#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2igk s ASP 44 N 0.00 0.44 0.00 6.12 1.01 -1.26 -5.01 116.67 117.97 2igk s ASP 44 Ca 0.00 1.19 0.03 0.00 0.71 0.00 0.00 52.55 54.48 2igk s ASP 44 Cb 0.00 -1.81 0.05 0.00 1.01 0.00 0.00 42.92 42.17 2igk s ASP 44 CO 0.00 -4.49 0.87 2.30 0.21 0.00 0.00 175.17 174.06 2igk n ILE 45 N -5.08 0.59 -4.27 0.77 -6.64 -1.26 -5.00 119.36 98.46 2igk n ILE 45 Ca 0.06 -0.79 -0.27 0.00 -1.77 0.00 0.00 62.75 59.99 2igk n ILE 45 Cb 0.57 0.73 -0.17 0.00 -1.44 0.00 0.00 39.64 39.33 2igk n ILE 45 CO 0.00 0.00 0.00 -0.75 -1.77 0.00 0.00 176.55 174.03 2igk s LYS 46 N -0.68 1.79 0.19 6.28 2.47 -1.26 0.17 119.74 128.71 2igk s LYS 46 Ca 0.05 -0.40 0.02 0.00 -1.56 0.00 0.00 55.97 54.08 2igk s LYS 46 Cb 0.03 -1.62 -0.05 0.00 -1.46 0.00 0.00 37.83 34.73 2igk s LYS 46 CO 0.04 -0.12 -0.00 0.71 0.16 0.00 0.00 175.35 176.14 2igk s TYR 47 N 1.16 1.33 0.06 4.03 1.51 -0.30 -5.00 117.35 120.14 2igk s TYR 47 Ca -0.05 -0.98 -0.17 0.00 -1.01 0.00 0.00 57.07 54.87 2igk s TYR 47 Cb -0.14 -0.76 -0.17 0.00 -0.11 0.00 0.00 41.96 40.78 2igk s TYR 47 CO -0.03 -0.14 1.25 -0.44 -1.11 0.00 0.00 175.55 175.08 2igk h ASP 48 N 2.63 0.69 -3.68 2.29 3.32 -1.00 -3.11 116.42 117.55 2igk h ASP 48 Ca -0.37 -0.64 -0.32 0.00 0.02 0.00 0.00 57.03 55.72 2igk h ASP 48 Cb 1.21 -0.20 -0.31 0.00 0.22 0.00 0.00 39.33 40.25 2igk h ASP 48 CO 0.63 1.21 -0.75 -0.69 -1.72 0.00 0.00 179.24 177.93 2igk s VAL 49 N -3.71 0.25 -0.04 -1.35 1.01 -0.85 -0.92 120.40 114.79 2igk s VAL 49 Ca -0.12 -0.05 0.06 0.00 0.00 0.00 0.00 61.98 61.87 2igk s VAL 49 Cb 0.06 -0.27 -0.02 0.00 0.00 0.00 0.00 36.38 36.15 2igk s VAL 49 CO 0.84 0.11 -0.23 0.68 0.00 0.00 0.00 175.10 176.51 2igk s VAL 50 N 0.42 2.29 -0.13 2.92 -7.23 -0.37 -1.32 120.40 116.99 2igk s VAL 50 Ca -0.04 -1.01 0.02 0.00 -1.81 0.00 0.00 61.98 59.14 2igk s VAL 50 Cb -0.07 -1.83 0.01 0.00 0.56 0.00 0.00 36.38 35.05 2igk s VAL 50 CO -0.01 0.58 -0.18 -0.63 -0.31 0.00 0.00 175.10 174.55 2igk s ILE 51 N -0.50 1.78 -0.40 -0.62 1.01 -0.03 -0.89 121.20 121.54 2igk s ILE 51 Ca 0.06 -0.81 -0.19 0.00 0.00 0.00 0.00 60.65 59.72 2igk s ILE 51 Cb -0.11 -1.59 0.01 0.00 0.01 0.00 0.00 42.46 40.78 2igk s ILE 51 CO 0.01 0.49 0.54 -0.69 0.00 0.00 0.00 174.94 175.29 2igk s VAL 52 N 0.93 4.97 0.00 2.92 1.01 -0.18 -0.95 120.40 129.10 2igk s VAL 52 Ca -0.06 0.05 0.00 0.00 0.00 0.00 0.00 61.98 61.97 2igk s VAL 52 Cb -0.15 -4.08 0.00 0.00 0.00 0.00 0.00 36.38 32.15 2igk s VAL 52 CO -0.02 -0.42 0.00 0.61 0.00 0.00 0.00 175.10 175.27 2igk n GLY 53 N 4.98 2.44 1.05 4.51 0.00 0.83 -0.31 105.19 118.69 2igk n GLY 53 Ca -0.04 -1.47 -0.01 0.00 0.00 0.00 0.00 46.02 44.50 2igk n GLY 53 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2igk n SER 54 N 0.00 2.78 -2.97 1.61 3.41 -1.26 -4.32 113.62 112.86 2igk n SER 54 Ca 0.00 -3.58 -0.13 0.00 -0.26 0.00 0.00 58.87 54.90 2igk n SER 54 Cb 0.00 -0.61 0.11 0.00 -0.26 0.00 0.00 64.21 63.45 2igk n SER 54 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2igk n GLY 55 N -1.00 -2.76 0.24 5.00 0.00 -1.26 -2.28 105.19 103.13 2igk n GLY 55 Ca 0.30 -1.44 0.11 0.00 0.00 0.00 0.00 46.02 44.99 2igk n GLY 55 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2igk h PRO 56 N 0.00 0.00 0.09 1.61 0.13 -1.92 0.58 132.00 132.48 2igk h PRO 56 Ca -0.18 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 64.73 2igk h PRO 56 Cb 0.54 0.00 0.02 0.00 0.13 0.00 0.00 31.00 31.69 2igk h PRO 56 CO 0.11 0.18 -0.95 0.82 -0.23 0.00 0.00 178.00 177.94 2igk h ILE 57 N 0.00 1.38 -0.98 -3.56 1.08 -1.91 -1.85 117.51 111.67 2igk h ILE 57 Ca -0.00 -2.36 0.06 0.00 -0.39 0.00 0.00 64.86 62.16 2igk h ILE 57 Cb 0.50 2.80 -0.06 0.00 -3.07 0.00 0.00 36.82 36.98 2igk h ILE 57 CO 0.02 0.70 0.64 1.23 -0.69 0.00 0.00 178.15 180.05 2igk h GLY 58 N -0.00 1.47 2.00 5.37 0.00 -1.69 -1.97 103.07 108.24 2igk h GLY 58 Ca -0.14 -0.47 -0.04 0.00 0.00 0.00 0.00 47.33 46.68 2igk h GLY 58 CO 0.18 0.35 -0.19 0.00 0.00 0.00 0.00 176.54 176.88 2igk h THR 60 N 0.00 1.26 -0.87 0.00 2.02 -0.57 0.73 112.91 115.48 2igk h THR 60 Ca -0.00 -0.82 0.03 0.00 0.77 0.00 0.00 66.41 66.38 2igk h THR 60 Cb 0.57 1.59 -0.05 0.00 -1.74 0.00 0.00 68.15 68.51 2igk h THR 60 CO 0.02 0.24 0.56 1.88 0.37 0.00 0.00 175.52 178.59 2igk h TYR 61 N -0.08 1.06 -0.10 3.16 0.05 -1.15 -1.78 116.97 118.13 2igk h TYR 61 Ca 0.03 0.03 -0.01 0.00 0.05 0.00 0.00 58.73 58.83 2igk h TYR 61 Cb 0.37 -0.35 -0.00 0.00 1.01 0.00 0.00 36.73 37.75 2igk h TYR 61 CO 0.04 0.62 0.03 0.00 -1.05 0.00 0.00 178.16 177.79 2igk h ALA 62 N 1.35 0.14 -0.44 3.88 0.00 -0.97 -0.04 119.26 123.18 2igk h ALA 62 Ca 0.34 -0.12 0.04 0.00 0.00 0.00 0.00 54.91 55.16 2igk h ALA 62 Cb -0.02 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 2igk h ALA 62 CO -0.11 -0.24 0.22 -0.09 0.00 0.00 0.00 179.25 179.03 2igk h ARG 63 N -0.03 0.43 -0.28 0.00 2.43 -0.64 0.25 114.38 116.55 2igk h ARG 63 Ca 0.03 -0.03 -0.05 0.00 -0.81 0.00 0.00 59.98 59.13 2igk h ARG 63 Cb 0.23 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.67 2igk h ARG 63 CO -0.00 0.28 -0.03 0.93 -1.51 0.00 0.00 179.97 179.65 2igk h GLU 64 N 0.44 0.51 0.16 0.20 4.39 -1.16 -2.42 114.58 116.70 2igk h GLU 64 Ca 0.19 -0.17 -0.35 0.00 0.34 0.00 0.00 59.36 59.37 2igk h GLU 64 Cb 0.10 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.71 2igk h GLU 64 CO -0.13 0.68 -1.75 -0.07 -1.16 0.00 0.00 179.01 176.58 2igk h LEU 65 N 0.28 0.54 -0.56 1.33 3.38 -0.86 -2.61 115.31 116.81 2igk h LEU 65 Ca 0.07 -0.85 0.02 0.00 0.09 0.00 0.00 57.88 57.22 2igk h LEU 65 Cb 0.47 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 2igk h LEU 65 CO 0.02 1.72 0.35 0.58 0.09 0.00 0.00 178.44 181.20 2igk h VAL 66 N 0.09 1.08 -0.13 1.22 2.07 -1.08 -1.52 116.25 117.99 2igk h VAL 66 Ca -0.34 -0.24 -0.02 0.00 0.82 0.00 0.00 66.70 66.93 2igk h VAL 66 Cb 2.08 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 32.16 2igk h VAL 66 CO 0.16 0.13 0.00 1.23 0.02 0.00 0.00 177.57 179.11 2igk h GLY 67 N 0.70 0.19 -1.54 2.17 0.00 -1.46 -1.56 103.07 101.56 2igk h GLY 67 Ca 0.22 -0.09 0.00 0.00 0.00 0.00 0.00 47.33 47.47 2igk h GLY 67 CO -0.09 0.08 0.00 0.00 0.00 0.00 0.00 176.54 176.54 2igk n ALA 68 N -2.51 2.44 -0.32 3.60 0.00 -0.84 -4.91 120.51 117.97 2igk n ALA 68 Ca -0.01 -0.75 0.00 0.00 0.00 0.00 0.00 53.44 52.68 2igk n ALA 68 Cb 0.15 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 18.62 2igk n ALA 68 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2igk n GLY 69 N 1.20 0.82 3.80 0.00 0.00 -0.59 -4.92 105.19 105.49 2igk n GLY 69 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.82 2igk n GLY 69 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2igk s TYR 70 N -2.08 3.37 -0.52 1.61 1.51 -0.63 -4.65 117.35 115.95 2igk s TYR 70 Ca 0.00 1.67 -0.27 0.00 -1.01 0.00 0.00 57.07 57.46 2igk s TYR 70 Cb 0.00 -2.97 0.03 0.00 -0.11 0.00 0.00 41.96 38.91 2igk s TYR 70 CO 0.00 -0.24 1.04 0.21 -1.11 0.00 0.00 175.55 175.45 2igk s LYS 71 N -2.67 3.51 -0.10 -0.62 2.20 -1.26 -4.37 119.74 116.43 2igk s LYS 71 Ca 0.58 0.15 0.01 0.00 -0.36 0.00 0.00 55.97 56.35 2igk s LYS 71 Cb -0.16 -3.98 -0.02 0.00 -1.51 0.00 0.00 37.83 32.16 2igk s LYS 71 CO 0.21 -1.45 -0.13 0.08 -0.36 0.00 0.00 175.35 173.71 2igk s VAL 72 N 4.27 3.15 -0.03 4.02 1.01 -0.80 -0.35 120.40 131.67 2igk s VAL 72 Ca 0.39 -0.66 0.02 0.00 0.00 0.00 0.00 61.98 61.73 2igk s VAL 72 Cb -0.09 -2.29 -0.03 0.00 0.00 0.00 0.00 36.38 33.97 2igk s VAL 72 CO 0.25 0.55 -0.07 0.00 0.00 0.00 0.00 175.10 175.84 2igk s ALA 73 N -0.14 3.00 -0.04 5.51 0.00 -0.43 -1.72 121.76 127.93 2igk s ALA 73 Ca -0.00 -0.96 0.04 0.00 0.00 0.00 0.00 51.96 51.04 2igk s ALA 73 Cb -0.13 -1.18 -0.00 0.00 0.00 0.00 0.00 23.12 21.81 2igk s ALA 73 CO 0.03 0.59 -0.15 1.41 0.00 0.00 0.00 175.76 177.64 2igk s MET 74 N -1.11 1.58 0.01 0.00 1.75 0.31 -0.85 119.30 121.00 2igk s MET 74 Ca 0.15 -0.54 0.07 0.00 -1.25 0.00 0.00 55.69 54.12 2igk s MET 74 Cb -0.11 -1.40 -0.03 0.00 2.84 0.00 0.00 34.83 36.14 2igk s MET 74 CO 0.04 0.22 -0.21 -0.06 -0.65 0.00 0.00 175.02 174.36 2igk s PHE 75 N 0.07 2.47 -0.01 4.11 0.08 -0.12 -0.29 117.98 124.28 2igk s PHE 75 Ca -0.03 -0.32 0.00 0.00 0.12 0.00 0.00 56.93 56.69 2igk s PHE 75 Cb -0.11 -1.48 0.01 0.00 -0.57 0.00 0.00 43.02 40.87 2igk s PHE 75 CO 0.02 0.14 0.00 0.34 -0.10 0.00 0.00 175.22 175.62 2igk s ASP 76 N -1.08 0.10 0.47 1.36 -1.08 -0.78 -0.12 116.67 115.55 2igk s ASP 76 Ca 0.12 -0.00 0.26 0.00 -0.52 0.00 0.00 52.55 52.41 2igk s ASP 76 Cb -0.10 -0.04 1.04 0.00 -1.46 0.00 0.00 42.92 42.37 2igk s ASP 76 CO 0.02 -0.03 1.87 -0.29 0.52 0.00 0.00 175.17 177.27 2igk h ILE 77 N 5.44 0.42 -4.40 4.11 2.10 -1.80 0.14 117.51 123.54 2igk h ILE 77 Ca -0.30 -0.95 -0.19 0.00 1.08 0.00 0.00 64.86 64.50 2igk h ILE 77 Cb 1.18 1.69 0.03 0.00 -1.09 0.00 0.00 36.82 38.63 2igk h ILE 77 CO 0.50 0.16 0.03 0.61 -1.08 0.00 0.00 178.15 178.37 2igk n GLY 78 N 0.09 1.02 3.44 8.18 0.00 -1.26 -3.83 105.19 112.82 2igk n GLY 78 Ca 0.00 -2.03 -0.21 0.00 0.00 0.00 0.00 46.02 43.78 2igk n GLY 78 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2igk s GLU 79 N -3.39 1.59 -0.11 1.61 2.02 -1.26 -0.54 118.70 118.62 2igk s GLU 79 Ca 0.27 -1.84 -0.30 0.00 0.02 0.00 0.00 54.97 53.12 2igk s GLU 79 Cb -0.02 -1.02 -0.02 0.00 0.10 0.00 0.00 34.13 33.17 2igk s GLU 79 CO 0.17 -0.06 1.16 0.42 0.02 0.00 0.00 175.26 176.97 2igk s ILE 80 N -3.14 4.40 -0.40 -1.63 1.01 -1.26 -1.75 121.20 118.43 2igk s ILE 80 Ca 0.32 1.71 0.08 0.00 0.00 0.00 0.00 60.65 62.76 2igk s ILE 80 Cb 0.06 -4.10 0.34 0.00 0.01 0.00 0.00 42.46 38.78 2igk s ILE 80 CO 0.13 -0.05 1.30 -0.90 0.00 0.00 0.00 174.94 175.42 2igk n ASP 81 N 5.61 -1.86 -0.07 3.58 5.75 -1.26 -4.94 116.55 123.37 2igk n ASP 81 Ca 0.11 -2.49 0.08 0.00 -0.01 0.00 0.00 54.79 52.49 2igk n ASP 81 Cb 0.46 1.12 0.12 0.00 -1.03 0.00 0.00 41.12 41.79 2igk n ASP 81 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 2igk n SER 82 N -0.47 2.24 0.00 -1.12 7.64 -1.26 -5.00 113.62 115.64 2igk n SER 82 Ca -0.05 -2.90 0.00 0.00 1.01 0.00 0.00 58.87 56.93 2igk n SER 82 Cb 0.81 -0.36 0.00 0.00 -1.01 0.00 0.00 64.21 63.65 2igk n SER 82 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2igk n GLY 83 N -1.26 -1.72 0.23 0.23 0.00 -1.26 -4.48 105.19 96.92 2igk n GLY 83 Ca 0.13 -1.65 0.13 0.00 0.00 0.00 0.00 46.02 44.63 2igk n GLY 83 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2igk h LEU 84 N 0.00 0.00 -8.47 0.99 3.38 -2.02 -3.38 115.31 105.81 2igk h LEU 84 Ca 0.00 0.00 -0.58 0.00 0.09 0.00 0.00 57.88 57.39 2igk h LEU 84 Cb 0.00 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 40.65 2igk h LEU 84 CO 0.00 0.01 0.77 -0.54 0.09 0.00 0.00 178.44 178.78 2igk s LYS 85 N -3.27 3.34 0.15 1.13 1.02 -1.26 -4.99 119.74 115.85 2igk s LYS 85 Ca 0.06 -0.16 -0.31 0.00 0.02 0.00 0.00 55.97 55.58 2igk s LYS 85 Cb 0.06 -4.08 -0.08 0.00 -0.52 0.00 0.00 37.83 33.20 2igk s LYS 85 CO 0.65 -1.69 1.36 0.42 -0.92 0.00 0.00 175.35 175.17 2igk s ILE 86 N 4.57 3.26 -0.66 2.17 1.01 -1.26 -2.49 121.20 127.80 2igk s ILE 86 Ca 0.34 0.95 0.00 0.00 0.00 0.00 0.00 60.65 61.94 2igk s ILE 86 Cb -0.11 -3.61 0.00 0.00 0.01 0.00 0.00 42.46 38.76 2igk s ILE 86 CO 0.19 0.10 0.00 0.61 0.00 0.00 0.00 174.94 175.84 2igk n GLY 87 N 3.05 0.85 3.92 6.18 0.00 -1.26 -4.29 105.19 113.64 2igk n GLY 87 Ca 0.09 -0.61 -0.27 0.00 0.00 0.00 0.00 46.02 45.23 2igk n GLY 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2igk s ALA 88 N -2.18 2.99 -0.03 4.61 0.00 -1.04 -2.87 121.76 123.25 2igk s ALA 88 Ca 0.00 -0.79 -0.30 0.00 0.00 0.00 0.00 51.96 50.87 2igk s ALA 88 Cb 0.00 -2.74 -0.05 0.00 0.00 0.00 0.00 23.12 20.33 2igk s ALA 88 CO 0.00 -1.38 1.48 -1.58 0.00 0.00 0.00 175.76 174.28 2igk s HIS 89 N -3.34 2.57 -0.19 0.00 2.46 -1.26 -4.55 115.29 110.97 2igk s HIS 89 Ca 0.60 0.62 0.28 0.00 0.47 0.00 0.00 55.06 57.03 2igk s HIS 89 Cb -0.11 -3.75 1.23 0.00 -0.13 0.00 0.00 32.58 29.82 2igk s HIS 89 CO 0.46 -2.89 1.83 0.87 -2.47 0.00 0.00 174.74 172.54 2igk h LYS 90 N 8.39 0.00 -0.08 2.88 1.57 -1.46 -2.39 116.57 125.49 2igk h LYS 90 Ca -0.37 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.41 2igk h LYS 90 Cb 1.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.48 2igk h LYS 90 CO 0.93 0.00 0.00 0.36 -0.57 0.00 0.00 179.45 180.17 2igk n LYS 91 N -2.55 1.39 -0.84 3.15 2.85 -1.26 -4.17 118.16 116.73 2igk n LYS 91 Ca 0.01 -0.58 -0.16 0.00 -1.05 0.00 0.00 58.31 56.53 2igk n LYS 91 Cb 0.21 -1.36 0.05 0.00 -0.65 0.00 0.00 35.03 33.28 2igk n LYS 91 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 2igk n ASN 92 N -0.21 5.96 -4.77 -5.58 3.02 -0.90 -4.32 115.26 108.46 2igk n ASN 92 Ca 0.16 -3.01 -0.28 0.00 -0.03 0.00 0.00 54.58 51.41 2igk n ASN 92 Cb 0.21 -0.99 -0.06 0.00 -0.61 0.00 0.00 39.78 38.33 2igk n ASN 92 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2igk s THR 93 N -2.17 4.41 0.28 3.41 -4.23 -1.26 -5.02 115.64 111.07 2igk s THR 93 Ca 0.30 -0.97 -0.02 0.00 -1.18 0.00 0.00 61.69 59.83 2igk s THR 93 Cb 0.24 -3.19 0.27 0.00 1.34 0.00 0.00 72.50 71.17 2igk s THR 93 CO 0.00 0.01 1.91 0.58 -0.54 0.00 0.00 174.62 176.59 2igk h VAL 94 N 2.36 1.12 -0.89 2.29 2.07 -1.98 -1.92 116.25 119.31 2igk h VAL 94 Ca -0.47 -0.39 0.06 0.00 0.82 0.00 0.00 66.70 66.72 2igk h VAL 94 Cb 1.18 -0.11 -0.06 0.00 -1.52 0.00 0.00 31.29 30.78 2igk h VAL 94 CO 0.64 0.21 0.56 -0.08 0.02 0.00 0.00 177.57 178.91 2igk h GLU 95 N 1.14 0.99 0.00 1.57 4.57 -1.95 -1.29 114.58 119.61 2igk h GLU 95 Ca 0.39 -0.06 -0.09 0.00 -1.18 0.00 0.00 59.36 58.41 2igk h GLU 95 Cb 0.09 -0.22 -0.01 0.00 -0.16 0.00 0.00 28.75 28.44 2igk h GLU 95 CO -0.13 0.66 -0.49 1.88 -1.18 0.00 0.00 179.01 179.74 2igk h TYR 96 N 1.02 0.00 0.00 0.92 0.05 -1.65 -1.75 116.97 115.56 2igk h TYR 96 Ca 0.38 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.16 2igk h TYR 96 Cb 0.15 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.89 2igk h TYR 96 CO -0.03 0.44 0.00 1.96 -1.05 0.00 0.00 178.16 179.49 2igk h GLN 97 N 0.00 0.00 0.00 4.88 4.20 -0.97 -2.92 115.11 120.30 2igk h GLN 97 Ca -0.01 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.61 2igk h GLN 97 Cb 1.35 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.11 2igk h GLN 97 CO 0.06 0.00 -0.82 0.87 -0.67 0.00 0.00 178.83 178.27 2igk h LYS 98 N 0.00 0.00 -2.08 1.46 1.57 -1.09 -3.40 116.57 113.03 2igk h LYS 98 Ca 0.00 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 58.22 2igk h LYS 98 Cb 0.96 0.00 -0.40 0.00 0.08 0.00 0.00 32.23 32.87 2igk h LYS 98 CO 0.00 0.26 -0.92 0.09 -0.57 0.00 0.00 179.45 178.31 2igk n ASN 99 N -3.00 1.75 0.02 0.86 3.02 -0.67 -4.99 115.26 112.25 2igk n ASN 99 Ca -0.02 -3.06 0.01 0.00 -0.03 0.00 0.00 54.58 51.48 2igk n ASN 99 Cb 0.70 -0.64 0.33 0.00 -0.61 0.00 0.00 39.78 39.57 2igk n ASN 99 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 2igk h ILE 100 N 2.29 1.18 0.00 2.41 -0.00 -1.74 -2.71 117.51 118.94 2igk h ILE 100 Ca 0.12 -0.70 -0.01 0.00 -0.00 0.00 0.00 64.86 64.26 2igk h ILE 100 Cb 0.79 0.94 -0.00 0.00 -0.00 0.00 0.00 36.82 38.55 2igk h ILE 100 CO 0.61 0.24 -0.07 0.44 -0.00 0.00 0.00 178.15 179.38 2igk h ASP 101 N 0.46 0.00 0.48 2.19 3.32 -1.86 -0.39 116.42 120.61 2igk h ASP 101 Ca 0.10 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.15 2igk h ASP 101 Cb 0.29 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.84 2igk h ASP 101 CO 0.01 0.07 -0.02 0.11 -1.72 0.00 0.00 179.24 177.69 2igk h LYS 102 N 0.00 0.00 0.00 3.56 1.79 -1.79 -3.11 116.57 117.02 2igk h LYS 102 Ca -0.00 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.44 2igk h LYS 102 Cb 0.23 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.88 2igk h LYS 102 CO 0.01 0.02 -0.15 0.35 -1.08 0.00 0.00 179.45 178.59 2igk h PHE 103 N 0.00 0.00 -0.88 -1.35 3.57 -1.23 -2.61 116.94 114.45 2igk h PHE 103 Ca -0.00 0.00 0.21 0.00 3.53 0.00 0.00 57.97 61.71 2igk h PHE 103 Cb 0.26 0.00 -0.06 0.00 2.79 0.00 0.00 35.95 38.94 2igk h PHE 103 CO 0.00 0.15 0.59 -0.24 -2.23 0.00 0.00 178.31 176.58 2igk h VAL 104 N 0.00 0.67 -0.20 1.41 3.04 -1.74 -1.24 116.25 118.19 2igk h VAL 104 Ca -0.00 -0.12 -0.12 0.00 -1.01 0.00 0.00 66.70 65.45 2igk h VAL 104 Cb 0.42 0.30 -0.01 0.00 -2.01 0.00 0.00 31.29 29.99 2igk h VAL 104 CO 0.02 0.06 -0.40 0.78 -1.01 0.00 0.00 177.57 177.02 2igk h ASN 105 N 0.34 0.48 -0.26 3.17 4.21 -1.71 -0.77 115.58 121.04 2igk h ASN 105 Ca 0.45 -0.21 -0.02 0.00 1.21 0.00 0.00 56.30 57.74 2igk h ASN 105 Cb 1.22 -0.13 -0.01 0.00 -1.12 0.00 0.00 38.32 38.27 2igk h ASN 105 CO -0.15 0.83 0.10 0.58 -1.29 0.00 0.00 177.43 177.50 2igk h VAL 106 N 0.38 1.18 0.11 2.81 2.07 -1.38 -1.04 116.25 120.38 2igk h VAL 106 Ca 0.03 -0.54 0.01 0.00 0.82 0.00 0.00 66.70 67.03 2igk h VAL 106 Cb 0.87 1.05 -0.03 0.00 -1.52 0.00 0.00 31.29 31.67 2igk h VAL 106 CO 0.07 0.18 -0.20 0.40 0.02 0.00 0.00 177.57 178.05 2igk h ILE 107 N 0.26 0.56 -0.76 4.57 2.04 -1.17 -2.91 117.51 120.10 2igk h ILE 107 Ca 0.09 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.96 2igk h ILE 107 Cb 0.19 0.56 -0.04 0.00 -0.74 0.00 0.00 36.82 36.79 2igk h ILE 107 CO -0.01 0.00 0.50 1.56 0.00 0.00 0.00 178.15 180.21 2igk h GLN 108 N -0.37 0.98 0.00 2.37 4.20 -1.03 -1.42 115.11 119.83 2igk h GLN 108 Ca 0.03 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.68 2igk h GLN 108 Cb 0.39 -0.22 0.00 0.00 0.30 0.00 0.00 27.48 27.95 2igk h GLN 108 CO -0.11 0.65 0.00 0.78 -0.67 0.00 0.00 178.83 179.48 2igk h GLY 109 N 1.00 0.00 -1.43 3.46 0.00 -0.99 -2.96 103.07 102.16 2igk h GLY 109 Ca 0.28 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.56 2igk h GLY 109 CO -0.07 0.00 -0.58 0.61 0.00 0.00 0.00 176.54 176.51 2igk n GLN 110 N -2.97 0.83 -3.90 4.80 10.64 -0.55 -4.95 117.38 121.27 2igk n GLN 110 Ca -0.03 -2.46 -0.35 0.00 -1.83 0.00 0.00 57.00 52.33 2igk n GLN 110 Cb 0.08 -0.95 -0.14 0.00 -0.86 0.00 0.00 30.24 28.37 2igk n GLN 110 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 2igk s LEU 111 N -1.74 3.23 -0.21 2.61 1.43 -1.09 -3.91 118.68 119.00 2igk s LEU 111 Ca 0.30 -0.67 -0.05 0.00 -1.03 0.00 0.00 54.13 52.69 2igk s LEU 111 Cb 0.31 -1.74 -0.02 0.00 0.03 0.00 0.00 46.19 44.77 2igk s LEU 111 CO -0.07 -0.10 -0.02 -0.04 0.23 0.00 0.00 176.35 176.35 2igk s MET 112 N 1.42 3.50 0.26 1.70 -1.94 -0.17 -4.89 119.30 119.18 2igk s MET 112 Ca 0.03 -0.57 -0.30 0.00 -1.71 0.00 0.00 55.69 53.13 2igk s MET 112 Cb -0.16 -3.06 -0.14 0.00 2.01 0.00 0.00 34.83 33.49 2igk s MET 112 CO -0.03 -0.10 1.29 0.43 -0.01 0.00 0.00 175.02 176.60 2igk n SER 113 N 4.56 2.34 -0.03 3.03 7.64 -1.26 -1.08 113.62 128.82 2igk n SER 113 Ca -0.18 1.16 -0.14 0.00 1.01 0.00 0.00 58.87 60.72 2igk n SER 113 Cb 0.51 -1.39 -0.11 0.00 -1.01 0.00 0.00 64.21 62.22 2igk n SER 113 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 2igk h VAL 114 N 2.71 1.51 -2.60 0.44 2.07 -1.55 -3.45 116.25 115.38 2igk h VAL 114 Ca -0.44 -1.75 -0.28 0.00 0.82 0.00 0.00 66.70 65.05 2igk h VAL 114 Cb 1.30 2.59 -0.34 0.00 -1.52 0.00 0.00 31.29 33.31 2igk h VAL 114 CO 0.69 0.48 -0.59 -0.55 0.02 0.00 0.00 177.57 177.62 2igk s SER 115 N -6.18 0.98 -0.21 0.57 0.15 -1.26 -4.66 113.70 103.09 2igk s SER 115 Ca -0.16 0.06 -0.04 0.00 0.70 0.00 0.00 55.95 56.52 2igk s SER 115 Cb 0.01 0.51 -0.01 0.00 -1.71 0.00 0.00 66.02 64.82 2igk s SER 115 CO 0.73 -0.30 -0.04 -0.69 1.20 0.00 0.00 173.24 174.14 2igk s VAL 116 N 2.36 3.43 0.81 4.45 1.01 -1.26 -4.77 120.40 126.45 2igk s VAL 116 Ca 0.06 -0.48 -0.11 0.00 0.00 0.00 0.00 61.98 61.44 2igk s VAL 116 Cb -0.14 -2.55 0.08 0.00 0.00 0.00 0.00 36.38 33.77 2igk s VAL 116 CO -0.11 0.43 1.09 -2.16 0.00 0.00 0.00 175.10 174.35 2igk s PRO 