#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2igk n ASP 44 N 0.00 0.12 0.10 6.12 8.00 -1.26 -4.99 116.55 124.64 2igk n ASP 44 Ca 0.00 0.43 0.10 0.00 0.71 0.00 0.00 54.79 56.03 2igk n ASP 44 Cb 0.00 -1.45 -0.01 0.00 -0.02 0.00 0.00 41.12 39.64 2igk n ASP 44 CO 0.00 0.00 0.00 0.16 -0.39 0.00 0.00 177.20 176.97 2igk h ILE 45 N -1.76 0.07 -3.34 0.53 3.07 -1.94 -3.49 117.51 110.65 2igk h ILE 45 Ca -0.43 -1.15 -0.48 0.00 1.55 0.00 0.00 64.86 64.35 2igk h ILE 45 Cb 1.27 1.59 -0.35 0.00 -0.27 0.00 0.00 36.82 39.06 2igk h ILE 45 CO 0.41 0.04 -0.80 -0.75 -1.05 0.00 0.00 178.15 176.00 2igk s LYS 46 N -3.30 1.32 0.15 0.16 2.47 -1.26 -1.78 119.74 117.51 2igk s LYS 46 Ca -0.01 -0.23 0.05 0.00 -1.56 0.00 0.00 55.97 54.21 2igk s LYS 46 Cb 0.09 -1.27 -0.04 0.00 -1.46 0.00 0.00 37.83 35.15 2igk s LYS 46 CO 0.79 -0.12 -0.10 0.71 0.16 0.00 0.00 175.35 176.79 2igk s TYR 47 N 1.17 1.30 -0.01 4.03 1.51 -0.60 -5.02 117.35 119.73 2igk s TYR 47 Ca -0.06 -0.76 -0.24 0.00 -1.01 0.00 0.00 57.07 54.99 2igk s TYR 47 Cb -0.14 -0.67 -0.19 0.00 -0.11 0.00 0.00 41.96 40.85 2igk s TYR 47 CO -0.02 0.08 1.26 -0.44 -1.11 0.00 0.00 175.55 175.32 2igk h ASP 48 N 2.75 0.12 -3.36 2.29 3.32 -1.63 -3.16 116.42 116.76 2igk h ASP 48 Ca -0.37 -0.52 -0.51 0.00 0.02 0.00 0.00 57.03 55.65 2igk h ASP 48 Cb 1.19 -0.03 -0.34 0.00 0.22 0.00 0.00 39.33 40.37 2igk h ASP 48 CO 0.63 0.62 -0.81 -0.69 -1.72 0.00 0.00 179.24 177.28 2igk s VAL 49 N -4.12 1.07 -0.14 -1.35 1.01 -0.84 -1.61 120.40 114.41 2igk s VAL 49 Ca -0.16 -0.41 -0.03 0.00 0.00 0.00 0.00 61.98 61.39 2igk s VAL 49 Cb 0.02 -1.01 -0.03 0.00 0.00 0.00 0.00 36.38 35.37 2igk s VAL 49 CO 0.70 0.35 -0.06 0.68 0.00 0.00 0.00 175.10 176.77 2igk s VAL 50 N 0.96 3.72 -0.16 2.92 -7.23 -0.21 -1.51 120.40 118.89 2igk s VAL 50 Ca -0.09 -0.42 -0.00 0.00 -1.81 0.00 0.00 61.98 59.65 2igk s VAL 50 Cb -0.15 -2.61 -0.00 0.00 0.56 0.00 0.00 36.38 34.18 2igk s VAL 50 CO 0.00 0.51 -0.14 -0.63 -0.31 0.00 0.00 175.10 174.53 2igk s ILE 51 N 0.27 2.81 -0.41 -0.62 1.01 0.08 -0.68 121.20 123.66 2igk s ILE 51 Ca -0.04 -0.72 -0.18 0.00 0.00 0.00 0.00 60.65 59.70 2igk s ILE 51 Cb -0.14 -2.19 0.01 0.00 0.01 0.00 0.00 42.46 40.15 2igk s ILE 51 CO 0.03 0.51 0.50 -0.69 0.00 0.00 0.00 174.94 175.29 2igk s VAL 52 N 0.80 5.01 0.00 2.92 1.01 0.26 -1.28 120.40 129.12 2igk s VAL 52 Ca -0.05 -0.07 0.00 0.00 0.00 0.00 0.00 61.98 61.86 2igk s VAL 52 Cb -0.15 -4.05 0.00 0.00 0.00 0.00 0.00 36.38 32.18 2igk s VAL 52 CO 0.00 -0.40 0.00 0.61 0.00 0.00 0.00 175.10 175.31 2igk n GLY 53 N 5.02 2.66 1.40 4.51 0.00 0.54 -0.52 105.19 118.79 2igk n GLY 53 Ca -0.05 -1.43 -0.06 0.00 0.00 0.00 0.00 46.02 44.47 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 3.14 -3.21 1.61 3.41 -1.26 -4.40 113.62 112.91 2igk n SER 54 Ca 0.00 -3.58 -0.20 0.00 -0.26 0.00 0.00 58.87 54.83 2igk n SER 54 Cb 0.00 -0.67 0.16 0.00 -0.26 0.00 0.00 64.21 63.44 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 -0.95 -2.52 0.26 5.00 0.00 -1.26 -2.54 105.19 103.18 2igk n GLY 55 Ca 0.37 -1.50 0.13 0.00 0.00 0.00 0.00 46.02 45.01 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 0.11 1.61 0.13 -1.91 0.12 132.00 132.06 2igk h PRO 56 Ca -0.28 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.70 2igk h PRO 56 Cb 0.83 0.00 0.02 0.00 0.13 0.00 0.00 31.00 31.98 2igk h PRO 56 CO 0.18 0.12 -0.65 0.82 -0.23 0.00 0.00 178.00 178.25 2igk h ILE 57 N 0.00 1.56 -0.82 -3.56 1.08 -1.91 -1.62 117.51 112.23 2igk h ILE 57 Ca -0.00 -2.47 0.14 0.00 -0.39 0.00 0.00 64.86 62.14 2igk h ILE 57 Cb 0.35 3.19 -0.09 0.00 -3.07 0.00 0.00 36.82 37.20 2igk h ILE 57 CO 0.02 0.69 0.40 1.23 -0.69 0.00 0.00 178.15 179.80 2igk h GLY 58 N -0.47 1.31 2.00 5.37 0.00 -1.68 0.74 103.07 110.35 2igk h GLY 58 Ca -0.11 -0.23 -0.04 0.00 0.00 0.00 0.00 47.33 46.95 2igk h GLY 58 CO 0.12 -0.04 -0.17 0.00 0.00 0.00 0.00 176.54 176.45 2igk h THR 60 N 0.00 1.31 -0.74 0.00 2.02 0.15 0.70 112.91 116.36 2igk h THR 60 Ca -0.00 -1.36 0.01 0.00 0.77 0.00 0.00 66.41 65.82 2igk h THR 60 Cb 0.51 1.62 -0.04 0.00 -1.74 0.00 0.00 68.15 68.49 2igk h THR 60 CO 0.02 0.43 0.48 1.88 0.37 0.00 0.00 175.52 178.70 2igk h TYR 61 N 0.32 0.94 -0.31 3.16 0.05 -1.03 -2.15 116.97 117.95 2igk h TYR 61 Ca 0.05 0.02 -0.06 0.00 0.05 0.00 0.00 58.73 58.78 2igk h TYR 61 Cb 0.76 -0.31 -0.01 0.00 1.01 0.00 0.00 36.73 38.18 2igk h TYR 61 CO 0.07 0.60 -0.05 0.00 -1.05 0.00 0.00 178.16 177.73 2igk h ALA 62 N 1.26 0.42 0.04 3.88 0.00 -0.90 0.90 119.26 124.86 2igk h ALA 62 Ca 0.27 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.92 2igk h ALA 62 Cb -0.10 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 2igk h ALA 62 CO -0.06 0.22 -0.08 -0.09 0.00 0.00 0.00 179.25 179.25 2igk h ARG 63 N 0.35 -0.15 0.18 0.00 2.43 -0.73 0.25 114.38 116.71 2igk h ARG 63 Ca 0.08 0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.25 2igk h ARG 63 Cb 0.53 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.11 2igk h ARG 63 CO 0.03 -0.10 -0.08 0.93 -1.51 0.00 0.00 179.97 179.23 2igk h GLU 64 N -0.16 -0.23 0.04 0.20 4.39 -1.29 -2.29 114.58 115.25 2igk h GLU 64 Ca 0.02 0.02 -0.22 0.00 0.34 0.00 0.00 59.36 59.51 2igk h GLU 64 Cb 0.17 0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.86 2igk h GLU 64 CO -0.05 -0.12 -1.02 -0.07 -1.16 0.00 0.00 179.01 176.59 2igk h LEU 65 N -0.28 0.24 -0.28 1.33 3.38 -0.65 -2.37 115.31 116.68 2igk h LEU 65 Ca -0.02 -0.23 -0.16 0.00 0.09 0.00 0.00 57.88 57.56 2igk h LEU 65 Cb 0.21 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.89 2igk h LEU 65 CO 0.04 1.11 -0.44 0.58 0.09 0.00 0.00 178.44 179.82 2igk h VAL 66 N 0.07 1.29 0.00 1.22 2.07 -0.59 -1.68 116.25 118.63 2igk h VAL 66 Ca -0.06 -1.63 0.00 0.00 0.82 0.00 0.00 66.70 65.82 2igk h VAL 66 Cb 1.72 1.64 0.00 0.00 -1.52 0.00 0.00 31.29 33.13 2igk h VAL 66 CO 0.15 0.53 0.00 0.61 0.02 0.00 0.00 177.57 178.88 2igk n GLY 67 N 0.31 -1.30 1.31 2.17 0.00 -0.86 -2.13 105.19 104.70 2igk n GLY 67 Ca -0.04 0.02 0.11 0.00 0.00 0.00 0.00 46.02 46.11 2igk n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2igk n ALA 68 N -1.69 2.41 -0.30 4.61 0.00 -0.90 -4.97 120.51 119.67 2igk n ALA 68 Ca 0.03 -1.32 0.00 0.00 0.00 0.00 0.00 53.44 52.16 2igk n ALA 68 Cb 0.26 -0.89 0.00 0.00 0.00 0.00 0.00 19.45 18.82 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 1.51 0.85 3.84 0.00 0.00 -0.90 -4.92 105.19 105.56 2igk n GLY 69 Ca 0.24 -0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.93 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 -2.00 3.36 -0.43 1.61 1.51 -0.65 -4.63 117.35 116.12 2igk s TYR 70 Ca 0.00 1.42 -0.23 0.00 -1.01 0.00 0.00 57.07 57.25 2igk s TYR 70 Cb 0.00 -2.71 0.02 0.00 -0.11 0.00 0.00 41.96 39.16 2igk s TYR 70 CO 0.00 -0.08 0.80 0.21 -1.11 0.00 0.00 175.55 175.36 2igk s LYS 71 N -3.30 3.50 -0.07 -0.62 2.20 -1.26 -4.28 119.74 115.90 2igk s LYS 71 Ca 0.58 0.01 0.05 0.00 -0.36 0.00 0.00 55.97 56.25 2igk s LYS 71 Cb -0.10 -3.91 -0.01 0.00 -1.51 0.00 0.00 37.83 32.30 2igk s LYS 71 CO 0.19 -1.07 -0.21 0.08 -0.36 0.00 0.00 175.35 173.98 2igk s VAL 72 N 3.29 2.41 -0.01 4.02 1.01 -0.72 -1.65 120.40 128.75 2igk s VAL 72 Ca 0.31 -0.93 0.05 0.00 0.00 0.00 0.00 61.98 61.40 2igk s VAL 72 Cb -0.12 -1.92 -0.03 0.00 0.00 0.00 0.00 36.38 34.31 2igk s VAL 72 CO 0.22 0.57 -0.15 0.00 0.00 0.00 0.00 175.10 175.74 2igk s ALA 73 N -0.18 2.67 -0.03 5.51 0.00 -0.57 -1.45 121.76 127.72 2igk s ALA 73 Ca -0.02 -1.06 0.02 0.00 0.00 0.00 0.00 51.96 50.91 2igk s ALA 73 Cb -0.14 -0.90 0.00 0.00 0.00 0.00 0.00 23.12 22.09 2igk s ALA 73 CO 0.03 0.57 -0.09 1.41 0.00 0.00 0.00 175.76 177.68 2igk s MET 74 N -1.04 0.98 0.06 0.00 1.75 -0.09 -0.74 119.30 120.22 2igk s MET 74 Ca 0.13 -0.30 0.09 0.00 -1.25 0.00 0.00 55.69 54.36 2igk s MET 74 Cb -0.11 -0.91 -0.03 0.00 2.84 0.00 0.00 34.83 36.62 2igk s MET 74 CO 0.03 0.11 -0.25 -0.06 -0.65 0.00 0.00 175.02 174.20 2igk s PHE 75 N 0.22 2.37 -0.02 4.11 0.08 -0.41 -0.63 117.98 123.71 2igk s PHE 75 Ca -0.04 -0.38 0.00 0.00 0.12 0.00 0.00 56.93 56.64 2igk s PHE 75 Cb -0.09 -1.38 0.02 0.00 -0.57 0.00 0.00 43.02 41.00 2igk s PHE 75 CO 0.01 0.20 0.00 0.34 -0.10 0.00 0.00 175.22 175.66 2igk s ASP 76 N -1.46 0.25 0.55 1.36 -1.08 -0.58 -0.34 116.67 115.37 2igk s ASP 76 Ca 0.13 -0.01 0.28 0.00 -0.52 0.00 0.00 52.55 52.43 2igk s ASP 76 Cb -0.10 -0.12 1.59 0.00 -1.46 0.00 0.00 42.92 42.83 2igk s ASP 76 CO 0.04 -0.07 2.14 -0.29 0.52 0.00 0.00 175.17 177.50 2igk h ILE 77 N 5.88 0.54 -5.25 4.11 2.10 -1.80 0.06 117.51 123.14 2igk h ILE 77 Ca -0.38 -0.36 -0.31 0.00 1.08 0.00 0.00 64.86 64.89 2igk h ILE 77 Cb 1.15 1.23 0.04 0.00 -1.09 0.00 0.00 36.82 38.15 2igk h ILE 77 CO 0.49 0.08 0.01 0.61 -1.08 0.00 0.00 178.15 178.26 2igk n GLY 78 N -0.89 1.36 3.50 8.18 0.00 -1.26 -3.89 105.19 112.20 2igk n GLY 78 Ca -0.02 -2.11 -0.24 0.00 0.00 0.00 0.00 46.02 43.66 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 -3.93 1.73 -0.07 1.61 2.02 -1.26 -1.44 118.70 117.36 2igk s GLU 79 Ca 0.42 -1.96 -0.30 0.00 0.02 0.00 0.00 54.97 53.15 2igk s GLU 79 Cb -0.03 -1.16 -0.02 0.00 0.10 0.00 0.00 34.13 33.02 2igk s GLU 79 CO 0.27 -0.11 1.06 0.42 0.02 0.00 0.00 175.26 176.92 2igk s ILE 80 N -3.06 4.63 -0.37 -1.63 1.01 -1.26 -1.51 121.20 119.01 2igk s ILE 80 Ca 0.35 1.90 0.07 0.00 0.00 0.00 0.00 60.65 62.98 2igk s ILE 80 Cb 0.08 -4.22 0.30 0.00 0.01 0.00 0.00 42.46 38.63 2igk s ILE 80 CO 0.16 0.03 1.28 -0.90 0.00 0.00 0.00 174.94 175.51 2igk n ASP 81 N 4.85 -1.66 -0.88 3.58 5.75 -1.26 -4.99 116.55 121.94 2igk n ASP 81 Ca 0.09 -2.22 0.05 0.00 -0.01 0.00 0.00 54.79 52.70 2igk n ASP 81 Cb 0.48 0.98 0.15 0.00 -1.03 0.00 0.00 41.12 41.70 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 -0.63 1.50 -0.00 -1.12 7.64 -1.26 -5.03 113.62 114.71 2igk n SER 82 Ca -0.10 -3.32 0.00 0.00 1.01 0.00 0.00 58.87 56.46 2igk n SER 82 Cb 0.80 -0.46 0.00 0.00 -1.01 0.00 0.00 64.21 63.54 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 -0.62 -1.56 0.23 0.23 0.00 -1.26 -4.27 105.19 97.94 2igk n GLY 83 Ca 0.15 -1.32 0.13 0.00 0.00 0.00 0.00 46.02 44.98 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 -8.43 0.99 3.38 -2.03 -3.39 115.31 105.84 2igk h LEU 84 Ca 0.00 0.00 -0.59 0.00 0.09 0.00 0.00 57.88 57.38 2igk h LEU 84 Cb 0.00 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 40.64 2igk h LEU 84 CO 0.00 0.01 0.71 -0.54 0.09 0.00 0.00 178.44 178.71 2igk s LYS 85 N -3.31 3.28 0.13 1.13 1.02 -1.26 -4.99 119.74 115.73 2igk s LYS 85 Ca 0.06 -0.31 -0.31 0.00 0.02 0.00 0.00 55.97 55.42 2igk s LYS 85 Cb 0.06 -4.11 -0.09 0.00 -0.52 0.00 0.00 37.83 33.17 2igk s LYS 85 CO 0.64 -1.71 1.46 0.42 -0.92 0.00 0.00 175.35 175.25 2igk s ILE 86 N 4.43 3.07 -0.88 2.17 1.01 -1.26 -2.60 121.20 127.15 2igk s ILE 86 Ca 0.31 0.75 0.00 0.00 0.00 0.00 0.00 60.65 61.71 2igk s ILE 86 Cb -0.12 -3.48 0.00 0.00 0.01 0.00 0.00 42.46 38.87 2igk s ILE 86 CO 0.17 0.05 0.00 0.61 0.00 0.00 0.00 174.94 175.78 2igk n GLY 87 N 3.61 1.01 3.93 6.18 0.00 -1.26 -4.31 105.19 114.35 2igk n GLY 87 Ca 0.13 -0.67 -0.26 0.00 0.00 0.00 0.00 46.02 45.22 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 -2.31 3.20 -0.05 4.61 0.00 -1.07 -2.72 121.76 123.42 2igk s ALA 88 Ca 0.00 -0.94 -0.30 0.00 0.00 0.00 0.00 51.96 50.72 2igk s ALA 88 Cb 0.00 -2.58 -0.04 0.00 0.00 0.00 0.00 23.12 20.50 2igk s ALA 88 CO 0.00 -1.27 1.39 -1.58 0.00 0.00 0.00 175.76 174.30 2igk s HIS 89 N -3.22 2.75 0.28 0.00 2.46 -1.26 -4.56 115.29 111.73 2igk s HIS 89 Ca 0.60 0.81 0.34 0.00 0.47 0.00 0.00 55.06 57.28 2igk s HIS 89 Cb -0.11 -3.64 1.56 0.00 -0.13 0.00 0.00 32.58 30.27 2igk s HIS 89 CO 0.44 -2.36 2.07 0.87 -2.47 0.00 0.00 174.74 173.29 2igk h LYS 90 N 8.16 0.00 -0.05 2.88 1.57 -1.39 -2.51 116.57 125.22 2igk h LYS 90 Ca -0.35 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.43 2igk h LYS 90 Cb 1.16 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.47 2igk h LYS 90 CO 0.92 0.04 0.00 0.36 -0.57 0.00 0.00 179.45 180.21 2igk n LYS 91 N -3.21 1.23 -0.17 3.15 2.85 -1.26 -3.96 118.16 116.80 2igk n LYS 91 Ca -0.01 -0.35 -0.02 0.00 -1.05 0.00 0.00 58.31 56.88 2igk n LYS 91 Cb 0.26 -1.33 0.04 0.00 -0.65 0.00 0.00 35.03 33.35 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 -0.44 2.63 -4.93 -5.58 3.02 -0.95 -4.19 115.26 104.82 2igk n ASN 92 Ca 0.15 -2.21 -0.27 0.00 -0.03 0.00 0.00 54.58 52.23 2igk n ASN 92 Cb 0.15 -0.54 -0.03 0.00 -0.61 0.00 0.00 39.78 38.75 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 -0.76 5.21 0.33 3.41 -4.23 -1.25 -5.00 115.64 113.35 2igk s THR 93 Ca 0.08 -0.44 0.01 0.00 -1.18 0.00 0.00 61.69 60.17 2igk s THR 93 Cb 0.07 -3.75 0.27 0.00 1.34 0.00 0.00 72.50 70.43 2igk s THR 93 CO 0.02 -0.20 1.98 0.58 -0.54 0.00 0.00 174.62 176.46 2igk h VAL 94 N 1.48 1.15 -0.79 2.29 2.07 -1.97 -1.68 116.25 118.80 2igk h VAL 94 Ca -0.48 -0.32 -0.02 0.00 0.82 0.00 0.00 66.70 66.69 2igk h VAL 94 Cb 1.19 0.12 -0.04 0.00 -1.52 0.00 0.00 31.29 31.05 2igk h VAL 94 CO 0.67 0.17 0.42 -0.33 0.02 0.00 0.00 177.57 178.53 2igk h GLU 95 N 0.95 1.11 0.00 1.57 4.39 -1.94 -1.77 114.58 118.89 2igk h GLU 95 Ca 0.28 -0.14 -0.08 0.00 0.34 0.00 0.00 59.36 59.76 2igk h GLU 95 Cb -0.04 -0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 28.39 2igk h GLU 95 CO -0.07 0.83 -0.37 1.88 -1.16 0.00 0.00 179.01 180.12 2igk h TYR 96 N 1.10 0.00 0.00 4.33 0.05 -1.72 -1.81 116.97 118.92 2igk h TYR 96 Ca 0.28 0.00 -0.05 0.00 0.05 0.00 0.00 58.73 59.01 2igk h TYR 96 Cb 0.05 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.78 2igk h TYR 96 CO 0.00 0.37 -0.24 1.96 -1.05 0.00 0.00 178.16 179.21 2igk h GLN 97 N 0.00 0.00 0.05 4.88 1.08 -0.95 -2.79 115.11 117.38 2igk h GLN 97 Ca -0.00 0.00 -0.29 0.00 -1.45 0.00 0.00 58.65 56.91 2igk h GLN 97 Cb 1.19 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 28.59 2igk h GLN 97 CO 0.05 0.24 -1.56 0.87 -0.95 0.00 0.00 178.83 177.47 2igk h LYS 98 N 0.00 0.10 -2.34 1.46 1.57 -1.17 -3.41 116.57 112.77 2igk h LYS 98 Ca -0.00 -0.18 -0.59 0.00 -1.87 0.00 0.00 60.65 58.02 2igk h LYS 98 Cb 0.84 0.07 -0.39 0.00 0.08 0.00 0.00 32.23 32.83 2igk h LYS 98 CO 0.03 0.84 -0.92 0.09 -0.57 0.00 0.00 179.45 178.92 2igk n ASN 99 N -3.27 0.64 -0.10 0.86 3.02 -0.70 -4.98 115.26 110.74 2igk n ASN 99 Ca -0.15 -2.70 0.20 0.00 -0.03 0.00 0.00 54.58 51.90 2igk n ASN 99 Cb 1.03 -0.62 0.62 0.00 -0.61 0.00 0.00 39.78 40.20 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 3.66 0.72 0.00 2.41 6.09 -1.74 -2.31 117.51 126.35 2igk h ILE 100 Ca 0.19 -0.06 -0.04 0.00 -1.37 0.00 0.00 64.86 63.58 2igk h ILE 100 Cb 0.85 0.53 -0.01 0.00 0.47 0.00 0.00 36.82 38.67 2igk h ILE 100 CO 0.49 0.03 -0.17 0.44 -3.07 0.00 0.00 178.15 175.87 2igk h ASP 101 N 0.17 0.00 0.69 2.19 3.32 -1.87 -1.01 116.42 119.90 2igk h ASP 101 Ca 0.34 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.39 2igk h ASP 101 Cb 1.09 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.64 2igk h ASP 101 CO -0.06 0.17 0.00 0.11 -1.72 0.00 0.00 179.24 177.75 2igk h LYS 102 N 0.00 0.00 0.00 3.56 1.79 -1.74 -3.11 116.57 117.08 2igk h LYS 102 Ca -0.00 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.43 2igk h LYS 102 Cb 0.50 