 58.31 3mj5 h GLN 134 Cb 0.19 -0.09 0.02 0.00 1.07 0.00 0.00 27.48 28.67 3mj5 h GLN 134 CO -0.14 0.39 -0.77 0.93 -2.65 0.00 0.00 178.83 176.60 3mj5 h GLU 135 N 0.46 0.45 -0.62 1.69 5.08 -0.98 -2.04 114.58 118.62 3mj5 h GLU 135 Ca 0.11 -0.54 -0.05 0.00 -1.00 0.00 0.00 59.36 57.89 3mj5 h GLU 135 Cb 0.11 0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.50 3mj5 h GLU 135 CO -0.01 1.19 0.19 0.00 -1.00 0.00 0.00 179.01 179.38 3mj5 h ALA 136 N 0.28 1.18 -0.19 3.43 0.00 -0.83 -2.57 119.26 120.56 3mj5 h ALA 136 Ca -0.11 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.55 3mj5 h ALA 136 Cb 1.49 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 3mj5 h ALA 136 CO 0.15 0.58 -0.08 -0.92 0.00 0.00 0.00 179.25 178.98 3mj5 h TYR 137 N 0.91 0.45 -0.56 0.00 3.20 -1.05 0.27 116.97 120.19 3mj5 h TYR 137 Ca 0.20 -0.11 0.08 0.00 3.14 0.00 0.00 58.73 62.04 3mj5 h TYR 137 Cb 0.26 -0.11 -0.06 0.00 1.54 0.00 0.00 36.73 38.36 3mj5 h TYR 137 CO 0.02 0.68 0.22 -0.92 -1.64 0.00 0.00 178.16 176.52 3mj5 h TYR 138 N 0.10 0.39 -0.51 -3.82 5.03 -1.30 0.23 116.97 117.09 3mj5 h TYR 138 Ca 0.05 0.03 -0.06 0.00 2.58 0.00 0.00 58.73 61.33 3mj5 h TYR 138 Cb 0.55 -0.09 -0.02 0.00 1.55 0.00 0.00 36.73 38.72 3mj5 h TYR 138 CO 0.06 0.13 0.09 0.00 -1.32 0.00 0.00 178.16 177.11 3mj5 h ARG 139 N 0.42 0.79 -0.26 1.82 3.08 -1.23 -2.68 114.38 116.32 3mj5 h ARG 139 Ca 0.27 -0.17 -0.02 0.00 0.07 0.00 0.00 59.98 60.13 3mj5 h ARG 139 Cb 0.30 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.22 3mj5 h ARG 139 CO -0.26 0.74 0.07 0.00 -1.07 0.00 0.00 179.97 179.45 3mj5 h ALA 140 N 1.34 0.34 -0.32 0.04 0.00 0.18 0.14 119.26 120.98 3mj5 h ALA 140 Ca 0.16 -0.16 0.09 0.00 0.00 0.00 0.00 54.91 55.01 3mj5 h ALA 140 Cb 0.33 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 3mj5 h ALA 140 CO 0.00 -0.01 0.35 0.00 0.00 0.00 0.00 179.25 179.59 3mj5 h ARG 141 N 0.25 0.00 -0.60 0.00 3.08 -0.28 0.27 114.38 117.10 3mj5 h ARG 141 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.13 3mj5 h ARG 141 Cb 0.27 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.32 3mj5 h ARG 141 CO -0.00 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 178.90 3mj5 n ALA 142 N -2.34 2.40 0.00 0.04 0.00 -0.83 -4.87 120.51 114.91 3mj5 n ALA 142 Ca 0.05 -1.07 0.00 0.00 0.00 0.00 0.00 53.44 52.42 3mj5 n ALA 142 Cb 0.50 -0.95 0.00 0.00 0.00 0.00 0.00 19.45 19.00 3mj5 n ALA 142 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3mj5 n GLY 143 N 1.48 2.29 3.17 0.00 0.00 0.94 -5.04 105.19 108.03 3mj5 n GLY 143 Ca 0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 3mj5 n GLY 143 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3mj5 s ASP 144 N -1.52 5.71 0.00 1.61 2.15 0.42 -4.84 116.67 120.20 3mj5 s ASP 144 Ca 0.00 -2.77 0.05 0.00 0.43 0.00 0.00 52.55 50.26 3mj5 s ASP 144 Cb 0.00 -1.97 0.05 0.00 -0.30 0.00 0.00 42.92 40.70 3mj5 s ASP 144 CO 0.00 -0.44 0.71 0.00 -0.17 0.00 0.00 175.17 175.27 3mj5 n ALA 145 N 3.68 2.44 -0.13 3.66 0.00 -1.26 -2.46 120.51 126.44 3mj5 n ALA 145 Ca 0.09 -0.61 -0.05 0.00 0.00 0.00 0.00 53.44 52.87 3mj5 n ALA 145 Cb 0.41 -0.17 0.01 0.00 0.00 0.00 0.00 19.45 19.70 3mj5 n ALA 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3mj5 h ALA 146 N 0.94 0.11 -0.09 0.00 0.00 -1.91 -0.70 119.26 117.61 3mj5 h ALA 146 Ca 0.00 0.15 0.03 0.00 0.00 0.00 0.00 54.91 55.09 3mj5 h ALA 146 Cb 0.25 0.50 -0.04 0.00 0.00 0.00 0.00 17.79 18.50 3mj5 h ALA 146 CO 0.00 -0.56 -0.14 -0.91 0.00 0.00 0.00 179.25 177.64 3mj5 h ASN 147 N -0.12 -0.43 -0.19 0.00 4.21 -1.92 -1.05 115.58 116.08 3mj5 h ASN 147 Ca 0.21 0.08 0.04 0.00 1.21 0.00 0.00 56.30 57.83 3mj5 h ASN 147 Cb 0.44 0.20 -0.04 0.00 -1.12 0.00 0.00 38.32 37.80 3mj5 h ASN 147 CO -0.50 -0.19 -0.05 0.15 -1.29 0.00 0.00 177.43 175.55 3mj5 h PHE 148 N -0.19 -0.10 -0.30 1.19 3.57 -1.62 0.22 116.94 119.70 3mj5 h PHE 148 Ca 0.08 0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.65 3mj5 h PHE 148 Cb 0.30 0.07 -0.05 0.00 2.79 0.00 0.00 35.95 39.07 3mj5 h PHE 148 CO -0.24 -0.08 0.01 0.00 -2.23 0.00 0.00 178.31 175.77 3mj5 h ALA 150 N 1.26 1.39 -0.07 0.00 0.00 -0.17 0.10 119.26 121.76 3mj5 h ALA 150 Ca 0.15 -0.20 -0.24 0.00 0.00 0.00 0.00 54.91 54.61 3mj5 h ALA 150 Cb 0.19 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 17.96 3mj5 h ALA 150 CO -0.24 0.27 -0.92 -0.07 0.00 0.00 0.00 179.25 178.30 3mj5 h LEU 151 N 0.00 0.90 -0.63 0.00 3.38 0.10 -2.20 115.31 116.87 3mj5 h LEU 151 Ca -0.00 -0.66 0.03 0.00 0.09 0.00 0.00 57.88 57.34 3mj5 h LEU 151 Cb 0.46 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.89 3mj5 h LEU 151 CO 0.03 1.46 0.38 0.40 0.09 0.00 0.00 178.44 180.80 3mj5 h ILE 152 N 0.45 1.06 -0.47 1.22 2.04 0.14 0.27 117.51 122.22 3mj5 h ILE 152 Ca -0.09 -0.25 0.03 0.00 1.00 0.00 0.00 64.86 65.54 3mj5 h ILE 152 Cb 1.56 0.25 -0.03 0.00 -0.74 0.00 0.00 36.82 37.86 3mj5 h ILE 152 CO 0.18 0.14 0.27 -0.07 0.00 0.00 0.00 178.15 178.66 3mj5 h LEU 153 N 0.74 0.42 0.72 1.44 3.38 -1.11 -2.07 115.31 118.83 3mj5 h LEU 153 Ca 0.26 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.20 3mj5 h LEU 153 Cb 0.05 -0.08 0.01 0.00 0.09 0.00 0.00 40.66 40.73 3mj5 h LEU 153 CO -0.11 0.30 -0.35 0.00 0.09 0.00 0.00 178.44 178.36 3mj5 h ALA 154 N 1.22 -0.98 0.00 1.53 0.00 -0.69 -0.06 119.26 120.29 3mj5 h ALA 154 Ca 0.19 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3mj5 h ALA 154 Cb 0.04 0.38 0.00 0.00 0.00 0.00 0.00 17.79 18.22 3mj5 h ALA 154 CO -0.10 -1.05 0.00 1.88 0.00 0.00 0.00 179.25 179.98 3mj5 h TYR 155 N -0.97 0.00 -0.33 0.00 0.05 -0.46 -2.36 116.97 112.90 3mj5 h TYR 155 Ca -0.10 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.68 3mj5 h TYR 155 Cb 0.75 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.49 3mj5 h TYR 155 CO -0.03 0.00 0.00 -1.13 -1.05 0.00 0.00 178.16 175.95 3mj5 n SER 156 N -3.01 3.06 -3.76 3.88 3.41 -0.79 -4.90 113.62 111.51 3mj5 n SER 156 Ca -0.03 -2.16 -0.23 0.00 -0.26 0.00 0.00 58.87 56.19 3mj5 n SER 156 Cb 0.08 -0.28 0.03 0.00 -0.26 0.00 0.00 64.21 63.78 3mj5 