117 N 1.30 1.93 0.29 2.72 0.04 -1.26 0.83 135.00 140.84 2igk s PRO 117 Ca 0.04 0.82 -0.30 0.00 0.04 0.00 0.00 61.00 61.59 2igk s PRO 117 Cb -0.14 -1.89 -0.11 0.00 0.04 0.00 0.00 34.50 32.40 2igk s PRO 117 CO -0.02 -1.77 1.54 0.08 0.04 0.00 0.00 177.00 176.87 2igk s VAL 118 N -3.03 2.25 -0.02 -0.36 1.01 -1.25 -4.60 120.40 114.39 2igk s VAL 118 Ca 0.61 0.21 -0.29 0.00 0.00 0.00 0.00 61.98 62.52 2igk s VAL 118 Cb -0.16 -3.14 -0.03 0.00 0.00 0.00 0.00 36.38 33.06 2igk s VAL 118 CO 0.55 0.04 0.93 0.21 0.00 0.00 0.00 175.10 176.83 2igk s ASN 119 N 0.40 7.28 -0.11 3.32 3.84 -1.26 -4.96 114.94 123.46 2igk s ASN 119 Ca 0.61 1.56 0.15 0.00 0.21 0.00 0.00 52.86 55.39 2igk s ASN 119 Cb -0.46 -2.54 0.24 0.00 -0.55 0.00 0.00 41.25 37.94 2igk s ASN 119 CO 0.48 -0.25 1.12 0.35 -2.79 0.00 0.00 177.10 176.00 2igk n THR 120 N 3.95 1.52 -2.10 -5.21 -2.24 -1.26 -4.84 114.28 104.10 2igk n THR 120 Ca 0.05 -1.85 -0.41 0.00 -2.27 0.00 0.00 64.05 59.57 2igk n THR 120 Cb 0.51 -0.09 -0.02 0.00 -2.10 0.00 0.00 70.33 68.63 2igk n THR 120 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2igk s LEU 121 N -2.31 4.41 -0.26 3.22 1.43 -1.26 -4.99 118.68 118.92 2igk s LEU 121 Ca 0.26 2.61 -0.14 0.00 -1.03 0.00 0.00 54.13 55.83 2igk s LEU 121 Cb 0.23 -3.63 -0.04 0.00 0.03 0.00 0.00 46.19 42.78 2igk s LEU 121 CO 0.02 -0.60 0.33 -0.69 0.23 0.00 0.00 176.35 175.64 2igk s VAL 122 N -0.38 5.21 -0.40 -1.59 1.01 -1.26 -5.02 120.40 117.97 2igk s VAL 122 Ca 0.55 0.50 -0.07 0.00 0.00 0.00 0.00 61.98 62.96 2igk s VAL 122 Cb -0.40 -3.66 0.08 0.00 0.00 0.00 0.00 36.38 32.40 2igk s VAL 122 CO 0.45 0.19 0.20 -0.69 0.00 0.00 0.00 175.10 175.26 2igk s VAL 123 N 1.87 3.82 -0.16 2.92 1.01 -1.26 -4.93 120.40 123.67 2igk s VAL 123 Ca 0.14 -1.53 0.17 0.00 0.00 0.00 0.00 61.98 60.76 2igk s VAL 123 Cb -0.16 -3.37 0.35 0.00 0.00 0.00 0.00 36.38 33.21 2igk s VAL 123 CO 0.10 -0.47 1.24 -0.90 0.00 0.00 0.00 175.10 175.06 2igk n ASP 124 N 4.80 2.86 -0.87 3.32 5.68 -1.26 -4.47 116.55 126.61 2igk n ASP 124 Ca -0.09 -2.97 0.02 0.00 -0.50 0.00 0.00 54.79 51.25 2igk n ASP 124 Cb 0.43 -0.44 0.21 0.00 -1.14 0.00 0.00 41.12 40.18 2igk n ASP 124 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 2igk n THR 125 N -1.02 2.35 -1.66 2.12 -2.24 -1.26 -5.02 114.28 107.56 2igk n THR 125 Ca 0.17 -2.54 -0.34 0.00 -2.27 0.00 0.00 64.05 59.06 2igk n THR 125 Cb 0.70 -0.28 0.07 0.00 -2.10 0.00 0.00 70.33 68.71 2igk n THR 125 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2igk s LEU 126 N -3.10 3.40 0.48 3.22 1.43 -1.26 -5.00 118.68 117.86 2igk s LEU 126 Ca 0.41 2.22 -0.24 0.00 -1.03 0.00 0.00 54.13 55.49 2igk s LEU 126 Cb 0.37 -4.58 -0.07 0.00 0.03 0.00 0.00 46.19 41.94 2igk s LEU 126 CO 0.01 -1.91 1.42 -0.55 0.23 0.00 0.00 176.35 175.56 2igk s SER 127 N -2.16 5.64 0.58 2.29 0.15 -1.26 -4.89 113.70 114.05 2igk s SER 127 Ca 0.72 2.91 0.29 0.00 0.70 0.00 0.00 55.95 60.57 2igk s SER 127 Cb -0.26 -2.65 1.46 0.00 -1.71 0.00 0.00 66.02 62.86 2igk s SER 127 CO 0.42 -1.33 1.88 -0.65 1.20 0.00 0.00 173.24 174.75 2igk h PRO 128 N 2.03 0.00 0.00 5.44 0.11 -2.00 -1.19 132.00 136.40 2igk h PRO 128 Ca -0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2igk h PRO 128 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 2igk h PRO 128 CO 0.60 0.00 0.00 1.79 -0.21 0.00 0.00 178.00 180.18 2igk h THR 129 N 0.00 0.00 -3.86 -1.15 1.35 -2.04 -3.46 112.91 103.75 2igk h THR 129 Ca 0.26 -0.83 -0.50 0.00 -0.55 0.00 0.00 66.41 64.79 2igk h THR 129 Cb 1.31 1.83 0.02 0.00 -1.73 0.00 0.00 68.15 69.57 2igk h THR 129 CO -0.00 0.00 0.45 -0.44 -0.25 0.00 0.00 175.52 175.27 2igk s SER 130 N -5.71 7.09 0.18 5.36 0.01 -0.45 -4.99 113.70 115.19 2igk s SER 130 Ca 0.08 2.17 -0.31 0.00 1.31 0.00 0.00 55.95 59.20 2igk s SER 130 Cb 0.07 -2.61 -0.10 0.00 0.21 0.00 0.00 66.02 63.59 2igk s SER 130 CO 0.64 -0.26 1.51 0.86 0.41 0.00 0.00 173.24 176.40 2igk s TRP 131 N -1.34 3.08 -0.01 2.43 -0.00 -1.26 -4.95 118.94 116.89 2igk s TRP 131 Ca 0.49 0.78 0.01 0.00 -0.00 0.00 0.00 56.10 57.39 2igk s TRP 131 Cb -0.28 -3.86 -0.00 0.00 -0.00 0.00 0.00 33.47 29.33 2igk s TRP 131 CO 0.36 -3.05 -0.04 -1.14 -0.00 0.00 0.00 176.95 173.07 2igk s GLN 132 N 0.74 0.36 0.38 5.86 0.74 -1.26 -5.14 119.66 121.34 2igk s GLN 132 Ca 0.66 -0.14 -0.19 0.00 0.05 0.00 0.00 55.36 55.75 2igk s GLN 132 Cb -0.42 -0.35 -0.10 0.00 1.10 0.00 0.00 33.01 33.23 2igk s GLN 132 CO 0.34 0.08 0.86 0.00 -0.55 0.00 0.00 175.29 176.02 2igk s ALA 133 N -0.03 3.16 -0.56 1.58 0.00 -1.26 -4.98 121.76 119.68 2igk s ALA 133 Ca 0.01 0.25 0.23 0.00 0.00 0.00 0.00 51.96 52.45 2igk s ALA 133 Cb -0.02 -2.99 0.13 0.00 0.00 0.00 0.00 23.12 20.24 2igk s ALA 133 CO -0.00 0.22 1.11 0.43 0.00 0.00 0.00 175.76 177.52 2igk n SER 134 N -0.50 0.65 -4.25 0.00 7.64 -1.26 -4.98 113.62 110.93 2igk n SER 134 Ca 0.05 -0.02 -0.14 0.00 1.01 0.00 0.00 58.87 59.77 2igk n SER 134 Cb 0.54 0.58 -0.10 0.00 -1.01 0.00 0.00 64.21 64.21 2igk n SER 134 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2igk s THR 135 N -3.22 0.32 -1.15 0.44 -4.23 -1.26 -5.06 115.64 101.49 2igk s THR 135 Ca 0.04 -1.99 -0.14 0.00 -1.18 0.00 0.00 61.69 58.42 2igk s THR 135 Cb 0.13 -2.46 0.18 0.00 1.34 0.00 0.00 72.50 71.69 2igk s THR 135 CO 0.78 -0.11 1.33 -0.36 -0.54 0.00 0.00 174.62 175.72 2igk s PHE 136 N -3.92 3.58 0.77 3.99 0.08 -1.26 -5.00 117.98 116.22 2igk s PHE 136 Ca 0.35 -2.12 -0.12 0.00 0.12 0.00 0.00 56.93 55.16 2igk s PHE 136 Cb 0.07 -4.23 0.05 0.00 -0.57 0.00 0.00 43.02 38.35 2igk s PHE 136 CO 0.11 -1.33 1.14 -0.59 -0.10 0.00 0.00 175.22 174.45 2igk s PHE 137 N 1.25 3.09 -0.33 0.36 -0.71 -1.26 -4.91 117.98 115.47 2igk s PHE 137 Ca 0.39 0.89 -0.28 0.00 -1.04 0.00 0.00 56.93 56.89 2igk s PHE 137 Cb -0.04 -3.30 -0.02 0.00 -1.21 0.00 0.00 43.02 38.44 2igk s PHE 137 CO -0.03 -1.55 1.84 0.08 -1.34 0.00 0.00 175.22 174.23 2igk s VAL 138 N -3.46 3.43 0.09 -2.49 1.01 -1.26 -4.83 120.40 112.88 2igk s VAL 138 Ca 0.60 0.43 0.06 0.00 0.00 0.00 0.00 61.98 63.07 2igk s VAL 138 Cb -0.11 -3.59 -0.03 0.00 0.00 0.00 0.00 36.38 32.64 2igk s VAL 138 CO 0.50 -0.39 -0.16 -0.13 0.00 0.00 0.00 175.10 174.93 2igk s ARG 139 N 5.79 0.96 -1.73 2.72 0.52 -1.26 -4.91 118.95 121.04 2igk s ARG 139 Ca 0.81 -1.08 -0.01 0.00 -0.52 0.00 0.00 55.73 54.93 2igk s ARG 139 Cb -0.23 -1.02 0.00 0.00 0.52 0.00 0.00 34.95 34.23 2igk s ARG 139 CO 0.33 0.22 0.16 0.09 0.02 0.00 0.00 175.30 176.13 2igk n ASN 140 N 1.06 -5.98 0.00 0.23 3.02 -1.26 -1.79 115.26 110.54 2igk n ASN 140 Ca -0.19 -0.09 0.00 0.00 -0.03 0.00 0.00 54.58 54.27 2igk n ASN 140 Cb 0.55 -4.94 0.00 0.00 -0.61 0.00 0.00 39.78 34.78 2igk n ASN 140 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2igk n GLY 141 N -1.15 0.60 3.75 7.41 0.00 -1.26 -5.02 105.19 109.52 2igk n GLY 141 Ca -0.21 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.47 2igk n GLY 141 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2igk s SER 142 N -2.19 4.75 -0.37 1.61 1.04 -0.74 -4.79 113.70 113.01 2igk s SER 142 Ca 0.00 2.19 -0.07 0.00 0.48 0.00 0.00 55.95 58.55 2igk s SER 142 Cb 0.00 -2.57 0.06 0.00 0.10 0.00 0.00 66.02 63.60 2igk s SER 142 CO 0.00 -1.88 0.17 0.21 0.98 0.00 0.00 173.24 172.72 2igk s ASN 143 N -2.22 5.43 0.21 7.02 2.47 0.24 -4.77 114.94 123.33 2igk s ASN 143 Ca 0.71 -1.33 0.22 0.00 0.42 0.00 0.00 52.86 52.88 2igk s ASN 143 Cb -0.25 -1.91 0.91 0.00 -1.45 0.00 0.00 41.25 38.55 2igk s ASN 143 CO 0.42 -0.42 1.67 -0.81 -3.72 0.00 0.00 177.10 174.24 2igk n PRO 144 N 4.84 0.16 0.23 0.43 -0.04 -1.26 -2.04 135.00 137.32 2igk n PRO 144 Ca -0.11 0.38 0.12 0.00 -0.04 0.00 0.00 63.50 63.85 2igk n PRO 144 Cb 0.44 -1.80 0.47 0.00 -0.04 0.00 0.00 33.50 32.56 2igk n PRO 144 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2igk h GLU 145 N 0.00 0.00 -6.47 0.54 4.39 -1.95 -3.46 114.58 107.63 2igk h GLU 145 Ca 0.00 0.00 -0.57 0.00 0.34 0.00 0.00 59.36 59.13 2igk h GLU 145 Cb 0.36 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 28.95 2igk h GLU 145 CO 0.00 0.16 0.90 -1.14 -1.16 0.00 0.00 179.01 177.77 2igk s GLN 146 N -3.58 3.90 -0.17 2.33 2.00 -0.87 -5.00 119.66 118.28 2igk s GLN 146 Ca 0.01 0.90 -0.29 0.00 -2.00 0.00 0.00 55.36 53.99 2igk s GLN 146 Cb 0.09 -3.83 -0.04 0.00 0.80 0.00 0.00 33.01 30.04 2igk s GLN 146 CO 0.62 -1.13 1.72 0.34 -0.50 0.00 0.00 175.29 176.35 2igk s ASP 147 N 2.18 6.32 0.64 6.67 -1.08 -1.26 -4.67 116.67 125.46 2igk s ASP 147 Ca 0.48 1.84 0.42 0.00 -0.52 0.00 0.00 52.55 54.76 2igk s ASP 147 Cb -0.11 -2.53 2.14 0.00 -1.46 0.00 0.00 42.92 40.97 2igk s ASP 147 CO 0.23 -1.27 2.27 1.55 0.52 0.00 0.00 175.17 178.47 2igk h PRO 148 N 11.05 0.00 -0.04 4.34 0.13 -1.96 -2.08 132.00 143.44 2igk h PRO 148 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 2igk h PRO 148 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2igk h PRO 148 CO 0.98 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 180.04 2igk n LEU 149 N -3.10 2.42 -2.48 1.56 4.77 -1.26 -4.14 117.00 114.76 2igk n LEU 149 Ca -0.02 -0.83 -0.14 0.00 -0.03 0.00 0.00 56.01 55.00 2igk n LEU 149 Cb 0.13 -0.01 0.03 0.00 -2.33 0.00 0.00 43.42 41.24 2igk n LEU 149 CO 0.22 0.41 0.07 0.54 -1.33 0.00 0.00 177.39 177.30 2igk n ARG 150 N 0.89 2.52 -3.79 3.23 1.74 -0.78 -4.98 116.66 115.49 2igk n ARG 150 Ca 0.16 -3.84 -0.21 0.00 -0.77 0.00 0.00 57.85 53.19 2igk n ARG 150 Cb 0.50 -1.87 -0.03 0.00 -1.02 0.00 0.00 32.46 30.05 2igk n ARG 150 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 2igk s ASN 151 N -3.58 5.63 -1.01 0.55 2.47 -1.22 -0.61 114.94 117.17 2igk s ASN 151 Ca 0.38 -0.31 -0.05 0.00 0.42 0.00 0.00 52.86 53.30 2igk s ASN 151 Cb 0.39 -1.21 0.25 0.00 -1.45 0.00 0.00 41.25 39.22 2igk s ASN 151 CO -0.02 -0.29 0.95 -0.76 -3.72 0.00 0.00 177.10 173.26 2igk s LEU 152 N -4.02 5.93 0.48 3.21 1.43 -1.26 -4.79 118.68 119.66 2igk s LEU 152 Ca 0.40 -3.69 0.20 0.00 -1.03 0.00 0.00 54.13 50.01 2igk s LEU 152 Cb -0.07 -2.05 1.19 0.00 0.03 0.00 0.00 46.19 45.28 2igk s LEU 152 CO 0.28 -0.23 2.02 0.77 0.23 0.00 0.00 176.35 179.42 2igk h SER 153 N 6.30 0.00 1.01 2.29 4.64 -1.82 -0.58 113.55 125.39 2igk h SER 153 Ca 0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 2igk h SER 153 Cb 0.84 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.93 2igk h SER 153 CO 0.94 0.17 0.00 0.61 -0.87 0.00 0.00 176.83 177.68 2igk n GLY 154 N -0.84 -1.49 3.77 -0.77 0.00 0.31 -4.82 105.19 101.35 2igk n GLY 154 Ca -0.02 -0.09 -0.40 0.00 0.00 0.00 0.00 46.02 45.51 2igk n GLY 154 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2igk s GLN 155 N -3.01 4.18 0.11 1.61 -1.52 -0.23 -3.40 119.66 117.40 2igk s GLN 155 Ca 0.13 2.21 -0.14 0.00 -1.95 0.00 0.00 55.36 55.62 2igk s GLN 155 Cb 0.18 -2.93 0.02 0.00 -0.22 0.00 0.00 33.01 30.06 2igk s GLN 155 CO 0.52 -0.33 0.33 0.00 -0.25 0.00 0.00 175.29 175.56 2igk s ALA 156 N -1.19 -0.71 0.19 6.09 0.00 -1.26 -1.39 121.76 123.49 2igk s ALA 156 Ca 0.52 -0.22 0.09 0.00 0.00 0.00 0.00 51.96 52.36 2igk s ALA 156 Cb -0.39 0.61 -0.04 0.00 0.00 0.00 0.00 23.12 23.29 2igk s ALA 156 CO 0.52 -0.59 -0.18 0.14 0.00 0.00 0.00 175.76 175.65 2igk s VAL 157 N -3.76 1.92 -0.11 0.00 -7.23 -0.25 -4.86 120.40 106.12 2igk s VAL 157 Ca 0.03 -2.05 0.03 0.00 -1.81 0.00 0.00 61.98 58.18 2igk s VAL 157 Cb 0.03 -1.97 -0.00 0.00 0.56 0.00 0.00 36.38 35.00 2igk s VAL 157 CO -0.11 -0.38 -0.22 -0.89 -0.31 0.00 0.00 175.10 173.19 2igk s THR 158 N -2.29 2.19 -0.56 5.32 2.01 -1.25 -1.00 115.64 120.05 2igk s THR 158 Ca 0.19 -0.97 0.02 0.00 0.31 0.00 0.00 61.69 61.24 2igk s THR 158 Cb -0.05 -1.85 0.14 0.00 0.01 0.00 0.00 72.50 70.76 2igk s THR 158 CO 0.08 0.55 0.33 -0.13 -0.69 0.00 0.00 174.62 174.76 2igk s ARG 159 N 0.41 2.20 0.02 4.92 0.52 -1.26 -4.73 118.95 121.04 2igk s ARG 159 Ca -0.16 -2.62 -0.18 0.00 -0.52 0.00 0.00 55.73 52.25 2igk s ARG 159 Cb -0.17 -3.47 0.03 0.00 0.52 0.00 0.00 34.95 31.86 2igk s ARG 159 CO 0.07 -1.14 0.40 0.14 0.02 0.00 0.00 175.30 174.79 2igk s VAL 160 N -0.25 0.05 0.20 3.52 -7.23 -1.26 -4.34 120.40 111.09 2igk s VAL 160 Ca 0.17 -0.45 -0.31 0.00 -1.81 0.00 0.00 61.98 59.58 2igk s VAL 160 Cb -0.24 -0.87 -0.10 0.00 0.56 0.00 0.00 36.38 35.73 2igk s VAL 160 CO -0.01 -0.25 1.56 -0.69 -0.31 0.00 0.00 175.10 175.40 2igk s VAL 161 N -2.09 2.52 0.00 1.32 1.01 -0.72 -0.58 120.40 121.86 2igk s VAL 161 Ca -0.08 0.39 0.00 0.00 0.00 0.00 0.00 61.98 62.29 2igk s VAL 161 Cb -0.02 -3.25 0.00 0.00 0.00 0.00 0.00 36.38 33.11 2igk s VAL 161 CO 0.00 0.04 0.00 0.61 0.00 0.00 0.00 175.10 175.75 2igk n GLY 162 N 3.31 0.53 7.00 4.51 0.00 -0.97 -4.27 105.19 115.30 2igk n GLY 162 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 2igk n GLY 162 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2igk n GLY 163 N -2.00 1.34 0.14 -0.02 0.00 0.25 -2.39 105.19 102.51 2igk n GLY 163 Ca 0.00 -0.53 0.12 0.00 0.00 0.00 0.00 46.02 45.61 2igk n GLY 163 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2igk n MET 164 N 3.59 0.20 0.00 1.61 2.81 -1.26 -2.37 117.12 121.70 2igk n MET 164 Ca 0.00 0.46 0.10 0.00 -1.81 0.00 0.00 57.70 56.46 2igk n MET 164 Cb 0.00 -1.90 0.56 0.00 -0.71 0.00 0.00 33.22 31.16 2igk n MET 164 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 2igk n SER 165 N -2.28 0.00 -0.06 7.83 3.41 -1.01 -1.46 113.62 120.05 2igk n SER 165 Ca 0.02 -0.27 0.14 0.00 -0.26 0.00 0.00 58.87 58.50 2igk n SER 165 Cb 0.20 -0.17 0.61 0.00 -0.26 0.00 0.00 64.21 64.59 2igk n SER 165 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2igk n THR 166 N -1.17 0.00 -0.18 6.66 -2.24 -1.00 -4.20 114.28 112.14 2igk n THR 166 Ca 0.12 -0.03 0.00 0.00 -2.27 0.00 0.00 64.05 61.87 2igk n THR 166 Cb 0.13 -0.22 0.00 0.00 -2.10 0.00 0.00 70.33 68.14 2igk n THR 166 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2igk n HIS 167 N -1.17 0.00 -0.89 4.78 1.44 -0.56 -1.17 115.22 117.65 2igk n HIS 167 Ca 0.12 0.00 -0.28 0.00 -2.01 0.00 0.00 57.72 55.55 2igk n HIS 167 Cb 0.28 0.00 0.21 0.00 0.12 0.00 0.00 29.99 30.60 2igk n HIS 167 CO 0.00 0.00 0.00 1.67 -2.81 0.00 0.00 176.34 175.20 2igk s TRP 168 N -0.23 1.77 -0.84 -1.40 1.48 -0.53 -4.94 118.94 114.24 2igk s TRP 168 Ca 0.00 1.09 0.27 0.00 -1.06 0.00 0.00 56.10 56.40 2igk s TRP 168 Cb 0.00 -3.19 0.95 0.00 -1.16 0.00 0.00 33.47 30.07 2igk s TRP 168 CO 0.00 -3.33 1.80 2.41 -4.06 0.00 0.00 176.95 173.77 2igk n THR 169 N -4.51 0.33 -1.10 0.66 -1.04 -1.26 -4.94 114.28 102.42 2igk n THR 169 Ca 0.04 -0.16 -0.03 0.00 -2.04 0.00 0.00 64.05 61.85 2igk n THR 169 Cb 0.56 -0.50 -0.01 0.00 -1.82 0.00 0.00 70.33 68.55 2igk n THR 169 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2igk s ALA 171 N -2.00 3.58 -0.52 0.00 0.00 -1.26 -0.75 121.76 120.81 2igk s ALA 171 Ca 0.00 0.36 0.07 0.00 0.00 0.00 0.00 51.96 52.40 2igk s ALA 171 Cb 0.00 -3.53 0.26 0.00 0.00 0.00 0.00 23.12 19.85 2igk s ALA 171 CO 0.00 -0.91 0.66 0.25 0.00 0.00 0.00 175.76 175.76 2igk n THR 172 N 5.01 1.02 -2.35 0.00 -2.24 0.10 -4.78 114.28 111.05 2igk n THR 172 Ca 0.11 -4.71 -0.33 0.00 -2.27 0.00 0.00 64.05 56.85 2igk n THR 172 Cb 0.46 -1.92 -0.02 0.00 -2.10 0.00 0.00 70.33 66.75 2igk n THR 172 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 2igk s PRO 173 N -2.00 3.77 0.58 -0.78 0.04 -1.26 -4.78 135.00 130.58 2igk s PRO 173 Ca 0.38 1.09 -0.11 0.00 0.04 0.00 0.00 61.00 62.40 2igk s PRO 173 Cb 0.17 -2.10 -0.05 0.00 0.04 0.00 0.00 34.50 32.56 2igk s PRO 173 CO -0.06 -0.43 0.99 1.03 0.04 0.00 0.00 177.00 178.57 2igk s ARG 174 N -3.91 3.66 0.01 4.56 0.52 -1.26 -4.71 118.95 117.82 2igk s ARG 174 Ca 0.61 0.72 -0.19 0.00 -0.52 0.00 0.00 55.73 56.35 2igk s ARG 174 Cb -0.12 -2.13 -0.06 0.00 0.52 0.00 0.00 34.95 33.16 2igk s ARG 174 CO 0.30 -0.46 0.54 -0.06 0.02 0.00 0.00 175.30 175.64 2igk s PHE 175 N -3.02 3.72 1.02 -0.53 0.40 -1.26 -5.01 117.98 113.30 2igk s PHE 175 Ca 0.55 1.16 -0.15 0.00 -0.60 0.00 0.00 56.93 57.88 2igk s PHE 175 Cb -0.11 -2.51 0.20 0.00 0.51 0.00 0.00 43.02 41.11 2igk s PHE 175 CO 0.49 0.46 1.16 0.16 0.70 0.00 0.00 175.22 178.19 2igk s ASP 176 N -0.57 2.50 0.27 1.36 -4.77 -1.26 -4.85 116.67 109.36 2igk s ASP 176 Ca 0.29 0.74 -0.00 0.00 -3.30 0.00 0.00 52.55 50.27 2igk s ASP 176 Cb -0.18 -1.11 0.54 0.00 -1.09 0.00 0.00 42.92 41.08 2igk s ASP 176 CO 0.16 -3.15 1.79 0.03 0.70 0.00 0.00 175.17 174.70 2igk h ARG 177 N -1.92 0.76 0.00 2.11 3.08 -1.99 -1.96 114.38 114.46 2igk h ARG 177 Ca -0.48 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 59.52 2igk h ARG 177 Cb 1.30 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 31.18 2igk h ARG 177 CO 0.48 0.50 0.00 1.05 -1.07 0.00 0.00 179.97 180.93 2igk h GLU 178 N 0.78 0.00 -0.01 0.04 4.11 -1.98 -2.05 114.58 115.47 2igk h GLU 178 Ca 0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.90 2igk h GLU 178 Cb 0.58 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.83 2igk h GLU 178 CO -0.31 0.00 -0.70 1.04 0.07 0.00 0.00 179.01 179.11 2igk n GLN 179 N -2.81 0.80 -4.24 1.06 6.02 -0.76 -4.86 117.38 112.59 2igk n GLN 179 Ca 0.01 -0.51 -0.35 0.00 -0.01 0.00 0.00 57.00 56.14 2igk n GLN 179 Cb 0.25 -1.46 -0.10 0.00 1.02 0.00 0.00 30.24 29.96 2igk n GLN 179 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 2igk s ARG 180 N -2.65 3.39 0.56 -1.09 3.52 -0.77 -4.62 118.95 117.29 2igk s ARG 180 Ca 0.13 -0.38 -0.19 0.00 -0.13 0.00 0.00 55.73 55.16 2igk s ARG 180 Cb 0.16 -2.96 -0.05 0.00 -1.56 0.00 0.00 34.95 30.55 2igk s ARG 180 CO 0.69 0.53 1.16 -1.25 -0.81 0.00 0.00 175.30 175.61 2igk s PRO 181 N -0.39 3.20 0.22 5.12 0.04 -1.26 -4.95 135.00 136.98 2igk s PRO 181 Ca 0.08 1.68 -0.30 0.00 0.04 0.00 0.00 61.00 62.50 2igk s PRO 181 Cb -0.12 -1.98 -0.08 0.00 0.04 0.00 0.00 34.50 32.36 2igk s PRO 181 CO 0.02 -0.99 1.05 -0.51 0.04 0.00 0.00 177.00 176.62 2igk s LEU 182 N -3.93 4.54 -0.02 -3.56 1.43 -1.26 -4.94 118.68 110.94 2igk s LEU 182 Ca 0.74 2.09 0.16 0.00 -1.03 0.00 0.00 54.13 56.08 2igk s LEU 182 Cb -0.26 -3.61 -0.24 0.00 0.03 0.00 0.00 46.19 42.11 2igk s LEU 182 CO 0.29 -0.10 0.34 0.18 0.23 0.00 0.00 176.35 177.29 2igk n LEU 183 N 1.87 0.00 -3.93 1.79 4.77 -1.26 -4.95 117.00 115.28 2igk n LEU 183 Ca 0.00 0.00 -0.22 0.00 -0.03 0.00 0.00 56.01 55.76 2igk n LEU 183 Cb 0.46 0.00 -0.17 0.00 -2.33 0.00 0.00 43.42 41.39 2igk n LEU 183 CO 0.53 0.00 -0.43 -0.69 -1.33 0.00 0.00 177.39 175.47 2igk s VAL 184 N -3.07 0.76 0.47 4.08 1.01 -1.26 -5.05 120.40 117.34 2igk s VAL 184 Ca -0.06 -0.24 -0.19 0.00 0.00 0.00 0.00 61.98 61.49 2igk s VAL 184 Cb 0.10 -0.75 -0.10 0.00 0.00 0.00 0.00 36.38 35.63 2igk s VAL 184 CO 0.64 0.28 0.97 -0.54 0.00 0.00 0.00 175.10 176.45 2igk s LYS 185 N 0.95 4.08 -1.39 2.72 1.02 -1.26 -4.39 119.74 121.47 2igk s LYS 185 Ca -0.10 1.09 -0.09 0.00 0.02 0.00 0.00 55.97 56.89 2igk s LYS 185 Cb -0.15 -2.16 0.06 0.00 -0.52 0.00 0.00 37.83 35.07 2igk s LYS 185 CO 0.00 -0.16 0.59 -0.25 -0.92 0.00 0.00 175.35 174.62 2igk n ASP 186 N -1.00 -4.49 -2.71 2.83 8.00 -1.26 -4.82 116.55 113.09 2igk n ASP 186 Ca 0.07 -0.42 -0.04 0.00 0.71 0.00 0.00 54.79 55.11 2igk n ASP 186 Cb 0.54 -3.67 0.03 0.00 -0.02 0.00 0.00 41.12 38.00 2igk n ASP 186 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2igk n ASP 187 N -2.43 -2.30 -0.21 -2.24 -0.08 -1.26 -5.04 116.55 102.99 2igk n ASP 187 Ca -0.03 -1.92 -0.03 0.00 -1.51 0.00 0.00 54.79 51.30 2igk n ASP 187 Cb 0.56 1.19 0.16 0.00 2.34 0.00 0.00 41.12 45.38 2igk n ASP 187 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2igk h ALA 188 N 4.39 1.23 -0.13 -1.67 0.00 -1.87 -0.27 119.26 120.93 2igk h ALA 188 Ca -0.01 -0.16 -0.15 0.00 0.00 0.00 0.00 54.91 54.59 2igk h ALA 188 Cb 1.14 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 2igk