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.14 2igk h LYS 102 CO 0.02 0.00 -0.16 0.35 -1.08 0.00 0.00 179.45 178.58 2igk h PHE 103 N 0.00 0.00 -0.93 -1.35 3.57 -1.34 -1.91 116.94 114.97 2igk h PHE 103 Ca 0.00 0.00 0.24 0.00 3.53 0.00 0.00 57.97 61.74 2igk h PHE 103 Cb 0.35 0.00 -0.06 0.00 2.79 0.00 0.00 35.95 39.03 2igk h PHE 103 CO 0.00 0.16 0.63 -0.24 -2.23 0.00 0.00 178.31 176.64 2igk h VAL 104 N 0.00 0.60 -0.15 1.41 3.04 -1.73 0.37 116.25 119.80 2igk h VAL 104 Ca -0.00 -0.08 -0.13 0.00 -1.01 0.00 0.00 66.70 65.48 2igk h VAL 104 Cb 0.53 0.34 -0.01 0.00 -2.01 0.00 0.00 31.29 30.13 2igk h VAL 104 CO 0.02 0.04 -0.46 0.78 -1.01 0.00 0.00 177.57 176.94 2igk h ASN 105 N 0.24 0.40 -0.28 3.17 4.21 -1.59 -1.41 115.58 120.31 2igk h ASN 105 Ca 0.48 -0.19 -0.03 0.00 1.21 0.00 0.00 56.30 57.77 2igk h ASN 105 Cb 1.46 -0.11 -0.01 0.00 -1.12 0.00 0.00 38.32 38.53 2igk h ASN 105 CO -0.13 0.81 0.07 0.58 -1.29 0.00 0.00 177.43 177.47 2igk h VAL 106 N 0.30 1.22 0.07 2.81 2.07 -1.07 -0.64 116.25 121.00 2igk h VAL 106 Ca 0.02 -0.71 0.01 0.00 0.82 0.00 0.00 66.70 66.84 2igk h VAL 106 Cb 0.93 1.15 -0.02 0.00 -1.52 0.00 0.00 31.29 31.83 2igk h VAL 106 CO 0.08 0.23 -0.13 0.40 0.02 0.00 0.00 177.57 178.17 2igk h ILE 107 N 0.29 0.69 -0.50 4.57 2.04 -1.28 -2.78 117.51 120.54 2igk h ILE 107 Ca 0.09 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.93 2igk h ILE 107 Cb 0.29 0.69 -0.02 0.00 -0.74 0.00 0.00 36.82 37.04 2igk h ILE 107 CO 0.00 0.00 0.24 1.56 0.00 0.00 0.00 178.15 179.96 2igk h GLN 108 N -0.25 0.70 0.00 2.37 4.20 -1.11 -1.36 115.11 119.65 2igk h GLN 108 Ca 0.02 -0.08 -0.01 0.00 0.06 0.00 0.00 58.65 58.65 2igk h GLN 108 Cb 0.28 -0.14 -0.00 0.00 0.30 0.00 0.00 27.48 27.92 2igk h GLN 108 CO -0.08 0.54 -0.03 0.78 -0.67 0.00 0.00 178.83 179.37 2igk h GLY 109 N 0.81 0.00 -1.08 3.46 0.00 -0.84 -3.08 103.07 102.33 2igk h GLY 109 Ca 0.18 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.49 2igk h GLY 109 CO -0.02 0.00 -0.50 0.61 0.00 0.00 0.00 176.54 176.63 2igk n GLN 110 N -3.56 1.38 -4.09 4.80 10.64 -0.53 -4.94 117.38 121.08 2igk n GLN 110 Ca -0.02 -3.07 -0.33 0.00 -1.83 0.00 0.00 57.00 51.74 2igk n GLN 110 Cb 0.13 -1.43 -0.16 0.00 -0.86 0.00 0.00 30.24 27.93 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 -2.84 2.50 -0.21 2.61 1.43 -1.11 -4.02 118.68 117.05 2igk s LEU 111 Ca 0.36 -0.79 -0.04 0.00 -1.03 0.00 0.00 54.13 52.64 2igk s LEU 111 Cb 0.36 -1.52 -0.01 0.00 0.03 0.00 0.00 46.19 45.04 2igk s LEU 111 CO -0.07 -0.05 -0.05 -0.04 0.23 0.00 0.00 176.35 176.38 2igk s MET 112 N 1.27 3.41 0.31 1.70 -1.94 -0.20 -4.88 119.30 118.96 2igk s MET 112 Ca 0.02 -0.62 -0.30 0.00 -1.71 0.00 0.00 55.69 53.09 2igk s MET 112 Cb -0.15 -2.98 -0.12 0.00 2.01 0.00 0.00 34.83 33.60 2igk s MET 112 CO -0.10 -0.13 1.49 0.43 -0.01 0.00 0.00 175.02 176.70 2igk n SER 113 N 4.60 3.45 -0.03 3.03 7.64 -1.26 -0.74 113.62 130.31 2igk n SER 113 Ca -0.18 1.17 -0.13 0.00 1.01 0.00 0.00 58.87 60.74 2igk n SER 113 Cb 0.51 -1.55 -0.09 0.00 -1.01 0.00 0.00 64.21 62.07 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 3.08 1.39 -2.57 0.44 2.07 -1.56 -3.45 116.25 115.65 2igk h VAL 114 Ca -0.47 -1.28 -0.26 0.00 0.82 0.00 0.00 66.70 65.51 2igk h VAL 114 Cb 1.25 2.11 -0.34 0.00 -1.52 0.00 0.00 31.29 32.79 2igk h VAL 114 CO 0.73 0.35 -0.57 -0.55 0.02 0.00 0.00 177.57 177.55 2igk s SER 115 N -5.91 0.85 -0.23 0.57 0.15 -1.26 -4.67 113.70 103.20 2igk s SER 115 Ca -0.15 0.14 -0.02 0.00 0.70 0.00 0.00 55.95 56.62 2igk s SER 115 Cb 0.03 0.59 0.02 0.00 -1.71 0.00 0.00 66.02 64.95 2igk s SER 115 CO 0.71 -0.29 -0.08 -0.69 1.20 0.00 0.00 173.24 174.09 2igk s VAL 116 N 2.39 2.83 0.82 4.45 1.01 -1.26 -4.76 120.40 125.88 2igk s VAL 116 Ca 0.06 -0.93 -0.11 0.00 0.00 0.00 0.00 61.98 61.00 2igk s VAL 116 Cb -0.14 -2.38 0.09 0.00 0.00 0.00 0.00 36.38 33.94 2igk s VAL 116 CO -0.11 0.28 1.09 -2.16 0.00 0.00 0.00 175.10 174.20 2igk s PRO 117 N 1.34 1.86 0.22 2.72 0.04 -1.26 0.81 135.00 140.73 2igk s PRO 117 Ca 0.02 0.91 -0.32 0.00 0.04 0.00 0.00 61.00 61.64 2igk s PRO 117 Cb -0.16 -1.87 -0.12 0.00 0.04 0.00 0.00 34.50 32.39 2igk s PRO 117 CO -0.06 -1.85 1.64 0.28 0.04 0.00 0.00 177.00 177.05 2igk n VAL 118 N -3.63 0.34 -2.57 -0.36 0.31 -1.26 -4.59 118.33 106.58 2igk n VAL 118 Ca 0.08 -0.09 -0.42 0.00 -0.01 0.00 0.00 64.34 63.90 2igk n VAL 118 Cb 0.55 -1.85 -0.03 0.00 -0.91 0.00 0.00 33.84 31.60 2igk n VAL 118 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 2igk s ASN 119 N 0.87 7.21 -0.13 4.52 3.84 -1.26 -4.96 114.94 125.03 2igk s ASN 119 Ca 0.72 1.81 0.19 0.00 0.21 0.00 0.00 52.86 55.79 2igk s ASN 119 Cb -0.55 -2.57 0.30 0.00 -0.55 0.00 0.00 41.25 37.88 2igk s ASN 119 CO 0.39 -0.39 1.17 0.35 -2.79 0.00 0.00 177.10 175.82 2igk n THR 120 N 4.04 1.91 -2.17 -5.21 -2.24 -1.26 -4.85 114.28 104.50 2igk n THR 120 Ca 0.08 -2.24 -0.42 0.00 -2.27 0.00 0.00 64.05 59.20 2igk n THR 120 Cb 0.48 -0.24 -0.03 0.00 -2.10 0.00 0.00 70.33 68.45 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 -2.87 4.40 -0.22 