n SER 156 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3mj5 n ASN 157 N 0.34 -1.65 -4.48 4.04 3.02 -0.75 -5.01 115.26 110.77 3mj5 n ASN 157 Ca 0.13 -0.83 -0.24 0.00 -0.03 0.00 0.00 54.58 53.60 3mj5 n ASN 157 Cb 0.50 -3.92 -0.10 0.00 -0.61 0.00 0.00 39.78 35.64 3mj5 n ASN 157 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3mj5 s LYS 158 N -6.14 1.69 0.01 3.52 -0.14 -0.11 -5.04 119.74 113.52 3mj5 s LYS 158 Ca 0.11 -1.80 0.08 0.00 -1.36 0.00 0.00 55.97 53.00 3mj5 s LYS 158 Cb -0.06 -1.70 -0.02 0.00 -1.68 0.00 0.00 37.83 34.37 3mj5 s LYS 158 CO 0.82 0.27 -0.24 0.99 -0.76 0.00 0.00 175.35 176.43 3mj5 s THR 159 N -2.57 1.93 0.40 2.17 2.01 -1.26 -4.43 115.64 113.88 3mj5 s THR 159 Ca 0.30 -1.16 -0.24 0.00 0.31 0.00 0.00 61.69 60.90 3mj5 s THR 159 Cb -0.03 -1.63 -0.12 0.00 0.01 0.00 0.00 72.50 70.74 3mj5 s THR 159 CO 0.15 0.43 0.88 0.52 -0.69 0.00 0.00 174.62 175.90 3mj5 n VAL 160 N 2.17 2.23 0.00 3.82 0.31 -1.26 -1.85 118.33 123.75 3mj5 n VAL 160 Ca -0.16 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.67 3mj5 n VAL 160 Cb 0.52 -0.94 0.00 0.00 -0.91 0.00 0.00 33.84 32.51 3mj5 n VAL 160 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3mj5 n GLY 161 N 1.37 3.03 3.73 2.92 0.00 -1.05 -5.03 105.19 110.16 3mj5 n GLY 161 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 3mj5 n GLY 161 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3mj5 s GLU 162 N -0.13 4.59 0.47 1.61 2.02 -0.77 -4.43 118.70 122.06 3mj5 s GLU 162 Ca 0.00 1.66 -0.23 0.00 0.02 0.00 0.00 54.97 56.42 3mj5 s GLU 162 Cb 0.00 -3.32 -0.07 0.00 0.10 0.00 0.00 34.13 30.84 3mj5 s GLU 162 CO 0.00 0.05 1.21 -1.17 0.02 0.00 0.00 175.26 175.37 3mj5 s LEU 163 N -0.03 4.00 0.32 1.80 2.96 -1.26 -4.79 118.68 121.69 3mj5 s LEU 163 Ca 0.50 2.42 0.04 0.00 -0.22 0.00 0.00 54.13 56.87 3mj5 s LEU 163 Cb -0.28 -4.22 -0.04 0.00 0.50 0.00 0.00 46.19 42.16 3mj5 s LEU 163 CO 0.33 -1.03 0.16 -0.83 -1.32 0.00 0.00 176.35 173.66 3mj5 s GLY 164 N -1.23 2.16 -0.19 7.98 0.00 -1.26 -5.08 107.32 109.70 3mj5 s GLY 164 Ca 0.64 -1.72 -0.02 0.00 0.00 0.00 0.00 44.72 43.62 3mj5 s GLY 164 CO 0.38 -1.61 -0.08 -0.35 0.00 0.00 0.00 173.10 171.44 3mj5 s ASP 165 N -3.41 4.13 0.18 1.64 2.15 -1.26 -4.76 116.67 115.35 3mj5 s ASP 165 Ca 0.34 -0.39 -0.13 0.00 0.43 0.00 0.00 52.55 52.81 3mj5 s ASP 165 Cb 0.04 -1.68 0.13 0.00 -0.30 0.00 0.00 42.92 41.11 3mj5 s ASP 165 CO 0.18 0.04 1.82 0.58 -0.17 0.00 0.00 175.17 177.61 3mj5 h VAL 166 N 5.63 1.04 -0.18 1.11 2.07 -2.00 -2.14 116.25 121.79 3mj5 h VAL 166 Ca -0.38 -0.22 -0.10 0.00 0.82 0.00 0.00 66.70 66.82 3mj5 h VAL 166 Cb 1.17 0.34 -0.00 0.00 -1.52 0.00 0.00 31.29 31.28 3mj5 h VAL 166 CO 0.60 0.12 -0.28 -0.09 0.02 0.00 0.00 177.57 177.94 3mj5 h ARG 167 N 0.65 0.50 -0.45 1.57 2.43 -1.96 -0.39 114.38 116.73 3mj5 h ARG 167 Ca 0.23 -0.30 0.07 0.00 -0.81 0.00 0.00 59.98 59.16 3mj5 h ARG 167 Cb 0.04 0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 29.57 3mj5 h ARG 167 CO -0.11 0.90 0.13 0.93 -1.51 0.00 0.00 179.97 180.31 3mj5 h GLU 168 N 0.15 0.28 0.00 0.20 5.08 -1.98 -1.34 114.58 116.97 3mj5 h GLU 168 Ca 0.02 -0.02 0.03 0.00 -1.00 0.00 0.00 59.36 58.39 3mj5 h GLU 168 Cb 0.86 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 30.01 3mj5 h GLU 168 CO 0.06 0.18 -0.20 1.15 -1.00 0.00 0.00 179.01 179.21 3mj5 h THR 169 N 0.28 0.53 -0.79 1.13 2.02 -1.27 -1.39 112.91 113.43 3mj5 h THR 169 Ca 0.22 0.00 0.14 0.00 0.77 0.00 0.00 66.41 67.53 3mj5 h THR 169 Cb 0.25 0.53 -0.06 0.00 -1.74 0.00 0.00 68.15 67.14 3mj5 h THR 169 CO -0.25 0.00 0.52 0.24 0.37 0.00 0.00 175.52 176.40 3mj5 h MET 170 N -0.32 0.53 -0.61 6.66 2.86 -0.55 0.20 114.93 123.69 3mj5 h MET 170 Ca 0.06 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.66 3mj5 h MET 170 Cb 0.39 -0.12 -0.03 0.00 0.06 0.00 0.00 31.60 31.90 3mj5 h MET 170 CO -0.18 0.35 0.34 1.15 1.06 0.00 0.00 176.91 179.63 3mj5 h THR 171 N 0.54 1.18 -0.08 2.22 2.02 -0.18 0.11 112.91 118.72 3mj5 h THR 171 Ca 0.38 -0.45 -0.21 0.00 0.77 0.00 0.00 66.41 66.90 3mj5 h THR 171 Cb 0.73 0.35 0.00 0.00 -1.74 0.00 0.00 68.15 67.50 3mj5 h THR 171 CO -0.14 0.20 -0.82 0.45 0.37 0.00 0.00 175.52 175.58 3mj5 h HIS 172 N 0.84 0.78 -0.43 3.16 3.86 -0.04 -3.21 115.15 120.12 3mj5 h HIS 172 Ca 0.22 -0.37 -0.11 0.00 -1.16 0.00 0.00 60.37 58.95 3mj5 h HIS 172 Cb 0.01 -0.11 -0.01 0.00 1.06 0.00 0.00 27.41 28.36 3mj5 h HIS 172 CO 0.00 1.17 -0.17 -0.07 0.86 0.00 0.00 177.93 179.72 3mj5 h LEU 173 N 0.36 0.89 -0.05 2.43 3.38 -0.35 -3.23 115.31 118.74 3mj5 h LEU 173 Ca -0.06 -0.39 0.00 0.00 0.09 0.00 0.00 57.88 57.52 3mj5 h LEU 173 Cb 1.43 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.94 3mj5 h LEU 173 CO 0.15 1.09 -0.03 0.18 0.09 0.00 0.00 178.44 179.92 3mj5 n LEU 174 N -4.22 0.11 0.16 1.67 4.77 0.31 -0.55 117.00 119.24 3mj5 n LEU 174 Ca -0.01 0.22 0.13 0.00 -0.03 0.00 0.00 56.01 56.32 3mj5 n LEU 174 Cb 0.42 -0.27 0.52 0.00 -2.33 0.00 0.00 43.42 41.77 3mj5 n LEU 174 CO 0.45 0.02 0.88 1.56 -1.33 0.00 0.00 177.39 178.97 3mj5 h GLN 175 N 0.12 0.00 -0.23 3.23 4.20 -1.57 -3.07 115.11 117.79 3mj5 h GLN 175 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3mj5 h GLN 175 Cb 0.31 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.09 3mj5 h GLN 175 CO 0.00 0.00 0.00 0.72 -0.67 0.00 0.00 178.83 178.88 3mj5 n HIS 176 N -2.41 0.31 -3.39 2.96 8.25 0.29 -4.98 115.22 116.25 3mj5 n HIS 176 Ca 0.02 -0.40 -0.22 0.00 -0.26 0.00 0.00 57.72 56.86 3mj5 n HIS 176 Cb 0.25 -0.02 -0.00 0.00 1.12 0.00 0.00 29.99 31.34 3mj5 n HIS 176 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3mj5 s ALA 177 N -0.96 3.92 -0.76 -1.41 0.00 -1.13 -0.87 121.76 120.55 3mj5 s ALA 177 Ca 0.18 -1.18 -0.24 0.00 0.00 0.00 0.00 51.96 50.71 3mj5 s ALA 177 Cb 0.10 -1.92 0.05 0.00 0.00 0.00 0.00 23.12 21.35 3mj5 s ALA 177 CO 0.13 -0.09 1.18 1.21 0.00 0.00 0.00 175.76 178.18 3mj5 s ASN 178 N -4.12 6.24 -0.23 0.00 3.84 -0.44 -4.65 114.94 115.57 3mj5 s ASN 178 Ca 0.43 -0.87 0.14 0.00 0.21 0.00 0.00 52.86 52.77 3mj5 s ASN 178 Cb -0.10 -2.50 0.51 