h ALA 188 CO -0.04 0.58 -0.55 -0.44 0.00 0.00 0.00 179.25 178.79 2igk h ASP 189 N 0.98 0.44 -0.26 0.00 3.32 -1.98 -1.04 116.42 117.87 2igk h ASP 189 Ca 0.23 -0.23 -0.17 0.00 0.02 0.00 0.00 57.03 56.88 2igk h ASP 189 Cb 0.16 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 39.58 2igk h ASP 189 CO -0.02 0.90 -0.48 0.00 -1.72 0.00 0.00 179.24 177.92 2igk h ALA 190 N 1.11 0.56 -0.00 3.45 0.00 -1.73 -1.18 119.26 121.47 2igk h ALA 190 Ca 0.00 -0.49 -0.00 0.00 0.00 0.00 0.00 54.91 54.43 2igk h ALA 190 Cb 1.06 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.76 2igk h ALA 190 CO 0.09 0.68 0.00 0.22 0.00 0.00 0.00 179.25 180.24 2igk h ASP 191 N 0.66 0.00 -0.49 0.00 3.58 -1.01 -1.59 116.42 117.57 2igk h ASP 191 Ca 0.03 -0.06 0.09 0.00 0.42 0.00 0.00 57.03 57.51 2igk h ASP 191 Cb 1.07 -0.00 -0.07 0.00 1.72 0.00 0.00 39.33 42.04 2igk h ASP 191 CO 0.11 0.06 0.05 0.44 -2.88 0.00 0.00 179.24 177.01 2igk h ASP 192 N -0.06 -0.11 -0.59 2.28 5.19 -1.13 -0.92 116.42 121.08 2igk h ASP 192 Ca 0.00 0.10 -0.06 0.00 -0.62 0.00 0.00 57.03 56.46 2igk h ASP 192 Cb 0.06 0.17 -0.03 0.00 0.18 0.00 0.00 39.33 39.71 2igk h ASP 192 CO -0.00 -0.02 0.17 0.00 -3.12 0.00 0.00 179.24 176.26 2igk h ALA 193 N 1.41 1.12 -0.12 3.45 0.00 -1.06 -0.69 119.26 123.37 2igk h ALA 193 Ca 0.25 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 2igk h ALA 193 Cb 0.35 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 2igk h ALA 193 CO -0.37 0.60 -0.01 1.49 0.00 0.00 0.00 179.25 180.96 2igk h GLU 194 N 0.93 0.21 -0.92 0.00 4.57 -0.83 -1.10 114.58 117.44 2igk h GLU 194 Ca 0.20 -0.07 -0.00 0.00 -1.18 0.00 0.00 59.36 58.31 2igk h GLU 194 Cb 0.31 -0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 28.84 2igk h GLU 194 CO -0.00 0.47 0.57 -1.49 -1.18 0.00 0.00 179.01 177.38 2igk h TRP 195 N -0.08 1.19 -0.60 0.92 4.06 -1.02 -1.49 115.95 118.94 2igk h TRP 195 Ca 0.03 0.01 0.04 0.00 2.06 0.00 0.00 58.89 61.03 2igk h TRP 195 Cb 0.39 -0.40 -0.04 0.00 -1.00 0.00 0.00 29.16 28.11 2igk h TRP 195 CO 0.04 0.78 0.35 0.22 -3.56 0.00 0.00 178.44 176.27 2igk h ASP 196 N 1.26 0.54 -0.25 -3.49 3.58 -0.97 0.20 116.42 117.28 2igk h ASP 196 Ca 0.33 0.01 -0.00 0.00 0.42 0.00 0.00 57.03 57.79 2igk h ASP 196 Cb -0.08 -0.10 -0.01 0.00 1.72 0.00 0.00 39.33 40.86 2igk h ASP 196 CO -0.06 0.37 0.15 -0.09 -2.88 0.00 0.00 179.24 176.73 2igk h ARG 197 N 0.67 0.35 -0.13 0.28 2.43 -0.61 -1.03 114.38 116.34 2igk h ARG 197 Ca 0.25 -0.03 -0.05 0.00 -0.81 0.00 0.00 59.98 59.34 2igk h ARG 197 Cb 0.09 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 29.56 2igk h ARG 197 CO -0.13 0.28 -0.13 -0.07 -1.51 0.00 0.00 179.97 178.41 2igk h LEU 198 N 0.31 0.34 -0.98 3.80 3.38 -1.10 -2.86 115.31 118.21 2igk h LEU 198 Ca 0.09 -0.48 0.02 0.00 0.09 0.00 0.00 57.88 57.60 2igk h LEU 198 Cb 0.03 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 40.63 2igk h LEU 198 CO -0.02 0.75 0.64 1.88 0.09 0.00 0.00 178.44 181.79 2igk h TYR 199 N -0.07 1.21 -0.91 1.13 0.05 -0.60 0.01 116.97 117.80 2igk h TYR 199 Ca 0.02 0.03 -0.00 0.00 0.05 0.00 0.00 58.73 58.83 2igk h TYR 199 Cb 0.66 -0.41 -0.04 0.00 1.01 0.00 0.00 36.73 37.95 2igk h TYR 199 CO 0.09 0.74 0.56 1.15 -1.05 0.00 0.00 178.16 179.64 2igk h THR 200 N 1.28 1.25 -0.12 -2.88 2.02 -1.15 0.14 112.91 113.45 2igk h THR 200 Ca 0.37 -0.52 -0.07 0.00 0.77 0.00 0.00 66.41 66.96 2igk h THR 200 Cb -0.08 -0.04 -0.00 0.00 -1.74 0.00 0.00 68.15 66.28 2igk h THR 200 CO -0.10 0.26 -0.18 0.50 0.37 0.00 0.00 175.52 176.36 2igk h LYS 201 N 1.25 0.33 -0.73 6.66 3.64 -1.14 -2.24 116.57 124.35 2igk h LYS 201 Ca 0.33 -0.20 0.10 0.00 -1.27 0.00 0.00 60.65 59.61 2igk h LYS 201 Cb -0.07 0.02 -0.08 0.00 -0.41 0.00 0.00 32.23 31.70 2igk h LYS 201 CO -0.06 0.78 0.36 0.00 -2.27 0.00 0.00 179.45 178.25 2igk h ALA 202 N 0.55 1.01 -0.38 5.00 0.00 -0.67 -1.15 119.26 123.62 2igk h ALA 202 Ca 0.01 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 2igk h ALA 202 Cb 0.75 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 2igk h ALA 202 CO 0.04 -0.07 0.16 0.93 0.00 0.00 0.00 179.25 180.32 2igk h GLU 203 N 0.59 0.53 -0.43 0.00 5.08 -0.69 -1.18 114.58 118.48 2igk h GLU 203 Ca 0.37 -0.06 -0.10 0.00 -1.00 0.00 0.00 59.36 58.57 2igk h GLU 203 Cb 0.42 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 2igk h GLU 203 CO -0.29 0.43 -0.11 1.03 -1.00 0.00 0.00 179.01 179.08 2igk h SER 204 N 0.53 0.83 -0.52 1.42 0.87 -0.68 0.53 113.55 116.53 2igk h SER 204 Ca 0.13 -0.36 -0.06 0.00 -1.23 0.00 0.00 61.79 60.26 2igk h SER 204 Cb 0.10 -0.23 -0.02 0.00 -0.44 0.00 0.00 62.40 61.81 2igk h SER 204 CO -0.01 1.01 0.09 1.88 -0.53 0.00 0.00 176.83 179.26 2igk h TYR 205 N 0.65 0.95 0.00 2.24 -1.99 -0.46 -2.77 116.97 115.60 2igk h TYR 205 Ca 0.11 -0.11 0.00 0.00 2.00 0.00 0.00 58.73 60.72 2igk h TYR 205 Cb 0.64 -0.27 0.00 0.00 2.00 0.00 0.00 36.73 39.11 2igk h TYR 205 CO 0.05 0.82 -0.38 1.19 -0.00 0.00 0.00 178.16 179.84 2igk n PHE 206 N -4.24 0.20 -3.58 4.88 3.72 -0.52 -3.78 117.46 114.14 2igk n PHE 206 Ca 0.04 0.06 -0.20 0.00 -0.05 0.00 0.00 57.45 57.29 2igk n PHE 206 Cb 0.26 -0.46 0.06 0.00 -0.94 0.00 0.00 39.48 38.41 2igk n PHE 206 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 2igk n GLN 207 N -1.70 -6.12 -2.17 -1.08 1.13 -0.15 -4.06 117.38 103.23 2igk n GLN 207 Ca 0.05 0.75 -0.41 0.00 -1.94 0.00 0.00 57.00 55.46 2igk n GLN 207 Cb 0.37 -5.61 -0.02 0.00 0.11 0.00 0.00 30.24 25.09 2igk n GLN 207 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 2igk s THR 208 N -3.46 2.87 0.25 5.09 2.01 -0.01 -2.42 115.64 119.98 2igk s THR 208 Ca 0.12 0.85 -0.13 0.00 0.31 0.00 0.00 61.69 62.84 2igk s THR 208 Cb -0.06 -3.54 -0.00 0.00 0.01 0.00 0.00 72.50 68.91 2igk s THR 208 CO 0.77 0.19 0.48 -0.83 -0.69 0.00 0.00 174.62 174.53 2igk s GLY 209 N -0.37 0.53 -0.15 4.40 0.00 -0.37 -4.90 107.32 106.45 2igk s GLY 209 Ca 0.50 -0.87 0.18 0.00 0.00 0.00 0.00 44.72 44.52 2igk s GLY 209 CO 0.49 -0.62 1.18 -1.30 0.00 0.00 0.00 173.10 172.85 2igk n THR 210 N -0.38 1.33 -0.34 0.90 -2.24 -1.26 -1.49 114.28 110.80 2igk n THR 210 Ca -0.02 -2.54 0.00 0.00 -2.27 0.00 0.00 64.05 59.22 2igk n THR 210 Cb 0.62 0.30 0.00 0.00 -2.10 0.00 0.00 70.33 69.15 2igk n THR 210 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2igk n ASP 211 N -0.41 0.47 0.12 3.42 5.75 -1.26 -4.71 116.55 119.93 2igk n ASP 211 Ca 0.16 -0.86 0.12 0.00 -0.01 0.00 0.00 54.79 54.20 2igk n ASP 211 Cb 0.91 0.11 0.48 0.00 -1.03 0.00 0.00 41.12 41.60 2igk n ASP 211 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2igk n GLN 212 N -0.11 0.19 -0.12 0.11 3.00 -1.26 -2.72 117.38 116.47 2igk n GLN 212 Ca 0.00 0.42 0.07 0.00 -0.01 0.00 0.00 57.00 57.48 2igk n GLN 212 Cb 0.08 -1.86 0.13 0.00 0.00 0.00 0.00 30.24 28.59 2igk n GLN 212 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.06 178.25 2igk n PHE 213 N -2.21 0.17 0.22 1.08 3.01 -1.26 -4.84 117.46 113.63 2igk n PHE 213 Ca 0.02 -0.83 0.06 0.00 1.01 0.00 0.00 57.45 57.72 2igk n PHE 213 Cb 0.23 -0.14 0.51 0.00 -0.01 0.00 0.00 39.48 40.06 2igk n PHE 213 CO 0.00 0.00 0.00 1.57 1.01 0.00 0.00 176.76 179.34 2igk h LYS 214 N 0.40 0.00 -0.62 -1.08 2.10 -1.84 -2.08 116.57 113.45 2igk h LYS 214 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2igk h LYS 214 Cb 0.93 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.26 2igk h LYS 214 CO 0.03 0.23 0.00 0.39 -2.00 0.00 0.00 179.45 178.11 2igk n GLU 215 N -4.05 4.39 -2.62 0.07 1.02 -1.26 -4.88 120.64 113.32 2igk n GLU 215 Ca -0.02 -3.05 -0.42 0.00 -0.02 0.00 0.00 57.16 53.65 2igk n GLU 215 Cb 0.31 -2.10 -0.03 0.00 -0.02 0.00 0.00 31.44 29.59 2igk n GLU 215 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2igk s SER 216 N -0.85 7.30 0.15 1.62 0.15 -0.79 -4.95 113.70 116.34 2igk s SER 216 Ca 0.54 1.81 -0.12 0.00 0.70 0.00 0.00 55.95 58.87 2igk s SER 216 Cb 0.38 -2.58 0.03 0.00 -1.71 0.00 0.00 66.02 62.14 2igk s SER 216 CO 0.20 -0.29 1.63 0.40 1.20 0.00 0.00 173.24 176.38 2igk h ILE 217 N 4.54 1.26 -0.37 6.45 2.04 -1.90 -1.88 117.51 127.64 2igk h ILE 217 Ca -0.42 -0.99 -0.11 0.00 1.00 0.00 0.00 64.86 64.34 2igk h ILE 217 Cb 1.22 0.89 -0.01 0.00 -0.74 0.00 0.00 36.82 38.17 2igk h ILE 217 CO 0.76 0.35 -0.23 0.03 0.00 0.00 0.00 178.15 179.06 2igk h ARG 218 N 0.75 0.74 0.23 2.37 3.08 -1.92 0.20 114.38 119.82 2igk h ARG 218 Ca 0.15 -0.30 -0.01 0.00 0.07 0.00 0.00 59.98 59.89 2igk h ARG 218 Cb 0.44 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.46 2igk h ARG 218 CO 0.02 0.90 -0.11 1.25 -1.07 0.00 0.00 179.97 180.96 2igk h HIS 219 N 0.64 -0.29 -0.36 3.04 2.76 -1.75 -2.31 115.15 116.88 2igk h HIS 219 Ca 0.09 -0.01 -0.10 0.00 -2.20 0.00 0.00 60.37 58.15 2igk h HIS 219 Cb 0.73 0.09 -0.02 0.00 1.55 0.00 0.00 27.41 29.77 2igk h HIS 219 CO 0.04 -0.14 -0.18 -0.91 -1.30 0.00 0.00 177.93 175.44 2igk h ASN 220 N -0.36 0.67 -0.32 3.26 2.35 -1.13 0.49 115.58 120.54 2igk h ASN 220 Ca -0.03 -0.22 0.03 0.00 -0.55 0.00 0.00 56.30 55.53 2igk h ASN 220 Cb 0.28 -0.18 -0.03 0.00 0.05 0.00 0.00 38.32 38.43 2igk h ASN 220 CO 0.05 0.86 0.13 0.25 -1.65 0.00 0.00 177.43 177.07 2igk h LEU 221 N 0.60 0.17 -0.05 1.61 5.85 -0.42 0.45 115.31 123.52 2igk h LEU 221 Ca 0.09 0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.80 2igk h LEU 221 Cb 0.64 -0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.67 2igk h LEU 221 CO 0.05 0.14 -0.12 0.58 -0.34 0.00 0.00 178.44 178.75 2igk h VAL 222 N 0.29 1.43 -0.28 1.05 2.07 -1.18 -2.42 116.25 117.21 2igk h VAL 222 Ca 0.14 -1.46 0.05 0.00 0.82 0.00 0.00 66.70 66.25 2igk h VAL 222 Cb 0.09 2.28 -0.04 0.00 -1.52 0.00 0.00 31.29 32.09 2igk h VAL 222 CO -0.12 0.40 0.02 0.25 0.02 0.00 0.00 177.57 178.14 2igk h LEU 223 N -0.35 -0.06 -0.65 2.57 5.85 -0.80 -1.64 115.31 120.22 2igk h LEU 223 Ca -0.00 0.06 -0.09 0.00 0.84 0.00 0.00 57.88 58.69 2igk h LEU 223 Cb 0.71 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.81 2igk h LEU 223 CO 0.03 0.00 0.06 0.78 -0.34 0.00 0.00 178.44 178.96 2igk h ASN 224 N 0.11 1.07 -0.02 1.25 2.35 -0.96 -0.66 115.58 118.73 2igk h ASN 224 Ca 0.13 -0.28 -0.00 0.00 -0.55 0.00 0.00 56.30 55.60 2igk h ASN 224 Cb 0.16 -0.29 -0.00 0.00 0.05 0.00 0.00 38.32 38.25 2igk h ASN 224 CO -0.21 1.09 0.01 0.50 -1.65 0.00 0.00 177.43 177.17 2igk h LYS 225 N 1.02 0.03 -0.70 0.81 1.63 -1.13 -1.53 116.57 116.70 2igk h LYS 225 Ca 0.19 -0.00 -0.06 0.00 -0.85 0.00 0.00 60.65 59.92 2igk h LYS 225 Cb 0.50 -0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 32.10 2igk h LYS 225 CO 0.02 0.09 0.19 -0.07 -3.45 0.00 0.00 179.45 176.23 2igk h LEU 226 N -0.04 1.05 -0.31 5.20 3.38 -1.26 -0.57 115.31 122.76 2igk h LEU 226 Ca 0.01 -0.23 0.07 0.00 0.09 0.00 0.00 57.88 57.82 2igk h LEU 226 Cb 0.07 -0.28 -0.07 0.00 0.09 0.00 0.00 40.66 40.47 2igk h LEU 226 CO -0.00 1.00 -0.16 0.74 0.09 0.00 0.00 178.44 180.11 2igk h THR 227 N 1.05 0.53 0.11 0.22 2.02 -0.99 -1.10 112.91 114.74 2igk h THR 227 Ca 0.22 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.40 2igk h THR 227 Cb 0.35 0.53 0.00 0.00 -1.74 0.00 0.00 68.15 67.29 2igk h THR 227 CO -0.00 0.00 -0.05 -0.08 0.37 0.00 0.00 175.52 175.76 2igk h GLU 228 N -0.11 -0.14 -0.78 6.66 4.57 -1.15 -1.63 114.58 122.00 2igk h GLU 228 Ca 0.16 0.01 0.15 0.00 -1.18 0.00 0.00 59.36 58.50 2igk h GLU 228 Cb 0.35 0.03 -0.05 0.00 -0.16 0.00 0.00 28.75 28.92 2igk h GLU 228 CO -0.38 0.02 0.52 0.93 -1.18 0.00 0.00 179.01 178.92 2igk h GLU 229 N -0.27 0.45 -0.29 1.92 4.39 -0.85 -2.50 114.58 117.43 2igk h GLU 229 Ca -0.01 -0.03 -0.06 0.00 0.34 0.00 0.00 59.36 59.60 2igk h GLU 229 Cb 0.22 -0.10 -0.04 0.00 -0.10 0.00 0.00 28.75 28.74 2igk h GLU 229 CO 0.02 0.29 -0.00 0.66 -1.16 0.00 0.00 179.01 178.82 2igk n TYR 230 N -4.49 0.99 -1.67 4.33 4.02 -0.44 -5.03 117.16 114.88 2igk n TYR 230 Ca 0.15 -1.10 -0.46 0.00 -0.01 0.00 0.00 57.90 56.49 2igk n TYR 230 Cb 0.52 -0.37 -0.04 0.00 -0.02 0.00 0.00 39.34 39.43 2igk n TYR 230 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 176.86 176.21 2igk n LYS 231 N -0.73 2.11 -0.93 -0.72 2.85 -0.62 -0.24 118.16 119.87 2igk n LYS 231 Ca 0.25 0.76 0.00 0.00 -1.05 0.00 0.00 58.31 58.27 2igk n LYS 231 Cb 0.94 -2.49 0.00 0.00 -0.65 0.00 0.00 35.03 32.83 2igk n LYS 231 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2igk n GLY 232 N 2.97 0.52 0.19 2.58 0.00 -1.26 -4.77 105.19 105.42 2igk n GLY 232 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 2igk n GLY 232 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2igk n GLN 233 N -1.91 0.00 -3.90 1.61 6.02 0.66 -5.10 117.38 114.76 2igk n GLN 233 Ca 0.00 0.00 -0.10 0.00 -0.01 0.00 0.00 57.00 56.89 2igk n GLN 233 Cb 0.08 -0.74 -0.10 0.00 1.02 0.00 0.00 30.24 30.50 2igk n GLN 233 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 2igk s ARG 234 N -1.67 0.48 -0.06 -1.09 0.52 -0.54 -5.12 118.95 111.47 2igk s ARG 234 Ca 0.00 -0.52 -0.03 0.00 -0.52 0.00 0.00 55.73 54.66 2igk s ARG 234 Cb 0.00 0.19 -0.04 0.00 0.52 0.00 0.00 34.95 35.62 2igk s ARG 234 CO 0.00 -0.11 0.09 -0.51 0.02 0.00 0.00 175.30 174.79 2igk s ASP 235 N -1.57 5.83 0.14 0.23 1.01 -1.26 -4.63 116.67 116.41 2igk s ASP 235 Ca -0.13 0.26 0.10 0.00 0.71 0.00 0.00 52.55 53.49 2igk s ASP 235 Cb -0.07 -1.75 -0.04 0.00 1.01 0.00 0.00 42.92 42.08 2igk s ASP 235 CO -0.00 0.34 -0.24 -0.36 0.21 0.00 0.00 175.17 175.12 2igk s PHE 236 N -1.08 2.09 0.35 4.23 0.40 -1.26 -4.34 117.98 118.37 2igk s PHE 236 Ca 0.19 -0.40 -0.15 0.00 -0.60 0.00 0.00 56.93 55.96 2igk s PHE 236 Cb -0.12 -1.11 0.04 0.00 0.51 0.00 0.00 43.02 42.34 2igk s PHE 236 CO 0.09 0.32 0.73 1.14 0.70 0.00 0.00 175.22 178.20 2igk s GLN 237 N -2.20 2.07 0.33 0.44 -2.07 -0.59 -4.99 119.66 112.65 2igk s GLN 237 Ca 0.13 -1.36 -0.28 0.00 -1.82 0.00 0.00 55.36 52.03 2igk s GLN 237 Cb -0.09 0.60 -0.10 0.00 -1.09 0.00 0.00 33.01 32.33 2igk s GLN 237 CO 0.06 -0.95 1.23 -1.14 -1.32 0.00 0.00 175.29 173.17 2igk s GLN 238 N -2.82 4.36 0.10 9.60 0.74 -1.26 -1.03 119.66 129.34 2igk s GLN 238 Ca 0.16 2.05 -0.36 0.00 0.05 0.00 0.00 55.36 57.26 2igk s GLN 238 Cb -0.05 -3.02 -0.16 0.00 1.10 0.00 0.00 33.01 30.87 2igk s GLN 238 CO 0.11 -0.12 1.37 -0.89 -0.55 0.00 0.00 175.29 175.21 2igk n ILE 239 N 0.75 0.00 -2.00 -2.34 5.41 0.02 -4.73 119.36 116.47 2igk n ILE 239 Ca 0.01 -0.00 -0.42 0.00 1.00 0.00 0.00 62.75 63.33 2igk n ILE 239 Cb 0.43 -0.91 -0.03 0.00 -0.71 0.00 0.00 39.64 38.43 2igk n ILE 239 CO 0.00 0.00 0.00 -2.84 0.00 0.00 0.00 176.55 173.71 2igk s PRO 240 N 0.53 4.19 -0.04 0.38 0.02 -1.26 -4.74 135.00 134.07 2igk s PRO 240 Ca 0.84 2.21 0.06 0.00 0.02 0.00 0.00 61.00 64.13 2igk s PRO 240 Cb -0.92 -3.90 -0.01 0.00 0.02 0.00 0.00 34.50 29.69 2igk s PRO 240 CO 0.46 -0.81 -0.22 -0.51 -0.33 0.00 0.00 177.00 175.58 2igk s LEU 241 N 3.71 2.01 -0.78 -5.54 1.43 -0.55 -0.72 118.68 118.24 2igk s LEU 241 Ca 0.73 -0.44 -0.24 0.00 -1.03 0.00 0.00 54.13 53.16 2igk s LEU 241 Cb -0.35 -1.19 0.06 0.00 0.03 0.00 0.00 46.19 44.74 2igk s LEU 241 CO 0.30 0.22 1.18 0.00 0.23 0.00 0.00 176.35 178.29 2igk s ALA 242 N -0.20 2.93 -0.26 4.21 0.00 0.07 -1.24 121.76 127.27 2igk s ALA 242 Ca -0.00 -1.81 -0.29 0.00 0.00 0.00 0.00 51.96 49.85 2igk s ALA 242 Cb -0.12 -4.15 0.18 0.00 0.00 0.00 0.00 23.12 19.04 2igk s ALA 242 CO 0.02 -3.14 1.30 0.00 0.00 0.00 0.00 175.76 173.94 2igk s ALA 243 N 4.75 -2.09 -0.08 0.00 0.00 -1.02 -1.07 121.76 122.26 2igk s ALA 243 Ca 0.32 1.84 0.01 0.00 0.00 0.00 0.00 51.96 54.13 2igk s ALA 243 Cb -0.09 -1.37 0.02 0.00 0.00 0.00 0.00 23.12 21.67 2igk s ALA 243 CO 0.07 -0.26 -0.08 0.99 0.00 0.00 0.00 175.76 176.49 2igk s THR 244 N -1.05 0.91 0.20 0.00 2.01 -0.48 -4.56 115.64 112.68 2igk s THR 244 Ca 0.07 -0.28 -0.30 0.00 0.31 0.00 0.00 61.69 61.49 2igk s THR 244 Cb -0.01 -0.90 -0.08 0.00 0.01 0.00 0.00 72.50 71.52 2igk s THR 244 CO -0.06 0.33 1.16 -0.60 -0.69 0.00 0.00 174.62 174.75 2igk s ARG 245 N 1.21 4.54 -0.10 4.92 3.52 -1.26 -0.36 118.95 131.42 2igk s ARG 245 Ca -0.05 1.84 0.11 0.00 -0.13 0.00 0.00 55.73 57.49 2igk s ARG 245 Cb -0.14 -3.23 -0.15 0.00 -1.56 0.00 0.00 34.95 29.87 2igk s ARG 245 CO -0.02 -0.00 0.08 0.54 -0.81 0.00 0.00 175.30 175.08 2igk n ARG 246 N 2.19 1.85 -3.91 5.12 5.12 0.33 -4.88 116.66 122.48 2igk n ARG 246 Ca 0.03 -0.02 -0.09 0.00 -1.93 0.00 0.00 57.85 55.83 2igk n ARG 246 Cb 0.45 -1.29 -0.01 0.00 -1.16 0.00 0.00 32.46 30.44 2igk n ARG 246 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 2igk s SER 247 N -4.24 0.08 0.42 0.55 1.04 -0.91 -4.96 113.70 105.68 2igk s SER 247 Ca -0.05 -1.03 0.27 0.00 0.48 0.00 0.00 55.95 55.61 2igk s SER 247 Cb 0.04 0.74 1.45 0.00 0.10 0.00 0.00 66.02 68.35 2igk s SER 247 CO 0.48 -1.43 1.80 -0.65 0.98 0.00 0.00 173.24 174.41 2igk h PRO 248 N 2.07 0.00 0.00 4.02 0.11 -2.01 -2.66 132.00 133.53 2igk h PRO 248 Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 2igk h PRO 248 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2igk h PRO 248 CO 0.35 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.39 2igk n THR 249 N -2.46 0.64 -3.70 -1.15 -2.24 -1.26 -4.87 114.28 99.23 2igk n THR 249 Ca -0.02 -0.80 -0.17 0.00 -2.27 0.00 0.00 64.05 60.79 2igk n THR 249 Cb 0.09 0.70 -0.17 0.00 -2.10 0.00 0.00 70.33 68.86 2igk n THR 249 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 2igk s PHE 250 N -0.64 -0.03 -0.17 4.78 2.19 -1.01 -4.88 117.98 118.24 2igk s PHE 250 Ca 0.00 0.34 -0.01 0.00 0.33 0.00 0.00 56.93 57.59 2igk s PHE 250 Cb 0.00 -0.33 -0.00 0.00 -1.31 0.00 0.00 43.02 41.37 2igk s PHE 250 CO 0.00 -0.18 -0.13 0.08 1.83 0.00 0.00 175.22 176.82 2igk s VAL 251 N 1.84 2.80 -0.57 3.12 1.01 -1.26 -0.52 120.40 126.83 2igk s VAL 251 Ca -0.00 -0.71 -0.26 0.00 0.00 0.00 0.00 61.98 61.01 2igk s VAL 251 Cb -0.12 -2.21 0.04 0.00 0.00 0.00 0.00 36.38 34.09 2igk s VAL 251 CO -0.04 0.50 1.06 -0.70 0.00 0.00 0.00 175.10 175.92 2igk s GLU 252 N 0.97 3.40 0.26 2.72 2.12 0.51 -4.88 118.70 123.79 2igk s GLU 252 Ca -0.02 -0.06 -0.30 0.00 0.36 0.00 0.00 54.97 54.95 2igk s GLU 252 Cb -0.15 -4.05 -0.09 0.00 0.26 0.00 0.00 34.13 30.10 2igk s GLU 252 CO -0.02 -1.60 1.01 -1.58 -0.54 0.00 0.00 175.26 172.53 2igk s TRP 253 N 4.43 3.80 0.77 5.30 0.52 -1.26 -1.38 118.94 131.12 2igk s TRP 253 Ca 0.36 1.82 -0.12 0.00 0.02 0.00 0.00 56.10 58.18 2igk s TRP 253 Cb -0.10 -3.11 0.06 0.00 -1.15 0.00 0.00 33.47 29.17 2igk s TRP 253 CO 0.21 0.01 1.15 -1.12 0.02 0.00 0.00 176.95 177.23 2igk s SER 254 N -1.07 4.82 0.11 2.95 0.01 -0.23 -4.55 113.70 115.75 2igk s SER 254 Ca 0.43 0.89 -0.08 0.00 1.31 0.00 0.00 55.95 58.51 2igk s SER 254 Cb -0.28 -1.49 0.03 0.00 0.21 0.00 0.00 66.02 64.49 2igk s SER 254 CO 0.36 -1.71 0.38 -1.54 0.41 0.00 0.00 173.24 171.13 2igk n SER 255 N -3.21 -0.82 -0.34 2.44 3.41 -1.26 -4.69 113.62 109.14 2igk n SER 255 Ca 0.08 -1.50 0.19 0.00 -0.26 0.00 0.00 58.87 57.37 2igk n SER 255 Cb 0.60 1.35 0.40 0.00 -0.26 0.00 0.00 64.21 66.30 2igk n SER 255 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2igk h ALA 256 N 2.00 1.84 -0.57 7.33 0.00 -1.78 -1.91 119.26 126.18 2igk h ALA 256 Ca -0.12 0.13 0.01 0.00 0.00 0.00 0.00 54.91 54.92 2igk h ALA 256 Cb 0.50 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 2igk h ALA 256 CO 0.16 -0.32 0.38 -0.97 0.00 0.00 0.00 179.25 178.49 2igk h ASN 257 N 0.55 0.65 -0.67 0.00 -0.73 -1.65 -0.21 115.58 113.52 2igk h ASN 257 Ca 0.65 -0.02 -0.00 0.00 1.87 0.00 0.00 56.30 58.80 2igk h ASN 257 Cb 1.29 -0.16 -0.03 0.00 0.27 0.00 0.00 38.32 39.68 2igk h ASN 257 CO -0.47 0.47 0.42 0.74 -0.37 0.00 0.00 177.43 178.22 2igk h THR 258 N 0.77 1.19 -0.24 -3.57 2.02 -1.67 -3.00 112.91 108.40 2igk h THR 258 Ca 0.21 -0.39 -0.09 0.00 0.77 0.00 0.00 66.41 66.91 