3.22 1.43 -1.26 -4.98 118.68 118.40 2igk s LEU 121 Ca 0.32 2.42 -0.20 0.00 -1.03 0.00 0.00 54.13 55.64 2igk s LEU 121 Cb 0.28 -3.60 -0.02 0.00 0.03 0.00 0.00 46.19 42.87 2igk s LEU 121 CO 0.03 -0.60 0.61 -0.69 0.23 0.00 0.00 176.35 175.93 2igk s VAL 122 N 0.41 5.02 -0.41 -1.59 1.01 -1.26 -5.02 120.40 118.57 2igk s VAL 122 Ca 0.60 1.12 -0.05 0.00 0.00 0.00 0.00 61.98 63.65 2igk s VAL 122 Cb -0.38 -3.92 0.10 0.00 0.00 0.00 0.00 36.38 32.19 2igk s VAL 122 CO 0.36 0.09 0.22 -0.69 0.00 0.00 0.00 175.10 175.08 2igk s VAL 123 N 2.09 3.57 -0.17 2.92 1.01 -1.26 -4.93 120.40 123.63 2igk s VAL 123 Ca 0.27 -1.85 0.17 0.00 0.00 0.00 0.00 61.98 60.57 2igk s VAL 123 Cb -0.16 -3.35 0.40 0.00 0.00 0.00 0.00 36.38 33.28 2igk s VAL 123 CO 0.10 -0.63 1.28 -0.90 0.00 0.00 0.00 175.10 174.95 2igk n ASP 124 N 4.70 3.12 -0.65 3.32 5.68 -1.26 -4.45 116.55 127.02 2igk n ASP 124 Ca -0.05 -3.01 0.09 0.00 -0.50 0.00 0.00 54.79 51.31 2igk n ASP 124 Cb 0.42 -0.48 0.22 0.00 -1.14 0.00 0.00 41.12 40.14 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 -0.92 2.09 -1.70 2.12 -2.24 -1.26 -5.01 114.28 107.36 2igk n THR 125 Ca 0.18 -1.92 -0.36 0.00 -2.27 0.00 0.00 64.05 59.68 2igk n THR 125 Cb 0.75 -0.20 0.07 0.00 -2.10 0.00 0.00 70.33 68.86 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 -2.71 3.53 0.43 3.22 1.43 -1.26 -4.98 118.68 118.34 2igk s LEU 126 Ca 0.38 2.55 -0.26 0.00 -1.03 0.00 0.00 54.13 55.76 2igk s LEU 126 Cb 0.31 -4.61 -0.09 0.00 0.03 0.00 0.00 46.19 41.83 2igk s LEU 126 CO 0.07 -2.02 1.41 -0.55 0.23 0.00 0.00 176.35 175.49 2igk s SER 127 N -1.54 6.04 0.62 2.29 0.15 -1.26 -4.89 113.70 115.10 2igk s SER 127 Ca 0.80 2.89 0.28 0.00 0.70 0.00 0.00 55.95 60.62 2igk s SER 127 Cb -0.35 -2.65 1.43 0.00 -1.71 0.00 0.00 66.02 62.73 2igk s SER 127 CO 0.40 -1.06 1.83 -0.65 1.20 0.00 0.00 173.24 174.96 2igk h PRO 128 N 2.51 0.00 0.00 5.44 0.11 -2.00 -1.16 132.00 136.91 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 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 2igk h PRO 128 CO 0.62 0.00 -0.14 1.79 -0.21 0.00 0.00 178.00 180.06 2igk h THR 129 N 0.00 0.00 -4.05 -1.15 1.35 -2.04 -3.47 112.91 103.56 2igk h THR 129 Ca 0.16 -0.85 -0.47 0.00 -0.55 0.00 0.00 66.41 64.70 2igk h THR 129 Cb 1.17 1.78 0.02 0.00 -1.73 0.00 0.00 68.15 69.39 2igk h THR 129 CO -0.00 0.00 0.39 -0.44 -0.25 0.00 0.00 175.52 175.22 2igk s SER 130 N -5.63 6.41 0.15 5.36 0.01 -0.44 -4.97 113.70 114.59 2igk s SER 130 Ca 0.07 1.95 -0.31 0.00 1.31 0.00 0.00 55.95 58.97 2igk s SER 130 Cb 0.08 -2.56 -0.09 0.00 0.21 0.00 0.00 66.02 63.66 2igk s SER 130 CO 0.67 -0.73 1.41 0.86 0.41 0.00 0.00 173.24 175.85 2igk s TRP 131 N -1.92 3.20 -0.02 2.43 -0.00 -1.26 -4.95 118.94 116.41 2igk s TRP 131 Ca 0.66 0.96 0.03 0.00 -0.00 0.00 0.00 56.10 57.75 2igk s TRP 131 Cb -0.17 -3.72 -0.00 0.00 -0.00 0.00 0.00 33.47 29.57 2igk s TRP 131 CO 0.21 -2.49 -0.12 -1.14 -0.00 0.00 0.00 176.95 173.42 2igk s GLN 132 N 0.74 1.11 0.56 5.86 0.74 -1.26 -5.13 119.66 122.28 2igk s GLN 132 Ca 0.63 -0.41 -0.16 0.00 0.05 0.00 0.00 55.36 55.48 2igk s GLN 132 Cb -0.38 -1.03 -0.05 0.00 1.10 0.00 0.00 33.01 32.64 2igk s GLN 132 CO 0.33 0.19 1.04 0.00 -0.55 0.00 0.00 175.29 176.30 2igk s ALA 133 N -0.01 2.84 -0.60 1.58 0.00 -1.26 -4.96 121.76 119.36 2igk s ALA 133 Ca -0.00 0.35 0.22 0.00 0.00 0.00 0.00 51.96 52.53 2igk s ALA 133 Cb -0.08 -3.20 -0.14 0.00 0.00 0.00 0.00 23.12 19.70 2igk s ALA 133 CO 0.00 -0.61 0.84 0.43 0.00 0.00 0.00 175.76 176.43 2igk n SER 134 N -1.82 0.58 -4.16 0.00 7.64 -1.26 -5.01 113.62 109.60 2igk n SER 134 Ca 0.08 -0.43 -0.11 0.00 1.01 0.00 0.00 58.87 59.42 2igk n SER 134 Cb 0.53 1.18 -0.09 0.00 -1.01 0.00 0.00 64.21 64.82 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 -3.21 0.01 -1.27 0.44 -4.23 -1.26 -5.06 115.64 101.05 2igk s THR 135 Ca 0.02 -1.89 -0.14 0.00 -1.18 0.00 0.00 61.69 58.50 2igk s THR 135 Cb 0.15 -2.43 0.14 0.00 1.34 0.00 0.00 72.50 71.70 2igk s THR 135 CO 0.85 -0.02 1.67 0.49 -0.54 0.00 0.00 174.62 177.07 2igk n PHE 136 N -0.28 4.34 -1.99 3.99 3.72 -1.26 -4.99 117.46 120.98 2igk n PHE 136 Ca 0.01 -3.09 -0.28 0.00 -0.05 0.00 0.00 57.45 54.03 2igk n PHE 136 Cb 0.65 -2.26 0.11 0.00 -0.94 0.00 0.00 39.48 37.04 2igk n PHE 136 CO 0.00 0.00 0.00 -0.59 -0.05 0.00 0.00 176.76 176.12 2igk s PHE 137 N 2.00 2.50 -0.36 1.38 -0.71 -1.26 -4.91 117.98 116.62 2igk s PHE 137 Ca 0.45 0.53 -0.29 0.00 -1.04 0.00 0.00 56.93 56.58 2igk s PHE 137 Cb 0.03 -3.60 0.01 0.00 -1.21 0.00 0.00 43.02 38.24 2igk s PHE 137 CO 0.01 -1.96 1.36 0.08 -1.34 0.00 0.00 175.22 173.37 2igk s VAL 138 N -3.59 4.01 0.04 -2.49 1.01 -1.26 -4.84 120.40 113.28 2igk s VAL 138 Ca 0.65 1.09 0.03 0.00 0.00 0.00 0.00 61.98 63.75 2igk s VAL 138 Cb -0.09 -4.17 -0.02 0.00 0.00 0.00 0.00 36.38 32.10 2igk s VAL 138 CO 0.49 -0.62 -0.09 -0.13 0.00 0.00 0.00 175.10 174.75 2igk s ARG 139 N 4.56 0.61 -1.62 2.72 0.52 -1.26 -4.91 118.95 119.58 2igk s ARG 139 Ca 0.59 -0.70 -0.03 0.00 -0.52 0.00 0.00 55.73 55.07 2igk s ARG 139 Cb -0.15 -0.48 0.01 0.00 