0.00 -0.55 0.00 0.00 41.25 38.62 3mj5 s ASN 178 CO 0.34 -1.61 1.44 0.18 -2.79 0.00 0.00 177.10 174.66 3mj5 n LEU 179 N 8.54 3.96 -0.25 3.21 4.77 -1.26 -4.75 117.00 131.22 3mj5 n LEU 179 Ca 0.05 -3.33 0.10 0.00 -0.03 0.00 0.00 56.01 52.81 3mj5 n LEU 179 Cb 0.48 -0.58 0.37 0.00 -2.33 0.00 0.00 43.42 41.35 3mj5 n LEU 179 CO 0.67 0.91 1.22 1.05 -1.33 0.00 0.00 177.39 179.90 3mj5 h GLU 180 N 1.38 0.70 -0.09 3.23 4.11 -1.99 0.63 114.58 122.55 3mj5 h GLU 180 Ca 0.10 -0.04 0.00 0.00 0.07 0.00 0.00 59.36 59.49 3mj5 h GLU 180 Cb 1.54 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.63 3mj5 h GLU 180 CO 0.30 0.46 0.00 0.43 0.07 0.00 0.00 179.01 180.27 3mj5 n SER 181 N -4.53 2.43 -4.73 3.06 7.64 -1.26 -4.96 113.62 111.26 3mj5 n SER 181 Ca 0.15 -1.80 -0.41 0.00 1.01 0.00 0.00 58.87 57.82 3mj5 n SER 181 Cb 0.40 -0.04 -0.03 0.00 -1.01 0.00 0.00 64.21 63.52 3mj5 n SER 181 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3mj5 s ALA 182 N -1.91 3.48 -0.14 -0.43 0.00 0.21 -4.73 121.76 118.24 3mj5 s ALA 182 Ca 0.33 1.01 -0.17 0.00 0.00 0.00 0.00 51.96 53.13 3mj5 s ALA 182 Cb 0.20 -3.46 0.04 0.00 0.00 0.00 0.00 23.12 19.91 3mj5 s ALA 182 CO 0.31 -0.47 0.46 0.21 0.00 0.00 0.00 175.76 176.27 3mj5 s LYS 183 N 0.23 0.59 -0.01 0.00 2.20 -0.43 -4.31 119.74 118.02 3mj5 s LYS 183 Ca 0.57 0.50 0.01 0.00 -0.36 0.00 0.00 55.97 56.68 3mj5 s LYS 183 Cb -0.34 0.28 0.01 0.00 -1.51 0.00 0.00 37.83 36.27 3mj5 s LYS 183 CO 0.35 -0.10 -0.02 0.50 -0.36 0.00 0.00 175.35 175.72 3mj5 s ARG 184 N -0.08 0.30 -0.25 4.03 3.52 -0.47 -1.06 118.95 124.94 3mj5 s ARG 184 Ca -0.03 -0.06 0.02 0.00 -0.13 0.00 0.00 55.73 55.53 3mj5 s ARG 184 Cb -0.03 -0.34 0.06 0.00 -1.56 0.00 0.00 34.95 33.07 3mj5 s ARG 184 CO 0.02 0.01 -0.11 0.08 -0.81 0.00 0.00 175.30 174.49 3mj5 s VAL 185 N 0.27 2.04 -0.07 7.11 1.01 0.02 0.14 120.40 130.91 3mj5 s VAL 185 Ca -0.02 -1.49 -0.05 0.00 0.00 0.00 0.00 61.98 60.42 3mj5 s VAL 185 Cb -0.05 -2.15 -0.04 0.00 0.00 0.00 0.00 36.38 34.14 3mj5 s VAL 185 CO -0.01 0.01 0.13 -0.76 0.00 0.00 0.00 175.10 174.47 3mj5 s LEU 186 N 1.17 4.23 0.15 3.92 1.43 -0.69 -0.45 118.68 128.46 3mj5 s LEU 186 Ca -0.07 0.36 0.11 0.00 -1.03 0.00 0.00 54.13 53.50 3mj5 s LEU 186 Cb -0.19 -2.20 -0.04 0.00 0.03 0.00 0.00 46.19 43.78 3mj5 s LEU 186 CO -0.06 0.35 -0.24 0.21 0.23 0.00 0.00 176.35 176.85 3mj5 s ASN 187 N -1.33 3.50 -0.07 2.29 2.47 -0.07 -1.08 114.94 120.65 3mj5 s ASN 187 Ca 0.19 -0.75 -0.05 0.00 0.42 0.00 0.00 52.86 52.67 3mj5 s ASN 187 Cb -0.12 -0.31 0.02 0.00 -1.45 0.00 0.00 41.25 39.40 3mj5 s ASN 187 CO 0.09 0.15 0.17 0.54 -3.72 0.00 0.00 177.10 174.33 3mj5 s VAL 188 N -1.33 -0.02 -0.01 -5.21 0.11 0.29 -1.01 120.40 113.23 3mj5 s VAL 188 Ca 0.18 0.06 0.06 0.00 -2.93 0.00 0.00 61.98 59.35 3mj5 s VAL 188 Cb -0.09 -0.26 -0.02 0.00 -1.53 0.00 0.00 36.38 34.49 3mj5 s VAL 188 CO 0.08 0.02 -0.20 -0.69 -3.33 0.00 0.00 175.10 170.99 3mj5 s VAL 189 N 0.48 1.56 0.33 2.04 1.01 -0.49 -0.71 120.40 124.61 3mj5 s VAL 189 Ca -0.03 -0.86 0.09 0.00 0.00 0.00 0.00 61.98 61.18 3mj5 s VAL 189 Cb -0.05 -1.30 -0.06 0.00 0.00 0.00 0.00 36.38 34.97 3mj5 s VAL 189 CO -0.02 0.42 -0.09 0.00 0.00 0.00 0.00 175.10 175.41 3mj5 n LYS 191 N -0.74 0.00 0.00 0.00 4.81 -1.26 -3.29 118.16 117.68 3mj5 n LYS 191 Ca -0.05 0.57 0.00 0.00 -0.87 0.00 0.00 58.31 57.95 3mj5 n LYS 191 Cb 0.63 -1.42 0.00 0.00 0.02 0.00 0.00 35.03 34.26 3mj5 n LYS 191 CO 0.00 0.00 0.00 -2.39 1.17 0.00 0.00 177.40 176.18 3mj5 n HIS 192 N -2.03 0.00 -0.28 5.64 1.44 -1.26 -4.33 115.22 114.41 3mj5 n HIS 192 Ca 0.00 0.00 0.10 0.00 -2.01 0.00 0.00 57.72 55.81 3mj5 n HIS 192 Cb 0.00 -0.11 0.21 0.00 0.12 0.00 0.00 29.99 30.20 3mj5 n HIS 192 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3mj5 n GLY 194 N -1.42 1.09 3.96 0.00 0.00 -1.21 -4.91 105.19 102.70 3mj5 n GLY 194 Ca 0.17 -1.05 -0.22 0.00 0.00 0.00 0.00 46.02 44.92 3mj5 n GLY 194 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3mj5 s GLN 195 N 0.00 3.46 -0.29 1.61 -0.21 -1.26 0.58 119.66 123.54 3mj5 s GLN 195 Ca 0.00 -0.62 -0.17 0.00 0.02 0.00 0.00 55.36 54.59 3mj5 s GLN 195 Cb 0.00 -2.82 0.17 0.00 1.00 0.00 0.00 33.01 31.36 3mj5 s GLN 195 CO 0.00 0.34 1.08 0.21 -2.12 0.00 0.00 175.29 174.80 3mj5 s LYS 196 N -4.09 0.27 -0.07 2.91 2.20 0.11 -4.95 119.74 116.13 3mj5 s LYS 196 Ca 0.36 0.46 -0.12 0.00 -0.36 0.00 0.00 55.97 56.31 3mj5 s LYS 196 Cb -0.09 0.06 -0.05 0.00 -1.51 0.00 0.00 37.83 36.24 3mj5 s LYS 196 CO 0.31 -0.06 0.30 0.99 -0.36 0.00 0.00 175.35 176.53 3mj5 s THR 197 N 1.13 5.24 -0.08 3.43 2.01 -1.26 -0.54 115.64 125.57 3mj5 s THR 197 Ca -0.07 0.57 0.01 0.00 0.31 0.00 0.00 61.69 62.51 3mj5 s THR 197 Cb -0.03 -3.59 0.02 0.00 0.01 0.00 0.00 72.50 68.90 3mj5 s THR 197 CO -0.13 0.56 -0.10 -0.89 -0.69 0.00 0.00 174.62 173.36 3mj5 s THR 198 N -0.76 1.06 -0.16 -0.82 2.01 -0.24 -5.01 115.64 111.72 3mj5 s THR 198 Ca 0.19 -0.40 -0.13 0.00 0.31 0.00 0.00 61.69 61.67 3mj5 s THR 198 Cb -0.14 -1.00 -0.05 0.00 0.01 0.00 0.00 72.50 71.32 3mj5 s THR 198 CO 0.08 0.35 0.26 -0.89 -0.69 0.00 0.00 174.62 173.73 3mj5 s THR 199 N 0.97 5.32 -0.01 -0.82 2.01 -1.26 -1.70 115.64 120.15 3mj5 s THR 199 Ca -0.09 0.48 0.04 0.00 0.31 0.00 0.00 61.69 62.43 3mj5 s THR 199 Cb -0.15 -3.59 -0.03 0.00 0.01 0.00 0.00 72.50 68.74 3mj5 s THR 199 CO 0.00 0.42 -0.10 -0.76 -0.69 0.00 0.00 174.62 173.49 3mj5 s LEU 200 N 0.29 2.98 0.24 4.42 1.43 0.12 -4.97 118.68 123.19 3mj5 s LEU 200 Ca 0.15 -0.19 0.00 0.00 -1.03 0.00 0.00 54.13 53.06 3mj5 s LEU 200 Cb -0.13 -1.70 -0.03 0.00 0.03 0.00 0.00 46.19 44.36 3mj5 s LEU 200 CO 0.03 0.30 0.20 0.42 0.23 0.00 0.00 176.35 177.53 3mj5 s THR 201 N -0.91 0.00 0.00 5.49 -4.23 -1.26 -1.37 115.64 113.36 3mj5 s THR 201 Ca 0.15 -1.95 0.00 0.00 -1.18 0.00 0.00 61.69 58.71 3mj5 s THR 201 Cb -0.11 -2.49 0.00 0.00 1.34 0.00 0.00 72.50 71.24 3mj5 s THR 201 CO 0.05 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.74 3mj5 n GLY 202 N -0.37 0.92 0.37 3.99 0.00 -1.26 -3.43 105.19 105.41 3mj5 n GLY 202 Ca 0.03 -0.71 0.14 0.00 0.00 0.00 