2igk h THR 258 Cb -0.09 0.24 -0.00 0.00 -1.74 0.00 0.00 68.15 66.55 2igk h THR 258 CO -0.05 0.19 -0.19 0.58 0.37 0.00 0.00 175.52 176.43 2igk h VAL 259 N 0.91 1.31 -2.22 3.16 2.07 -1.08 -3.45 116.25 116.95 2igk h VAL 259 Ca 0.24 -1.32 -0.01 0.00 0.82 0.00 0.00 66.70 66.43 2igk h VAL 259 Cb -0.06 1.63 -0.23 0.00 -1.52 0.00 0.00 31.29 31.12 2igk h VAL 259 CO -0.05 0.41 -0.16 0.12 0.02 0.00 0.00 177.57 177.91 2igk s PHE 260 N -4.44 -1.02 -1.34 1.57 5.36 -0.23 -4.76 117.98 113.12 2igk s PHE 260 Ca -0.13 1.92 0.18 0.00 -0.96 0.00 0.00 56.93 57.94 2igk s PHE 260 Cb 0.07 0.56 0.89 0.00 -0.34 0.00 0.00 43.02 44.20 2igk s PHE 260 CO 0.79 -0.53 1.55 -0.40 -1.46 0.00 0.00 175.22 175.18 2igk n ASP 261 N 4.86 0.00 -0.02 6.13 5.68 -1.18 -3.96 116.55 128.07 2igk n ASP 261 Ca -0.16 0.12 -0.00 0.00 -0.50 0.00 0.00 54.79 54.25 2igk n ASP 261 Cb 0.53 -0.33 -0.00 0.00 -1.14 0.00 0.00 41.12 40.19 2igk n ASP 261 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 2igk n LEU 262 N -1.33 0.56 -4.77 -2.12 4.77 -1.26 -4.20 117.00 108.66 2igk n LEU 262 Ca 0.08 0.00 -0.39 0.00 -0.03 0.00 0.00 56.01 55.67 2igk n LEU 262 Cb 0.16 -1.67 -0.04 0.00 -2.33 0.00 0.00 43.42 39.54 2igk n LEU 262 CO 0.14 -0.58 0.80 -1.10 -1.33 0.00 0.00 177.39 175.32 2igk s GLN 263 N -1.20 4.44 0.52 3.23 -1.52 -1.26 -4.76 119.66 119.11 2igk s GLN 263 Ca 0.00 1.77 -0.22 0.00 -1.95 0.00 0.00 55.36 54.97 2igk s GLN 263 Cb 0.00 -2.98 -0.06 0.00 -0.22 0.00 0.00 33.01 29.76 2igk s GLN 263 CO 0.00 0.04 1.26 -0.80 -0.25 0.00 0.00 175.29 175.54 2igk s ASN 264 N -1.03 5.61 0.04 5.90 0.01 -1.26 -4.87 114.94 119.33 2igk s ASN 264 Ca 0.49 2.54 0.03 0.00 -0.71 0.00 0.00 52.86 55.21 2igk s ASN 264 Cb -0.30 -2.62 -0.02 0.00 0.41 0.00 0.00 41.25 38.72 2igk s ASN 264 CO 0.39 -1.32 -0.10 -0.13 -1.51 0.00 0.00 177.10 174.43 2igk s ARG 265 N -2.88 0.67 0.55 -0.60 0.52 -0.02 -4.25 118.95 112.94 2igk s ARG 265 Ca 0.69 -0.72 -0.19 0.00 -0.52 0.00 0.00 55.73 55.00 2igk s ARG 265 Cb -0.34 -0.57 -0.05 0.00 0.52 0.00 0.00 34.95 34.51 2igk s ARG 265 CO 0.41 0.13 1.13 -2.14 0.02 0.00 0.00 175.30 174.84 2igk s PRO 266 N -1.30 3.30 0.28 3.54 0.02 -0.63 -1.57 135.00 138.64 2igk s PRO 266 Ca -0.04 1.59 -0.03 0.00 0.02 0.00 0.00 61.00 62.53 2igk s PRO 266 Cb -0.08 -2.00 -0.01 0.00 0.02 0.00 0.00 34.50 32.42 2igk s PRO 266 CO 0.01 -0.88 0.36 0.54 -0.33 0.00 0.00 177.00 176.69 2igk s ASN 267 N -1.86 0.56 0.30 2.53 2.20 -1.13 -4.96 114.94 112.59 2igk s ASN 267 Ca 0.72 -1.36 0.05 0.00 -0.94 0.00 0.00 52.86 51.34 2igk s ASN 267 Cb -0.23 0.55 0.74 0.00 -2.00 0.00 0.00 41.25 40.31 2igk s ASN 267 CO 0.28 -1.11 1.75 0.74 -2.94 0.00 0.00 177.10 175.83 2igk h THR 268 N 2.29 0.64 0.00 0.54 2.02 -1.97 -0.20 112.91 116.23 2igk h THR 268 Ca -0.29 -0.22 -0.03 0.00 0.77 0.00 0.00 66.41 66.63 2igk h THR 268 Cb 1.24 -0.07 -0.00 0.00 -1.74 0.00 0.00 68.15 67.58 2igk h THR 268 CO 0.41 0.12 -0.25 0.44 0.37 0.00 0.00 175.52 176.62 2igk h ASP 269 N 0.65 0.00 -1.83 4.18 3.32 -1.99 -3.38 116.42 117.37 2igk h ASP 269 Ca 0.58 0.00 -0.51 0.00 0.02 0.00 0.00 57.03 57.11 2igk h ASP 269 Cb 0.96 0.00 -0.37 0.00 0.22 0.00 0.00 39.33 40.14 2igk h ASP 269 CO -0.42 0.14 -1.08 0.00 -1.72 0.00 0.00 179.24 176.16 2igk n ALA 270 N -2.14 2.02 0.41 3.45 0.00 -0.21 -5.00 120.51 119.04 2igk n ALA 270 Ca 0.03 -3.23 0.12 0.00 0.00 0.00 0.00 53.44 50.35 2igk n ALA 270 Cb 0.59 -0.88 0.49 0.00 0.00 0.00 0.00 19.45 19.65 2igk n ALA 270 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2igk n PRO 271 N 1.15 0.20 -0.13 0.00 -0.04 -0.48 -2.51 135.00 133.19 2igk n PRO 271 Ca 0.21 0.42 0.10 0.00 -0.04 0.00 0.00 63.50 64.18 2igk n PRO 271 Cb 0.57 -1.88 0.16 0.00 -0.04 0.00 0.00 33.50 32.31 2igk n PRO 271 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2igk n GLU 272 N -2.26 2.12 -3.70 0.54 -0.58 -1.26 -4.72 120.64 110.78 2igk n GLU 272 Ca 0.02 -1.97 -0.24 0.00 -0.42 0.00 0.00 57.16 54.55 2igk n GLU 272 Cb 0.24 -1.40 -0.02 0.00 -0.57 0.00 0.00 31.44 29.69 2igk n GLU 272 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 2igk s GLU 273 N -1.34 3.48 -0.14 3.49 2.02 -1.05 -4.94 118.70 120.22 2igk s GLU 273 Ca 0.30 -0.49 -0.02 0.00 0.02 0.00 0.00 54.97 54.77 2igk s GLU 273 Cb 0.18 -2.80 0.04 0.00 0.10 0.00 0.00 34.13 31.65 2igk s GLU 273 CO 0.25 0.33 0.01 1.03 0.02 0.00 0.00 175.26 176.91 2igk s ARG 274 N -3.86 0.72 -0.24 1.61 0.52 -1.26 -1.60 118.95 114.84 2igk s ARG 274 Ca 0.37 -0.21 -0.16 0.00 -0.52 0.00 0.00 55.73 55.21 2igk s ARG 274 Cb -0.10 -1.63 0.07 0.00 0.52 0.00 0.00 34.95 33.80 2igk s ARG 274 CO 0.31 -0.48 0.59 0.12 0.02 0.00 0.00 175.30 175.87 2igk s PHE 275 N 1.89 -0.82 -0.05 -0.53 5.36 -0.61 -1.90 117.98 121.31 2igk s PHE 275 Ca 0.02 1.76 0.03 0.00 -0.96 0.00 0.00 56.93 57.78 2igk s PHE 275 Cb -0.15 0.41 0.01 0.00 -0.34 0.00 0.00 43.02 42.95 2igk s PHE 275 CO -0.07 -0.42 -0.13 -0.80 -1.46 0.00 0.00 175.22 172.35 2igk s ASN 276 N 1.16 1.79 -0.19 6.13 -0.87 -0.70 -0.84 114.94 121.42 2igk s ASN 276 Ca -0.07 -0.30 -0.08 0.00 -1.57 0.00 0.00 52.86 50.85 2igk s ASN 276 Cb -0.06 -0.70 -0.04 0.00 -0.02 0.00 0.00 41.25 40.43 2igk s ASN 276 CO -0.11 0.07 0.08 -0.22 -2.57 0.00 0.00 177.10 174.34 2igk s LEU 277 N 0.44 3.89 -0.46 0.60 2.96 -1.26 -0.53 118.68 124.32 2igk s LEU 277 Ca -0.10 0.11 0.02 0.00 -0.22 0.00 0.00 54.13 53.93 2igk s LEU 277 Cb -0.14 -1.99 0.12 0.00 0.50 0.00 0.00 46.19 44.69 2igk s LEU 277 CO 0.03 0.17 0.22 -0.36 -1.32 0.00 0.00 176.35 175.09 2igk s PHE 278 N 0.41 3.48 0.72 5.38 0.08 0.60 -4.97 117.98 123.67 2igk s PHE 278 Ca 0.04 -2.91 -0.11 0.00 0.12 0.00 0.00 56.93 54.07 2igk s PHE 278 Cb -0.12 -3.00 0.02 0.00 -0.57 0.00 0.00 43.02 39.35 2igk s PHE 278 CO -0.00 -0.87 1.08 -2.14 -0.10 0.00 0.00 175.22 173.19 2igk s PRO 279 N 0.37 2.77 -1.40 0.24 0.02 -1.26 -1.86 135.00 133.87 2igk s PRO 279 Ca 0.14 0.63 -0.07 0.00 0.02 0.00 0.00 61.00 61.71 2igk s PRO 279 Cb -0.22 -2.00 0.04 0.00 0.02 0.00 0.00 34.50 32.34 2igk s PRO 279 CO -0.04 -1.14 0.93 0.00 -0.33 0.00 0.00 177.00 176.42 2igk n ALA 280 N -3.11 -1.60 -3.95 -1.55 0.00 0.30 -4.86 120.51 105.75 2igk n ALA 280 Ca 0.07 0.09 -0.30 0.00 0.00 0.00 0.00 53.44 53.30 2igk n ALA 280 Cb 0.56 -3.64 -0.16 0.00 0.00 0.00 0.00 19.45 16.20 2igk n ALA 280 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2igk s VAL 281 N -3.43 1.42 -0.23 0.00 1.01 0.10 -0.68 120.40 118.59 2igk s VAL 281 Ca 0.37 -0.88 -0.29 0.00 0.00 0.00 0.00 61.98 61.19 2igk s VAL 281 Cb -0.18 -1.55 -0.01 0.00 0.00 0.00 0.00 36.38 34.64 2igk s VAL 281 CO 0.80 0.13 1.33 0.00 0.00 0.00 0.00 175.10 177.36 2igk s ALA 282 N 1.49 3.49 -0.13 5.51 0.00 -0.34 -2.54 121.76 129.24 2igk s ALA 282 Ca -0.01 0.31 -0.22 0.00 0.00 0.00 0.00 51.96 52.05 2igk s ALA 282 Cb -0.16 -3.72 -0.03 0.00 0.00 0.00 0.00 23.12 19.21 2igk s ALA 282 CO -0.08 -1.53 0.66 0.00 0.00 0.00 0.00 175.76 174.81 2igk n GLU 284 N 4.31 0.70 -3.47 0.00 1.02 0.09 -4.96 120.64 118.33 2igk n GLU 284 Ca -0.02 0.07 -0.12 0.00 -0.02 0.00 0.00 57.16 57.07 2igk n GLU 284 Cb 0.51 -1.28 -0.03 0.00 -0.02 0.00 0.00 31.44 30.61 2igk n GLU 284 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 2igk s ARG 285 N -2.28 1.05 -0.05 3.49 1.70 -1.18 -4.72 118.95 116.97 2igk s ARG 285 Ca -0.16 -0.27 -0.02 0.00 -0.47 0.00 0.00 55.73 54.80 2igk s ARG 285 Cb 0.05 0.49 -0.04 0.00 -0.57 0.00 0.00 34.95 34.88 2igk s ARG 285 CO 0.35 -0.44 0.08 0.14 -1.08 0.00 0.00 175.30 174.35 2igk s VAL 286 N -3.01 4.84 -0.26 4.99 -7.23 -1.26 -0.46 120.40 118.01 2igk s VAL 286 Ca 0.00 -0.22 -0.10 0.00 -1.81 0.00 0.00 61.98 59.85 2igk s VAL 286 Cb -0.01 -3.15 -0.04 0.00 0.56 0.00 0.00 36.38 33.74 2igk s VAL 286 CO -0.07 0.47 0.15 -0.69 -0.31 0.00 0.00 175.10 174.64 2igk s VAL 287 N -1.09 5.04 0.30 1.32 1.01 -0.46 -4.72 120.40 121.80 2igk s VAL 287 Ca 0.19 0.08 -0.18 0.00 0.00 0.00 0.00 61.98 62.07 2igk s VAL 287 Cb -0.12 -3.38 -0.09 0.00 0.00 0.00 0.00 36.38 32.79 2igk s VAL 287 CO 0.09 0.29 0.77 -0.13 0.00 0.00 0.00 175.10 176.13 2igk s ARG 288 N 1.61 4.15 0.95 2.72 0.52 -1.26 -0.35 118.95 127.28 2igk s ARG 288 Ca 0.07 0.83 -0.12 0.00 -0.52 0.00 0.00 55.73 55.99 2igk s ARG 288 Cb -0.15 -2.56 0.16 0.00 0.52 0.00 0.00 34.95 32.91 2igk s ARG 288 CO 0.08 0.22 1.12 0.54 0.02 0.00 0.00 175.30 177.28 2igk s ASN 289 N -2.02 3.13 0.38 0.23 4.22 -0.81 -4.85 114.94 115.22 2igk s ASN 289 Ca 0.51 1.02 0.06 0.00 -2.14 0.00 0.00 52.86 52.31 2igk s ASN 289 Cb -0.13 -1.62 0.76 0.00 1.28 0.00 0.00 41.25 41.54 2igk s ASN 289 CO 0.18 -2.79 1.99 0.00 -2.04 0.00 0.00 177.10 174.44 2igk h ALA 290 N -1.66 1.58 0.00 3.54 0.00 -1.98 -1.95 119.26 118.78 2igk h ALA 290 Ca -0.52 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.30 2igk h ALA 290 Cb 1.33 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2igk h ALA 290 CO 0.60 0.34 0.00 1.28 0.00 0.00 0.00 179.25 181.47 2igk n LEU 291 N -4.40 0.00 -3.98 0.00 4.77 -1.26 -4.90 117.00 107.23 2igk n LEU 291 Ca 0.03 0.16 -0.26 0.00 -0.03 0.00 0.00 56.01 55.90 2igk n LEU 291 Cb 0.13 -0.16 -0.02 0.00 -2.33 0.00 0.00 43.42 41.03 2igk n LEU 291 CO 0.37 -0.02 -0.22 0.59 -1.33 0.00 0.00 177.39 176.78 2igk n ASN 292 N -1.16 -0.60 0.00 -1.43 3.02 -0.73 -4.89 115.26 109.46 2igk n ASN 292 Ca 0.17 -1.01 0.00 0.00 -0.03 0.00 0.00 54.58 53.71 2igk n ASN 292 Cb 0.16 -3.01 0.00 0.00 -0.61 0.00 0.00 39.78 36.32 2igk n ASN 292 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2igk n SER 293 N -2.96 0.01 -3.64 6.41 3.41 -1.26 -4.47 113.62 111.12 2igk n SER 293 Ca -0.27 -0.46 -0.15 0.00 -0.26 0.00 0.00 58.87 57.72 2igk n SER 293 Cb 0.67 0.90 -0.08 0.00 -0.26 0.00 0.00 64.21 65.44 2igk n SER 293 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 2igk s GLU 294 N -0.90 0.82 0.03 4.33 2.12 -1.26 -1.14 118.70 122.70 2igk s GLU 294 Ca 0.00 0.25 -0.23 0.00 0.36 0.00 0.00 54.97 55.35 2igk s GLU 294 Cb 0.00 0.38 -0.06 0.00 0.26 0.00 0.00 34.13 34.72 2igk s GLU 294 CO 0.00 -0.21 0.69 0.42 -0.54 0.00 0.00 175.26 175.61 2igk s ILE 295 N -0.84 4.80 -0.06 -3.70 -1.09 -1.26 -1.92 121.20 117.13 2igk s ILE 295 Ca -0.09 1.45 0.18 0.00 -2.23 0.00 0.00 60.65 59.97 2igk s ILE 295 Cb -0.03 -4.03 -0.28 0.00 -1.58 0.00 0.00 42.46 36.55 2igk s ILE 295 CO 0.06 0.40 0.34 -0.62 -1.23 0.00 0.00 174.94 173.89 2igk n GLU 296 N 2.70 0.68 -3.72 2.79 -0.58 0.52 -4.95 120.64 118.08 2igk n GLU 296 Ca -0.05 -0.14 -0.01 0.00 -0.42 0.00 0.00 57.16 56.54 2igk n GLU 296 Cb 0.50 -1.45 -0.01 0.00 -0.57 0.00 0.00 31.44 29.92 2igk n GLU 296 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 2igk s SER 297 N -4.37 -0.11 -0.13 1.62 1.04 -1.25 -4.77 113.70 105.72 2igk s SER 297 Ca -0.07 -0.33 0.02 0.00 0.48 0.00 0.00 55.95 56.05 2igk s SER 297 Cb 0.11 0.37 0.01 0.00 0.10 0.00 0.00 66.02 66.61 2igk s SER 297 CO 0.77 -0.69 -0.19 -0.22 0.98 0.00 0.00 173.24 173.90 2igk s LEU 298 N -3.02 1.92 -0.19 2.42 2.96 0.05 -1.36 118.68 121.47 2igk s LEU 298 Ca 0.14 -0.53 -0.18 0.00 -0.22 0.00 0.00 54.13 53.34 2igk s LEU 298 Cb 0.01 -1.29 -0.03 0.00 0.50 0.00 0.00 46.19 45.38 2igk s LEU 298 CO 0.00 0.04 0.49 -1.00 -1.32 0.00 0.00 176.35 174.56 2igk s HIS 299 N 0.98 3.39 0.22 5.38 3.76 0.39 -0.78 115.29 128.64 2igk s HIS 299 Ca -0.05 0.76 0.10 0.00 -0.15 0.00 0.00 55.06 55.72 2igk s HIS 299 Cb -0.15 -2.63 -0.05 0.00 1.11 0.00 0.00 32.58 30.86 2igk s HIS 299 CO -0.03 -0.05 -0.19 0.96 -0.85 0.00 0.00 174.74 174.58 2igk s ILE 300 N 1.46 2.11 -0.18 0.60 -4.36 -0.60 -0.73 121.20 119.50 2igk s ILE 300 Ca 0.23 -2.20 -0.02 0.00 -0.26 0.00 0.00 60.65 58.40 2igk s ILE 300 Cb -0.15 -2.11 0.05 0.00 1.25 0.00 0.00 42.46 41.50 2igk s ILE 300 CO 0.09 -0.40 0.00 -2.28 0.24 0.00 0.00 174.94 172.59 2igk s HIS 301 N -2.44 1.33 -0.26 1.37 5.65 0.27 -2.18 115.29 119.03 2igk s HIS 301 Ca 0.24 -0.98 -0.29 0.00 0.25 0.00 0.00 55.06 54.28 2igk s HIS 301 Cb -0.04 -1.14 0.00 0.00 -1.18 0.00 0.00 32.58 30.21 2igk s HIS 301 CO 0.10 -0.61 1.23 0.34 -0.65 0.00 0.00 174.74 175.15 2igk s ASP 302 N 1.76 6.83 0.29 9.88 -1.08 0.22 -1.20 116.67 133.37 2igk s ASP 302 Ca -0.01 1.33 0.26 0.00 -0.52 0.00 0.00 52.55 53.61 2igk s ASP 302 Cb -0.17 -2.54 0.78 0.00 -1.46 0.00 0.00 42.92 39.54 2igk s ASP 302 CO -0.07 -0.92 1.75 -0.07 0.52 0.00 0.00 175.17 176.37 2igk h LEU 303 N 10.31 0.00 0.00 -1.34 3.38 -1.21 0.33 115.31 126.78 2igk h LEU 303 Ca -0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.72 2igk h LEU 303 Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.84 2igk h LEU 303 CO 1.01 0.00 -0.37 0.40 0.09 0.00 0.00 178.44 179.57 2igk h ILE 304 N 0.00 0.00 0.00 1.22 1.08 -1.91 -3.39 117.51 114.51 2igk h ILE 304 Ca 0.00 -0.96 -0.08 0.00 -0.39 0.00 0.00 64.86 63.44 2igk h ILE 304 Cb 0.71 0.00 -0.01 0.00 -3.07 0.00 0.00 36.82 34.45 2igk h ILE 304 CO 0.00 0.00 -0.36 0.77 -0.69 0.00 0.00 178.15 177.87 2igk h SER 305 N -0.96 0.00 0.00 1.72 4.64 -1.94 -3.47 113.55 113.54 2igk h SER 305 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2igk h SER 305 Cb 0.37 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 2igk h SER 305 CO 0.00 0.36 0.00 0.61 -0.87 0.00 0.00 176.83 176.93 2igk n GLY 306 N -0.48 2.04 3.75 -0.77 0.00 0.12 -5.03 105.19 104.82 2igk n GLY 306 Ca -0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 2igk n GLY 306 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2igk s ASP 307 N -3.51 4.85 0.09 1.61 1.01 -1.24 -4.67 116.67 114.81 2igk s ASP 307 Ca 0.00 2.30 0.09 0.00 0.71 0.00 0.00 52.55 55.65 2igk s ASP 307 Cb 0.00 -2.59 -0.04 0.00 1.01 0.00 0.00 42.92 41.31 2igk s ASP 307 CO 0.00 -1.82 -0.23 -0.13 0.21 0.00 0.00 175.17 173.20 2igk s ARG 308 N -3.67 1.73 0.05 8.23 0.52 -1.26 -0.61 118.95 123.94 2igk s ARG 308 Ca 0.74 -1.17 -0.02 0.00 -0.52 0.00 0.00 55.73 54.75 2igk s ARG 308 Cb -0.28 -2.03 -0.03 0.00 0.52 0.00 0.00 34.95 33.13 2igk s ARG 308 CO 0.38 0.49 0.01 -0.06 0.02 0.00 0.00 175.30 176.15 2igk s PHE 309 N -0.98 0.43 -0.22 -0.53 0.08 -0.93 -5.01 117.98 110.82 2igk s PHE 309 Ca 0.14 -0.94 -0.04 0.00 0.12 0.00 0.00 56.93 56.22 2igk s PHE 309 Cb -0.10 -0.31 -0.01 0.00 -0.57 0.00 0.00 43.02 42.02 2igk s PHE 309 CO 0.06 -0.39 -0.04 -1.83 -0.10 0.00 0.00 175.22 172.91 2igk s GLU 310 N -3.71 3.39 -0.15 0.44 -1.05 -1.26 -1.55 118.70 114.80 2igk s GLU 310 Ca 0.05 -0.62 -0.09 0.00 -0.15 0.00 0.00 54.97 54.17 2igk s GLU 310 Cb 0.06 -3.02 -0.04 0.00 -0.44 0.00 0.00 34.13 30.68 2igk s GLU 310 CO -0.09 -0.19 0.15 0.42 0.95 0.00 0.00 175.26 176.49 2igk s ILE 311 N 1.47 5.45 -0.04 1.83 -1.09 0.04 -4.89 121.20 123.98 2igk s ILE 311 Ca 0.06 0.22 -0.01 0.00 -2.23 0.00 0.00 60.65 58.69 2igk s ILE 311 Cb -0.14 -3.44 -0.04 0.00 -1.58 0.00 0.00 42.46 37.26 2igk s ILE 311 CO -0.03 0.54 0.03 -0.54 -1.23 0.00 0.00 174.94 173.71 2igk s LYS 312 N -0.43 2.96 0.15 2.79 1.02 0.13 -0.77 119.74 125.59 2igk s LYS 312 Ca 0.12 -0.48 -0.12 0.00 0.02 0.00 0.00 55.97 55.51 2igk s LYS 312 Cb -0.12 -2.79 0.01 0.00 -0.52 0.00 0.00 37.83 34.42 2igk s LYS 312 CO 0.02 0.67 0.33 0.00 -0.92 0.00 0.00 175.35 175.45 2igk s ALA 313 N -1.04 -0.40 0.16 5.17 0.00 -1.26 -1.15 121.76 123.25 2igk s ALA 313 Ca 0.18 -0.55 -0.03 0.00 0.00 0.00 0.00 51.96 51.56 2igk s ALA 313 Cb -0.12 0.75 0.01 0.00 0.00 0.00 0.00 23.12 23.76 2igk s ALA 313 CO 0.08 -0.65 1.39 -0.44 0.00 0.00 0.00 175.76 176.14 2igk h ASP 314 N 2.49 0.52 -3.71 0.00 3.32 -0.96 -3.46 116.42 114.62 2igk h ASP 314 Ca -0.32 -0.36 -0.46 0.00 0.02 0.00 0.00 57.03 55.91 2igk h ASP 314 Cb 1.23 -0.15 -0.32 0.00 0.22 0.00 0.00 39.33 40.31 2igk h ASP 314 CO 0.47 1.12 -0.80 -0.69 -1.72 0.00 0.00 179.24 177.62 2igk s VAL 315 N -3.54 0.91 -0.15 -1.35 1.01 -0.59 -4.81 120.40 111.89 2igk s VAL 315 Ca -0.06 -0.40 0.02 0.00 0.00 0.00 0.00 61.98 61.54 2igk s VAL 315 Cb 0.10 -0.82 0.01 0.00 0.00 0.00 0.00 36.38 35.68 2igk s VAL 315 CO 0.85 0.29 -0.20 -0.31 0.00 0.00 0.00 175.10 175.73 2igk s TYR 316 N 0.35 2.60 -0.09 5.22 1.51 -0.42 -1.24 117.35 125.28 2igk s TYR 316 Ca -0.07 -1.40 0.04 0.00 -1.01 0.00 0.00 57.07 54.63 2igk s TYR 316 Cb -0.11 -1.79 0.00 0.00 -0.11 0.00 0.00 41.96 39.95 2igk s TYR 316 CO 0.01 -0.67 -0.22 0.08 -1.11 0.00 0.00 175.55 173.64 2igk s VAL 317 N 1.05 1.86 -0.27 0.71 1.01 -0.07 -0.84 120.40 123.85 2igk s VAL 317 Ca -0.02 -0.91 -0.03 0.00 0.00 0.00 0.00 61.98 61.02 2igk s VAL 317 Cb -0.14 -1.62 0.02 0.00 0.00 0.00 0.00 36.38 34.64 2igk s VAL 317 CO -0.06 0.52 -0.00 -0.76 0.00 0.00 0.00 175.10 174.79 2igk s LEU 318 N 0.37 3.50 -0.36 3.92 1.43 -0.14 -1.01 118.68 126.39 2igk s LEU 318 Ca -0.17 -0.86 0.14 0.00 -1.03 0.00 0.00 54.13 52.21 2igk s LEU 318 Cb -0.17 -1.75 0.45 0.00 0.03 0.00 0.00 46.19 44.75 2igk s LEU 318 CO 0.08 -0.17 1.00 0.35 0.23 0.00 0.00 176.35 177.84 2igk n THR 319 N 4.73 1.44 0.50 5.49 -2.24 0.57 -0.72 114.28 124.05 2igk n THR 319 Ca -0.15 -3.66 0.06 0.00 -2.27 0.00 0.00 64.05 58.03 2igk n THR 319 Cb 0.47 0.05 0.20 0.00 -2.10 0.00 0.00 70.33 68.95 2igk n THR 319 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2igk n ALA 320 N -0.20 2.58 0.00 6.98 0.00 -1.09 -4.30 120.51 124.48 2igk n ALA 320 Ca 0.19 -0.82 0.00 0.00 0.00 0.00 0.00 53.44 52.81 2igk n ALA 320 Cb 0.77 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 19.23 2igk n ALA 320 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2igk n GLY 321 N 1.05 0.96 0.34 0.00 0.00 -1.26 -4.13 105.19 102.15 2igk n GLY 321 Ca 0.15 -1.80 0.05 0.00 0.00 0.00 0.00 46.02 44.42 2igk n GLY 321 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2igk h ALA 322 N 0.00 1.65 0.00 4.61 0.00 -1.90 0.88 119.26 124.50 2igk h ALA 322 Ca 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2igk h ALA 322 Cb 0.00 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 2igk h ALA 322 CO 0.00 0.27 -0.06 0.28 0.00 0.00 0.00 179.25 179.74 2igk h VAL 323 N 0.77 1.76 0.00 0.00 2.07 -1.95 -3.29 116.25 115.61 2igk h VAL 323 Ca 0.27 -2.34 -0.07 0.00 0.82 0.00 0.00 66.70 65.38 2igk h VAL 323 Cb 0.11 3.35 -0.01 0.00 -1.52 0.00 0.00 31.29 33.22 2igk h VAL 323 CO -0.08 0.60 -0.34 0.45 0.02 0.00 0.00 177.57 178.22 2igk h HIS 324 N -1.00 0.00 -0.71 1.57 -0.00 -1.69 -0.91 115.15 112.41 2igk h HIS 324 Ca -0.02 0.00 -0.04 0.00 -0.00 0.00 0.00 60.37 60.31 2igk h HIS 324 Cb 1.01 0.00 -0.03 0.00 -0.00 0.00 0.00 27.41 28.39 2igk h HIS 324 CO 0.27 0.34 0.28 -0.91 -0.00 0.00 0.00 177.93 177.91 2igk h ASN 325 N 0.00 0.99 -0.56 2.45 2.35 -0.98 -1.28 115.58 118.54 2igk h ASN 325 Ca -0.00 -0.18 -0.09 0.00 -0.55 0.00 0.00 56.30 55.48 2igk h ASN 325 Cb 0.90 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 39.00 2igk h ASN 325 CO 0.04 0.90 -0.01 0.74 -1.65 0.00 0.00 177.43 177.45 2igk h THR 326 N 1.02 1.27 -0.37 2.81 2.02 -1.48 -1.69 112.91 116.49 2igk h THR 326 Ca 0.24 -1.13 0.01 0.00 0.77 0.00 0.00 66.41 66.29 2igk h THR 326 Cb 0.22 0.88 -0.02 0.00 -1.74 0.00 0.00 68.15 67.48 2igk h THR 326 CO -0.02 0.41 0.23 -0.61 0.37 0.00 0.00 175.52 175.90 2igk h GLN 327 N 0.88 0.46 -0.44 6.66 4.15 -0.97 -0.01 115.11 125.86 2igk h GLN 327 Ca 0.16 -0.03 -0.13 0.00 0.77 0.00 0.00 58.65 59.42 2igk h GLN 327 Cb 0.55 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 28.13 2igk h GLN 327 CO 0.03 0.31 -0.24 1.25 -1.93 0.00 0.00 178.83 178.25 2igk h LEU 328 N 0.48 0.93 -0.46 -2.39 6.46 -1.03 0.05 115.31 119.36 2igk h LEU 328 Ca 0.14 -0.36 -0.05 0.00 -0.12 0.00 0.00 57.88 57.49 2igk h LEU 328 Cb -0.04 -0.26 -0.02 0.00 -0.73 0.00 0.00 40.66 39.62 2igk h LEU 328 CO -0.04 1.12 0.08 -0.07 -0.62 0.00 0.00 178.44 178.92 2igk h LEU 329 N 0.78 0.72 -0.69 2.25 3.38 -1.05 -1.89 115.31 118.80 2igk h LEU 329 Ca 0.10 -0.25 -0.09 0.00 0.09 0.00 0.00 57.88 57.72 2igk h LEU 329 Cb 0.80 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.33 