0.52 0.00 0.00 34.95 34.84 2igk s ARG 139 CO 0.28 0.11 0.38 0.09 0.02 0.00 0.00 175.30 176.18 2igk n ASN 140 N 1.73 -5.94 -0.04 0.23 3.02 -1.26 -1.78 115.26 111.23 2igk n ASN 140 Ca -0.20 -0.19 -0.00 0.00 -0.03 0.00 0.00 54.58 54.16 2igk n ASN 140 Cb 0.55 -4.85 -0.00 0.00 -0.61 0.00 0.00 39.78 34.87 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 -1.32 0.44 3.74 7.41 0.00 -1.26 -5.03 105.19 109.16 2igk n GLY 141 Ca -0.16 -0.11 -0.32 0.00 0.00 0.00 0.00 46.02 45.44 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 -2.12 4.19 -0.39 1.61 1.04 -0.74 -4.79 113.70 112.51 2igk s SER 142 Ca 0.00 2.03 -0.06 0.00 0.48 0.00 0.00 55.95 58.40 2igk s SER 142 Cb 0.00 -2.55 0.08 0.00 0.10 0.00 0.00 66.02 63.65 2igk s SER 142 CO 0.00 -2.25 0.19 0.21 0.98 0.00 0.00 173.24 172.37 2igk s ASN 143 N -2.86 5.38 0.00 7.02 2.47 0.24 -4.77 114.94 122.42 2igk s ASN 143 Ca 0.66 -1.62 0.11 0.00 0.42 0.00 0.00 52.86 52.43 2igk s ASN 143 Cb -0.21 -1.89 0.48 0.00 -1.45 0.00 0.00 41.25 38.18 2igk s ASN 143 CO 0.52 -0.49 1.36 -0.81 -3.72 0.00 0.00 177.10 173.96 2igk n PRO 144 N 4.76 0.00 0.21 0.43 -0.04 -1.26 -1.69 135.00 137.41 2igk n PRO 144 Ca -0.08 0.31 0.10 0.00 -0.04 0.00 0.00 63.50 63.78 2igk n PRO 144 Cb 0.43 -1.50 0.33 0.00 -0.04 0.00 0.00 33.50 32.72 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 -6.15 0.54 4.39 -1.96 -3.46 114.58 107.94 2igk h GLU 145 Ca 0.00 0.00 -0.58 0.00 0.34 0.00 0.00 59.36 59.12 2igk h GLU 145 Cb 0.19 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 28.78 2igk h GLU 145 CO 0.00 0.22 0.78 -1.14 -1.16 0.00 0.00 179.01 177.71 2igk s GLN 146 N -3.41 4.15 -0.23 2.33 2.00 -0.68 -5.00 119.66 118.81 2igk s GLN 146 Ca 0.03 1.16 -0.29 0.00 -2.00 0.00 0.00 55.36 54.26 2igk s GLN 146 Cb 0.08 -3.69 -0.00 0.00 0.80 0.00 0.00 33.01 30.20 2igk s GLN 146 CO 0.66 -0.75 1.20 0.34 -0.50 0.00 0.00 175.29 176.23 2igk s ASP 147 N 1.44 6.91 0.48 6.67 -1.08 -1.26 -4.71 116.67 125.12 2igk s ASP 147 Ca 0.43 1.41 0.33 0.00 -0.52 0.00 0.00 52.55 54.21 2igk s ASP 147 Cb -0.14 -2.54 1.55 0.00 -1.46 0.00 0.00 42.92 40.34 2igk s ASP 147 CO 0.11 -0.84 1.98 1.55 0.52 0.00 0.00 175.17 178.49 2igk h PRO 148 N 8.29 0.00 -0.02 4.34 0.13 -1.96 -2.15 132.00 140.63 2igk h PRO 148 Ca -0.24 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.89 2igk h PRO 148 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 2igk h PRO 148 CO 1.00 0.00 -0.09 1.28 -0.23 0.00 0.00 178.00 179.96 2igk n LEU 149 N -2.77 1.87 -2.30 1.56 4.77 -1.26 -4.18 117.00 114.69 2igk n LEU 149 Ca -0.00 -0.62 -0.18 0.00 -0.03 0.00 0.00 56.01 55.18 2igk n LEU 149 Cb 0.18 -0.02 0.03 0.00 -2.33 0.00 0.00 43.42 41.27 2igk n LEU 149 CO 0.21 0.32 0.12 0.54 -1.33 0.00 0.00 177.39 177.25 2igk n ARG 150 N 0.33 3.02 -3.92 3.23 1.74 -0.81 -4.96 116.66 115.29 2igk n ARG 150 Ca 0.16 -4.00 -0.22 0.00 -0.77 0.00 0.00 57.85 53.02 2igk n ARG 150 Cb 0.43 -2.06 -0.04 0.00 -1.02 0.00 0.00 32.46 29.77 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 -3.63 5.25 -0.97 0.55 3.84 -1.24 -0.76 114.94 117.98 2igk s ASN 151 Ca 0.44 -0.48 -0.03 0.00 0.21 0.00 0.00 52.86 53.00 2igk s ASN 151 Cb 0.39 -1.03 0.27 0.00 -0.55 0.00 0.00 41.25 40.32 2igk s ASN 151 CO -0.00 -0.27 1.09 0.18 -2.79 0.00 0.00 177.10 175.30 2igk n LEU 152 N -1.30 5.18 0.29 3.21 4.77 -1.26 -4.79 117.00 123.10 2igk n LEU 152 Ca -0.03 -5.19 0.14 0.00 -0.03 0.00 0.00 56.01 50.90 2igk n LEU 152 Cb 0.59 -1.18 0.88 0.00 -2.33 0.00 0.00 43.42 41.39 2igk n LEU 152 CO 0.43 1.64 1.12 0.77 -1.33 0.00 0.00 177.39 180.01 2igk h SER 153 N 5.67 0.00 1.47 -1.43 4.64 -1.81 -1.12 113.55 120.97 2igk h SER 153 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 2igk h SER 153 Cb 0.73 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.82 2igk h SER 153 CO 1.05 0.00 -0.09 1.23 -0.87 0.00 0.00 176.83 178.15 2igk h GLY 154 N 0.00 0.00 -4.25 -0.77 0.00 -0.83 -3.46 103.07 93.76 2igk h GLY 154 Ca 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.80 2igk h GLY 154 CO -0.00 0.00 0.76 1.20 0.00 0.00 0.00 176.54 178.50 2igk s GLN 155 N -3.13 4.27 0.12 4.80 -1.52 -0.42 -3.67 119.66 120.11 2igk s GLN 155 Ca 0.09 2.30 -0.08 0.00 -1.95 0.00 0.00 55.36 55.72 2igk s GLN 155 Cb 0.11 -3.11 -0.01 0.00 -0.22 0.00 0.00 33.01 29.78 2igk s GLN 155 CO 0.63 -0.42 0.21 0.00 -0.25 0.00 0.00 175.29 175.45 2igk s ALA 156 N 0.02 -0.00 0.21 6.09 0.00 -1.26 -1.41 121.76 125.41 2igk s ALA 156 Ca 0.59 -0.83 0.09 0.00 0.00 0.00 0.00 51.96 51.81 2igk s ALA 156 Cb -0.42 0.67 -0.05 0.00 0.00 0.00 0.00 23.12 23.33 2igk s ALA 156 CO 0.43 -0.56 -0.17 0.14 0.00 0.00 0.00 175.76 175.60 2igk s VAL 157 N -3.93 1.96 -0.11 0.00 -7.23 0.08 -4.85 120.40 106.33 2igk s VAL 157 Ca 0.12 -2.19 0.03 0.00 -1.81 0.00 0.00 61.98 58.13 2igk s VAL 157 Cb 0.05 -2.06 0.00 0.00 0.56 0.00 0.00 36.38 34.92 2igk s VAL 157 CO -0.05 -0.47 -0.23 -0.89 -0.31 0.00 0.00 175.10 173.15 2igk s THR 158 N -2.61 2.11 -0.63 5.32 2.01 -1.26 -1.04 115.64 119.55 2igk s THR 158 Ca 0.23 -0.99 0.05 0.00 0.31 0.00 0.00 61.69 61.28 2igk s THR 