0.00 46.02 45.49 3mj5 n GLY 202 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3mj5 h VAL 203 N 0.00 0.71 0.00 1.61 2.07 -1.95 0.12 116.25 118.81 3mj5 h VAL 203 Ca 0.00 -0.23 0.00 0.00 0.82 0.00 0.00 66.70 67.29 3mj5 h VAL 203 Cb 0.00 -0.03 0.00 0.00 -1.52 0.00 0.00 31.29 29.74 3mj5 h VAL 203 CO 0.00 0.12 0.00 -0.33 0.02 0.00 0.00 177.57 177.38 3mj5 h GLU 204 N 0.68 0.00 0.00 1.57 5.08 -1.83 -2.08 114.58 118.00 3mj5 h GLU 204 Ca 0.55 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.84 3mj5 h GLU 204 Cb 0.96 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.20 3mj5 h GLU 204 CO -0.32 0.00 -0.33 0.00 -1.00 0.00 0.00 179.01 177.37 3mj5 h ALA 205 N 2.10 1.36 -0.00 3.43 0.00 -0.82 -3.23 119.26 122.10 3mj5 h ALA 205 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.61 3mj5 h ALA 205 Cb 0.41 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.15 3mj5 h ALA 205 CO 0.00 0.41 -0.41 1.33 0.00 0.00 0.00 179.25 180.58 3mj5 n VAL 206 N -4.01 0.00 -4.39 0.00 0.24 -0.89 -4.63 118.33 104.66 3mj5 n VAL 206 Ca -0.02 -0.29 -0.33 0.00 -2.04 0.00 0.00 64.34 61.66 3mj5 n VAL 206 Cb 0.38 1.04 -0.16 0.00 -1.47 0.00 0.00 33.84 33.63 3mj5 n VAL 206 CO 0.00 0.00 0.00 -0.04 -2.14 0.00 0.00 176.83 174.65 3mj5 s MET 207 N -1.82 3.06 -0.09 7.34 -1.94 -0.84 0.17 119.30 125.18 3mj5 s MET 207 Ca 0.06 -0.82 0.02 0.00 -1.71 0.00 0.00 55.69 53.24 3mj5 s MET 207 Cb 0.08 -2.55 0.01 0.00 2.01 0.00 0.00 34.83 34.38 3mj5 s MET 207 CO 0.38 -0.10 -0.13 -0.47 -0.01 0.00 0.00 175.02 174.69 3mj5 s TYR 208 N 1.04 1.71 -0.21 -0.03 6.14 -0.81 -4.68 117.35 120.50 3mj5 s TYR 208 Ca -0.01 -0.73 -0.07 0.00 0.64 0.00 0.00 57.07 56.90 3mj5 s TYR 208 Cb -0.14 -1.25 -0.03 0.00 0.42 0.00 0.00 41.96 40.95 3mj5 s TYR 208 CO -0.06 -0.38 0.04 1.41 0.64 0.00 0.00 175.55 177.20 3mj5 s MET 209 N 0.89 3.74 0.00 4.97 -2.45 -1.26 -0.03 119.30 125.15 3mj5 s MET 209 Ca -0.10 -0.45 0.00 0.00 -1.25 0.00 0.00 55.69 53.89 3mj5 s MET 209 Cb -0.15 -3.21 0.00 0.00 1.25 0.00 0.00 34.83 32.72 3mj5 s MET 209 CO 0.01 0.02 0.00 0.41 1.05 0.00 0.00 175.02 176.50 3mj5 n GLY 210 N 4.28 1.28 3.08 2.11 0.00 0.35 -4.96 105.19 111.33 3mj5 n GLY 210 Ca -0.17 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.76 3mj5 n GLY 210 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3mj5 s THR 211 N 0.00 0.12 -0.28 2.61 -1.32 -1.22 -4.91 115.64 110.64 3mj5 s THR 211 Ca 0.00 -1.00 0.21 0.00 -1.21 0.00 0.00 61.69 59.69 3mj5 s THR 211 Cb 0.00 -0.69 0.11 0.00 -1.51 0.00 0.00 72.50 70.40 3mj5 s THR 211 CO 0.00 -0.55 1.25 -0.07 -2.21 0.00 0.00 174.62 173.03 3mj5 h LEU 212 N 3.98 0.00 -8.52 9.08 3.38 -1.86 -3.24 115.31 118.13 3mj5 h LEU 212 Ca -0.32 0.00 -0.69 0.00 0.09 0.00 0.00 57.88 56.96 3mj5 h LEU 212 Cb 1.19 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 41.75 3mj5 h LEU 212 CO 0.47 0.11 -0.15 -0.55 0.09 0.00 0.00 178.44 178.41 3mj5 s SER 213 N -5.79 6.21 0.54 -0.43 0.15 -1.26 -4.72 113.70 108.40 3mj5 s SER 213 Ca 0.02 -0.69 0.25 0.00 0.70 0.00 0.00 55.95 56.23 3mj5 s SER 213 Cb 0.08 -2.24 1.40 0.00 -1.71 0.00 0.00 66.02 63.55 3mj5 s SER 213 CO 0.75 -0.64 2.02 0.22 1.20 0.00 0.00 173.24 176.79 3mj5 h TYR 214 N 8.77 0.00 -0.30 3.44 3.20 -1.96 -0.03 116.97 130.09 3mj5 h TYR 214 Ca -0.26 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.61 3mj5 h TYR 214 Cb 1.11 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 39.36 3mj5 h TYR 214 CO 0.64 0.00 0.20 -0.44 -1.64 0.00 0.00 178.16 176.93 3mj5 h ASP 215 N 0.00 0.35 -0.13 -2.11 5.19 -1.99 -2.75 116.42 114.99 3mj5 h ASP 215 Ca 0.21 -0.01 0.01 0.00 -0.62 0.00 0.00 57.03 56.62 3mj5 h ASP 215 Cb 0.86 -0.09 -0.01 0.00 0.18 0.00 0.00 39.33 40.27 3mj5 h ASP 215 CO -0.00 0.25 0.04 0.78 -3.12 0.00 0.00 179.24 177.19 3mj5 h ASN 216 N 0.41 0.05 -0.99 6.45 4.21 -1.34 -0.81 115.58 123.56 3mj5 h ASN 216 Ca 0.11 0.01 0.23 0.00 1.21 0.00 0.00 56.30 57.87 3mj5 h ASN 216 Cb -0.05 0.01 -0.12 0.00 -1.12 0.00 0.00 38.32 37.04 3mj5 h ASN 216 CO -0.03 0.05 0.58 0.25 -1.29 0.00 0.00 177.43 176.99 3mj5 h LEU 217 N 0.11 0.67 -0.31 1.61 5.85 -1.40 0.84 115.31 122.66 3mj5 h LEU 217 Ca 0.05 0.13 -0.20 0.00 0.84 0.00 0.00 57.88 58.70 3mj5 h LEU 217 Cb 0.03 0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.08 3mj5 h LEU 217 CO -0.06 0.13 -0.81 0.11 -0.34 0.00 0.00 178.44 177.47 3mj5 h LYS 218 N 0.60 0.40 0.00 1.25 1.57 -0.98 0.66 116.57 120.07 3mj5 h LYS 218 Ca 0.62 -0.37 0.00 0.00 -1.87 0.00 0.00 60.65 59.04 3mj5 h LYS 218 Cb 1.15 0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.55 3mj5 h LYS 218 CO -0.46 1.02 -1.17 0.25 -0.57 0.00 0.00 179.45 178.52 3mj5 n THR 219 N -3.80 0.28 0.00 -0.16 -2.24 -0.41 -4.47 114.28 103.48 3mj5 n THR 219 Ca -0.05 -0.38 0.00 0.00 -2.27 0.00 0.00 64.05 61.35 3mj5 n THR 219 Cb 0.76 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.99 3mj5 n THR 219 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3mj5 n GLY 220 N 1.29 4.13 3.43 3.38 0.00 0.28 -4.97 105.19 112.73 3mj5 n GLY 220 Ca 0.00 -1.08 -0.31 0.00 0.00 0.00 0.00 46.02 44.63 3mj5 n GLY 220 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3mj5 s VAL 221 N -0.25 2.67 -0.35 1.61 -7.23 0.10 -4.68 120.40 112.27 3mj5 s VAL 221 Ca 0.00 -1.11 -0.29 0.00 -1.81 0.00 0.00 61.98 58.77 3mj5 s VAL 221 Cb 0.00 -2.08 0.02 0.00 0.56 0.00 0.00 36.38 34.88 3mj5 s VAL 221 CO 0.00 0.42 1.12 -0.55 -0.31 0.00 0.00 175.10 175.78 3mj5 s SER 222 N -1.16 6.83 -0.06 4.85 0.15 -1.26 -1.58 113.70 121.47 3mj5 s SER 222 Ca 0.13 0.93 0.03 0.00 0.70 0.00 0.00 55.95 57.74 3mj5 s SER 222 Cb -0.10 -2.54 0.01 0.00 -1.71 0.00 0.00 66.02 61.67 3mj5 s SER 222 CO 0.03 -0.99 -0.16 0.27 1.20 0.00 0.00 173.24 173.59 3mj5 s ILE 223 N 3.93 1.38 -0.50 6.45 -4.36 0.34 -4.98 121.20 123.47 3mj5 s ILE 223 Ca 0.47 -0.65 -0.26 0.00 -0.26 0.00 0.00 60.65 59.95 3mj5 s ILE 223 Cb -0.11 -1.22 -0.06 0.00 1.25 0.00 0.00 42.46 42.32 3mj5 s ILE 223 CO 0.20 0.41 2.29 -2.16 0.24 0.00 0.00 174.94 175.92 3mj5 s PRO 224 N 0.38 2.25 1.11 0.37 0.04 -1.26 -1.04 135.00 136.85 3mj5 s PRO 224 