2igk h LEU 329 CO 0.07 0.79 -0.02 0.58 0.09 0.00 0.00 178.44 179.95 2igk h VAL 330 N 0.62 1.26 0.00 1.22 2.07 -0.78 -0.76 116.25 119.87 2igk h VAL 330 Ca 0.14 -1.14 0.00 0.00 0.82 0.00 0.00 66.70 66.52 2igk h VAL 330 Cb 0.37 0.84 0.00 0.00 -1.52 0.00 0.00 31.29 30.98 2igk h VAL 330 CO 0.01 0.41 0.00 -3.20 0.02 0.00 0.00 177.57 174.81 2igk n ASN 331 N -4.18 0.20 -0.88 0.57 5.15 -0.01 -2.33 115.26 113.78 2igk n ASN 331 Ca 0.03 0.57 0.10 0.00 -0.60 0.00 0.00 54.58 54.67 2igk n ASN 331 Cb 0.35 -0.60 0.14 0.00 -0.53 0.00 0.00 39.78 39.13 2igk n ASN 331 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 2igk n SER 332 N -1.74 2.92 0.00 1.20 7.64 -0.40 -4.89 113.62 118.35 2igk n SER 332 Ca 0.02 -1.87 0.00 0.00 1.01 0.00 0.00 58.87 58.03 2igk n SER 332 Cb 0.12 -0.12 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2igk n SER 332 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2igk n GLY 333 N 1.16 0.89 3.89 0.23 0.00 -0.98 -4.74 105.19 105.63 2igk n GLY 333 Ca 0.14 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.87 2igk n GLY 333 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2igk s PHE 334 N -2.02 3.48 0.00 1.61 0.40 -0.58 -4.73 117.98 116.14 2igk s PHE 334 Ca 0.00 0.91 0.00 0.00 -0.60 0.00 0.00 56.93 57.24 2igk s PHE 334 Cb 0.00 -2.33 0.00 0.00 0.51 0.00 0.00 43.02 41.20 2igk s PHE 334 CO 0.00 -0.06 0.00 0.41 0.70 0.00 0.00 175.22 176.27 2igk n GLY 335 N -1.33 2.07 2.84 4.36 0.00 0.16 -4.01 105.19 109.27 2igk n GLY 335 Ca 0.01 -0.46 -0.15 0.00 0.00 0.00 0.00 46.02 45.42 2igk n GLY 335 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2igk s GLN 336 N 0.00 0.20 0.28 1.61 0.74 -1.26 -4.67 119.66 116.56 2igk s GLN 336 Ca 0.00 0.04 -0.21 0.00 0.05 0.00 0.00 55.36 55.24 2igk s GLN 336 Cb 0.00 -0.33 -0.09 0.00 1.10 0.00 0.00 33.01 33.68 2igk s GLN 336 CO 0.00 -0.08 0.82 -1.17 -0.55 0.00 0.00 175.29 174.31 2igk s LEU 337 N 0.67 4.28 0.00 3.68 2.96 -1.26 -4.69 118.68 124.32 2igk s LEU 337 Ca -0.06 1.56 0.00 0.00 -0.22 0.00 0.00 54.13 55.41 2igk s LEU 337 Cb -0.09 -3.86 0.00 0.00 0.50 0.00 0.00 46.19 42.73 2igk s LEU 337 CO -0.01 -0.06 0.00 0.61 -1.32 0.00 0.00 176.35 175.57 2igk n GLY 338 N 0.43 -0.26 3.71 7.98 0.00 0.16 -4.86 105.19 112.35 2igk n GLY 338 Ca 0.01 -1.86 -0.43 0.00 0.00 0.00 0.00 46.02 43.73 2igk n GLY 338 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2igk n ARG 339 N -0.35 2.51 -1.66 1.61 0.63 -1.26 -4.53 116.66 113.61 2igk n ARG 339 Ca 0.00 0.90 -0.46 0.00 -0.92 0.00 0.00 57.85 57.37 2igk n ARG 339 Cb 0.00 -2.69 -0.04 0.00 0.45 0.00 0.00 32.46 30.18 2igk n ARG 339 CO 0.00 0.00 0.00 -2.30 -2.51 0.00 0.00 177.63 172.82 2igk n PRO 340 N 3.10 2.06 -3.59 -0.14 -0.02 -1.26 -4.96 135.00 130.19 2igk n PRO 340 Ca 0.14 0.74 -0.29 0.00 -2.02 0.00 0.00 63.50 62.07 2igk n PRO 340 Cb 0.33 -2.50 -0.14 0.00 -0.02 0.00 0.00 33.50 31.17 2igk n PRO 340 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 2igk s ASN 341 N 0.85 3.59 0.21 2.55 3.04 -1.26 -5.00 114.94 118.91 2igk s ASN 341 Ca 0.79 -1.59 0.20 0.00 0.04 0.00 0.00 52.86 52.30 2igk s ASN 341 Cb -0.70 -0.53 0.90 0.00 -1.54 0.00 0.00 41.25 39.38 2igk s ASN 341 CO 0.39 -0.40 1.62 -0.81 -3.04 0.00 0.00 177.10 174.86 2igk n PRO 342 N 4.87 0.14 0.01 0.43 -0.04 -1.26 -0.85 135.00 138.30 2igk n PRO 342 Ca -0.01 0.44 0.11 0.00 -0.04 0.00 0.00 63.50 63.99 2igk n PRO 342 Cb 0.41 -1.80 0.46 0.00 -0.04 0.00 0.00 33.50 32.52 2igk n PRO 342 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2igk n ALA 343 N -1.71 1.99 -3.17 0.55 0.00 -1.26 -4.10 120.51 112.81 2igk n ALA 343 Ca 0.02 -0.06 -0.19 0.00 0.00 0.00 0.00 53.44 53.20 2igk n ALA 343 Cb 0.17 -1.36 -0.03 0.00 0.00 0.00 0.00 19.45 18.23 2igk n ALA 343 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2igk n ASN 344 N -1.59 1.18 -4.75 0.00 2.85 -0.03 -5.13 115.26 107.79 2igk n ASN 344 Ca 0.05 -3.06 -0.38 0.00 -0.11 0.00 0.00 54.58 51.08 2igk n ASN 344 Cb 0.26 -0.62 0.04 0.00 1.24 0.00 0.00 39.78 40.71 2igk n ASN 344 CO 0.00 0.00 0.00 -2.84 -2.11 0.00 0.00 177.26 172.31 2igk s PRO 345 N -2.46 3.08 0.57 1.20 0.02 -1.26 -4.88 135.00 131.28 2igk s PRO 345 Ca 0.41 2.21 -0.17 0.00 0.02 0.00 0.00 61.00 63.47 2igk s PRO 345 Cb 0.33 -2.21 -0.05 0.00 0.02 0.00 0.00 34.50 32.59 2igk s PRO 345 CO -0.09 -1.23 1.07 -1.25 -0.33 0.00 0.00 177.00 175.17 2igk s PRO 346 N -2.96 3.36 0.21 5.54 0.04 -1.26 -4.97 135.00 134.96 2igk s PRO 346 Ca 0.73 1.32 -0.08 0.00 0.04 0.00 0.00 61.00 63.01 2igk s PRO 346 Cb -0.40 -2.03 0.15 0.00 0.04 0.00 0.00 34.50 32.25 2igk s PRO 346 CO 0.47 -0.79 1.76 1.49 0.04 0.00 0.00 177.00 179.97 2igk h GLU 347 N 0.73 1.17 -6.52 4.56 4.81 -1.92 -3.42 114.58 114.00 2igk h GLU 347 Ca -0.48 -0.23 -0.70 0.00 -0.13 0.00 0.00 59.36 57.83 2igk h GLU 347 Cb 1.23 -0.18 -0.29 0.00 0.63 0.00 0.00 28.75 30.14 2igk h GLU 347 CO 0.57 0.97 -0.86 -0.51 -0.73 0.00 0.00 179.01 178.45 2igk s LEU 348 N -9.68 2.20 -1.03 1.64 1.43 -1.26 -4.84 118.68 107.14 2igk s LEU 348 Ca -0.12 -0.41 -0.17 0.00 -1.03 0.00 0.00 54.13 52.40 2igk s LEU 348 Cb 0.15 -1.39 0.01 0.00 0.03 0.00 0.00 46.19 44.99 2igk s LEU 348 CO 0.84 0.32 0.71 0.18 0.23 0.00 0.00 176.35 178.63 2igk n LEU 349 N 2.43 -2.34 0.29 1.79 4.77 -1.26 -0.67 117.00 122.01 2igk n LEU 349 Ca -0.16 -0.98 0.19 0.00 -0.03 0.00 0.00 56.01 55.03 2igk n LEU 349 Cb 0.51 -2.09 0.98 0.00 -2.33 0.00 0.00 43.42 40.49 2igk n LEU 349 CO 0.24 0.37 1.08 1.55 -1.33 0.00 0.00 177.39 179.29 2igk h PRO 350 N -1.42 0.00 -0.01 3.23 0.13 -1.88 -0.93 132.00 131.12 2igk h PRO 350 Ca -0.60 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.53 2igk h PRO 350 Cb 1.34 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.47 2igk h PRO 350 CO 0.44 0.00 -0.19 0.43 -0.23 0.00 0.00 178.00 178.45 2igk n SER 351 N -2.93 0.87 -4.72 1.44 7.64 -1.26 -4.85 113.62 109.81 2igk n SER 351 Ca -0.02 -0.82 -0.42 0.00 1.01 0.00 0.00 58.87 58.62 2igk n SER 351 Cb 0.13 0.06 -0.03 0.00 -1.01 0.00 0.00 64.21 63.36 2igk n SER 351 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 2igk s LEU 352 N -2.46 4.37 0.00 -3.43 2.96 -0.35 -1.61 118.68 118.15 2igk s LEU 352 Ca 0.27 2.78 0.00 0.00 -0.22 0.00 0.00 54.13 56.96 2igk s LEU 352 Cb 0.20 -3.60 0.00 0.00 0.50 0.00 0.00 46.19 43.29 2igk s LEU 352 CO 0.49 -0.93 0.00 0.61 -1.32 0.00 0.00 176.35 175.21 2igk n GLY 353 N 3.92 0.94 3.80 7.98 0.00 0.26 -4.90 105.19 117.18 2igk n GLY 353 Ca 0.15 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.95 2igk n GLY 353 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2igk s SER 354 N -2.89 4.89 -1.19 1.61 0.01 -0.64 -0.48 113.70 115.02 2igk s SER 354 Ca 0.00 -0.73 0.00 0.00 1.31 0.00 0.00 55.95 56.53 2igk s SER 354 Cb 0.00 -0.73 0.00 0.00 0.21 0.00 0.00 66.02 65.50 2igk s SER 354 CO 0.00 -0.42 0.00 -1.22 0.41 0.00 0.00 173.24 172.01 2igk n TYR 355 N -1.30 -0.48 -2.32 2.43 4.02 -0.68 -4.64 117.16 114.18 2igk n TYR 355 Ca -0.01 0.00 -0.38 0.00 -0.01 0.00 0.00 57.90 57.50 2igk n TYR 355 Cb 0.61 -2.77 -0.02 0.00 -0.02 0.00 0.00 39.34 37.15 2igk n TYR 355 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 176.86 176.81 2igk s ILE 356 N -2.62 3.23 0.03 -0.72 -4.36 -0.98 -4.49 121.20 111.29 2igk s ILE 356 Ca 0.00 0.99 0.06 0.00 -0.26 0.00 0.00 60.65 61.45 2igk s ILE 356 Cb 0.00 -3.54 -0.02 0.00 1.25 0.00 0.00 42.46 40.15 2igk s ILE 356 CO 0.00 0.05 -0.19 0.42 0.24 0.00 0.00 174.94 175.47 2igk s THR 357 N -1.48 1.50 0.01 8.37 -4.23 -0.41 -4.58 115.64 114.81 2igk s THR 357 Ca 0.59 -1.07 0.00 0.00 -1.18 0.00 0.00 61.69 60.02 2igk s THR 357 Cb -0.29 -1.30 -0.01 0.00 1.34 0.00 0.00 72.50 72.24 2igk s THR 357 CO 0.36 0.20 -0.01 -0.70 -0.54 0.00 0.00 174.62 173.93 2igk s GLU 358 N -1.02 0.09 0.34 3.99 2.56 -1.26 -0.86 118.70 122.55 2igk s GLU 358 Ca 0.06 -0.18 -0.26 0.00 0.00 0.00 0.00 54.97 54.59 2igk s GLU 358 Cb -0.08 0.03 -0.09 0.00 2.00 0.00 0.00 34.13 35.99 2igk s GLU 358 CO 0.01 -0.01 1.04 -0.65 -0.56 0.00 0.00 175.26 175.08 2igk s GLN 359 N -0.43 4.42 0.40 4.30 -0.21 -1.26 -4.50 119.66 122.37 2igk s GLN 359 Ca -0.05 1.55 -0.25 0.00 0.02 0.00 0.00 55.36 56.64 2igk s GLN 359 Cb -0.03 -2.81 -0.09 0.00 1.00 0.00 0.00 33.01 31.08 2igk s GLN 359 CO -0.00 0.08 1.12 -1.12 -2.12 0.00 0.00 175.29 173.25 2igk s SER 360 N -1.36 6.60 -0.06 5.90 0.01 -1.24 -4.66 113.70 118.89 2igk s SER 360 Ca 0.52 2.24 0.01 0.00 1.31 0.00 0.00 55.95 60.02 2igk s SER 360 Cb -0.24 -2.60 0.02 0.00 0.21 0.00 0.00 66.02 63.41 2igk s SER 360 CO 0.31 -0.61 -0.05 -0.22 0.41 0.00 0.00 173.24 173.07 2igk s LEU 361 N -2.54 1.20 0.14 2.44 2.96 -1.26 -0.38 118.68 121.24 2igk s LEU 361 Ca 0.57 -0.17 0.06 0.00 -0.22 0.00 0.00 54.13 54.38 2igk s LEU 361 Cb -0.28 -0.56 -0.04 0.00 0.50 0.00 0.00 46.19 45.81 2igk s LEU 361 CO 0.35 -0.08 -0.00 0.68 -1.32 0.00 0.00 176.35 175.97 2igk s VAL 362 N 1.21 3.81 -0.04 1.68 -7.23 -0.38 -1.03 120.40 118.42 2igk s VAL 362 Ca -0.06 -1.26 -0.11 0.00 -1.81 0.00 0.00 61.98 58.74 2igk s VAL 362 Cb -0.14 -2.88 0.02 0.00 0.56 0.00 0.00 36.38 33.94 2igk s VAL 362 CO -0.02 -0.02 0.25 0.12 -0.31 0.00 0.00 175.10 175.12 2igk s PHE 363 N -1.56 -0.17 0.31 2.82 5.36 -0.36 -1.63 117.98 122.75 2igk s PHE 363 Ca 0.27 0.33 -0.17 0.00 -0.96 0.00 0.00 56.93 56.40 2igk s PHE 363 Cb -0.10 0.06 0.03 0.00 -0.34 0.00 0.00 43.02 42.67 2igk s PHE 363 CO 0.18 -0.27 0.70 0.00 -1.46 0.00 0.00 175.22 174.37 2igk s GLN 365 N -3.36 1.32 0.27 0.00 -0.21 -0.61 -0.72 119.66 116.35 2igk s GLN 365 Ca 0.15 -1.40 0.12 0.00 0.02 0.00 0.00 55.36 54.24 2igk s GLN 365 Cb -0.05 -1.48 -0.05 0.00 1.00 0.00 0.00 33.01 32.43 2igk s GLN 365 CO 0.09 0.31 -0.18 0.95 -2.12 0.00 0.00 175.29 174.34 2igk s THR 366 N -1.81 2.57 -0.20 -0.19 -4.23 -0.34 -0.55 115.64 110.89 2igk s THR 366 Ca 0.16 -2.32 -0.03 0.00 -1.18 0.00 0.00 61.69 58.32 2igk s THR 366 Cb -0.07 -2.34 -0.01 0.00 1.34 0.00 0.00 72.50 71.42 2igk s THR 366 CO 0.07 -0.37 -0.07 -0.69 -0.54 0.00 0.00 174.62 173.02 2igk s VAL 367 N -2.40 3.25 0.37 2.29 1.01 -0.33 -2.13 120.40 122.47 2igk s VAL 367 Ca 0.29 -0.55 -0.26 0.00 0.00 0.00 0.00 61.98 61.46 2igk s VAL 367 Cb -0.05 -2.45 -0.11 0.00 0.00 0.00 0.00 36.38 33.76 2igk s VAL 367 CO 0.15 0.46 1.17 0.80 0.00 0.00 0.00 175.10 177.67 2igk n MET 368 N 4.46 1.76 -2.04 2.72 1.56 0.43 -3.40 117.12 122.61 2igk n MET 368 Ca -0.18 0.62 -0.37 0.00 -0.27 0.00 0.00 57.70 57.50 2igk n MET 368 Cb 0.51 -2.19 0.02 0.00 2.15 0.00 0.00 33.22 33.71 2igk n MET 368 CO 0.00 0.00 0.00 -1.54 -0.73 0.00 0.00 175.97 173.70 2igk s SER 369 N -0.51 5.60 0.26 6.12 1.04 0.14 -4.86 113.70 121.49 2igk s SER 369 Ca 0.59 2.47 -0.02 0.00 0.48 0.00 0.00 55.95 59.47 2igk s SER 369 Cb -0.57 -2.61 0.50 0.00 0.10 0.00 0.00 66.02 63.43 2igk s SER 369 CO 0.59 -1.32 1.79 0.74 0.98 0.00 0.00 173.24 176.02 2igk h THR 370 N 1.44 0.81 -0.28 2.02 2.02 -1.90 -0.81 112.91 116.21 2igk h THR 370 Ca -0.50 -0.25 0.02 0.00 0.77 0.00 0.00 66.41 66.45 2igk h THR 370 Cb 1.28 0.02 -0.02 0.00 -1.74 0.00 0.00 68.15 67.69 2igk h THR 370 CO 0.58 0.13 0.14 -0.33 0.37 0.00 0.00 175.52 176.41 2igk h GLU 371 N 0.73 0.29 -0.48 6.66 5.08 -1.96 0.16 114.58 125.05 2igk h GLU 371 Ca 0.45 -0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 58.72 2igk h GLU 371 Cb 0.54 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.71 2igk h GLU 371 CO -0.31 0.19 0.04 -0.07 -1.00 0.00 0.00 179.01 177.86 2igk h LEU 372 N 0.30 0.80 -0.31 1.33 3.38 -1.81 -1.92 115.31 117.07 2igk h LEU 372 Ca 0.12 -0.29 0.01 0.00 0.09 0.00 0.00 57.88 57.81 2igk h LEU 372 Cb 0.04 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 2igk h LEU 372 CO -0.08 0.88 0.19 0.40 0.09 0.00 0.00 178.44 179.92 2igk h ILE 373 N 0.68 1.05 -0.90 1.22 1.08 -0.66 -2.33 117.51 117.65 2igk h ILE 373 Ca 0.14 -0.14 0.04 0.00 -0.39 0.00 0.00 64.86 64.51 2igk h ILE 373 Cb 0.45 0.62 -0.05 0.00 -3.07 0.00 0.00 36.82 34.77 2igk h ILE 373 CO 0.02 0.07 0.59 0.44 -0.69 0.00 0.00 178.15 178.58 2igk h ASP 374 N 0.40 0.96 -0.24 1.72 3.32 -0.63 -2.13 116.42 119.81 2igk h ASP 374 Ca 0.12 -0.01 0.06 0.00 0.02 0.00 0.00 57.03 57.23 2igk h ASP 374 Cb -0.02 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.30 2igk h ASP 374 CO -0.04 0.65 0.17 0.77 -1.72 0.00 0.00 179.24 179.07 2igk h SER 375 N 1.11 0.03 -0.78 6.45 4.64 -0.81 -1.69 113.55 122.49 2igk h SER 375 Ca 0.36 0.00 0.11 0.00 -0.47 0.00 0.00 61.79 61.79 2igk h SER 375 Cb 0.05 -0.01 -0.05 0.00 -0.31 0.00 0.00 62.40 62.08 2igk h SER 375 CO -0.11 0.02 0.51 0.58 -0.87 0.00 0.00 176.83 176.96 2igk h VAL 376 N 0.03 0.90 -0.45 0.95 2.07 -1.05 -2.04 116.25 116.66 2igk h VAL 376 Ca 0.11 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 67.41 2igk h VAL 376 Cb 0.42 0.20 0.00 0.00 -1.52 0.00 0.00 31.29 30.39 2igk h VAL 376 CO -0.01 0.12 0.00 2.29 0.02 0.00 0.00 177.57 179.99 2igk n LYS 377 N -4.51 3.70 0.06 1.57 2.85 -0.65 -4.71 118.16 116.48 2igk n LYS 377 Ca 0.14 -2.88 0.12 0.00 -1.05 0.00 0.00 58.31 54.64 2igk n LYS 377 Cb 0.38 -1.93 0.58 0.00 -0.65 0.00 0.00 35.03 33.42 2igk n LYS 377 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2igk h SER 378 N 2.99 0.17 -0.08 -5.58 4.64 -1.23 -1.56 113.55 112.90 2igk h SER 378 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2igk h SER 378 Cb 1.54 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.59 2igk h SER 378 CO 0.28 0.11 0.00 0.47 -0.87 0.00 0.00 176.83 176.82 2igk n ASP 379 N -4.47 1.08 -4.78 4.97 8.00 -1.26 -4.92 116.55 115.16 2igk n ASP 379 Ca 0.05 -1.53 -0.38 0.00 0.71 0.00 0.00 54.79 53.63 2igk n ASP 379 Cb 0.30 -0.05 -0.06 0.00 -0.02 0.00 0.00 41.12 41.29 2igk n ASP 379 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 2igk s MET 380 N -1.90 4.18 -0.22 -1.24 -1.94 -0.59 -4.65 119.30 112.95 2igk s MET 380 Ca 0.34 0.57 -0.13 0.00 -1.71 0.00 0.00 55.69 54.76 2igk s MET 380 Cb 0.17 -3.31 -0.05 0.00 2.01 0.00 0.00 34.83 33.66 2igk s MET 380 CO 0.27 0.47 0.27 0.99 -0.01 0.00 0.00 175.02 177.01 2igk s THR 381 N -0.45 5.29 -0.30 2.05 2.01 0.34 -4.96 115.64 119.62 2igk s THR 381 Ca 0.27 0.42 0.01 0.00 0.31 0.00 0.00 61.69 62.71 2igk s THR 381 Cb -0.17 -3.60 0.07 0.00 0.01 0.00 0.00 72.50 68.80 2igk s THR 381 CO 0.15 0.32 -0.02 -0.63 -0.69 0.00 0.00 174.62 173.74 2igk s ILE 382 N 1.07 2.57 -0.15 1.82 1.01 -1.26 -1.30 121.20 124.97 2igk s ILE 382 Ca 0.13 -1.67 -0.06 0.00 0.00 0.00 0.00 60.65 59.04 2igk s ILE 382 Cb -0.14 -2.57 -0.04 0.00 0.01 0.00 0.00 42.46 39.72 2igk s ILE 382 CO 0.05 -0.19 0.07 -0.13 0.00 0.00 0.00 174.94 174.75 2igk s ARG 383 N 1.13 3.63 0.91 2.79 0.52 -0.44 -4.99 118.95 122.51 2igk s ARG 383 Ca -0.04 -0.30 0.00 0.00 -0.52 0.00 0.00 55.73 54.87 2igk s ARG 383 Cb -0.20 -3.12 0.00 0.00 0.52 0.00 0.00 34.95 32.15 2igk s ARG 383 CO -0.04 0.49 0.00 0.41 0.02 0.00 0.00 175.30 176.18 2igk n GLY 384 N 2.85 -1.79 3.38 -3.53 0.00 -1.26 -1.44 105.19 103.39 2igk n GLY 384 Ca -0.18 -1.64 -0.32 0.00 0.00 0.00 0.00 46.02 43.88 2igk n GLY 384 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2igk s THR 385 N 0.00 2.62 0.30 2.61 -4.23 -1.26 -4.90 115.64 110.78 2igk s THR 385 Ca 0.00 -0.88 -0.28 0.00 -1.18 0.00 0.00 61.69 59.35 2igk s THR 385 Cb 0.00 -2.00 -0.13 0.00 1.34 0.00 0.00 72.50 71.71 2igk s THR 385 CO 0.00 0.58 1.13 -2.65 -0.54 0.00 0.00 174.62 173.13 2igk n PRO 386 N 2.61 1.64 0.00 3.99 -0.02 -1.26 -2.79 135.00 139.17 2igk n PRO 386 Ca -0.17 0.58 0.00 0.00 -2.02 0.00 0.00 63.50 61.89 2igk n PRO 386 Cb 0.52 -2.03 0.00 0.00 -0.02 0.00 0.00 33.50 31.96 2igk n PRO 386 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2igk n GLY 387 N 1.12 3.18 3.78 -1.23 0.00 -1.26 -5.02 105.19 105.75 2igk n GLY 387 Ca 0.08 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.86 2igk n GLY 387 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2igk s GLU 388 N -0.93 2.79 0.60 1.61 2.02 -1.12 -5.02 118.70 118.65 2igk s GLU 388 Ca 0.00 -1.03 0.29 0.00 0.02 0.00 0.00 54.97 54.25 2igk s GLU 388 Cb 0.00 -2.53 1.55 0.00 0.10 0.00 0.00 34.13 33.25 2igk s GLU 388 CO 0.00 0.44 1.95 -0.07 0.02 0.00 0.00 175.26 177.59 2igk h LEU 389 N 2.04 0.00 -0.21 1.80 -0.00 -1.97 -2.26 115.31 114.72 2igk h LEU 389 Ca -0.48 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 57.38 2igk h LEU 389 Cb 1.22 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.87 2igk h LEU 389 CO 0.61 0.00 0.04 0.71 -0.00 0.00 0.00 178.44 179.80 2igk h THR 390 N 0.00 1.22 -0.92 0.22 1.35 -1.94 -3.47 112.91 109.37 2igk h THR 390 Ca 0.14 -0.71 -0.77 0.00 -0.55 0.00 0.00 66.41 64.53 2igk h THR 390 Cb 0.92 1.29 0.03 0.00 -1.73 0.00 0.00 68.15 68.66 2igk h THR 390 CO -0.00 0.22 0.35 0.00 -0.25 0.00 0.00 175.52 175.84 2igk n TYR 391 N -4.75 1.11 -3.94 4.73 9.36 -0.85 -4.82 117.16 118.00 2igk n TYR 391 Ca -0.04 1.02 -0.15 0.00 3.32 0.00 0.00 57.90 62.05 2igk n TYR 391 Cb 0.18 -1.99 -0.15 0.00 -0.63 0.00 0.00 39.34 36.75 2igk n TYR 391 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 2igk s SER 392 N 1.39 0.28 -0.20 2.98 0.15 -0.52 -5.01 113.70 112.76 2igk s SER 392 Ca 0.90 -0.02 0.01 0.00 0.70 0.00 0.00 55.95 57.54 2igk s SER 392 Cb -1.28 -0.10 0.03 0.00 -1.71 0.00 0.00 66.02 62.97 2igk s SER 392 CO 0.64 -0.03 -0.14 -0.69 1.20 0.00 0.00 173.24 174.21 2igk s VAL 393 N 0.43 1.89 0.12 4.45 1.01 -1.26 -1.33 120.40 125.72 2igk s VAL 393 Ca -0.04 -1.06 0.03 0.00 0.00 0.00 0.00 61.98 60.92 2igk s VAL 393 Cb -0.06 -1.85 -0.04 0.00 0.00 0.00 0.00 36.38 34.43 2igk s VAL 393 CO -0.01 0.30 -0.09 0.42 0.00 0.00 0.00 175.10 175.73 2igk s THR 394 N 1.31 0.95 0.09 3.92 -4.23 -0.42 -4.97 115.64 112.30 2igk s THR 394 Ca 0.00 -1.91 -0.02 0.00 -1.18 0.00 0.00 61.69 58.58 2igk s THR 394 Cb -0.15 -1.67 -0.04 0.00 1.34 0.00 0.00 72.50 71.98 2igk s THR 394 CO -0.10 -0.74 0.04 -0.72 -0.54 0.00 0.00 174.62 172.56 2igk s TYR 395 N -3.20 0.63 -0.46 3.99 1.13 -1.26 -0.51 117.35 117.66 2igk s TYR 395 Ca 0.12 -1.09 -0.17 0.00 -1.41 0.00 0.00 57.07 54.52 2igk s TYR 395 Cb 0.02 -0.39 0.05 0.00 -1.10 0.00 0.00 41.96 40.54 2igk s TYR 395 CO -0.01 -0.46 0.49 0.99 -2.51 0.00 0.00 175.55 174.04 2igk s THR 396 N -3.97 5.05 0.17 -3.49 2.01 -1.26 -5.06 115.64 109.10 2igk s THR 396 Ca 0.14 -0.57 -0.33 0.00 0.31 0.00 0.00 61.69 61.24 2igk s THR 396 Cb 0.07 -4.14 -0.13 0.00 0.01 0.00 0.00 72.50 68.30 2igk s THR 396 CO -0.05 -0.58 1.61 -2.65 -0.69 0.00 0.00 174.62 172.26 2igk n PRO 397 N 5.69 2.30 0.00 4.92 -0.02 -1.26 -2.97 135.00 143.65 2igk n PRO 397 Ca -0.08 0.83 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 2igk n PRO 397 Cb 0.46 -2.61 0.00 0.00 -0.02 0.00 0.00 33.50 31.32 2igk n PRO 397 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2igk n GLY 398 N 3.51 2.78 3.48 -1.23 0.00 -1.26 -5.03 105.19 107.44 2igk n GLY 398 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 2igk n GLY 398 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2igk n ALA 399 N -0.79 -1.09 0.13 4.61 0.00 -1.16 -4.92 120.51 117.28 2igk n ALA 399 Ca 0.00 0.04 0.09 0.00 0.00 0.00 0.00 53.44 53.57 2igk n ALA 399 Cb 0.00 -1.84 0.04 0.00 0.00 0.00 0.00 19.45 17.65 2igk n ALA 399 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2igk h SER 400 N 0.47 0.00 1.36 0.00 4.64 -1.95 -3.04 113.55 115.02 2igk h SER 400 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 2igk h SER 400 Cb 1.