158 Cb -0.03 -1.82 0.15 0.00 0.01 0.00 0.00 72.50 70.82 2igk s THR 158 CO 0.09 0.56 0.41 -0.13 -0.69 0.00 0.00 174.62 174.85 2igk s ARG 159 N 0.45 2.24 0.05 4.92 0.52 -1.26 -4.69 118.95 121.17 2igk s ARG 159 Ca -0.16 -3.05 -0.07 0.00 -0.52 0.00 0.00 55.73 51.93 2igk s ARG 159 Cb -0.17 -3.32 -0.01 0.00 0.52 0.00 0.00 34.95 31.97 2igk s ARG 159 CO 0.06 -1.23 0.14 0.14 0.02 0.00 0.00 175.30 174.44 2igk s VAL 160 N -0.99 0.13 0.17 3.52 -7.23 -1.26 -4.35 120.40 110.39 2igk s VAL 160 Ca 0.22 -1.09 -0.32 0.00 -1.81 0.00 0.00 61.98 58.99 2igk s VAL 160 Cb -0.12 -1.04 -0.11 0.00 0.56 0.00 0.00 36.38 35.67 2igk s VAL 160 CO -0.11 -0.60 1.71 -0.69 -0.31 0.00 0.00 175.10 175.10 2igk s VAL 161 N -2.95 2.36 0.00 1.32 1.01 -0.57 -0.43 120.40 121.15 2igk s VAL 161 Ca -0.02 0.16 0.00 0.00 0.00 0.00 0.00 61.98 62.12 2igk s VAL 161 Cb 0.01 -3.10 0.00 0.00 0.00 0.00 0.00 36.38 33.28 2igk s VAL 161 CO -0.06 0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.66 2igk n GLY 162 N 3.99 0.53 7.00 4.51 0.00 -1.05 -4.25 105.19 115.92 2igk n GLY 162 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 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 1.63 0.00 -0.02 0.00 0.43 -2.27 105.19 102.95 2igk n GLY 163 Ca 0.00 -0.52 0.08 0.00 0.00 0.00 0.00 46.02 45.58 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 4.35 0.02 0.00 1.61 2.81 -1.26 -2.58 117.12 122.06 2igk n MET 164 Ca 0.00 0.20 0.12 0.00 -1.81 0.00 0.00 57.70 56.21 2igk n MET 164 Cb 0.00 -1.50 0.63 0.00 -0.71 0.00 0.00 33.22 31.64 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 -1.48 0.00 0.00 7.83 3.41 -0.96 -1.58 113.62 120.83 2igk n SER 165 Ca 0.04 -0.26 0.14 0.00 -0.26 0.00 0.00 58.87 58.54 2igk n SER 165 Cb 0.20 -0.20 0.64 0.00 -0.26 0.00 0.00 64.21 64.58 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 -1.20 0.05 -0.35 6.66 -2.24 -1.07 -4.17 114.28 111.96 2igk n THR 166 Ca 0.13 0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.92 2igk n THR 166 Cb 0.16 -0.53 0.00 0.00 -2.10 0.00 0.00 70.33 67.86 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 -1.44 0.00 -0.67 4.78 1.44 -0.65 -1.03 115.22 117.65 2igk n HIS 167 Ca 0.09 0.00 -0.30 0.00 -2.01 0.00 0.00 57.72 55.49 2igk n HIS 167 Cb 0.30 0.00 0.19 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 -0.12 1.57 -0.76 -1.40 1.48 -0.62 -4.93 118.94 114.16 2igk s TRP 168 Ca 0.00 1.61 0.25 0.00 -1.06 0.00 0.00 56.10 56.91 2igk s TRP 168 Cb 0.00 -3.26 0.92 0.00 -1.16 0.00 0.00 33.47 29.97 2igk s TRP 168 CO 0.00 -3.09 1.78 2.41 -4.06 0.00 0.00 176.95 173.99 2igk n THR 169 N -4.41 0.54 -1.13 0.66 -1.04 -1.26 -4.93 114.28 102.70 2igk n THR 169 Ca 0.09 -0.09 -0.05 0.00 -2.04 0.00 0.00 64.05 61.97 2igk n THR 169 Cb 0.53 -0.71 -0.02 0.00 -1.82 0.00 0.00 70.33 68.31 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 -2.09 3.67 -0.55 0.00 0.00 -1.26 -0.44 121.76 121.09 2igk s ALA 171 Ca 0.00 0.04 0.07 0.00 0.00 0.00 0.00 51.96 52.06 2igk s ALA 171 Cb 0.00 -3.44 0.25 0.00 0.00 0.00 0.00 23.12 19.93 2igk s ALA 171 CO 0.00 -1.02 0.67 0.25 0.00 0.00 0.00 175.76 175.66 2igk n THR 172 N 5.32 1.24 -2.50 0.00 -2.24 -0.11 -4.78 114.28 111.20 2igk n THR 172 Ca 0.09 -4.78 -0.33 0.00 -2.27 0.00 0.00 64.05 56.77 2igk n THR 172 Cb 0.47 -2.04 -0.04 0.00 -2.10 0.00 0.00 70.33 66.62 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 -2.01 3.93 0.53 -0.78 0.04 -1.26 -4.76 135.00 130.68 2igk s PRO 173 Ca 0.38 1.10 -0.19 0.00 0.04 0.00 0.00 61.00 62.33 2igk s PRO 173 Cb 0.16 -2.13 -0.07 0.00 0.04 0.00 0.00 34.50 32.50 2igk s PRO 173 CO -0.05 -0.29 1.06 1.03 0.04 0.00 0.00 177.00 178.79 2igk s ARG 174 N -3.68 3.59 0.20 4.56 0.52 -1.26 -4.77 118.95 118.12 2igk s ARG 174 Ca 0.62 1.36 -0.30 0.00 -0.52 0.00 0.00 55.73 56.89 2igk s ARG 174 Cb -0.11 -2.06 -0.08 0.00 0.52 0.00 0.00 34.95 33.21 2igk s ARG 174 CO 0.25 -0.61 0.98 -0.06 0.02 0.00 0.00 175.30 175.88 2igk s PHE 175 N -2.08 3.86 0.86 -0.53 0.40 -1.26 -5.01 117.98 114.22 2igk s PHE 175 Ca 0.67 1.83 -0.13 0.00 -0.60 0.00 0.00 56.93 58.70 2igk s PHE 175 Cb -0.17 -3.06 0.12 0.00 0.51 0.00 0.00 43.02 40.41 2igk s PHE 175 CO 0.26 0.17 1.23 0.16 0.70 0.00 0.00 175.22 177.74 2igk s ASP 176 N -0.72 4.01 0.25 1.36 -4.77 -1.26 -4.88 116.67 110.67 2igk s ASP 176 Ca 0.44 0.60 -0.03 0.00 -3.30 0.00 0.00 52.55 50.26 2igk s ASP 176 Cb -0.26 -0.93 0.51 0.00 -1.09 0.00 0.00 42.92 41.15 2igk s ASP 176 CO 0.33 -2.20 1.72 0.03 0.70 0.00 0.00 175.17 175.75 2igk h ARG 177 N -1.26 0.41 0.00 2.11 3.08 -1.98 -1.81 114.38 114.92 2igk h ARG 177 Ca -0.45 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 59.55 2igk h ARG 177 Cb 1.30 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 31.25 2igk h ARG 177 CO 0.56 0.27 -0.09 1.05 -1.07 0.00 0.00 179.97 180.69 2igk h GLU 178 N 0.42 0.00 -0.01 0.04 4.11 -1.98 -2.40 114.58 114.77 2igk h GLU 178 Ca 0.44 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.87 2igk h GLU 178 Cb 0.72 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.97 2igk h GLU 178 CO -0.44 0.09 -0.60 1.04 