Ca -0.11 1.28 -0.18 0.00 0.04 0.00 0.00 61.00 62.03 3mj5 s PRO 224 Cb -0.14 -4.54 0.25 0.00 0.04 0.00 0.00 34.50 30.11 3mj5 s PRO 224 CO 0.04 -3.12 1.18 0.00 0.04 0.00 0.00 177.00 175.14 3mj5 n VAL 226 N -4.41 0.00 0.25 0.00 0.31 -1.26 -1.05 118.33 112.17 3mj5 n VAL 226 Ca 0.14 0.72 0.03 0.00 -0.01 0.00 0.00 64.34 65.22 3mj5 n VAL 226 Cb 0.59 -1.00 0.14 0.00 -0.91 0.00 0.00 33.84 32.67 3mj5 n VAL 226 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3mj5 n GLY 228 N -0.81 3.00 3.75 0.00 0.00 -0.21 -5.03 105.19 105.89 3mj5 n GLY 228 Ca 0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.67 3mj5 n GLY 228 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3mj5 s ARG 229 N -0.20 3.00 0.14 1.61 0.52 -1.26 -4.63 118.95 118.13 3mj5 s ARG 229 Ca 0.00 1.96 -0.12 0.00 -0.52 0.00 0.00 55.73 57.06 3mj5 s ARG 229 Cb 0.00 -2.03 -0.07 0.00 0.52 0.00 0.00 34.95 33.37 3mj5 s ARG 229 CO 0.00 -1.22 0.50 -0.51 0.02 0.00 0.00 175.30 174.09 3mj5 s ASP 230 N -1.38 6.72 0.08 0.23 1.11 -1.26 -2.85 116.67 119.31 3mj5 s ASP 230 Ca 0.76 0.94 0.09 0.00 0.18 0.00 0.00 52.55 54.52 3mj5 s ASP 230 Cb -0.34 -2.24 -0.03 0.00 1.07 0.00 0.00 42.92 41.38 3mj5 s ASP 230 CO 0.38 0.09 -0.23 0.00 1.18 0.00 0.00 175.17 176.59 3mj5 s ALA 231 N -1.52 2.44 -0.15 5.23 0.00 -0.20 -4.55 121.76 123.00 3mj5 s ALA 231 Ca 0.38 -1.31 -0.01 0.00 0.00 0.00 0.00 51.96 51.02 3mj5 s ALA 231 Cb -0.14 -0.55 -0.01 0.00 0.00 0.00 0.00 23.12 22.42 3mj5 s ALA 231 CO 0.19 0.55 -0.10 0.99 0.00 0.00 0.00 175.76 177.40 3mj5 s THR 232 N -0.95 3.20 -0.07 0.00 2.01 -0.99 -0.50 115.64 118.34 3mj5 s THR 232 Ca 0.14 -0.60 0.03 0.00 0.31 0.00 0.00 61.69 61.58 3mj5 s THR 232 Cb -0.10 -2.38 0.00 0.00 0.01 0.00 0.00 72.50 70.04 3mj5 s THR 232 CO 0.05 0.50 -0.18 -1.58 -0.69 0.00 0.00 174.62 172.73 3mj5 s GLN 233 N 0.59 2.20 0.01 4.92 0.74 -0.61 -1.40 119.66 126.12 3mj5 s GLN 233 Ca -0.06 -0.63 -0.13 0.00 0.05 0.00 0.00 55.36 54.59 3mj5 s GLN 233 Cb -0.15 -1.76 0.02 0.00 1.10 0.00 0.00 33.01 32.21 3mj5 s GLN 233 CO 0.03 0.13 0.27 1.52 -0.55 0.00 0.00 175.29 176.70 3mj5 s TYR 234 N 0.40 -0.10 -0.12 1.67 -0.85 -0.18 0.00 117.35 118.17 3mj5 s TYR 234 Ca -0.14 0.05 -0.29 0.00 -0.52 0.00 0.00 57.07 56.17 3mj5 s TYR 234 Cb -0.16 0.06 -0.02 0.00 0.38 0.00 0.00 41.96 42.22 3mj5 s TYR 234 CO 0.05 -0.42 1.28 -1.17 -1.52 0.00 0.00 175.55 173.77 3mj5 s LEU 235 N -1.69 4.22 -0.07 -3.49 2.96 0.22 -0.89 118.68 119.95 3mj5 s LEU 235 Ca -0.10 1.78 0.18 0.00 -0.22 0.00 0.00 54.13 55.77 3mj5 s LEU 235 Cb -0.03 -3.54 -0.22 0.00 0.50 0.00 0.00 46.19 42.89 3mj5 s LEU 235 CO 0.00 -0.73 0.47 0.55 -1.32 0.00 0.00 176.35 175.32 3mj5 n VAL 236 N 5.16 1.13 -3.64 1.68 3.14 0.41 -4.48 118.33 121.73 3mj5 n VAL 236 Ca 0.13 -0.74 -0.09 0.00 -2.96 0.00 0.00 64.34 60.69 3mj5 n VAL 236 Cb 0.45 -0.56 -0.07 0.00 -1.06 0.00 0.00 33.84 32.60 3mj5 n VAL 236 CO 0.00 0.00 0.00 -1.58 -6.46 0.00 0.00 176.83 168.79 3mj5 s GLN 237 N -2.81 0.66 -0.01 1.45 0.74 -1.15 -0.47 119.66 118.07 3mj5 s GLN 237 Ca -0.07 0.97 0.03 0.00 0.05 0.00 0.00 55.36 56.34 3mj5 s GLN 237 Cb 0.08 0.23 -0.01 0.00 1.10 0.00 0.00 33.01 34.41 3mj5 s GLN 237 CO 0.84 -0.11 -0.10 -1.14 -0.55 0.00 0.00 175.29 174.23 3mj5 s GLN 238 N 0.99 0.83 -0.29 1.67 2.00 0.38 -0.80 119.66 124.44 3mj5 s GLN 238 Ca -0.05 -0.35 -0.03 0.00 -2.00 0.00 0.00 55.36 52.93 3mj5 s GLN 238 Cb -0.05 -0.80 0.11 0.00 0.80 0.00 0.00 33.01 33.08 3mj5 s GLN 238 CO -0.11 0.21 0.18 -1.21 -0.50 0.00 0.00 175.29 173.86 3mj5 s GLU 239 N -0.20 0.24 -0.03 1.67 0.41 -0.23 -0.51 118.70 120.06 3mj5 s GLU 239 Ca 0.03 -0.44 -0.31 0.00 -0.41 0.00 0.00 54.97 53.85 3mj5 s GLU 239 Cb -0.04 -1.01 0.12 0.00 -1.78 0.00 0.00 34.13 31.42 3mj5 s GLU 239 CO -0.00 -1.03 1.31 -1.54 -0.49 0.00 0.00 175.26 173.51 3mj5 s SER 240 N 2.15 -0.05 0.00 -0.19 1.04 -1.01 -1.31 113.70 114.33 3mj5 s SER 240 Ca 0.09 -0.12 0.23 0.00 0.48 0.00 0.00 55.95 56.63 3mj5 s SER 240 Cb -0.16 0.14 0.14 0.00 0.10 0.00 0.00 66.02 66.24 3mj5 s SER 240 CO -0.35 -0.26 1.16 -1.54 0.98 0.00 0.00 173.24 173.23 3mj5 n SER 241 N -0.50 1.19 -3.36 7.02 3.41 -1.25 -2.78 113.62 117.34 3mj5 n SER 241 Ca -0.09 -0.98 -0.05 0.00 -0.26 0.00 0.00 58.87 57.50 3mj5 n SER 241 Cb 0.63 0.57 0.01 0.00 -0.26 0.00 0.00 64.21 65.16 3mj5 n SER 241 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 3mj5 s PHE 242 N -2.78 0.02 0.03 7.33 -0.71 -1.26 -3.03 117.98 117.58 3mj5 s PHE 242 Ca 0.14 -0.49 -0.09 0.00 -1.04 0.00 0.00 56.93 55.45 3mj5 s PHE 242 Cb 0.17 0.73 0.00 0.00 -1.21 0.00 0.00 43.02 42.72 3mj5 s PHE 242 CO 0.70 -1.11 0.19 0.14 -1.34 0.00 0.00 175.22 173.80 3mj5 s VAL 243 N -2.58 0.10 -0.08 -2.49 -7.23 -0.68 -4.82 120.40 102.63 3mj5 s VAL 243 Ca 0.17 -0.82 0.01 0.00 -1.81 0.00 0.00 61.98 59.53 3mj5 s VAL 243 Cb -0.03 -0.78 0.02 0.00 0.56 0.00 0.00 36.38 36.14 3mj5 s VAL 243 CO 0.07 -0.45 -0.08 -0.32 -0.31 0.00 0.00 175.10 174.00 3mj5 s MET 244 N -2.20 1.37 -0.12 4.82 0.00 0.13 -1.22 119.30 122.08 3mj5 s MET 244 Ca -0.08 -0.25 -0.02 0.00 0.00 0.00 0.00 55.69 55.34 3mj5 s MET 244 Cb -0.03 -1.33 -0.03 0.00 0.00 0.00 0.00 34.83 33.45 3mj5 s MET 244 CO -0.02 -0.13 -0.04 -1.64 0.00 0.00 0.00 175.02 173.19 3mj5 s MET 245 N 1.21 3.28 0.11 4.11 -1.94 0.08 -1.93 119.30 124.22 3mj5 s MET 245 Ca -0.05 -0.51 0.07 0.00 -1.71 0.00 0.00 55.69 53.50 3mj5 s MET 245 Cb -0.14 -2.80 -0.04 0.00 2.01 0.00 0.00 34.83 33.87 3mj5 s MET 245 CO -0.02 0.45 -0.19 -1.12 -0.01 0.00 0.00 175.02 174.13 3mj5 s SER 246 N -0.20 2.36 0.02 3.03 0.01 0.96 -1.55 113.70 118.32 3mj5 s SER 246 Ca 0.04 -0.72 -0.28 0.00 1.31 0.00 0.00 55.95 56.30 3mj5 s SER 246 Cb -0.13 -0.12 0.07 0.00 0.21 0.00 0.00 66.02 66.06 3mj5 s SER 246 CO 0.02 -0.00 0.67 0.00 0.41 0.00 0.00 173.24 174.35 3mj5 s ALA 247 N -1.43 -1.72 0.30 1.44 0.00 0.05 -0.50 121.76 119.91 3mj5 s ALA 247 Ca 0.07 1.05 -0.29 0.00 0.00 0.00 0.00 51.96 52.78 3mj5 s ALA 247 Cb -0.09 0.28 -0.13 0.00 0.00 0.00 0.00 23.12 23.18 3mj5 s ALA 247 CO 0.04 -0.51 1.28 -2.30 0.00 0.00 0.00 175.76 174.27 3mj5 n PRO 248 N 0.44 1.97 -1.65 0.00 -0.02 -1.26 -4.42 135.00 130.06 3mj5 n PRO 248 Ca -0.18 0.69 -0.48 0.00 -2.02 0.00 0.00 63.50 61.51 3mj5 n PRO 248 Cb 0.60 -2.27 -0.05 0.00 -0.02 0.00 0.00 33.50 31.76 3mj5 n PRO 248 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 3mj5 n PRO 249 N 1.02 1.81 -3.96 0.52 -0.04 -1.26 -4.87 135.00 128.21 3mj5 n PRO 249 Ca 0.08 0.65 -0.09 0.00 -0.04 0.00 0.00 63.50 64.10 3mj5 n PRO 249 Cb 0.34 -2.39 -0.10 0.00 -0.04 0.00 0.00 33.50 31.31 3mj5 n PRO 249 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3mj5 s ALA 250 N 1.18 0.05 -0.09 0.55 0.00 -1.22 -4.88 121.76 117.35 3mj5 s ALA 250 Ca 0.83 -0.59 -0.33 0.00 0.00 0.00 0.00 51.96 51.86 3mj5 s ALA 250 Cb -0.78 0.19 -0.10 0.00 0.00 0.00 0.00 23.12 22.43 3mj5 s ALA 250 CO 0.43 -0.24 1.96 -1.91 0.00 0.00 0.00 175.76 176.00 3mj5 n GLU 251 N 1.12 2.27 -3.98 0.00 4.07 -1.25 -2.25 120.64 120.62 3mj5 n GLU 251 Ca -0.21 0.81 -0.09 0.00 -0.06 0.00 0.00 57.16 57.61 3mj5 n GLU 251 Cb 0.57 -2.79 -0.10 0.00 -0.06 0.00 0.00 31.44 29.06 3mj5 n GLU 251 CO 0.00 0.00 0.00 -0.47 -0.06 0.00 0.00 177.13 176.60 3mj5 s TYR 252 N 4.83 0.28 -0.26 4.31 5.04 0.12 -4.86 117.35 126.81 3mj5 s TYR 252 Ca 0.94 -0.60 -0.05 0.00 -2.44 0.00 0.00 57.07 54.91 3mj5 s TYR 252 Cb -0.60 -0.21 -0.00 0.00 0.35 0.00 0.00 41.96 41.50 3mj5 s TYR 252 CO 0.48 -0.27 0.03 0.21 -1.34 0.00 0.00 175.55 174.65 3mj5 s LYS 253 N -2.19 3.24 -0.07 4.97 2.20 -1.26 -0.79 119.74 125.85 3mj5 s LYS 253 Ca -0.09 -0.74 -0.21 0.00 -0.36 0.00 0.00 55.97 54.57 3mj5 s LYS 253 Cb -0.04 -3.22 -0.04 0.00 -1.51 0.00 0.00 37.83 33.01 3mj5 s LYS 253 CO -0.03 -0.32 0.61 -0.51 -0.36 0.00 0.00 175.35 174.73 3mj5 s LEU 254 N 1.50 4.33 0.01 5.43 1.43 0.98 -4.95 118.68 127.41 3mj5 s LEU 254 Ca 0.04 1.07 0.07 0.00 -1.03 0.00 0.00 54.13 54.28 3mj5 s LEU 254 Cb -0.16 -2.93 -0.03 0.00 0.03 0.00 0.00 46.19 43.11 3mj5 s LEU 254 CO 0.00 -0.03 -0.21 -1.10 0.23 0.00 0.00 176.35 175.24 3mj5 s GLN 255 N 0.51 2.12 0.43 1.70 -0.21 -1.26 -2.02 119.66 120.93 3mj5 s GLN 255 Ca 0.32 -0.93 -0.26 0.00 0.02 0.00 0.00 55.36 54.51 3mj5 s GLN 255 Cb -0.17 -2.14 -0.09 0.00 1.00 0.00 0.00 33.01 31.61 3mj5 s GLN 255 CO 0.15 0.56 1.42 -1.14 -2.12 0.00 0.00 175.29 174.17 3mj5 s GLN 256 N -1.01 3.78 -1.21 2.91 0.74 -1.26 -2.50 119.66 121.11 3mj5 s GLN 256 Ca 0.12 2.42 0.00 0.00 0.05 0.00 0.00 55.36 57.95 3mj5 s GLN 256 Cb -0.10 -2.72 0.00 0.00 1.10 0.00 0.00 33.01 31.29 3mj5 s GLN 256 CO 0.02 -0.74 0.00 0.41 -0.55 0.00 0.00 175.29 174.43 3mj5 n GLY 257 N 0.57 0.19 0.00 2.59 0.00 -1.26 -4.85 105.19 102.44 3mj5 n GLY 257 Ca 0.04 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.72 3mj5 n GLY 257 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3mj5 n THR 258 N -3.68 0.04 -3.84 2.61 -2.24 -1.04 -5.08 114.28 101.04 3mj5 n THR 258 Ca -0.15 -0.12 -0.08 0.00 -2.27 0.00 0.00 64.05 61.43 3mj5 n THR 258 Cb 0.58 1.61 -0.03 0.00 -2.10 0.00 0.00 70.33 70.39 3mj5 n THR 258 CO 0.00 0.00 0.00 0.72 -0.57 0.00 0.00 175.07 175.22 3mj5 s PHE 259 N -0.04 -0.07 -0.18 4.78 -0.71 -1.26 -4.96 117.98 115.54 3mj5 s PHE 259 Ca 0.00 -0.33 -0.16 0.00 -1.04 0.00 0.00 56.93 55.40 3mj5 s PHE 259 Cb 0.00 0.51 -0.12 0.00 -1.21 0.00 0.00 43.02 42.20 3mj5 s PHE 259 CO 0.00 -1.09 0.06 1.25 -1.34 0.00 0.00 175.22 174.10 3mj5 h LEU 260 N 2.10 0.00 -7.43 -1.99 5.85 -1.23 -3.46 115.31 109.15 3mj5 h LEU 260 Ca -0.24 -0.30 0.22 0.00 0.84 0.00 0.00 57.88 58.41 3mj5 h LEU 260 Cb 1.26 0.00 -0.11 0.00 0.37 0.00 0.00 40.66 42.18 3mj5 h LEU 260 CO 0.30 1.16 0.61 0.00 -0.34 0.00 0.00 178.44 180.17 3mj5 s ALA 262 N -2.95 -1.60 0.08 0.00 0.00 0.15 0.17 121.76 117.61 3mj5 s ALA 262 Ca 0.12 0.44 0.02 0.00 0.00 0.00 0.00 51.96 52.55 3mj5 s ALA 262 Cb 0.01 0.71 -0.03 0.00 0.00 0.00 0.00 23.12 23.80 3mj5 s ALA 262 CO -0.01 -0.84 -0.08 0.54 0.00 0.00 0.00 175.76 175.37 3mj5 s ASN 263 N -2.73 1.12 0.14 0.00 2.20 -0.14 0.15 114.94 115.68 3mj5 s ASN 263 Ca 0.06 -0.80 0.07 0.00 -0.94 0.00 0.00 52.86 51.24 3mj5 s ASN 263 Cb -0.02 0.05 -0.04 0.00 -2.00 0.00 0.00 41.25 39.24 3mj5 s ASN 263 CO -0.06 -0.32 -0.15 -1.83 -2.94 0.00 0.00 177.10 171.79 3mj5 s GLU 264 N -2.80 1.10 -0.09 3.55 4.04 -0.54 -1.34 118.70 122.63 3mj5 s GLU 264 Ca 0.03 -1.30 -0.00 0.00 0.04 0.00 0.00 54.97 53.74 3mj5 s GLU 264 Cb -0.02 -1.03 0.02 0.00 0.02 0.00 0.00 34.13 33.13 3mj5 s GLU 264 CO -0.02 0.20 -0.06 -0.47 -1.84 0.00 0.00 175.26 173.08 3mj5 s TYR 265 N -2.15 1.15 -0.20 4.83 5.04 0.76 -1.82 117.35 124.97 3mj5 s TYR 265 Ca 0.11 -0.48 -0.04 0.00 -2.44 0.00 0.00 57.07 54.22 3mj5 s TYR 265 Cb -0.05 -1.01 -0.02 0.00 0.35 0.00 0.00 41.96 41.23 3mj5 s TYR 265 CO 0.04 -0.39 -0.03 0.99 -1.34 0.00 0.00 175.55 174.82 3mj5 s THR 266 N 1.53 3.59 -4.42 4.34 2.01 0.19 -4.72 115.64 118.15 3mj5 s THR 266 Ca 0.00 -0.43 0.00 0.00 0.31 0.00 0.00 61.69 61.57 3mj5 s THR 266 Cb -0.13 -2.62 0.00 0.00 0.01 0.00 0.00 72.50 69.76 3mj5 s THR 266 CO -0.05 0.44 0.00 0.61 -0.69 0.00 0.00 174.62 174.93 3mj5 n GLY 267 N 4.42 0.88 3.99 4.40 0.00 -1.26 0.32 105.19 117.93 3mj5 n GLY 267 Ca -0.18 -1.87 -0.21 0.00 0.00 0.00 0.00 46.02 43.76 3mj5 n GLY 267 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mj5 s ASN 268 N -4.00 5.01 0.24 1.61 2.20 0.18 -4.94 114.94 115.25 3mj5 s ASN 268 Ca 0.00 -0.92 -0.06 0.00 -0.94 0.00 0.00 52.86 50.94 3mj5 s ASN 268 Cb 0.00 0.22 0.34 0.00 -2.00 0.00 0.00 41.25 39.82 3mj5 s ASN 268 CO 0.00 -1.21 1.82 0.22 -2.94 0.00 0.00 177.10 175.00 3mj5 h TYR 269 N 0.40 0.87 0.00 1.54 5.03 -2.01 -2.26 116.97 120.55 3mj5 h TYR 269 Ca -0.33 0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.01 3mj5 h TYR 269 Cb 1.29 -0.27 0.00 0.00 1.55 0.00 0.00 36.73 39.30 3mj5 h TYR 269 CO 0.58 0.40 -0.30 1.04 -1.32 0.00 0.00 178.16 178.57 3mj5 n GLN 270 N -4.71 0.21 -3.63 1.82 6.02 -1.26 -4.81 117.38 111.01 3mj5 n GLN 270 Ca 0.12 0.11 -0.05 0.00 -0.01 0.00 0.00 57.00 57.18 3mj5 n GLN 270 Cb 0.22 -1.68 -0.06 0.00 1.02 0.00 0.00 30.24 29.74 3mj5 n GLN 270 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3mj5 n GLY 272 N 4.60 -1.59 