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.48 2igk h SER 400 CO 0.49 0.13 0.00 0.35 -0.87 0.00 0.00 176.83 176.92 2igk n THR 401 N -2.87 0.63 -1.66 2.95 -2.24 -1.26 -4.83 114.28 105.00 2igk n THR 401 Ca -0.00 -0.20 -0.42 0.00 -2.27 0.00 0.00 64.05 61.15 2igk n THR 401 Cb 0.60 -0.68 -0.03 0.00 -2.10 0.00 0.00 70.33 68.12 2igk n THR 401 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2igk n ASN 402 N -2.26 4.13 0.15 3.42 4.13 -1.15 -4.88 115.26 118.80 2igk n ASN 402 Ca 0.05 0.88 0.13 0.00 1.68 0.00 0.00 54.58 57.32 2igk n ASN 402 Cb 0.40 -1.52 0.47 0.00 -1.54 0.00 0.00 39.78 37.59 2igk n ASN 402 CO 0.00 0.00 0.00 0.11 0.28 0.00 0.00 177.26 177.65 2igk h LYS 403 N 10.70 0.00 -5.34 3.52 1.79 -1.90 -3.47 116.57 121.88 2igk h LYS 403 Ca -0.50 0.00 -0.40 0.00 -2.18 0.00 0.00 60.65 57.57 2igk h LYS 403 Cb 1.24 0.00 -0.19 0.00 -1.58 0.00 0.00 32.23 31.70 2igk h LYS 403 CO 0.94 0.00 -0.76 -1.01 -1.08 0.00 0.00 179.45 177.54 2igk s HIS 404 N -3.30 1.30 0.81 -1.35 3.76 -1.26 -5.13 115.29 110.12 2igk s HIS 404 Ca 0.06 -0.54 -0.11 0.00 -0.15 0.00 0.00 55.06 54.32 2igk s HIS 404 Cb 0.10 -0.70 0.08 0.00 1.11 0.00 0.00 32.58 33.16 2igk s HIS 404 CO 0.49 0.10 1.09 -1.25 -0.85 0.00 0.00 174.74 174.32 2igk s PRO 405 N -2.40 1.98 0.23 8.40 0.04 -1.26 -4.82 135.00 137.17 2igk s PRO 405 Ca 0.05 0.87 -0.07 0.00 0.04 0.00 0.00 61.00 61.88 2igk s PRO 405 Cb -0.06 -1.89 0.22 0.00 0.04 0.00 0.00 34.50 32.81 2igk s PRO 405 CO 0.02 -1.75 1.89 -0.44 0.04 0.00 0.00 177.00 176.76 2igk h ASP 406 N -1.19 1.08 -0.84 6.66 3.32 -1.99 -1.59 116.42 121.87 2igk h ASP 406 Ca -0.47 -0.05 0.05 0.00 0.02 0.00 0.00 57.03 56.58 2igk h ASP 406 Cb 1.26 -0.27 -0.05 0.00 0.22 0.00 0.00 39.33 40.48 2igk h ASP 406 CO 0.56 0.81 0.55 4.11 -1.72 0.00 0.00 179.24 183.55 2igk h TRP 407 N 1.25 0.98 0.17 4.55 5.08 -2.00 -0.09 115.95 125.89 2igk h TRP 407 Ca 0.33 0.02 -0.01 0.00 1.08 0.00 0.00 58.89 60.32 2igk h TRP 407 Cb -0.08 -0.32 0.00 0.00 -3.00 0.00 0.00 29.16 25.75 2igk h TRP 407 CO -0.00 0.54 -0.08 2.35 -1.28 0.00 0.00 178.44 179.97 2igk h TRP 408 N 0.99 -0.22 -0.51 0.12 2.91 -1.73 -2.93 115.95 114.58 2igk h TRP 408 Ca 0.35 -0.01 -0.02 0.00 1.13 0.00 0.00 58.89 60.34 2igk h TRP 408 Cb 0.13 0.07 -0.02 0.00 -0.51 0.00 0.00 29.16 28.83 2igk h TRP 408 CO -0.00 0.17 0.23 -0.91 -1.03 0.00 0.00 178.44 176.89 2igk h ASN 409 N -0.67 0.65 -0.79 2.65 2.35 -1.04 -1.45 115.58 117.27 2igk h ASN 409 Ca -0.02 -0.07 -0.05 0.00 -0.55 0.00 0.00 56.30 55.61 2igk h ASN 409 Cb 0.48 -0.17 -0.04 0.00 0.05 0.00 0.00 38.32 38.65 2igk h ASN 409 CO 0.04 0.57 0.31 -0.08 -1.65 0.00 0.00 177.43 176.62 2igk h GLU 410 N 0.72 1.19 -0.46 0.81 4.57 -1.07 0.22 114.58 120.56 2igk h GLU 410 Ca 0.18 -0.22 -0.10 0.00 -1.18 0.00 0.00 59.36 58.04 2igk h GLU 410 Cb 0.11 -0.19 -0.01 0.00 -0.16 0.00 0.00 28.75 28.49 2igk h GLU 410 CO -0.02 0.96 -0.09 0.87 -1.18 0.00 0.00 179.01 179.55 2igk h LYS 411 N 1.16 0.87 -0.13 1.92 1.57 -1.21 -0.86 116.57 119.89 2igk h LYS 411 Ca 0.26 -0.33 -0.05 0.00 -1.87 0.00 0.00 60.65 58.67 2igk h LYS 411 Cb 0.22 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.47 2igk h LYS 411 CO -0.02 0.96 -0.10 0.28 -0.57 0.00 0.00 179.45 180.01 2igk h VAL 412 N 0.71 1.33 -0.22 0.50 2.07 -1.06 -0.38 116.25 119.21 2igk h VAL 412 Ca 0.12 -1.20 0.03 0.00 0.82 0.00 0.00 66.70 66.47 2igk h VAL 412 Cb 0.63 1.84 -0.03 0.00 -1.52 0.00 0.00 31.29 32.21 2igk h VAL 412 CO 0.04 0.35 0.02 0.50 0.02 0.00 0.00 177.57 178.50 2igk h LYS 413 N -0.06 0.10 -0.39 1.57 3.64 -0.54 0.01 116.57 120.90 2igk h LYS 413 Ca 0.03 -0.01 -0.11 0.00 -1.27 0.00 0.00 60.65 59.29 2igk h LYS 413 Cb 0.60 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.38 2igk h LYS 413 CO 0.03 0.07 -0.22 -0.91 -2.27 0.00 0.00 179.45 176.14 2igk h ASN 414 N 0.10 0.79 -0.07 4.20 2.35 -1.06 -1.32 115.58 120.57 2igk h ASN 414 Ca 0.10 -0.28 -0.00 0.00 -0.55 0.00 0.00 56.30 55.57 2igk h ASN 414 Cb 0.12 -0.22 -0.00 0.00 0.05 0.00 0.00 38.32 38.27 2igk h ASN 414 CO -0.16 0.99 0.04 -0.74 -1.65 0.00 0.00 177.43 175.91 2igk h HIS 415 N 0.68 0.10 -0.03 1.19 -0.00 -0.80 -1.22 115.15 115.06 2igk h HIS 415 Ca 0.09 -0.00 -0.08 0.00 -0.00 0.00 0.00 60.37 60.38 2igk h HIS 415 Cb 0.73 -0.03 -0.01 0.00 -0.00 0.00 0.00 27.41 28.10 2igk h HIS 415 CO 0.04 0.14 -0.36 0.52 -0.00 0.00 0.00 177.93 178.27 2igk h MET 416 N 0.03 0.06 0.14 5.26 2.86 -0.70 -0.96 114.93 121.62 2igk h MET 416 Ca 0.02 -0.02 -0.29 0.00 -2.06 0.00 0.00 59.70 57.35 2igk h MET 416 Cb 0.08 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.74 2igk h MET 416 CO -0.00 0.42 -1.35 0.52 1.06 0.00 0.00 176.91 177.56 2igk h MET 417 N 0.05 0.29 0.00 1.72 2.07 -1.23 -3.32 114.93 114.52 2igk h MET 417 Ca 0.00 -0.49 -0.05 0.00 -2.07 0.00 0.00 59.70 57.10 2igk h MET 417 Cb 0.67 0.18 -0.01 0.00 -1.87 0.00 0.00 31.60 30.58 2igk h MET 417 CO 0.05 1.21 -0.88 1.96 1.07 0.00 0.00 176.91 180.32 2igk h GLN 418 N 0.08 0.00 -2.17 1.72 4.20 -1.10 -3.39 115.11 114.46 2igk h GLN 418 Ca -0.18 0.00 -0.57 0.00 0.06 0.00 0.00 58.65 57.96 2igk h GLN 418 Cb 2.00 0.00 -0.41 0.00 0.30 0.00 0.00 27.48 29.37 2igk h GLN 418 CO 0.20 0.10 -0.77 0.72 -0.67 0.00 0.00 178.83 178.41 2igk n HIS 419 N -2.84 2.68 0.40 2.96 8.25 -0.37 -4.93 115.22 121.37 2igk n HIS 419 Ca -0.01 -3.97 0.12 0.00 -0.26 0.00 0.00 57.72 53.60 2igk n HIS 419 Cb 0.62 -0.49 0.50 0.00 1.12 0.00 0.00 29.99 31.75 2igk n HIS 419 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 2igk n GLN 420 N 0.52 0.21 0.00 -0.41 6.02 -1.25 -1.17 117.38 121.30 2igk n GLN 420 Ca 0.28 0.42 0.14 0.00 -0.01 0.00 0.00 57.00 57.84 2igk n GLN 420 Cb 0.46 -1.89 0.68 0.00 1.02 0.00 0.00 30.24 30.51 2igk n GLN 420 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 177.06 175.20 2igk n GLU 421 N -2.27 0.24 -3.60 -1.09 0.00 -1.26 -4.57 120.64 108.09 2igk n GLU 421 Ca 0.02 -0.01 -0.36 0.00 0.00 0.00 0.00 57.16 56.81 2igk n GLU 421 Cb 0.24 -1.50 -0.07 0.00 0.00 0.00 0.00 31.44 30.11 2igk n GLU 421 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.13 177.47 2igk s ASP 422 N -2.76 6.40 0.00 -1.84 2.15 -0.31 -4.99 116.67 115.30 2igk s ASP 422 Ca 0.22 0.46 0.26 0.00 0.43 0.00 0.00 52.55 53.92 2igk s ASP 422 Cb 0.20 -2.16 1.22 0.00 -0.30 0.00 0.00 42.92 41.88 2igk s ASP 422 CO 0.50 0.14 1.83 -0.81 -0.17 0.00 0.00 175.17 176.66 2igk n PRO 423 N 3.42 1.41 -4.17 4.34 -0.04 -1.26 -4.88 135.00 133.81 2igk n PRO 423 Ca -0.13 -0.61 -0.30 0.00 -0.04 0.00 0.00 63.50 62.42 2igk n PRO 423 Cb 0.52 -1.44 -0.09 0.00 -0.04 0.00 0.00 33.50 32.45 2igk n PRO 423 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2igk s LEU 424 N -1.85 3.27 0.00 1.53 1.43 -1.26 -5.03 118.68 116.76 2igk s LEU 424 Ca 0.38 -0.27 0.26 0.00 -1.03 0.00 0.00 54.13 53.47 2igk s LEU 424 Cb 0.19 -2.03 0.74 0.00 0.03 0.00 0.00 46.19 45.12 2igk s LEU 424 CO 0.31 0.18 1.57 -0.81 0.23 0.00 0.00 176.35 177.83 2igk n PRO 425 N 0.62 0.13 -2.69 1.29 -0.04 -1.26 -4.85 135.00 128.19 2igk n PRO 425 Ca -0.12 -0.06 -0.42 0.00 -0.04 0.00 0.00 63.50 62.86 2igk n PRO 425 Cb 0.52 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.45 2igk n PRO 425 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2igk s ILE 426 N -2.91 4.81 0.41 0.52 1.01 -1.26 -4.63 121.20 119.14 2igk s ILE 426 Ca 0.14 2.04 -0.25 0.00 0.00 0.00 0.00 60.65 62.57 2igk s ILE 426 Cb 0.18 -4.31 -0.10 0.00 0.01 0.00 0.00 42.46 38.24 2igk s ILE 426 CO 0.63 0.10 1.19 -2.65 0.00 0.00 0.00 174.94 174.20 2igk n PRO 427 N 4.35 1.75 -0.32 2.79 -0.02 -1.26 -4.92 135.00 137.38 2igk n PRO 427 Ca 0.07 0.62 0.06 0.00 -2.02 0.00 0.00 63.50 62.24 2igk n PRO 427 Cb 0.50 -2.26 0.26 0.00 -0.02 0.00 0.00 33.50 31.98 2igk n PRO 427 CO 0.00 0.00 0.00 0.74 1.98 0.00 0.00 175.50 178.22 2igk h PHE 428 N 1.96 1.04 -0.50 6.00 0.04 -1.97 -2.15 116.94 121.36 2igk h PHE 428 Ca -0.46 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.33 2igk h PHE 428 Cb 1.31 -0.34 0.00 0.00 2.20 0.00 0.00 35.95 39.12 2igk h PHE 428 CO 0.47 0.47 0.00 0.39 -0.60 0.00 0.00 178.31 179.04 2igk n GLU 429 N -4.54 3.49 -1.92 1.51 1.02 -1.26 -4.95 120.64 113.99 2igk n GLU 429 Ca 0.16 -2.36 -0.42 0.00 -0.02 0.00 0.00 57.16 54.52 2igk n GLU 429 Cb 0.30 -1.88 -0.03 0.00 -0.02 0.00 0.00 31.44 29.81 2igk n GLU 429 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2igk s ASP 430 N -0.75 6.58 0.88 1.62 2.15 -0.81 -4.96 116.67 121.38 2igk s ASP 430 Ca 0.42 2.60 -0.11 0.00 0.43 0.00 0.00 52.55 55.90 2igk s ASP 430 Cb 0.29 -2.59 0.12 0.00 -0.30 0.00 0.00 42.92 40.44 2igk s ASP 430 CO 0.17 -0.85 1.12 -2.84 -0.17 0.00 0.00 175.17 172.60 2igk s PRO 431 N 1.54 1.31 0.71 4.34 0.02 -1.26 -4.96 135.00 136.69 2igk s PRO 431 Ca 0.71 1.31 -0.11 0.00 0.02 0.00 0.00 61.00 62.94 2igk s PRO 431 Cb -0.43 -1.78 0.02 0.00 0.02 0.00 0.00 34.50 32.33 2igk s PRO 431 CO 0.32 -2.35 1.07 -1.83 -0.33 0.00 0.00 177.00 173.87 2igk s GLU 432 N -4.75 2.79 0.58 5.54 1.03 -1.26 -4.41 118.70 118.23 2igk s GLU 432 Ca 0.65 0.91 -0.18 0.00 0.03 0.00 0.00 54.97 56.38 2igk s GLU 432 Cb -0.21 -1.98 -0.04 0.00 -0.80 0.00 0.00 34.13 31.11 2igk s GLU 432 CO 0.58 -1.19 1.13 -2.14 -1.33 0.00 0.00 175.26 172.31 2igk s PRO 433 N -5.06 3.16 -0.43 -4.83 0.02 -1.26 -4.45 135.00 122.15 2igk s PRO 433 Ca 0.58 1.57 0.07 0.00 0.02 0.00 0.00 61.00 63.24 2igk s PRO 433 Cb -0.14 -1.98 0.23 0.00 0.02 0.00 0.00 34.50 32.62 2igk s PRO 433 CO 0.55 -1.00 0.59 1.04 -0.33 0.00 0.00 177.00 177.85 2igk n GLN 434 N -1.64 0.61 -4.73 5.54 1.13 -1.25 -3.20 117.38 113.84 2igk n GLN 434 Ca 0.11 -2.78 -0.31 0.00 -1.94 0.00 0.00 57.00 52.08 2igk n GLN 434 Cb 0.51 -1.38 -0.13 0.00 0.11 0.00 0.00 30.24 29.36 2igk n GLN 434 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 2igk s VAL 435 N -0.35 2.91 0.03 5.09 1.01 -0.34 -0.80 120.40 127.95 2igk s VAL 435 Ca 0.34 -1.02 -0.03 0.00 0.00 0.00 0.00 61.98 61.26 2igk s VAL 435 Cb 0.14 -2.20 -0.02 0.00 0.00 0.00 0.00 36.38 34.30 2igk s VAL 435 CO -0.15 0.42 0.04 0.28 0.00 0.00 0.00 175.10 175.68 2igk s THR 436 N -0.87 0.13 -0.23 3.92 -1.32 -0.19 -0.92 115.64 116.15 2igk s THR 436 Ca 0.14 -1.09 -0.03 0.00 -1.21 0.00 0.00 61.69 59.50 2igk s THR 436 Cb -0.11 -0.70 0.01 0.00 -1.51 0.00 0.00 72.50 70.19 2igk s THR 436 CO 0.04 -0.60 -0.05 0.28 -2.21 0.00 0.00 174.62 172.08 2igk s THR 437 N -2.23 3.17 0.58 5.08 -1.32 -1.26 -1.54 115.64 118.11 2igk s THR 437 Ca -0.08 -0.71 -0.18 0.00 -1.21 0.00 0.00 61.69 59.51 2igk s THR 437 Cb -0.04 -2.50 -0.04 0.00 -1.51 0.00 0.00 72.50 68.41 2igk s THR 437 CO -0.03 0.33 1.15 -0.76 -2.21 0.00 0.00 174.62 173.10 2igk s LEU 438 N 1.42 3.65 0.04 9.08 1.43 -1.26 -3.83 118.68 129.20 2igk s LEU 438 Ca 0.04 2.20 -0.34 0.00 -1.03 0.00 0.00 54.13 55.00 2igk s LEU 438 Cb -0.15 -4.58 -0.17 0.00 0.03 0.00 0.00 46.19 41.31 2igk s LEU 438 CO -0.04 -1.41 0.86 0.33 0.23 0.00 0.00 176.35 176.32 2igk n PHE 439 N -1.61 0.36 -3.98 0.29 -0.00 -1.14 -4.94 117.46 106.44 2igk n PHE 439 Ca 0.12 0.94 -0.08 0.00 -0.00 0.00 0.00 57.45 58.42 2igk n PHE 439 Cb 0.51 -1.85 -0.09 0.00 -0.00 0.00 0.00 39.48 38.04 2igk n PHE 439 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.76 176.11 2igk s GLN 440 N -0.19 0.67 0.32 -4.13 -1.52 -1.04 -4.93 119.66 108.84 2igk s GLN 440 Ca 0.77 -1.03 0.09 0.00 -1.95 0.00 0.00 55.36 53.25 2igk s GLN 440 Cb -1.08 0.25 0.88 0.00 -0.22 0.00 0.00 33.01 32.85 2igk s GLN 440 CO 0.51 -0.17 1.73 -1.35 -0.25 0.00 0.00 175.29 175.76 2igk h PRO 441 N 3.16 0.55 -0.00 2.91 0.11 -1.99 0.14 132.00 136.89 2igk h PRO 441 Ca -0.34 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.74 2igk h PRO 441 Cb 1.17 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.16 2igk h PRO 441 CO 0.59 0.37 -0.01 -1.13 -0.21 0.00 0.00 178.00 177.61 2igk n SER 442 N -4.90 0.01 -3.05 -2.05 3.41 -1.26 -4.12 113.62 101.66 2igk n SER 442 Ca 0.27 0.42 -0.17 0.00 -0.26 0.00 0.00 58.87 59.13 2igk n SER 442 Cb 0.75 -0.47 -0.03 0.00 -0.26 0.00 0.00 64.21 64.20 2igk n SER 442 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2igk n HIS 443 N -1.48 -1.89 -1.49 7.33 1.44 0.39 -5.05 115.22 114.48 2igk n HIS 443 Ca 0.08 -2.65 -0.40 0.00 -2.01 0.00 0.00 57.72 52.74 2igk n HIS 443 Cb 0.33 0.61 -0.02 0.00 0.12 0.00 0.00 29.99 31.04 2igk n HIS 443 CO 0.00 0.00 0.00 -0.35 -2.81 0.00 0.00 176.34 173.18 2igk n PRO 444 N 2.09 3.09 -3.74 -1.40 -0.04 -0.65 -2.51 135.00 131.83 2igk n PRO 444 Ca 0.20 -2.35 -0.12 0.00 -0.04 0.00 0.00 63.50 61.19 2igk n PRO 444 Cb 0.55 -3.04 -0.07 0.00 -0.04 0.00 0.00 33.50 30.90 2igk n PRO 444 CO 0.00 0.00 0.00 1.67 -0.04 0.00 0.00 175.50 177.13 2igk s TRP 445 N 2.89 -0.13 0.33 0.54 -2.14 -1.26 -4.34 118.94 114.82 2igk s TRP 445 Ca 0.56 0.03 -0.10 0.00 2.66 0.00 0.00 56.10 59.25 2igk s TRP 445 Cb 0.15 0.11 -0.07 0.00 -3.10 0.00 0.00 33.47 30.57 2igk s TRP 445 CO -0.06 -0.51 0.67 -1.58 -2.66 0.00 0.00 176.95 172.81 2igk s HIS 446 N -2.47 3.44 0.01 1.66 5.65 -0.10 -2.89 115.29 120.58 2igk s HIS 446 Ca -0.05 0.97 0.03 0.00 0.25 0.00 0.00 55.06 56.26 2igk s HIS 446 Cb -0.01 -2.36 -0.01 0.00 -1.18 0.00 0.00 32.58 29.02 2igk s HIS 446 CO -0.03 0.07 -0.10 0.95 -0.65 0.00 0.00 174.74 174.99 2igk s THR 447 N -2.11 0.76 -0.05 0.89 -4.23 -1.25 -1.00 115.64 108.65 2igk s THR 447 Ca 0.50 -0.55 0.01 0.00 -1.18 0.00 0.00 61.69 60.46 2igk s THR 447 Cb -0.11 -0.67 0.02 0.00 1.34 0.00 0.00 72.50 73.09 2igk s THR 447 CO 0.26 0.11 -0.06 -1.10 -0.54 0.00 0.00 174.62 173.29 2igk s GLN 448 N -0.49 1.00 -0.38 3.99 -0.21 -0.10 -4.44 119.66 119.03 2igk s GLN 448 Ca 0.02 -0.15 0.01 0.00 0.02 0.00 0.00 55.36 55.26 2igk s GLN 448 Cb -0.05 -0.99 0.12 0.00 1.00 0.00 0.00 33.01 33.08 2igk s GLN 448 CO -0.00 -0.09 0.16 0.42 -2.12 0.00 0.00 175.29 173.65 2igk s ILE 449 N 1.01 1.36 0.00 1.08 1.01 -0.10 -1.12 121.20 124.45 2igk s ILE 449 Ca -0.09 -2.10 0.00 0.00 0.00 0.00 0.00 60.65 58.45 2igk s ILE 449 Cb -0.14 -1.99 0.00 0.00 0.01 0.00 0.00 42.46 40.34 2igk s ILE 449 CO -0.00 -0.77 0.00 0.00 0.00 0.00 0.00 174.94 174.17 2igk n HIS 450 N 4.14 -0.07 -4.26 3.97 1.44 -0.34 -1.20 115.22 118.90 2igk n HIS 450 Ca 0.04 0.00 -0.20 0.00 -2.01 0.00 0.00 57.72 55.54 2igk n HIS 450 Cb 0.38 0.00 -0.16 0.00 0.12 0.00 0.00 29.99 30.33 2igk n HIS 450 CO 0.00 0.00 0.00 1.03 -2.81 0.00 0.00 176.34 174.56 2igk s ARG 451 N 0.75 0.93 0.00 -1.40 1.81 -1.20 0.13 118.95 119.97 2igk s ARG 451 Ca 0.00 -0.19 0.00 0.00 -1.72 0.00 0.00 55.73 53.82 2igk s ARG 451 Cb 0.00 -0.88 0.00 0.00 -0.45 0.00 0.00 34.95 33.62 2igk s ARG 451 CO 0.00 -0.02 0.00 -0.40 -0.68 0.00 0.00 175.30 174.20 2igk n ASP 452 N 3.79 1.23 -4.65 0.23 5.75 -1.26 -5.01 116.55 116.63 2igk n ASP 452 Ca -0.23 -0.92 -0.55 0.00 -0.01 0.00 0.00 54.79 53.08 2igk n ASP 452 Cb 0.52 0.00 -0.07 0.00 -1.03 0.00 0.00 41.12 40.54 2igk n ASP 452 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2igk n ALA 453 N -3.00 -0.72 -3.24 2.12 0.00 -1.26 -4.96 120.51 109.45 2igk n ALA 453 Ca 0.00 0.46 -0.13 0.00 0.00 0.00 0.00 53.44 53.77 2igk n ALA 453 Cb 0.00 -2.13 -0.11 0.00 0.00 0.00 0.00 19.45 17.21 2igk n ALA 453 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 2igk s PHE 454 N 1.94 -0.35 -0.64 0.00 5.36 -1.26 -4.84 117.98 118.19 2igk s PHE 454 Ca 0.92 0.85 -0.18 0.00 -0.96 0.00 0.00 56.93 57.56 2igk s PHE 454 Cb -1.03 0.12 0.13 0.00 -0.34 0.00 0.00 43.02 41.89 2igk s PHE 454 CO 0.57 -0.17 0.71 -1.54 -1.46 0.00 0.00 175.22 173.32 2igk s SER 455 N 0.26 6.31 0.15 6.13 1.04 -1.26 -4.72 113.70 121.61 2igk s SER 455 Ca -0.01 -1.75 -0.30 0.00 0.48 0.00 0.00 55.95 54.37 2igk s SER 455 Cb -0.03 -2.28 -0.07 0.00 0.10 0.00 0.00 66.02 63.74 2igk s SER 455 CO -0.00 -0.98 1.18 -0.31 0.98 0.00 0.00 173.24 174.11 2igk s TYR 456 N 2.08 3.46 0.75 5.02 2.02 -1.26 -5.02 117.35 124.40 2igk s TYR 456 Ca 0.12 1.43 -0.16 0.00 -0.37 0.00 0.00 57.07 58.09 2igk s TYR 456 Cb -0.22 -3.40 -0.01 0.00 -0.40 0.00 0.00 41.96 37.93 2igk s TYR 456 CO 0.02 -1.11 0.69 0.41 -1.57 0.00 0.00 175.55 173.99 2igk n GLY 457 N 2.42 -1.17 0.27 0.71 0.00 -1.26 -4.71 105.19 101.45 2igk n GLY 457 Ca 0.05 -0.41 0.10 0.00 0.00 0.00 0.00 46.02 45.77 2igk n GLY 457 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2igk h ALA 458 N -0.48 1.78 0.14 4.61 0.00 -1.98 0.19 119.26 123.53 2igk h ALA 458 Ca -0.46 -0.02 -0.30 0.00 0.00 0.00 0.00 54.91 54.13 2igk h ALA 458 Cb 1.34 -0.00 0.03 0.00 0.00 0.00 0.00 17.79 19.15 2igk h ALA 458 CO 0.43 0.03 -1.28 0.28 0.00 0.00 0.00 179.25 178.72 2igk h VAL 459 N 0.00 1.33 -0.54 0.00 2.07 -2.00 -3.24 116.25 113.86 2igk h VAL 459 Ca -0.00 -2.61 -0.08 0.00 0.82 0.00 0.00 66.70 64.83 2igk h VAL 459 Cb 0.05 2.79 -0.02 0.00 -1.52 0.00 0.00 31.29 32.59 2igk h VAL 459 CO 0.00 0.78 0.02 1.56 0.02 0.00 0.00 177.57 179.96 2igk h GLN 460 N 0.21 0.90 0.00 1.57 4.20 -1.71 -2.21 115.11 118.08 2igk h GLN 460 Ca -0.19 -0.25 0.00 0.00 0.06 0.00 0.00 58.65 58.27 2igk h GLN 460 Cb 1.96 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 29.64 2igk h GLN 460 CO 0.24 0.89 0.04 1.04 -0.67 0.00 0.00 178.83 180.36 2igk n GLN 461 N -4.21 0.00 0.21 1.46 6.02 -0.00 0.18 117.38 121.04 2igk n GLN 461 Ca 0.03 0.27 0.10 0.00 -0.01 0.00 0.00 57.00 57.39 2igk n GLN 461 Cb 0.31 -1.54 0.28 0.00 1.02 0.00 0.00 30.24 30.30 2igk n GLN 461 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 2igk h SER 462 N 0.00 0.00 -3.40 1.08 0.87 -1.43 -3.44 113.55 107.23 2igk h SER 462 Ca 0.00 0.00 -0.59 0.00 -1.23 0.00 0.00 61.79 59.97 2igk h SER 462 Cb 0.08 0.00 -0.09 0.00 -0.44 0.00 0.00 62.40 61.95 2igk h SER 462 CO 0.00 0.18 -0.06 -0.63 -0.53 0.00 0.00 176.83 175.79 2igk s ILE 463 N -3.31 5.13 0.01 2.23 -1.09 0.13 -5.03 121.20 119.27 2igk s ILE 463 Ca 0.04 1.00 -0.35 0.00 -2.23 0.00 0.00 60.65 59.10 2igk s ILE 463 Cb 0.07 -3.85 -0.14 0.00 -1.58 0.00 0.00 42.46 36.96 2igk s ILE 463 CO 0.66 0.24 1.65 -0.67 -1.23 0.00 0.00 174.94 175.59 2igk n ASP 464 N 4.30 2.85 -0.14 3.58 -0.08 -1.26 -4.84 116.55 120.96 2igk n ASP 464 Ca -0.05 1.05 0.17 0.00 -1.51 0.00 0.00 54.79 54.46 2igk n ASP 464 Cb 0.51 -1.33 0.56 0.00 2.34 0.00 0.00 41.12 43.20 2igk n ASP 464 CO 0.00 0.00 0.00 -1.28 0.12 0.00 0.00 177.20 176.04 2igk h SER 465 N 6.88 0.29 0.05 1.67 0.87 -1.94 -1.19 113.55 120.18 2igk h SER 465 Ca -0.47 0.02 -0.00 0.00 -1.23 0.00 0.00 61.79 60.11 2igk h SER 465 Cb 1.28 -0.04 -0.00 0.00 -0.44 0.00 0.00 62.40 63.20 2igk h SER 465 CO 0.90 0.15 -0.01 0.03 -0.53 0.00 0.00 176.83 177.36 2igk h ARG 466 N 0.30 0.00 0.00 2.24 3.08 -1.98 -1.82 114.38 116.21 2igk h ARG 466 Ca 0.35 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.40 2igk h ARG 466 Cb 0.95 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.00 2igk h ARG 466 CO -0.09 0.01 -0.29 1.28 -1.07 0.00 0.00 179.97 179.80 2igk n LEU 467 N -3.43 0.76 -4.86 3.04 4.77 -0.45 -4.92 117.00 111.91 2igk n LEU 467 Ca -0.03 0.41 -0.37 0.00 -0.03 0.00 0.00 56.01 55.99 2igk n LEU 467 Cb 0.09 -0.26 -0.06 0.00 -2.33 0.00 0.00 43.42 40.86 2igk n LEU 467 CO 0.24 -0.12 -0.11 -0.63 -1.33 0.00 0.00 177.39 175.44 2igk s ILE 468 N -3.13 5.40 -0.03 -0.08 1.01 -0.69 -0.43 121.20 123.26 2igk s ILE 468 Ca 0.09 0.35 0.02 0.00 0.00 0.00 0.00 60.65 61.11 2igk s ILE 468 Cb 0.13 -3.48 0.00 0.00 0.01 0.00 0.00 42.46 39.13 2igk s ILE 468 CO 0.65 0.59 -0.09 -0.69 0.00 0.00 0.00 174.94 175.41 2igk s VAL 469 N -0.90 0.77 0.11 2.92 1.01 -0.90 -4.95 120.40 118.47 2igk s VAL 469 Ca 0.16 -0.36 -0.14 0.00 0.00 0.00 0.00 61.98 61.64 2igk s VAL 469 Cb -0.13 -0.69 -0.07 0.00 0.00 0.00 0.00 36.38 35.50 2igk s VAL 469 CO 0.05 0.24 0.52 -1.81 0.00 0.00 0.00 175.10 174.10 2igk s ASP 470 N 0.19 6.83 -0.15 3.32 1.01 0.12 -1.20 116.67 126.79 2igk s ASP 470 Ca -0.03 1.05 0.01 0.00 0.71 0.00 0.00 52.55 54.29 2igk s ASP 470 Cb -0.08 -2.28 0.02 0.00 1.01 0.00 0.00 42.92 41.59 2igk s ASP 470 CO 0.00 0.16 -0.17 0.26 0.21 0.00 0.00 175.17 175.64 2igk s TRP 471 N -1.37 2.37 -0.14 4.23 0.52 0.10 -1.20 118.94 123.45 2igk s TRP 471 Ca 0.34 -1.31 -0.01 0.00 0.02 0.00 0.00 56.10 55.14 2igk s TRP 471 Cb -0.16 -1.69 0.04 0.00 -1.15 0.00 0.00 33.47 30.51 2igk s TRP 471 CO 0.18 -0.68 -0.04 1.03 0.02 0.00 0.00 176.95 177.46 2igk s ARG 472 N 1.29 1.27 -0.08 4.98 0.52 -0.27 -1.84 118.95 124.82 2igk s ARG 472 Ca 0.02 -0.34 0.01 0.00 -0.52 0.00 0.00 55.73 54.89 2igk s ARG 472 Cb -0.13 -1.75 -0.03 0.00 0.52 0.00 0.00 34.95 33.56 2igk s ARG 472 CO -0.09 -0.38 -0.08 -0.06 0.02 0.00 0.00 175.30 174.70 2igk s PHE 473 N 1.72 2.90 -0.12 -0.53 0.40 -0.65 -0.93 117.98 120.79 2igk s PHE 473 Ca 0.02 -0.11 0.03 0.00 -0.60 0.00 0.00 56.93 56.27 2igk s PHE 473 Cb -0.14 -1.75 0.01 0.00 0.51 0.00 0.00 43.02 41.65 2igk s PHE 473 CO -0.08 0.21 -0.20 -0.06 0.70 0.00 0.00 175.22 175.79 2igk s PHE 474 N -0.53 2.39 0.37 0.36 0.40 -0.17 -1.25 117.98 119.55 2igk s PHE 474 Ca 0.08 -1.11 0.04 0.00 -0.60 0.00 0.00 56.93 55.34 2igk s PHE 474 Cb -0.12 -1.64 -0.01 0.00 0.51 0.00 0.00 43.02 41.76 2igk s PHE 474 CO 0.02 -0.51 0.54 0.20 0.70 0.00 0.00 175.22 176.17 2igk s GLY 475 N 0.72 1.56 -0.01 4.36 0.00 0.49 -0.93 107.32 113.51 2igk s GLY 475 Ca -0.11 -1.29 -0.02 0.00 0.00 0.00 0.00 44.72 43.30 2igk s GLY 475 CO 0.01 -1.19 0.12 1.09 0.00 0.00 0.00 173.10 173.14 2igk s ARG 476 N -4.30 3.21 -0.17 2.90 1.70 -1.26 -3.69 118.95 117.33 2igk s ARG 476 Ca 0.45 -0.41 -0.00 0.00 -0.47 0.00 0.00 55.73 55.30 2igk s ARG 476 Cb -0.10 -2.95 0.00 0.00 -0.57 0.00 0.00 34.95 31.33 2igk s ARG 476 CO 0.33 0.66 -0.15 0.99 -1.08 0.00 0.00 175.30 176.06 2igk s THR 477 N -1.23 2.62 0.25 4.99 2.01 -1.26 -4.73 115.64 118.30 2igk s THR 477 Ca 0.24 -0.77 -0.31 0.00 0.31 0.00 0.00 61.69 61.16 2igk s THR 477 Cb -0.12 -2.12 -0.11 0.00 0.01 0.00 0.00 72.50 70.16 2igk s THR 477 CO 0.15 0.51 1.62 -0.70 -0.69 0.00 0.00 174.62 175.50 2igk s GLU 478 N 1.04 4.14 0.05 4.92 2.12 -1.26 -4.15 118.70 125.56 2igk s GLU 478 Ca -0.01 2.54 -0.31 0.00 0.36 0.00 0.00 54.97 57.56 2igk s GLU 478 Cb -0.15 -3.06 -0.06 0.00 0.26 0.00 0.00 34.13 31.12 2igk s GLU 478 CO -0.04 -0.65 1.34 -1.25 -0.54 0.00 0.00 175.26 174.13 2igk s PRO 479 N 0.16 4.33 -0.02 4.30 0.04 -1.26 -4.82 135.00 137.73 2igk s PRO 479 Ca 0.67 1.95 0.03 0.00 0.04 0.00 0.00 61.00 63.68 2igk s PRO 479 Cb -0.47 -3.40 0.00 0.00 0.04 0.00 0.00 34.50 30.66 2igk s PRO 479 CO 0.41 -0.45 -0.09 0.15 0.04 0.00 0.00 177.00 177.06 2igk s LYS 480 N 1.62 0.97 0.47 4.56 -0.14 -1.26 -4.99 119.74 120.96 2igk s LYS 480 Ca 0.63 -0.32 0.14 0.00 -1.36 0.00 0.00 55.97 55.05 2igk s LYS 480 Cb -0.33 -0.90 1.09 0.00 -1.68 0.00 0.00 37.83 36.01 2igk s LYS 480 CO 0.28 0.13 2.07 1.49 -0.76 0.00 0.00 175.35 178.56 2igk h GLU 481 N 6.31 0.27 0.00 1.68 4.22 -1.93 -1.91 114.58 123.21 2igk h GLU 481 Ca -0.33 -0.02 0.00 0.00 0.08 0.00 0.00 59.36 59.10 2igk h GLU 481 Cb 1.17 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.36 2igk h GLU 481 CO 0.49 0.18 0.00 1.05 -2.18 0.00 0.00 179.01 178.54 2igk h GLU 482 N 0.27 0.00 -5.98 1.92 9.09 -1.96 -3.33 114.58 114.60 2igk h GLU 482 Ca 0.14 0.00 -0.59 0.00 0.05 0.00 0.00 59.36 58.96 2igk h GLU 482 Cb 0.20 0.00 -0.07 0.00 -1.65 0.00 0.00 28.75 27.23 2igk h GLU 482 CO -0.03 0.00 0.66 -0.80 0.05 0.00 0.00 179.01 178.89 2igk s ASN 483 N -4.86 6.96 0.02 3.06 0.01 -0.74 -4.79 114.94 114.60 2igk s ASN 483 Ca 0.06 1.18 0.00 0.00 -0.71 0.00 0.00 52.86 53.39 2igk s ASN 483 Cb 0.10 -2.49 -0.02 0.00 0.41 0.00 0.00 41.25 39.25 2igk s ASN 483 CO 0.52 -0.63 -0.03 -0.54 -1.51 0.00 0.00 177.10 174.91 2igk s LYS 484 N 3.10 0.26 -0.20 -0.60 1.02 -0.08 -1.68 119.74 121.57 2igk s LYS 484 Ca 0.40 -0.46 -0.04 0.00 0.02 0.00 0.00 55.97 55.89 2igk s LYS 484 Cb -0.15 0.02 -0.01 0.00 -0.52 0.00 0.00 37.83 37.17 2igk s LYS 484 CO 0.08 -0.02 -0.05 -1.17 -0.92 0.00 0.00 175.35 173.27 2igk s LEU 485 N -1.08 2.98 0.25 3.17 2.96 0.37 -0.54 118.68 126.80 2igk s LEU 485 Ca -0.11 -0.32 0.02 0.00 -0.22 0.00 0.00 54.13 53.50 2igk s LEU 485 Cb -0.07 -1.74 -0.05 0.00 0.50 0.00 0.00 46.19 44.82 2igk s LEU 485 CO -0.01 0.04 0.06 -1.66 -1.32 0.00 0.00 176.35 173.47 2igk s TRP 486 N 1.11 1.57 -0.07 5.38 1.48 0.41 -4.58 118.94 124.24 2igk s TRP 486 Ca 0.02 -1.08 0.03 0.00 -1.06 0.00 0.00 56.10 54.01 2igk s TRP 486 Cb -0.15 -0.94 0.00 0.00 -1.16 0.00 0.00 33.47 31.23 2igk s TRP 486 CO -0.00 -0.22 -0.18 -0.06 -4.06 0.00 0.00 176.95 172.43 2igk s PHE 487 N -3.61 1.93 0.43 1.66 0.08 -1.26 -0.03 117.98 117.18 2igk s PHE 487 Ca 0.34 -0.71 -0.25 0.00 0.12 0.00 0.00 56.93 56.43 2igk s PHE 487 Cb 0.07 -1.33 -0.08 0.00 -0.57 0.00 0.00 43.02 41.11 2igk s PHE 487 CO 0.12 -0.30 1.26 0.45 -0.10 0.00 0.00 175.22 176.64 2igk s SER 488 N 0.39 6.22 0.00 1.36 0.15 -0.33 0.39 113.70 121.88 2igk s SER 488 Ca -0.14 2.54 0.22 0.00 0.70 0.00 0.00 55.95 59.28 2igk s SER 488 Cb -0.16 -2.63 0.77 0.00 -1.71 0.00 0.00 66.02 62.29 2igk s SER 488 CO 0.05 -0.90 1.57 -0.90 1.20 0.00 0.00 173.24 174.26 2igk n ASP 489 N -0.10 1.80 0.00 5.45 5.68 -1.26 -4.12 116.55 124.00 2igk n ASP 489 Ca 0.05 -1.70 0.00 0.00 -0.50 0.00 0.00 54.79 52.64 2igk n ASP 489 Cb 0.45 -0.09 0.00 0.00 -1.14 0.00 0.00 41.12 40.34 2igk n ASP 489 CO 0.00 0.00 0.00 1.17 -1.33 0.00 0.00 177.20 177.04 2igk n LYS 490 N 0.41 0.00 -3.11 0.11 4.81 -1.26 -5.04 118.16 114.09 2igk n LYS 490 Ca 0.17 0.00 -0.38 0.00 -0.87 0.00 0.00 58.31 57.22 2igk n LYS 490 Cb 0.36 -0.50 -0.06 0.00 0.02 0.00 0.00 35.03 34.86 2igk n LYS 490 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 2igk s ILE 491 N -1.91 4.54 0.24 3.15 -1.09 -1.26 -5.01 121.20 119.86 2igk s ILE 491 Ca 0.00 1.44 0.11 0.00 -2.23 0.00 0.00 60.65 59.97 2igk s ILE 491 Cb 0.00 -4.00 -0.05 0.00 -1.58 0.00 0.00 42.46 36.84 2igk s ILE 491 CO 0.00 0.46 -0.19 0.42 -1.23 0.00 0.00 174.94 174.40 2igk s THR 492 N -1.22 2.23 0.00 2.92 -4.23 -1.26 -1.10 115.64 112.98 2igk s THR 492 Ca 0.35 -2.27 0.00 0.00 -1.18 0.00 0.00 61.69 58.60 2igk s THR 492 Cb -0.20 -2.17 0.00 0.00 1.34 0.00 0.00 72.50 71.46 2igk s THR 492 CO 0.23 -0.40 0.00 -0.90 -0.54 0.00 0.00 174.62 173.01 2igk n ASP 493 N -0.35 0.00 0.08 3.99 5.68 0.25 -4.75 116.55 121.45 2igk n ASP 493 Ca -0.07 -0.88 0.10 0.00 -0.50 0.00 0.00 54.79 53.43 2igk n ASP 493 Cb 0.59 0.00 0.42 0.00 -1.14 0.00 0.00 41.12 40.99 2igk n ASP 493 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2igk n ALA 494 N -3.00 1.62 -0.82 2.12 0.00 -1.26 -1.80 120.51 117.37 2igk n ALA 494 Ca 0.00 0.04 0.08 0.00 0.00 0.00 0.00 53.44 53.56 2igk n ALA 494 Cb 0.00 -1.32 0.27 0.00 0.00 0.00 0.00 19.45 18.40 2igk n ALA 494 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2igk n TYR 495 N -1.96 1.08 -2.33 0.00 4.02 -1.26 -4.95 117.16 111.76 2igk n TYR 495 Ca 0.02 -0.77 -0.17 0.00 -0.01 0.00 0.00 57.90 56.97 2igk n TYR 495 Cb 0.20 -0.29 -0.01 0.00 -0.02 0.00 0.00 39.34 39.22 2igk n TYR 495 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 2igk n ASN 496 N -0.04 -5.02 -4.78 7.72 4.13 -0.75 -5.01 115.26 111.51 2igk n ASN 496 Ca 0.21 -0.02 -0.24 0.00 1.68 0.00 0.00 54.58 56.21 2igk n ASN 496 Cb 0.87 -4.11 -0.05 0.00 -1.54 0.00 0.00 39.78 34.94 2igk n ASN 496 CO 0.00 0.00 0.00 -0.04 0.28 0.00 0.00 177.26 177.50 2igk s MET 497 N -4.86 2.79 0.13 3.52 -1.94 -1.26 -4.81 119.30 112.86 2igk s MET 497 Ca 0.00 -1.03 -0.34 0.00 -1.71 0.00 0.00 55.69 52.61 2igk s MET 497 Cb -0.00 -2.53 -0.14 0.00 2.01 0.00 0.00 34.83 34.17 2igk s MET 497 CO 0.00 0.44 1.57 -2.30 -0.01 0.00 0.00 175.02 174.72 2igk n PRO 498 N -0.71 2.02 -2.18 2.03 -0.02 -1.26 -0.59 135.00 134.29 2igk n PRO 498 Ca -0.08 0.73 -0.42 0.00 -2.02 0.00 0.00 63.50 61.70 2igk n PRO 498 Cb 0.56 -2.49 -0.03 0.00 -0.02 0.00 0.00 33.50 31.53 2igk n PRO 498 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 2igk s GLN 499 N 1.11 4.25 0.40 -0.52 2.00 -0.25 -4.62 119.66 122.04 2igk s GLN 499 Ca 0.81 2.00 -0.26 0.00 -2.00 0.00 0.00 55.36 55.91 2igk s GLN 499 Cb -0.72 -3.66 -0.08 0.00 0.80 0.00 0.00 33.01 29.35 2igk s GLN 499 CO 0.40 -0.64 1.21 -1.25 -0.50 0.00 0.00 175.29 174.51 2igk s PRO 500 N 2.79 4.04 -0.04 1.67 0.04 -1.26 -1.19 135.00 141.05 2igk s PRO 500 Ca 0.65 1.94 -0.02 0.00 0.04 0.00 0.00 61.00 63.61 2igk s PRO 500 Cb -0.31 -2.72 0.02 0.00 0.04 0.00 0.00 34.50 31.53 2igk s PRO 500 CO 0.26 -0.36 0.09 0.99 0.04 0.00 0.00 177.00 178.02 2igk s THR 501 N -1.35 -0.03 -0.04 1.26 2.01 0.96 -4.61 115.64 113.84 2igk s THR 501 Ca 0.57 0.11 -0.03 0.00 0.31 0.00 0.00 61.69 62.64 2igk s THR 501 Cb -0.33 -0.14 -0.04 0.00 0.01 0.00 0.00 72.50 71.99 2igk s THR 501 CO 0.42 0.04 0.13 -0.36 -0.69 0.00 0.00 174.62 174.17 2igk s PHE 502 N 0.64 3.47 -0.36 4.92 0.08 -1.26 -0.45 117.98 125.02 2igk s PHE 502 Ca -0.05 0.35 0.01 0.00 0.12 0.00 0.00 56.93 57.36 2igk s PHE 502 Cb -0.07 -1.83 0.11 0.00 -0.57 0.00 0.00 43.02 40.66 2igk s PHE 502 CO -0.03 0.63 0.14 0.34 -0.10 0.00 0.00 175.22 176.21 2igk s ASP 503 N -1.60 3.96 -0.01 1.36 -1.08 0.29 -4.60 116.67 115.00 2igk s ASP 503 Ca 0.22 -2.04 -0.01 0.00 -0.52 0.00 0.00 52.55 50.20 2igk s ASP 503 Cb -0.12 -1.00 0.00 0.00 -1.46 0.00 0.00 42.92 40.34 2igk s ASP 503 CO 0.13 -0.36 0.02 0.12 0.52 0.00 0.00 175.17 175.60 2igk s PHE 504 N 1.09 -0.02 0.01 -5.34 2.19 0.22 -0.90 117.98 115.22 2igk s PHE 504 Ca 0.13 0.06 -0.03 0.00 0.33 0.00 0.00 56.93 57.41 2igk s PHE 504 Cb -0.20 0.00 -0.01 0.00 -1.31 0.00 0.00 43.02 41.51 2igk s PHE 504 CO -0.14 -0.01 0.06 1.03 1.83 0.00 0.00 175.22 177.98 2igk s ARG 505 N 0.03 0.36 0.12 10.12 1.81 -1.26 -4.05 118.95 126.09 2igk s ARG 505 Ca -0.00 -0.43 -0.31 0.00 -1.72 0.00 0.00 55.73 53.27 2igk s ARG 505 Cb -0.00 0.14 -0.10 0.00 -0.45 0.00 0.00 34.95 34.54 2igk s ARG 505 CO -0.00 -0.07 1.75 -0.06 -0.68 0.00 0.00 175.30 176.23 2igk s PHE 506 N -1.24 2.38 0.44 -0.53 0.08 -1.26 -4.91 117.98 112.94 2igk s PHE 506 Ca -0.13 0.17 -0.25 0.00 0.12 0.00 0.00 56.93 56.83 2igk s PHE 506 Cb -0.08 -4.09 -0.09 0.00 -0.57 0.00 0.00 43.02 38.19 2igk s PHE 506 CO 0.00 -4.41 1.36 -2.30 -0.10 0.00 0.00 175.22 169.78 2igk n PRO 507 N 5.33 2.12 -1.04 0.24 -0.02 -1.26 -4.91 135.00 135.45 2igk n PRO 507 Ca 0.17 0.75 -0.33 0.00 -2.02 0.00 0.00 63.50 62.07 2igk n PRO 507 Cb 0.38 -2.52 0.13 0.00 -0.02 0.00 0.00 33.50 31.48 2igk n PRO 507 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2igk s ALA 508 N -1.19 1.78 0.00 3.55 0.00 -1.26 -3.17 121.76 121.47 2igk s ALA 508 Ca 0.61 0.76 0.00 0.00 0.00 0.00 0.00 51.96 53.33 2igk s ALA 508 Cb -0.48 -3.47 0.00 0.00 0.00 0.00 0.00 23.12 19.17 2igk s ALA 508 CO 0.58 -2.36 0.00 0.41 0.00 0.00 0.00 175.76 174.39 2igk n GLY 509 N 0.35 0.78 0.33 0.00 0.00 -1.26 -4.51 105.19 100.88 2igk n GLY 509 Ca 0.13 -1.52 0.07 0.00 0.00 0.00 0.00 46.02 44.70 2igk n GLY 509 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2igk h ARG 510 N 0.00 0.78 -0.43 1.61 2.43 -1.99 -1.67 114.38 115.11 2igk h ARG 510 Ca 0.00 -0.05 0.03 0.00 -0.81 0.00 0.00 59.98 59.15 2igk h ARG 510 Cb 0.00 -0.18 -0.03 0.00 -0.42 0.00 0.00 29.97 29.34 2igk h ARG 510 CO 0.00 0.52 0.23 1.15 -1.51 0.00 0.00 179.97 180.36 2igk h THR 511 N 0.81 0.99 -0.16 0.20 2.02 -1.79 0.13 112.91 115.11 2igk h THR 511 Ca 0.47 -0.16 -0.22 0.00 0.77 0.00 0.00 66.41 67.28 2igk h THR 511 Cb 0.55 0.49 0.01 0.00 -1.74 0.00 0.00 68.15 67.46 2igk h THR 511 CO -0.30 0.08 -0.75 0.28 0.37 0.00 0.00 175.52 175.20 2igk h SER 512 N 0.46 0.89 -0.39 4.18 0.02 -1.30 -1.35 113.55 116.06 2igk h SER 512 Ca 0.18 -0.57 -0.08 0.00 -0.84 0.00 0.00 61.79 60.48 2igk h SER 512 Cb 0.07 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.33 2igk h SER 512 CO -0.12 1.37 -0.08 0.50 -1.14 0.00 0.00 176.83 177.36 2igk h LYS 513 N 0.52 0.74 -0.57 3.45 3.64 -1.09 -2.15 116.57 121.11 2igk h LYS 513 Ca -0.04 -0.28 -0.05 0.00 -1.27 0.00 0.00 60.65 59.01 2igk h LYS 513 Cb 1.37 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 33.12 2igk h LYS 513 CO 0.15 0.88 0.14 0.93 -2.27 0.00 0.00 179.45 179.28 2igk h GLU 514 N 0.55 0.87 -0.53 1.90 5.08 -0.71 -0.66 114.58 121.08 2igk h GLU 514 Ca 0.10 -0.18 -0.02 0.00 -1.00 0.00 0.00 59.36 58.26 2igk h GLU 514 Cb 0.59 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.69 2igk h GLU 514 CO 0.04 0.78 0.27 0.00 -1.00 0.00 0.00 179.01 179.10 2igk h ALA 515 N 1.31 0.68 -0.30 3.43 0.00 -0.81 0.33 119.26 123.90 2igk h ALA 515 Ca 0.18 -0.11 -0.11 0.00 0.00 0.00 0.00 54.91 54.87 2igk h ALA 515 Cb 0.30 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2igk h ALA 515 CO -0.00 0.23 -0.26 1.49 0.00 0.00 0.00 179.25 180.71 2igk h GLU 516 N 0.71 0.71 -0.86 0.00 4.57 -1.12 -1.68 114.58 116.91 2igk h GLU 516 Ca 0.18 -0.36 0.11 0.00 -1.18 0.00 0.00 59.36 58.12 2igk h GLU 516 Cb 0.09 0.00 -0.06 0.00 -0.16 0.00 0.00 28.75 28.62 2igk h GLU 516 CO -0.03 0.97 0.56 -0.44 -1.18 0.00 0.00 179.01 178.89 2igk h ASP 517 N 0.46 0.70 -0.42 1.04 3.32 -0.89 -1.54 116.42 119.09 2igk h ASP 517 Ca 0.05 0.03 -0.08 0.00 0.02 0.00 0.00 57.03 57.05 2igk h ASP 517 Cb 0.82 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 40.24 2igk h ASP 517 CO 0.07 0.40 -0.05 -0.03 -1.72 0.00 0.00 179.24 177.90 2igk h MET 518 N 0.77 0.78 -0.34 3.56 4.05 -0.10 -0.28 114.93 123.37 2igk h MET 518 Ca 0.41 -0.28 0.06 0.00 -0.28 0.00 0.00 59.70 59.61 2igk h MET 518 Cb 0.53 -0.06 -0.05 0.00 -0.80 0.00 0.00 31.60 31.22 2igk h MET 518 CO -0.17 0.88 0.02 1.98 0.23 0.00 0.00 176.91 179.85 2igk h MET 519 N 0.61 0.12 -0.49 0.39 1.85 -0.74 -0.79 114.93 115.88 2igk h MET 519 Ca 0.11 -0.01 -0.02 0.00 -0.61 0.00 0.00 59.70 59.18 2igk h MET 519 Cb 0.56 -0.03 -0.02 0.00 0.43 0.00 0.00 31.60 32.54 2igk h MET 519 CO 0.03 0.08 0.23 1.15 -0.40 0.00 0.00 176.91 178.00 2igk h THR 520 N 0.12 1.20 -0.96 -0.77 2.02 -0.99 -1.76 112.91 111.77 2igk h THR 520 Ca 0.17 -0.56 0.07 0.00 0.77 0.00 0.00 66.41 66.85 2igk h THR 520 Cb 0.22 0.66 -0.07 0.00 -1.74 0.00 0.00 68.15 67.22 2igk h THR 520 CO -0.26 0.22 0.61 -0.78 0.37 0.00 0.00 175.52 175.68 2igk h ASP 521 N 0.65 0.97 -0.57 4.18 3.58 -0.82 0.14 116.42 124.55 2igk h ASP 521 Ca 0.17 0.01 -0.11 0.00 0.42 0.00 0.00 57.03 57.52 2igk h ASP 521 Cb 0.14 -0.19 -0.02 0.00 1.72 0.00 0.00 39.33 40.97 2igk h ASP 521 CO -0.02 0.61 -0.07 -0.03 -2.88 0.00 0.00 179.24 176.86 2igk h MET 522 N 1.10 1.06 -0.39 0.28 4.05 -0.44 0.59 114.93 121.18 2igk h MET 522 Ca 0.42 -0.37 -0.00 0.00 -0.28 0.00 0.00 59.70 59.46 2igk h MET 522 Cb 0.18 -0.08 -0.02 0.00 -0.80 0.00 0.00 31.60 30.89 2igk h MET 522 CO -0.18 1.07 0.23 0.00 0.23 0.00 0.00 176.91 178.27 2igk h VAL 524 N 0.52 1.20 -0.38 0.00 2.07 -0.54 -3.08 116.25 116.04 2igk h VAL 524 Ca 0.14 -0.62 -0.13 0.00 0.82 0.00 0.00 66.70 66.92 2igk h VAL 524 Cb 0.01 1.46 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 2igk h VAL 524 CO -0.03 0.17 -0.26 -0.03 0.02 0.00 0.00 177.57 177.45 2igk h MET 525 N -0.09 0.84 0.00 1.57 -1.53 -0.82 -3.19 114.93 111.71 2igk h MET 525 Ca 0.03 -0.40 -0.05 0.00 -3.44 0.00 0.00 59.70 55.83 2igk h MET 525 Cb 0.26 -0.01 -0.01 0.00 -0.55 0.00 0.00 31.60 31.30 2igk h MET 525 CO 0.00 1.04 -0.24 0.66 0.14 0.00 0.00 176.91 178.51 2igk h SER 526 N 0.64 0.00 0.25 1.39 4.64 -0.99 -2.00 113.55 117.48 2igk h SER 526 Ca 0.07 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.38 2igk h SER 526 Cb 0.83 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.92 2igk h SER 526 CO 0.07 0.24 -0.07 0.00 -0.87 0.00 0.00 176.83 176.20 2igk h ALA 527 N 1.76 1.34 0.00 5.18 0.00 -1.52 0.50 119.26 126.52 2igk h ALA 527 Ca -0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2igk h ALA 527 Cb 0.47 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2igk h ALA 527 CO 0.03 0.09 0.00 0.87 0.00 0.00 0.00 179.25 180.24 2igk h LYS 528 N 0.00 0.00 0.00 0.00 1.57 -1.46 -3.26 116.57 113.42 2igk h LYS 528 Ca -0.00 0.00 -0.35 0.00 -1.87 0.00 0.00 60.65 58.43 2igk h LYS 528 Cb 0.22 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.47 2igk h LYS 528 CO 0.01 0.00 -2.29 -0.89 -0.57 0.00 0.00 179.45 175.71 2igk n ILE 529 N -2.69 1.29 -3.60 1.86 2.08 0.10 -4.98 119.36 113.42 2igk n ILE 529 Ca 0.01 -0.46 0.01 0.00 0.56 0.00 0.00 62.75 62.86 2igk n ILE 529 Cb 0.23 -1.40 -0.01 0.00 -0.75 0.00 0.00 39.64 37.71 2igk n ILE 529 CO 0.00 0.00 0.00 -0.83 0.56 0.00 0.00 176.55 176.28 2igk s GLY 530 N -6.02 -0.36 0.72 7.39 0.00 -0.78 -0.68 107.32 107.59 2igk s GLY 530 Ca -0.31 1.31 -0.11 0.00 0.00 0.00 0.00 44.72 45.61 2igk s GLY 530 CO 0.50 0.36 1.09 -0.32 0.00 0.00 0.00 173.10 174.73 2igk s GLY 531 N -2.58 1.63 0.51 0.20 0.00 -1.22 -4.01 107.32 101.86 2igk s GLY 531 Ca 0.13 -0.28 -0.23 0.00 0.00 0.00 0.00 44.72 44.35 2igk s GLY 531 CO -0.05 0.09 1.33 -1.36 0.00 0.00 0.00 173.10 173.12 2igk s PHE 532 N -3.29 2.43 -0.14 1.90 0.08 -1.26 -1.18 117.98 116.51 2igk s PHE 532 Ca 0.58 1.39 -0.27 0.00 0.12 0.00 0.00 56.93 58.75 2igk s PHE 532 Cb -0.12 -3.74 -0.01 0.00 -0.57 0.00 0.00 43.02 38.58 2igk s PHE 532 CO 0.53 -2.64 0.90 -1.17 -0.10 0.00 0.00 175.22 172.74 2igk s LEU 533 N -3.28 4.21 0.24 -0.37 2.96 0.28 -4.64 118.68 118.08 2igk s LEU 533 Ca 0.68 1.32 -0.31 0.00 -0.22 0.00 0.00 54.13 55.60 2igk s LEU 533 Cb -0.39 -3.36 -0.13 0.00 0.50 0.00 0.00 46.19 42.80 2igk s LEU 533 CO 0.47 -0.41 1.39 -2.65 -1.32 0.00 0.00 176.35 173.82 2igk n PRO 534 N 5.11 2.00 0.00 0.98 -0.02 -1.26 -1.00 135.00 140.81 2igk n PRO 534 Ca 0.06 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 62.25 2igk n PRO 534 Cb 0.49 -2.36 0.00 0.00 -0.02 0.00 0.00 33.50 31.61 2igk n PRO 534 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2igk n GLY 535 N 2.07 1.45 2.56 -1.23 0.00 -1.26 -4.81 105.19 103.97 2igk n GLY 535 Ca 0.11 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.96 2igk n GLY 535 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2igk n SER 536 N 0.00 2.43 -4.85 1.61 7.64 -0.17 -5.05 113.62 115.23 2igk n SER 536 Ca 0.00 -3.11 -0.31 0.00 1.01 0.00 0.00 58.87 56.46 2igk n SER 536 Cb 0.00 -0.53 0.03 0.00 -1.01 0.00 0.00 64.21 62.70 2igk n SER 536 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2igk s LEU 537 N -3.13 3.13 0.21 -3.43 1.43 -1.24 -1.58 118.68 114.06 2igk s LEU 537 Ca 0.37 1.46 -0.32 0.00 -1.03 0.00 0.00 54.13 54.60 2igk s LEU 537 Cb 0.41 -4.40 -0.13 0.00 0.03 0.00 0.00 46.19 42.10 2igk s LEU 537 CO -0.06 -1.18 1.63 -0.81 0.23 0.00 0.00 176.35 176.17 2igk n PRO 538 N -2.94 2.49 -3.51 1.29 -0.04 -1.26 -4.61 135.00 126.41 2igk n PRO 538 Ca 0.07 0.89 -0.15 0.00 -0.04 0.00 0.00 63.50 64.27 2igk n PRO 538 Cb 0.54 -2.69 -0.05 0.00 -0.04 0.00 0.00 33.50 31.27 2igk n PRO 538 CO 0.00 0.00 0.00 1.14 -0.04 0.00 0.00 175.50 176.60 2igk s GLN 539 N 0.70 1.11 0.24 0.54 -2.07 -0.64 -4.98 119.66 114.56 2igk s GLN 539 Ca 0.74 -0.09 -0.30 0.00 -1.82 0.00 0.00 55.36 53.89 2igk s GLN 539 Cb -0.58 0.51 -0.09 0.00 -1.09 0.00 0.00 33.01 31.77 2igk s GLN 539 CO 0.38 -0.40 0.94 -0.06 -1.32 0.00 0.00 175.29 174.83 2igk s PHE 540 N -2.25 3.98 0.53 9.60 0.08 -1.26 -1.23 117.98 127.44 2igk s PHE 540 Ca -0.06 1.92 -0.14 0.00 0.12 0.00 0.00 56.93 58.77 2igk s PHE 540 Cb -0.01 -2.98 -0.06 0.00 -0.57 0.00 0.00 43.02 39.40 2igk s PHE 540 CO 0.00 0.45 0.97 -1.64 -0.10 0.00 0.00 175.22 174.89 2igk s MET 541 N -1.19 3.81 0.16 0.44 -1.94 -0.20 -4.97 119.30 115.41 2igk s MET 541 Ca 0.41 0.81 -0.34 0.00 -1.71 0.00 0.00 55.69 54.86 2igk s MET 541 Cb -0.26 -2.16 -0.16 0.00 2.01 0.00 0.00 34.83 34.27 2igk s MET 541 CO 0.32 -0.33 1.26 -1.91 -0.01 0.00 0.00 175.02 174.35 2igk n GLU 542 N -1.92 1.31 -1.69 2.03 2.13 -1.26 -4.77 120.64 116.46 2igk n GLU 542 Ca 0.06 0.47 -0.43 0.00 0.66 0.00 0.00 57.16 57.91 2igk n GLU 542 Cb 0.54 -2.04 -0.03 0.00 0.27 0.00 0.00 31.44 30.18 2igk n GLU 542 CO 0.00 0.00 0.00 -2.30 -0.41 0.00 0.00 177.13 174.42 2igk n PRO 543 N 2.08 2.69 0.00 5.31 -0.02 -1.26 -1.86 135.00 141.94 2igk n PRO 543 Ca 0.16 0.97 0.00 0.00 -2.02 0.00 