3.06 0.00 0.00 -1.26 0.51 105.19 110.51 3mj5 n GLY 272 Ca -0.17 -1.06 -0.20 0.00 0.00 0.00 0.00 46.02 44.59 3mj5 n GLY 272 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3mj5 s HIS 273 N -2.38 0.98 -0.08 1.61 2.46 0.15 -4.94 115.29 113.09 3mj5 s HIS 273 Ca 0.00 -0.21 -0.02 0.00 0.47 0.00 0.00 55.06 55.30 3mj5 s HIS 273 Cb 0.00 -0.62 -0.03 0.00 -0.13 0.00 0.00 32.58 31.80 3mj5 s HIS 273 CO 0.00 -0.01 0.03 0.71 -2.47 0.00 0.00 174.74 172.99 3mj5 s TYR 274 N -0.35 3.22 0.20 3.88 2.02 -1.26 0.52 117.35 125.59 3mj5 s TYR 274 Ca 0.03 0.23 0.06 0.00 -0.37 0.00 0.00 57.07 57.03 3mj5 s TYR 274 Cb -0.05 -1.80 -0.05 0.00 -0.40 0.00 0.00 41.96 39.67 3mj5 s TYR 274 CO -0.00 0.51 -0.11 0.95 -1.57 0.00 0.00 175.55 175.33 3mj5 s THR 275 N -0.94 1.51 -0.03 -0.71 -4.23 -0.76 -4.85 115.64 105.64 3mj5 s THR 275 Ca 0.15 -2.14 0.01 0.00 -1.18 0.00 0.00 61.69 58.52 3mj5 s THR 275 Cb -0.11 -2.08 -0.03 0.00 1.34 0.00 0.00 72.50 71.61 3mj5 s THR 275 CO 0.04 -0.56 -0.03 -2.28 -0.54 0.00 0.00 174.62 171.25 3mj5 s HIS 276 N -3.11 3.03 -0.14 3.99 2.46 -0.72 -1.47 115.29 119.34 3mj5 s HIS 276 Ca 0.23 0.08 0.02 0.00 0.47 0.00 0.00 55.06 55.85 3mj5 s HIS 276 Cb 0.01 -1.70 0.02 0.00 -0.13 0.00 0.00 32.58 30.78 3mj5 s HIS 276 CO 0.06 0.42 -0.18 0.42 -2.47 0.00 0.00 174.74 172.99 3mj5 s ILE 277 N -0.96 1.76 0.10 0.89 1.09 0.39 0.74 121.20 125.21 3mj5 s ILE 277 Ca 0.16 -0.78 0.08 0.00 -1.10 0.00 0.00 60.65 59.00 3mj5 s ILE 277 Cb -0.11 -1.60 -0.03 0.00 -1.06 0.00 0.00 42.46 39.66 3mj5 s ILE 277 CO 0.06 0.49 -0.20 0.28 -0.10 0.00 0.00 174.94 175.47 3mj5 s THR 278 N 1.07 1.61 -0.18 2.92 -1.32 0.02 0.35 115.64 120.12 3mj5 s THR 278 Ca -0.03 -1.50 -0.06 0.00 -1.21 0.00 0.00 61.69 58.89 3mj5 s THR 278 Cb -0.14 -1.48 -0.03 0.00 -1.51 0.00 0.00 72.50 69.34 3mj5 s THR 278 CO -0.05 -0.09 0.02 0.00 -2.21 0.00 0.00 174.62 172.29 3mj5 s ALA 279 N -1.18 3.19 0.00 11.08 0.00 -1.25 -0.24 121.76 133.36 3mj5 s ALA 279 Ca 0.05 -0.83 0.00 0.00 0.00 0.00 0.00 51.96 51.18 3mj5 s ALA 279 Cb -0.10 -1.77 0.00 0.00 0.00 0.00 0.00 23.12 21.25 3mj5 s ALA 279 CO 0.04 0.10 0.00 1.63 0.00 0.00 0.00 175.76 177.53 3mj5 n LYS 280 N 3.72 0.00 0.22 0.00 4.76 -1.26 -4.93 118.16 120.67 3mj5 n LYS 280 Ca -0.17 0.00 0.08 0.00 -2.87 0.00 0.00 58.31 55.35 3mj5 n LYS 280 Cb 0.52 0.00 0.50 0.00 -1.84 0.00 0.00 35.03 34.21 3mj5 n LYS 280 CO 0.00 0.00 0.00 1.05 -1.37 0.00 0.00 177.40 177.08 3mj5 h GLU 281 N 0.00 0.00 0.00 1.97 9.09 -2.01 -3.45 114.58 120.18 3mj5 h GLU 281 Ca 0.00 0.00 -0.41 0.00 0.05 0.00 0.00 59.36 59.00 3mj5 h GLU 281 Cb 0.00 0.00 -0.11 0.00 -1.65 0.00 0.00 28.75 26.99 3mj5 h GLU 281 CO 0.00 0.26 -0.38 -2.37 0.05 0.00 0.00 179.01 176.57 3mj5 n THR 282 N -3.70 0.00 -2.78 -1.06 5.66 -1.26 -5.10 114.28 106.04 3mj5 n THR 282 Ca -0.01 -2.18 -0.38 0.00 -3.05 0.00 0.00 64.05 58.43 3mj5 n THR 282 Cb 0.37 1.13 -0.06 0.00 -1.55 0.00 0.00 70.33 70.22 3mj5 n THR 282 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 3mj5 s LEU 283 N 0.00 4.49 -0.14 1.09 1.43 0.31 -4.55 118.68 121.29 3mj5 s LEU 283 Ca 0.36 1.87 0.00 0.00 -1.03 0.00 0.00 54.13 55.32 3mj5 s LEU 283 Cb 0.01 -3.80 0.02 0.00 0.03 0.00 0.00 46.19 42.46 3mj5 s LEU 283 CO 0.25 0.05 -0.12 -0.31 0.23 0.00 0.00 176.35 176.44 3mj5 s TYR 284 N -1.40 2.03 -0.45 0.29 1.51 0.67 -1.24 117.35 118.76 3mj5 s TYR 284 Ca 0.45 -1.14 -0.15 0.00 -1.01 0.00 0.00 57.07 55.22 3mj5 s TYR 284 Cb -0.22 -1.52 0.06 0.00 -0.11 0.00 0.00 41.96 40.17 3mj5 s TYR 284 CO 0.27 -0.64 0.35 0.50 -1.11 0.00 0.00 175.55 174.93 3mj5 s ARG 285 N 1.53 2.95 -0.36 -0.62 3.52 0.17 -0.80 118.95 125.34 3mj5 s ARG 285 Ca 0.05 -1.24 -0.17 0.00 -0.13 0.00 0.00 55.73 54.23 3mj5 s ARG 285 Cb -0.13 -4.06 -0.00 0.00 -1.56 0.00 0.00 34.95 29.20 3mj5 s ARG 285 CO -0.10 -0.93 0.47 0.42 -0.81 0.00 0.00 175.30 174.36 3mj5 s ILE 286 N 1.64 5.05 -0.76 4.11 1.01 0.23 -2.06 121.20 130.42 3mj5 s ILE 286 Ca 0.04 0.16 0.03 0.00 0.00 0.00 0.00 60.65 60.89 3mj5 s ILE 286 Cb -0.22 -3.95 0.21 0.00 0.01 0.00 0.00 42.46 38.51 3mj5 s ILE 286 CO 0.07 -0.23 0.70 -0.67 0.00 0.00 0.00 174.94 174.81 3mj5 n ASP 287 N 5.66 3.73 0.00 3.58 2.03 0.57 -1.76 116.55 130.37 3mj5 n ASP 287 Ca -0.06 -3.28 0.00 0.00 0.52 0.00 0.00 54.79 51.97 3mj5 n ASP 287 Cb 0.49 -0.83 0.00 0.00 -0.72 0.00 0.00 41.12 40.05 3mj5 n ASP 287 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3mj5 n GLY 288 N 1.67 2.49 0.11 0.27 0.00 -1.26 -0.93 105.19 107.55 3mj5 n GLY 288 Ca 0.24 0.15 -0.02 0.00 0.00 0.00 0.00 46.02 46.39 3mj5 n GLY 288 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mj5 h ALA 289 N -0.77 0.62 -2.39 4.61 0.00 -1.93 -3.40 119.26 115.99 3mj5 h ALA 289 Ca 0.00 -0.64 -0.47 0.00 0.00 0.00 0.00 54.91 53.80 3mj5 h ALA 289 Cb 0.00 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 3mj5 h ALA 289 CO 0.00 0.88 0.30 -1.01 0.00 0.00 0.00 179.25 179.43 3mj5 s HIS 290 N -3.02 3.61 -0.05 0.00 3.76 -0.11 -4.97 115.29 114.51 3mj5 s HIS 290 Ca 0.02 1.68 0.01 0.00 -0.15 0.00 0.00 55.06 56.61 3mj5 s HIS 290 Cb 0.10 -2.85 0.02 0.00 1.11 0.00 0.00 32.58 30.95 3mj5 s HIS 290 CO 0.77 0.17 -0.05 -1.17 -0.85 0.00 0.00 174.74 173.61 3mj5 s LEU 291 N -2.25 1.28 0.09 0.89 2.96 -1.26 -0.32 118.68 120.07 3mj5 s LEU 291 Ca 0.51 -0.15 0.08 0.00 -0.22 0.00 0.00 54.13 54.35 3mj5 s LEU 291 Cb -0.16 -0.52 -0.03 0.00 0.50 0.00 0.00 46.19 45.98 3mj5 s LEU 291 CO 0.21 -0.06 -0.21 -0.89 -1.32 0.00 0.00 176.35 174.09 3mj5 s THR 292 N 1.05 1.68 -0.03 3.68 2.01 -0.88 -4.97 115.64 118.18 3mj5 s THR 292 Ca -0.09 -1.46 0.07 0.00 0.31 0.00 0.00 61.69 60.52 3mj5 s THR 292 Cb -0.14 -1.51 -0.02 0.00 0.01 0.00 0.00 72.50 70.84 3mj5 s THR 292 CO -0.01 -0.01 -0.24 -0.54 -0.69 0.00 0.00 174.62 173.14 3mj5 s LYS 293 N -1.75 2.01 0.15 4.92 1.02 -1.26 0.43 119.74 125.26 3mj5 s LYS 293 Ca 0.06 -0.85 -0.19 0.00 0.02 0.00 0.00 55.97 55.02 3mj5 s LYS 293 Cb -0.10 -1.89 0.05 0.00 -0.52 0.00 0.00 37.83 35.37 3mj5 s LYS 293 CO 0.04 0.48 0.50 0.00 -0.92 0.00 0.00 175.35 175.44 3mj5 s MET 294 N -0.47 1.21 0.08 1.68 0.23 -0.37 -4.99 119.30 116.65 3mj5 s MET 294 Ca 0.07 -0.66 -0.10 0.00 -1.03 0.00 0.00 55.69 53.97 3mj5 s MET 294 Cb -0.10 0.52 -0.25 0.00 -1.53 0.00 0.00 34.83 33.48 3mj5 s MET 294 CO -0.00 -0.50 1.15 0.77 -2.03 0.00 0.00 175.02 174.41 3mj5 h SER 295 N 2.20 0.71 -5.33 -1.18 0.02 -1.96 0.89 113.55 108.90 3mj5 h SER 295 Ca -0.33 -0.66 -0.14 0.00 -0.84 0.00 0.00 61.79 59.82 3mj5 h SER 295 Cb 1.28 -0.22 -0.14 0.00 0.14 0.00 0.00 62.40 63.45 3mj5 h SER 295 CO 0.42 1.48 -0.56 -1.83 -1.14 0.00 0.00 176.83 175.20 3mj5 s GLU 296 N -2.96 0.91 -0.00 3.45 -1.05 -1.26 -4.03 118.70 113.75 3mj5 s GLU 296 Ca -0.07 -1.29 0.00 0.00 -0.15 0.00 0.00 54.97 53.45 3mj5 s GLU 296 Cb 0.07 0.28 0.01 0.00 -0.44 0.00 0.00 34.13 34.04 3mj5 s GLU 296 CO 0.91 -0.27 0.00 -0.47 0.95 0.00 0.00 175.26 176.38 3mj5 s TYR 297 N -3.99 0.03 -0.13 4.83 6.14 -0.85 -4.99 117.35 118.38 3mj5 s TYR 297 Ca 0.18 0.02 0.02 0.00 0.64 0.00 0.00 57.07 57.93 3mj5 s TYR 297 Cb 0.06 -0.07 0.00 0.00 0.42 0.00 0.00 41.96 42.38 3mj5 s TYR 297 CO -0.02 -0.02 -0.20 0.21 0.64 0.00 0.00 175.55 176.16 3mj5 s LYS 298 N 0.23 3.11 0.06 4.97 2.20 -1.26 -0.01 119.74 129.04 3mj5 s LYS 298 Ca -0.02 -0.82 -0.26 0.00 -0.36 0.00 0.00 55.97 54.51 3mj5 s LYS 298 Cb -0.03 -2.47 0.09 0.00 -1.51 0.00 0.00 37.83 33.92 3mj5 s LYS 298 CO -0.01 0.07 1.19 0.20 -0.36 0.00 0.00 175.35 176.44 3mj5 s GLY 299 N 0.64 -0.08 -1.24 5.54 0.00 0.03 -4.87 107.32 107.33 3mj5 s GLY 299 Ca -0.10 -0.00 -0.19 0.00 0.00 0.00 0.00 44.72 44.42 3mj5 s GLY 299 CO 0.02 3.60 1.68 2.56 0.00 0.00 0.00 173.10 180.96 3mj5 s PRO 300 N -2.17 3.89 0.10 2.90 0.04 -1.25 0.13 135.00 138.64 3mj5 s PRO 300 Ca 0.24 -1.80 -0.23 0.00 0.04 0.00 0.00 61.00 59.25 3mj5 s PRO 300 Cb -0.01 -5.50 -0.07 0.00 0.04 0.00 0.00 34.50 28.97 3mj5 s PRO 300 CO 0.01 -2.27 0.68 0.08 0.04 0.00 0.00 177.00 175.55 3mj5 s VAL 301 N 4.46 4.60 -0.06 -0.36 1.01 -0.95 -0.17 120.40 128.92 3mj5 s VAL 301 Ca 0.52 1.48 0.03 0.00 0.00 0.00 0.00 61.98 64.01 3mj5 s VAL 301 Cb 0.03 -4.03 -0.06 0.00 0.00 0.00 0.00 36.38 32.32 3mj5 s VAL 301 CO 0.04 0.50 -0.02 0.35 0.00 0.00 0.00 175.10 175.98 3mj5 n THR 302 N 1.90 0.40 -4.11 3.92 -2.24 -0.45 -3.38 114.28 110.33 3mj5 n THR 302 Ca -0.07 -0.20 -0.20 0.00 -2.27 0.00 0.00 64.05 61.30 3mj5 n THR 302 Cb 0.50 -0.81 -0.16 0.00 -2.10 0.00 0.00 70.33 67.76 3mj5 n THR 302 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3mj5 s ASP 303 N -4.14 1.03 -0.08 3.42 1.01 -1.10 -0.77 116.67 116.04 3mj5 s ASP 303 Ca -0.06 -0.12 0.04 0.00 0.71 0.00 0.00 52.55 53.12 3mj5 s ASP 303 Cb 0.02 -0.45 0.00 0.00 1.01 0.00 0.00 42.92 43.50 3mj5 s ASP 303 CO 0.20 -0.07 -0.21 -0.69 0.21 0.00 0.00 175.17 174.61 3mj5 s VAL 304 N 1.05 1.79 -0.07 -1.27 1.01 -0.59 -0.96 120.40 121.36 3mj5 s VAL 304 Ca -0.09 -0.88 -0.04 0.00 0.00 0.00 0.00 61.98 60.97 3mj5 s VAL 304 Cb -0.14 -1.56 -0.04 0.00 0.00 0.00 0.00 36.38 34.64 3mj5 s VAL 304 CO -0.01 0.50 0.10 -0.36 0.00 0.00 0.00 175.10 175.34 3mj5 s PHE 305 N 0.32 3.43 0.09 5.22 0.08 0.13 -0.74 117.98 126.50 3mj5 s PHE 305 Ca -0.15 0.36 0.04 0.00 0.12 0.00 0.00 56.93 57.31 3mj5 s PHE 305 Cb -0.16 -1.85 -0.03 0.00 -0.57 0.00 0.00 43.02 40.41 3mj5 s PHE 305 CO 0.06 0.63 -0.12 0.71 -0.10 0.00 0.00 175.22 176.41 3mj5 s TYR 306 N -1.08 1.13 0.22 0.36 1.51 -0.35 -0.66 117.35 118.48 3mj5 s TYR 306 Ca 0.18 -0.57 -0.22 0.00 -1.01 0.00 0.00 57.07 55.45 3mj5 s TYR 306 Cb -0.12 -0.62 -0.08 0.00 -0.11 0.00 0.00 41.96 41.03 3mj5 s TYR 306 CO 0.08 0.03 0.78 0.21 -1.11 0.00 0.00 175.55 175.54 3mj5 s LYS 307 N -2.38 4.41 0.06 -0.62 2.47 -1.26 -1.68 119.74 120.73 3mj5 s LYS 307 Ca 0.03 1.04 -0.10 0.00 -1.56 0.00 0.00 55.97 55.37 3mj5 s LYS 307 Cb -0.06 -2.98 0.01 0.00 -1.46 0.00 0.00 37.83 33.34 3mj5 s LYS 307 CO 0.01 0.43 0.22 -2.00 0.16 0.00 0.00 175.35 174.17 3mj5 s GLU 308 N -1.74 0.76 0.18 4.03 2.56 -1.17 -4.89 118.70 118.44 3mj5 s GLU 308 Ca 0.42 -0.69 0.00 0.00 0.00 0.00 0.00 54.97 54.70 3mj5 s GLU 308 Cb -0.19 0.32 0.00 0.00 2.00 0.00 0.00 34.13 36.26 3mj5 s GLU 308 CO 0.23 -0.23 0.00 0.25 -0.56 0.00 0.00 175.26 174.95 3mj5 n THR 309 N 0.45 0.41 -3.68 -1.70 -2.24 -1.12 -3.96 114.28 102.43 3mj5 n THR 309 Ca -0.18 0.13 -0.11 0.00 -2.27 0.00 0.00 64.05 61.62 3mj5 n THR 309 Cb 0.60 -0.84 -0.12 0.00 -2.10 0.00 0.00 70.33 67.87 3mj5 n THR 309 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3mj5 s SER 310 N -5.21 -0.14 -0.03 3.42 0.15 -1.26 -2.39 113.70 108.23 3mj5 s SER 310 Ca 0.00 0.75 0.03 0.00 0.70 0.00 0.00 55.95 57.42 3mj5 s SER 310 Cb 0.00 0.81 0.00 0.00 -1.71 0.00 0.00 66.02 65.12 3mj5 s SER 310 CO 0.00 -0.21 -0.10 -0.47 1.20 0.00 0.00 173.24 173.66 3mj5 s TYR 311 N 1.96 1.06 -0.14 3.44 5.04 0.33 -4.97 117.35 124.08 3mj5 s TYR 311 Ca -0.04 -0.28 0.02 0.00 -2.44 0.00 0.00 57.07 54.32 3mj5 s TYR 311 Cb -0.11 -0.76 0.01 0.00 0.35 0.00 0.00 41.96 41.46 3mj5 s TYR 311 CO -0.11 -0.12 -0.19 0.99 -1.34 0.00 0.00 175.55 174.78 3mj5 s THR 312 N 0.24 1.87 1.25 4.34 2.01 -1.26 -0.47 115.64 123.62 3mj5 s THR 312 Ca -0.04 -0.86 -0.18 0.00 0.31 0.00 0.00 61.69 60.92 3mj5 s THR 312 Cb -0.10 -1.68 0.27 0.00 0.01 0.00 0.00 72.50 71.01 3mj5 s THR 312 CO 0.01 0.51 0.64 1.07 -0.69 0.00 0.00 174.62 176.16 3mj5 n THR 313 N 4.21 0.00 -0.17 -0.82 5.66 0.38 -4.91 114.28 118.62 3mj5 n THR 313 Ca -0.20 -0.21 0.00 0.00 -3.05 0.00 0.00 64.05 60.60 3mj5 n THR 313 Cb 0.51 -0.83 0.00 0.00 -1.55 0.00 0.00 70.33 68.47 3mj5 n THR 313 CO 0.00 0.00 0.00 1.07 -3.05 0.00 0.00 175.07 173.09 3mj5 n THR 314 N -5.10 0.86 -3.86 1.09 5.66 -1.26 -5.03 114.28 106.64 3mj5 n THR 314 Ca 0.06 -0.87 -0.32 0.00 -3.05 0.00 0.00 64.05 59.87 3mj5 n THR 314 Cb 0.54 0.56 -0.04 0.00 -1.55 0.00 0.00 70.33 69.84 3mj5 n THR 314 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 175.07 171.39 3mj5 s ILE 315 N -0.88 5.36 0.00 1.09 1.01 -1.26 -5.27 121.20 121.25 3mj5 s ILE 315 Ca 0.01 -0.20 0.00 0.00 0.00 0.00 0.00 60.65 60.46 3mj5 s ILE 315 Cb 0.00 -3.60 0.00 0.00 0.01 0.00 0.00 42.46 38.88 3mj5 s ILE 315 CO 0.00 0.20 0.44 1.17 0.00 0.00 0.00 174.94 176.76