0.00 63.50 62.61 2igk n PRO 543 Cb 0.24 -2.85 0.00 0.00 -0.02 0.00 0.00 33.50 30.88 2igk n PRO 543 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2igk n GLY 544 N 4.11 1.95 0.28 -1.23 0.00 -1.26 -0.53 105.19 108.51 2igk n GLY 544 Ca 0.18 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.31 2igk n GLY 544 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2igk h LEU 545 N 0.00 0.00 -1.55 0.99 5.85 -1.38 -1.67 115.31 117.55 2igk h LEU 545 Ca 0.00 0.00 0.06 0.00 0.84 0.00 0.00 57.88 58.78 2igk h LEU 545 Cb 0.00 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.00 2igk h LEU 545 CO 0.00 0.00 0.39 1.62 -0.34 0.00 0.00 178.44 180.11 2igk h VAL 546 N 0.00 0.99 -4.99 1.05 3.04 -1.87 -3.48 116.25 111.00 2igk h VAL 546 Ca 0.03 -0.19 -0.28 0.00 -1.01 0.00 0.00 66.70 65.25 2igk h VAL 546 Cb 0.12 0.39 0.14 0.00 -2.01 0.00 0.00 31.29 29.92 2igk h VAL 546 CO -0.00 0.10 -0.62 0.18 -1.01 0.00 0.00 177.57 176.22 2igk n LEU 547 N -4.47 -3.63 -1.59 3.16 4.77 -0.63 -4.95 117.00 109.66 2igk n LEU 547 Ca 0.08 -0.50 -0.12 0.00 -0.03 0.00 0.00 56.01 55.44 2igk n LEU 547 Cb 0.24 -2.65 0.08 0.00 -2.33 0.00 0.00 43.42 38.76 2igk n LEU 547 CO 0.34 0.33 0.22 1.41 -1.33 0.00 0.00 177.39 178.37 2igk n HIS 548 N -3.66 1.65 -1.71 -1.77 8.25 -1.26 -5.06 115.22 111.67 2igk n HIS 548 Ca -0.22 -1.91 -0.43 0.00 -0.26 0.00 0.00 57.72 54.90 2igk n HIS 548 Cb 0.63 -0.30 -0.03 0.00 1.12 0.00 0.00 29.99 31.41 2igk n HIS 548 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 2igk n LEU 549 N -0.79 3.78 -4.31 2.41 7.94 -1.26 -4.61 117.00 120.15 2igk n LEU 549 Ca 0.32 1.06 -0.16 0.00 -1.11 0.00 0.00 56.01 56.12 2igk n LEU 549 Cb 0.87 -1.54 -0.10 0.00 0.53 0.00 0.00 43.42 43.18 2igk n LEU 549 CO 0.22 0.07 -0.29 -0.83 -1.11 0.00 0.00 177.39 175.45 2igk s GLY 550 N 1.18 1.60 0.00 -3.96 0.00 -0.04 -4.29 107.32 101.81 2igk s GLY 550 Ca 0.76 -1.80 0.00 0.00 0.00 0.00 0.00 44.72 43.69 2igk s GLY 550 CO 0.34 -1.61 0.00 0.61 0.00 0.00 0.00 173.10 172.44 2igk n GLY 551 N -0.42 0.95 0.19 0.20 0.00 -0.94 -1.29 105.19 103.88 2igk n GLY 551 Ca -0.03 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.13 2igk n GLY 551 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2igk h THR 552 N 0.00 0.00 -1.19 2.61 1.35 -1.74 -3.29 112.91 110.65 2igk h THR 552 Ca 0.00 -0.49 -0.40 0.00 -0.55 0.00 0.00 66.41 64.96 2igk h THR 552 Cb 0.00 1.41 -0.29 0.00 -1.73 0.00 0.00 68.15 67.53 2igk h THR 552 CO 0.00 0.00 -0.87 0.00 -0.25 0.00 0.00 175.52 174.40 2igk n HIS 553 N -2.67 -1.34 -2.22 4.73 1.44 -0.27 -0.58 115.22 114.32 2igk n HIS 553 Ca 0.03 -2.97 -0.32 0.00 -2.01 0.00 0.00 57.72 52.44 2igk n HIS 553 Cb 0.34 0.42 -0.01 0.00 0.12 0.00 0.00 29.99 30.86 2igk n HIS 553 CO 0.00 0.00 0.00 -0.98 -2.81 0.00 0.00 176.34 172.55 2igk s ARG 554 N -0.85 3.66 0.21 -1.40 1.70 -1.15 -4.08 118.95 117.05 2igk s ARG 554 Ca 0.33 1.04 -0.16 0.00 -0.47 0.00 0.00 55.73 56.48 2igk s ARG 554 Cb 0.26 -2.09 -0.08 0.00 -0.57 0.00 0.00 34.95 32.47 2igk s ARG 554 CO -0.12 -0.52 0.65 1.41 -1.08 0.00 0.00 175.30 175.64 2igk s MET 555 N -4.15 4.07 0.18 3.89 -2.45 0.59 0.10 119.30 121.54 2igk s MET 555 Ca 0.61 0.65 -0.22 0.00 -1.25 0.00 0.00 55.69 55.47 2igk s MET 555 Cb -0.12 -2.80 0.08 0.00 1.25 0.00 0.00 34.83 33.23 2igk s MET 555 CO 0.35 0.38 1.05 0.20 1.05 0.00 0.00 175.02 178.05 2igk s GLY 556 N -1.84 0.13 0.15 2.11 0.00 -0.19 -4.56 107.32 103.12 2igk s GLY 556 Ca 0.43 -0.37 -0.02 0.00 0.00 0.00 0.00 44.72 44.77 2igk s GLY 556 CO 0.20 2.84 1.35 0.74 0.00 0.00 0.00 173.10 178.23 2igk h PHE 557 N 2.00 0.51 -3.41 1.90 0.04 -1.93 -3.34 116.94 112.72 2igk h PHE 557 Ca -0.27 -0.27 -0.36 0.00 2.80 0.00 0.00 57.97 59.87 2igk h PHE 557 Cb 1.22 -0.06 -0.36 0.00 2.20 0.00 0.00 35.95 38.94 2igk h PHE 557 CO 1.45 1.07 -0.75 0.34 -0.60 0.00 0.00 178.31 179.82 2igk s ASP 558 N -7.02 0.77 0.18 2.17 2.15 -1.26 -4.91 116.67 108.75 2igk s ASP 558 Ca -0.05 0.00 -0.13 0.00 0.43 0.00 0.00 52.55 52.80 2igk s ASP 558 Cb 0.10 -0.21 0.17 0.00 -0.30 0.00 0.00 42.92 42.67 2igk s ASP 558 CO 0.85 -0.16 1.73 -0.08 -0.17 0.00 0.00 175.17 177.33 2igk h GLU 559 N 7.77 0.25 0.00 4.34 4.81 -1.88 -0.91 114.58 128.96 2igk h GLU 559 Ca -0.31 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 58.91 2igk h GLU 559 Cb 1.13 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.45 2igk h GLU 559 CO 0.35 0.17 -0.00 -0.22 -0.73 0.00 0.00 179.01 178.57 2igk h LYS 560 N 0.26 -0.00 -0.10 1.92 3.64 -1.97 -1.97 116.57 118.34 2igk h LYS 560 Ca 0.24 0.00 -0.16 0.00 -1.27 0.00 0.00 60.65 59.46 2igk h LYS 560 Cb 0.30 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.11 2igk h LYS 560 CO -0.29 0.77 -0.61 0.93 -2.27 0.00 0.00 179.45 177.98 2igk h GLU 561 N -0.79 0.37 -0.65 1.90 5.08 -1.97 -2.87 114.58 115.64 2igk h GLU 561 Ca -0.00 -0.25 0.00 0.00 -1.00 0.00 0.00 59.36 58.11 2igk h GLU 561 Cb 0.78 0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.07 2igk h GLU 561 CO 0.00 0.87 0.00 -0.25 -1.00 0.00 0.00 179.01 178.63 2igk n ASP 562 N -3.89 4.24 -3.84 1.42 8.00 -0.36 -5.01 116.55 117.12 2igk n ASP 562 Ca -0.03 -2.23 -0.35 0.00 0.71 0.00 0.00 54.79 52.89 2igk n ASP 562 Cb 0.63 -0.51 0.02 0.00 -0.02 0.00 0.00 41.12 41.24 2igk n ASP 562 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2igk n ASN 563 N 1.26 -4.87 -3.84 -2.24 4.13 -1.01 -4.86 115.26 103.84 2igk n ASN 563 Ca 0.24 -1.08 -0.14 0.00 1.68 0.00 0.00 54.58 55.28 2igk n ASN 563 Cb 0.74 -2.38 -0.08 0.00 -1.54 0.00 0.00 39.78 36.51 2igk n ASN 563 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2igk s VAL 566 N -2.04 1.78 0.35 0.00 -7.23 -1.00 -2.71 120.40 109.55 2igk s VAL 566 Ca -0.01 -1.98 -0.03 0.00 -1.81 0.00 0.00 61.98 58.15 2igk s VAL 566 Cb 0.01 -1.87 0.07 0.00 0.56 0.00 0.00 36.38 35.15 2igk s VAL 566 CO 0.07 -0.38 0.47 -0.46 -0.31 0.00 0.00 175.10 174.49 2igk n ASN 567 N 0.15 0.33 0.00 4.85 0.23 -0.63 -1.02 115.26 119.17 2igk n ASN 567 Ca -0.12 -1.35 0.09 0.00 -0.53 0.00 0.00 54.58 52.67 2igk n ASN 567 Cb 0.58 -0.34 0.47 0.00 -2.08 0.00 0.00 39.78 38.42 2igk n ASN 567 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 2igk n THR 568 N -2.33 0.36 0.67 5.53 -2.24 -1.25 -0.54 114.28 114.48 2igk n THR 568 Ca 0.07 0.09 0.09 0.00 -2.27 0.00 0.00 64.05 62.03 2igk n THR 568 Cb 0.24 -0.80 0.26 0.00 -2.10 0.00 0.00 70.33 67.94 2igk n THR 568 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2igk n ASP 569 N -1.22 2.44 -1.90 3.42 8.00 -1.26 -4.72 116.55 121.31 2igk n ASP 569 Ca 0.10 -1.92 -0.20 0.00 0.71 0.00 0.00 54.79 53.48 2igk n ASP 569 Cb 0.12 -0.25 -0.06 0.00 -0.02 0.00 0.00 41.12 40.92 2igk n ASP 569 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2igk n SER 570 N 0.82 -5.46 -4.76 -2.24 7.64 0.30 -4.30 113.62 105.63 2igk n SER 570 Ca 0.17 0.31 -0.39 0.00 1.01 0.00 0.00 58.87 59.97 2igk n SER 570 Cb 0.41 -4.72 -0.06 0.00 -1.01 0.00 0.00 64.21 58.83 2igk n SER 570 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 2igk s ARG 571 N -4.22 4.30 0.10 1.43 3.52 -1.26 -1.46 118.95 121.36 2igk s ARG 571 Ca 0.00 0.69 -0.31 0.00 -0.13 0.00 0.00 55.73 55.98 2igk s ARG 571 Cb 0.00 -3.35 -0.08 0.00 -1.56 0.00 0.00 34.95 29.96 2igk s ARG 571 CO 0.00 0.36 1.52 0.08 -0.81 0.00 0.00 175.30 176.45 2igk s VAL 572 N -0.15 3.09 0.22 7.11 1.01 -0.46 -1.60 120.40 129.62 2igk s VAL 572 Ca 0.30 0.69 -0.31 0.00 0.00 0.00 0.00 61.98 62.66 2igk s VAL 572 Cb -0.18 -3.44 -0.14 0.00 0.00 0.00 0.00 36.38 32.62 2igk s VAL 572 CO 0.16 0.03 1.22 0.49 0.00 0.00 0.00 175.10 177.00 2igk n PHE 573 N 4.67 1.61 0.00 5.22 3.72 -1.10 -1.63 117.46 129.95 2igk n PHE 573 Ca 0.14 0.60 0.00 0.00 -0.05 0.00 0.00 57.45 58.14 2igk n PHE 573 Cb 0.41 -2.34 0.00 0.00 -0.94 0.00 0.00 39.48 36.61 2igk n PHE 573 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2igk n GLY 574 N 1.85 3.02 3.59 1.37 0.00 -1.26 -5.00 105.19 108.77 2igk n GLY 574 Ca 0.12 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.80 2igk n GLY 574 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2igk s PHE 575 N -1.85 3.17 0.27 1.61 0.40 -0.65 -4.12 117.98 116.81 2igk s PHE 575 Ca 0.00 -0.04 0.10 0.00 -0.60 0.00 0.00 56.93 56.38 2igk s PHE 575 Cb 0.00 -2.02 0.34 0.00 0.51 0.00 0.00 43.02 41.85 2igk s PHE 575 CO 0.00 0.12 1.60 0.87 0.70 0.00 0.00 175.22 178.51 2igk h LYS 576 N 6.58 0.03 0.00 0.44 1.79 -1.42 -3.38 116.57 120.61 2igk h LYS 576 Ca -0.36 -0.02 -0.08 0.00 -2.18 0.00 0.00 60.65 58.01 2igk h LYS 576 Cb 1.18 0.00 -0.17 0.00 -1.58 0.00 0.00 32.23 31.66 2igk h LYS 576 CO 0.67 0.64 -0.70 0.27 -1.08 0.00 0.00 179.45 179.25 2igk n ASN 577 N -3.81 0.75 -4.18 0.86 6.94 -1.26 -5.04 115.26 109.53 2igk n ASN 577 Ca -0.01 -2.24 -0.32 0.00 -0.02 0.00 0.00 54.58 51.99 2igk n ASN 577 Cb 0.62 -0.29 -0.17 0.00 -2.36 0.00 0.00 39.78 37.58 2igk n ASN 577 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 2igk s LEU 578 N -0.48 2.06 0.07 -4.53 2.96 -1.26 -1.30 118.68 116.21 2igk s LEU 578 Ca 0.20 -0.56 0.06 0.00 -0.22 0.00 0.00 54.13 53.61 2igk s LEU 578 Cb 0.22 -1.39 -0.03 0.00 0.50 0.00 0.00 46.19 45.50 2igk s LEU 578 CO -0.08 0.11 -0.15 -0.36 -1.32 0.00 0.00 176.35 174.55 2igk s PHE 579 N 0.60 1.31 0.02 5.38 0.40 -0.02 -1.36 117.98 124.31 2igk s PHE 579 Ca -0.13 -0.44 0.08 0.00 -0.60 0.00 0.00 56.93 55.84 2igk s PHE 579 Cb -0.17 -0.74 -0.03 0.00 0.51 0.00 0.00 43.02 42.60 2igk s PHE 579 CO 0.03 0.08 -0.24 -0.51 0.70 0.00 0.00 175.22 175.28 2igk s LEU 580 N -1.70 2.23 0.09 -0.37 1.43 -0.53 -0.96 118.68 118.85 2igk s LEU 580 Ca -0.00 -0.51 0.06 0.00 -1.03 0.00 0.00 54.13 52.64 2igk s LEU 580 Cb -0.10 -1.35 -0.03 0.00 0.03 0.00 0.00 46.19 44.74 2igk s LEU 580 CO 0.02 0.28 -0.15 -0.83 0.23 0.00 0.00 176.35 175.91 2igk s GLY 581 N -1.06 0.95 0.00 -3.19 0.00 0.11 -4.81 107.32 99.32 2igk s GLY 581 Ca 0.12 -1.09 0.00 0.00 0.00 0.00 0.00 44.72 43.74 2igk s GLY 581 CO 0.01 -1.13 0.00 0.61 0.00 0.00 0.00 173.10 172.60 2igk n GLY 582 N 1.08 2.23 0.31 0.20 0.00 -1.26 -4.49 105.19 103.26 2igk n GLY 582 Ca -0.20 -2.02 0.18 0.00 0.00 0.00 0.00 46.02 43.99 2igk n GLY 582 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2igk h GLY 584 N 0.08 0.00 2.00 0.00 0.00 -1.87 -1.51 103.07 101.77 2igk h GLY 584 Ca -0.00 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.26 2igk h GLY 584 CO 0.00 0.00 -0.35 3.43 0.00 0.00 0.00 176.54 179.62 2igk h ASN 585 N 0.00 0.00 -2.87 0.19 2.35 -1.36 -0.61 115.58 113.28 2igk h ASN 585 Ca 0.10 0.00 -0.56 0.00 -0.55 0.00 0.00 56.30 55.28 2igk h ASN 585 Cb 0.61 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.95 2igk h ASN 585 CO -0.00 0.35 0.92 -0.63 -1.65 0.00 0.00 177.43 176.42 2igk s ILE 586 N -3.36 4.12 -2.54 2.81 1.01 -0.58 -0.30 121.20 122.37 2igk s ILE 586 Ca 0.02 1.38 0.25 0.00 0.00 0.00 0.00 60.65 62.29 2igk s ILE 586 Cb 0.09 -3.89 0.20 0.00 0.01 0.00 0.00 42.46 38.88 2igk s ILE 586 CO 0.69 -0.11 1.32 -0.81 0.00 0.00 0.00 174.94 176.04 2igk n PRO 587 N 6.53 1.78 -2.86 2.79 -0.04 -1.26 -2.21 135.00 139.73 2igk n PRO 587 Ca 0.14 -1.38 -0.19 0.00 -0.04 0.00 0.00 63.50 62.03 2igk n PRO 587 Cb 0.44 -1.47 0.03 0.00 -0.04 0.00 0.00 33.50 32.47 2igk n PRO 587 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 2igk s THR 588 N -2.18 2.72 -0.35 0.52 -4.23 -1.26 -4.78 115.64 106.08 2igk s THR 588 Ca 0.27 -0.86 -0.23 0.00 -1.18 0.00 0.00 61.69 59.69 2igk s THR 588 Cb 0.20 -2.86 0.01 0.00 1.34 0.00 0.00 72.50 71.18 2igk s THR 588 CO 0.40 0.00 0.78 0.00 -0.54 0.00 0.00 174.62 175.26 2igk s ALA 589 N -2.59 3.46 0.06 3.99 0.00 -1.26 -4.84 121.76 120.57 2igk s ALA 589 Ca 0.57 -0.60 0.05 0.00 0.00 0.00 0.00 51.96 51.99 2igk s ALA 589 Cb -0.09 -3.34 -0.03 0.00 0.00 0.00 0.00 23.12 19.67 2igk s ALA 589 CO 0.36 -1.40 -0.14 1.52 0.00 0.00 0.00 175.76 176.10 2igk s TYR 590 N 3.04 1.24 -0.14 0.00 1.13 -1.26 -4.57 117.35 116.79 2igk s TYR 590 Ca 0.31 -0.40 0.10 0.00 -1.41 0.00 0.00 57.07 55.67 2igk s TYR 590 Cb -0.13 -0.71 -0.15 0.00 -1.10 0.00 0.00 41.96 39.86 2igk s TYR 590 CO 0.16 0.05 0.00 0.41 -2.51 0.00 0.00 175.55 173.66 2igk n GLY 591 N 1.60 -0.57 3.76 5.49 0.00 -1.26 -4.13 105.19 110.07 2igk n GLY 591 Ca -0.19 -0.20 -0.31 0.00 0.00 0.00 0.00 46.02 45.31 2igk n GLY 591 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2igk s ALA 592 N -2.33 2.20 0.05 4.61 0.00 -1.26 -4.39 121.76 120.64 2igk s ALA 592 Ca -0.10 0.33 -0.31 0.00 0.00 0.00 0.00 51.96 51.88 2igk s ALA 592 Cb 0.04 -3.30 -0.07 0.00 0.00 0.00 0.00 23.12 19.80 2igk s ALA 592 CO 0.52 -1.82 1.52 -0.80 0.00 0.00 0.00 175.76 175.17 2igk s ASN 593 N -3.25 6.73 0.00 0.00 -0.87 -1.26 -4.91 114.94 111.38 2igk s ASN 593 Ca 0.62 2.32 0.28 0.00 -1.57 0.00 0.00 52.86 54.52 2igk s ASN 593 Cb -0.18 -2.57 1.08 0.00 -0.02 0.00 0.00 41.25 39.57 2igk s ASN 593 CO 0.55 -0.79 1.81 -0.81 -2.57 0.00 0.00 177.10 175.28 2igk n PRO 594 N 5.24 0.12 -0.34 -0.60 -0.04 -1.26 -4.36 135.00 133.76 2igk n PRO 594 Ca 0.14 -0.03 -0.02 0.00 -0.04 0.00 0.00 63.50 63.55 2igk n PRO 594 Cb 0.42 -1.50 0.13 0.00 -0.04 0.00 0.00 33.50 32.50 2igk n PRO 594 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 2igk h THR 595 N 0.07 1.25 -0.29 0.52 2.02 -1.91 -0.57 112.91 114.00 2igk h THR 595 Ca 0.00 -0.52 -0.09 0.00 0.77 0.00 0.00 66.41 66.57 2igk h THR 595 Cb 0.47 -0.08 -0.01 0.00 -1.74 0.00 0.00 68.15 66.78 2igk h THR 595 CO 0.00 0.26 -0.20 0.25 0.37 0.00 0.00 175.52 176.20 2igk h LEU 596 N 1.27 0.52 -0.30 2.58 5.85 -1.86 0.66 115.31 124.04 2igk h LEU 596 Ca 0.33 -0.16 -0.10 0.00 0.84 0.00 0.00 57.88 58.79 2igk h LEU 596 Cb -0.08 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 40.80 2igk h LEU 596 CO -0.07 0.73 -0.22 0.74 -0.34 0.00 0.00 178.44 179.29 2igk h THR 597 N 0.47 1.30 -0.94 1.05 2.02 -1.57 -0.51 112.91 114.73 2igk h THR 597 Ca 0.08 -1.36 0.00 0.00 0.77 0.00 0.00 66.41 65.90 2igk h THR 597 Cb 0.61 1.53 -0.05 0.00 -1.74 0.00 0.00 68.15 68.50 2igk h THR 597 CO 0.04 0.44 0.59 0.00 0.37 0.00 0.00 175.52 176.96 2igk h ALA 598 N 0.73 1.27 -0.73 6.16 0.00 -0.74 -1.53 119.26 124.42 2igk h ALA 598 Ca 0.06 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 2igk h ALA 598 Cb 0.77 -0.38 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 2igk h ALA 598 CO 0.06 0.64 0.27 1.98 0.00 0.00 0.00 179.25 182.20 2igk h MET 599 N 1.28 1.09 -0.51 0.00 -1.53 -0.65 -1.18 114.93 113.44 2igk h MET 599 Ca 0.34 -0.20 -0.02 0.00 -3.44 0.00 0.00 59.70 56.38 2igk h MET 599 Cb -0.09 -0.18 -0.02 0.00 -0.55 0.00 0.00 31.60 30.76 2igk h MET 599 CO -0.07 0.90 0.24 0.77 0.14 0.00 0.00 176.91 178.90 2igk h SER 600 N 1.06 0.67 -0.94 1.39 0.02 -0.56 -1.01 113.55 114.17 2igk h SER 600 Ca 0.24 -0.13 0.01 0.00 -0.84 0.00 0.00 61.79 61.07 2igk h SER 600 Cb 0.23 -0.17 -0.05 0.00 0.14 0.00 0.00 62.40 62.55 2igk h SER 600 CO -0.02 0.61 0.62 -0.07 -1.14 0.00 0.00 176.83 176.84 2igk h LEU 601 N 0.68 1.08 -0.86 5.07 3.38 -0.96 -2.37 115.31 121.33 2igk h LEU 601 Ca 0.18 -0.03 -0.07 0.00 0.09 0.00 0.00 57.88 58.05 2igk h LEU 601 Cb 0.12 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 2igk h LEU 601 CO -0.02 0.78 0.08 0.00 0.09 0.00 0.00 178.44 179.37 2igk h ALA 602 N 1.35 1.06 -0.17 1.53 0.00 -0.75 -1.04 119.26 121.24 2igk h ALA 602 Ca 0.35 -0.25 0.02 0.00 0.00 0.00 0.00 54.91 55.03 2igk h ALA 602 Cb -0.14 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.40 2igk h ALA 602 CO -0.08 0.60 0.02 0.82 0.00 0.00 0.00 179.25 180.62 2igk h ILE 603 N 0.88 0.91 -0.72 0.00 2.04 -0.87 -0.35 117.51 119.40 2igk h ILE 603 Ca 0.18 -0.03 0.06 0.00 1.00 0.00 0.00 64.86 66.07 2igk h ILE 603 Cb 0.40 0.82 -0.06 0.00 -0.74 0.00 0.00 36.82 37.25 2igk h ILE 603 CO 0.01 0.02 0.42 0.50 0.00 0.00 0.00 178.15 179.09 2igk h LYS 604 N 0.09 0.74 -0.70 2.37 3.64 -1.13 -1.86 116.57 119.72 2igk h LYS 604 Ca 0.08 -0.04 0.07 0.00 -1.27 0.00 0.00 60.65 59.48 2igk h LYS 604 Cb 0.08 -0.17 -0.06 0.00 -0.41 0.00 0.00 32.23 31.67 2igk h LYS 604 CO -0.11 0.49 0.38 1.03 -2.27 0.00 0.00 179.45 178.97 2igk h SER 605 N 0.77 0.55 0.08 4.20 0.87 -0.75 -1.16 113.55 118.10 2igk h SER 605 Ca 0.32 0.04 -0.04 0.00 -1.23 0.00 0.00 61.79 60.88 2igk h SER 605 Cb 0.18 -0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 62.07 2igk h SER 605 CO -0.18 0.34 -0.14 0.00 -0.53 0.00 0.00 176.83 176.32 2igk h GLU 607 N 0.14 0.85 -0.31 0.00 5.08 -0.57 -0.42 114.58 119.35 2igk h GLU 607 Ca 0.03 -0.18 0.00 0.00 -1.00 0.00 0.00 59.36 58.21 2igk h GLU 607 Cb 0.34 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 2igk h GLU 607 CO 0.02 0.77 0.20 -0.92 -1.00 0.00 0.00 179.01 178.08 2igk h TYR 608 N 0.76 0.39 -0.69 4.33 5.03 -0.89 -2.04 116.97 123.85 2igk h TYR 608 Ca 0.18 0.01 0.04 0.00 2.58 0.00 0.00 58.73 61.53 2igk h TYR 608 Cb 0.28 -0.13 -0.05 0.00 1.55 0.00 0.00 36.73 38.38 2igk h TYR 608 CO 0.02 0.26 0.42 0.82 -1.32 0.00 0.00 178.16 178.36 2igk h ILE 609 N 0.41 1.07 0.00 1.81 2.04 -1.05 -1.87 117.51 119.91 2igk h ILE 609 Ca 0.11 -0.28 -0.03 0.00 1.00 0.00 0.00 64.86 65.66 2igk h ILE 609 Cb -0.03 0.17 -0.00 0.00 -0.74 0.00 0.00 36.82 36.22 2igk h ILE 609 CO -0.02 0.15 -0.16 0.11 0.00 0.00 0.00 178.15 178.23 2igk h LYS 610 N 0.82 0.00 -0.00 2.37 1.57 -0.77 -1.62 116.57 118.93 2igk h LYS 610 Ca 0.29 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.07 2igk h LYS 610 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.37 2igk h LYS 610 CO -0.13 0.16 -0.31 1.04 -0.57 0.00 0.00 179.45 179.64 2igk n GLN 611 N -3.48 0.28 0.00 3.15 6.02 -0.76 -4.44 117.38 118.16 2igk n GLN 611 Ca -0.01 -0.14 0.00 0.00 -0.01 0.00 0.00 57.00 56.84 2igk n GLN 611 Cb 0.32 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.08 2igk n GLN 611 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2igk n ASN 612 N -1.24 0.14 -3.90 1.08 3.02 -0.83 -5.04 115.26 108.49 2igk n ASN 612 Ca 0.09 -0.46 -0.16 0.00 -0.03 0.00 0.00 54.58 54.01 2igk n ASN 612 Cb 0.33 0.34 -0.15 0.00 -0.61 0.00 0.00 39.78 39.69 2igk n ASN 612 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2igk s PHE 613 N -0.34 0.39 -0.14 3.10 0.08 -0.67 -5.07 117.98 115.32 2igk s PHE 613 Ca 0.00 -0.06 -0.12 0.00 0.12 0.00 0.00 56.93 56.87 2igk s PHE 613 Cb 0.00 -0.33 -0.05 0.00 -0.57 0.00 0.00 43.02 42.08 2igk s PHE 613 CO 0.00 -0.06 0.24 0.99 -0.10 0.00 0.00 175.22 176.30 2igk s THR 614 N 0.32 5.33 0.60 0.64 2.01 -1.26 -4.72 115.64 118.55 2igk s THR 614 Ca -0.03 0.45 -0.18 0.00 0.31 0.00 0.00 61.69 62.23 2igk s THR 614 Cb -0.06 -3.57 -0.03 0.00 0.01 0.00 0.00 72.50 68.85 2igk s THR 614 CO -0.01 0.46 1.17 -2.84 -0.69 0.00 0.00 174.62 172.72 2igk s PRO 615 N 0.02 2.98 0.50 4.92 0.02 -1.26 -4.99 135.00 137.18 2igk s PRO 615 Ca 0.15 1.71 -0.22 0.00 0.02 0.00 0.00 61.00 62.66 2igk s PRO 615 Cb -0.13 -1.94 -0.06 0.00 0.02 0.00 0.00 34.50 32.39 2igk s PRO 615 CO 0.04 -1.17 1.22 -1.54 -0.33 0.00 0.00 177.00 175.21 2igk s SER 616 N -1.80 5.81 0.35 2.53 1.04 -1.26 -4.98 113.70 115.39 2igk s SER 616 Ca 0.75 2.42 -0.28 0.00 0.48 0.00 0.00 55.95 59.32 2igk s SER 616 Cb -0.27 -2.61 -0.10 0.00 0.10 0.00 0.00 66.02 63.14 2igk s SER 616 CO 0.33 -1.17 1.29 -2.16 0.98 0.00 0.00 173.24 172.51 2igk s PRO 617 N -2.85 4.25 -0.53 4.02 0.04 -1.26 -4.86 135.00 133.80 2igk s PRO 617 Ca 0.68 2.15 -0.21 0.00 0.04 0.00 0.00 61.00 63.66 2igk s PRO 617 Cb -0.31 -2.97 0.06 0.00 0.04 0.00 0.00 34.50 31.31 2igk s PRO 617 CO 0.37 -0.26 0.74 0.12 0.04 0.00 0.00 177.00 178.02 2igk s PHE 618 N -1.19 2.95 -1.73 0.56 5.36 -1.26 -5.13 117.98 117.54 2igk s PHE 618 Ca 0.51 -0.41 0.14 0.00 -0.96 0.00 0.00 56.93 56.21 2igk s PHE 618 Cb -0.38 -3.76 0.11 0.00 -0.34 0.00 0.00 43.02 38.65 2igk s PHE 618 CO 0.50 -1.17 0.94 2.41 -1.46 0.00 0.00 175.22 176.44