0.07 0.00 0.00 179.01 179.17 2igk n GLN 179 N -3.54 0.58 -4.39 1.06 6.02 -0.69 -4.86 117.38 111.56 2igk n GLN 179 Ca -0.02 -0.44 -0.34 0.00 -0.01 0.00 0.00 57.00 56.19 2igk n GLN 179 Cb 0.22 -1.49 -0.11 0.00 1.02 0.00 0.00 30.24 29.89 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 -2.72 3.28 0.53 -1.09 3.52 -0.91 -4.57 118.95 116.99 2igk s ARG 180 Ca 0.15 -0.46 -0.21 0.00 -0.13 0.00 0.00 55.73 55.08 2igk s ARG 180 Cb 0.18 -2.84 -0.05 0.00 -1.56 0.00 0.00 34.95 30.67 2igk s ARG 180 CO 0.67 0.50 1.21 -1.25 -0.81 0.00 0.00 175.30 175.62 2igk s PRO 181 N -0.33 3.32 0.13 5.12 0.04 -1.26 -4.96 135.00 137.06 2igk s PRO 181 Ca 0.06 1.84 -0.31 0.00 0.04 0.00 0.00 61.00 62.64 2igk s PRO 181 Cb -0.12 -2.15 -0.08 0.00 0.04 0.00 0.00 34.50 32.18 2igk s PRO 181 CO 0.02 -0.93 1.35 -0.51 0.04 0.00 0.00 177.00 176.97 2igk s LEU 182 N -3.59 4.38 -0.16 -3.56 1.43 -1.26 -4.95 118.68 110.98 2igk s LEU 182 Ca 0.71 2.30 0.17 0.00 -1.03 0.00 0.00 54.13 56.28 2igk s LEU 182 Cb -0.30 -3.59 -0.24 0.00 0.03 0.00 0.00 46.19 42.08 2igk s LEU 182 CO 0.35 -0.60 0.13 0.18 0.23 0.00 0.00 176.35 176.64 2igk n LEU 183 N 3.63 0.00 -4.11 1.79 4.77 -1.26 -4.93 117.00 116.89 2igk n LEU 183 Ca 0.10 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.77 2igk n LEU 183 Cb 0.43 0.38 -0.17 0.00 -2.33 0.00 0.00 43.42 41.73 2igk n LEU 183 CO 0.58 0.38 -0.52 -0.69 -1.33 0.00 0.00 177.39 175.81 2igk s VAL 184 N -2.60 1.77 0.50 4.08 1.01 -1.26 -5.04 120.40 118.86 2igk s VAL 184 Ca -0.09 -0.80 -0.19 0.00 0.00 0.00 0.00 61.98 60.90 2igk s VAL 184 Cb 0.07 -1.59 -0.08 0.00 0.00 0.00 0.00 36.38 34.78 2igk s VAL 184 CO 0.76 0.49 1.03 -1.59 0.00 0.00 0.00 175.10 175.80 2igk s LYS 185 N 0.92 3.77 -1.85 2.72 -2.85 -1.26 -4.30 119.74 116.89 2igk s LYS 185 Ca -0.06 1.28 -0.22 0.00 -1.00 0.00 0.00 55.97 55.97 2igk s LYS 185 Cb -0.15 -2.10 0.22 0.00 -2.06 0.00 0.00 37.83 33.74 2igk s LYS 185 CO -0.02 -0.44 0.58 -0.25 0.10 0.00 0.00 175.35 175.32 2igk n ASP 186 N -1.15 -1.82 -3.00 0.03 8.00 -1.26 -4.85 116.55 112.50 2igk n ASP 186 Ca 0.09 -1.23 -0.01 0.00 0.71 0.00 0.00 54.79 54.35 2igk n ASP 186 Cb 0.53 -1.72 -0.00 0.00 -0.02 0.00 0.00 41.12 39.91 2igk n ASP 186 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2igk s ASP 187 N -3.32 -1.36 0.36 -2.24 -1.08 -1.26 -5.06 116.67 102.70 2igk s ASP 187 Ca 0.78 -1.03 0.03 0.00 -0.52 0.00 0.00 52.55 51.81 2igk s ASP 187 Cb -0.45 1.76 0.68 0.00 -1.46 0.00 0.00 42.92 43.44 2igk s ASP 187 CO 1.02 -0.11 2.00 0.00 0.52 0.00 0.00 175.17 178.60 2igk h ALA 188 N 6.09 1.55 -0.26 3.66 0.00 -1.88 -1.90 119.26 126.53 2igk h ALA 188 Ca 0.04 -0.06 -0.18 0.00 0.00 0.00 0.00 54.91 54.71 2igk h ALA 188 Cb 1.16 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.73 2igk h ALA 188 CO 0.05 0.39 -0.55 -0.44 0.00 0.00 0.00 179.25 178.70 2igk h ASP 189 N 0.75 0.93 -0.53 0.00 3.32 -1.98 -0.39 116.42 118.53 2igk h ASP 189 Ca 0.20 -0.55 -0.12 0.00 0.02 0.00 0.00 57.03 56.58 2igk h ASP 189 Cb -0.04 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.23 2igk h ASP 189 CO -0.04 1.31 -0.12 0.00 -1.72 0.00 0.00 179.24 178.67 2igk h ALA 190 N 0.65 0.77 0.05 3.45 0.00 -1.90 -1.28 119.26 121.00 2igk h ALA 190 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.56 2igk h ALA 190 Cb 1.17 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 2igk h ALA 190 CO 0.12 0.67 -0.06 0.22 0.00 0.00 0.00 179.25 180.21 2igk h ASP 191 N 0.91 -0.16 -0.49 0.00 3.58 -1.29 -0.30 116.42 118.66 2igk h ASP 191 Ca 0.14 0.02 0.07 0.00 0.42 0.00 0.00 57.03 57.67 2igk h ASP 191 Cb 0.69 0.06 -0.06 0.00 1.72 0.00 0.00 39.33 41.74 2igk h ASP 191 CO 0.05 -0.09 0.16 0.44 -2.88 0.00 0.00 179.24 176.92 2igk h ASP 192 N -0.13 0.16 -0.22 2.28 3.32 -1.00 -0.85 116.42 119.98 2igk h ASP 192 Ca 0.01 0.06 -0.10 0.00 0.02 0.00 0.00 57.03 57.02 2igk h ASP 192 Cb 0.13 0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.72 2igk h ASP 192 CO -0.03 0.12 -0.20 0.00 -1.72 0.00 0.00 179.24 177.41 2igk h ALA 193 N 1.33 0.99 -0.12 3.45 0.00 -1.04 0.48 119.26 124.36 2igk h ALA 193 Ca 0.23 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 2igk h ALA 193 Cb 0.25 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 2igk h ALA 193 CO -0.24 0.60 0.01 1.49 0.00 0.00 0.00 179.25 181.10 2igk h GLU 194 N 0.59 0.21 -0.58 0.00 4.57 -0.65 -2.01 114.58 116.70 2igk h GLU 194 Ca 0.09 -0.06 0.03 0.00 -1.18 0.00 0.00 59.36 58.24 2igk h GLU 194 Cb 0.67 -0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 29.20 2igk h GLU 194 CO 0.05 0.43 0.35 -1.49 -1.18 0.00 0.00 179.01 177.17 2igk h TRP 195 N -0.05 0.65 -0.87 0.92 4.06 -1.02 -1.37 115.95 118.27 2igk h TRP 195 Ca 0.03 0.02 -0.01 0.00 2.06 0.00 0.00 58.89 61.00 2igk h TRP 195 Cb 0.33 -0.21 -0.04 0.00 -1.00 0.00 0.00 29.16 28.24 2igk h TRP 195 CO 0.03 0.36 0.51 0.22 -3.56 0.00 0.00 178.44 176.00 2igk h ASP 196 N 0.68 1.06 -0.15 -3.49 3.58 -0.86 0.85 116.42 118.10 2igk h ASP 196 Ca 0.24 -0.08 -0.00 0.00 0.42 0.00 0.00 57.03 57.61 2igk h ASP 196 Cb 0.04 -0.27 -0.01 0.00 1.72 0.00 0.00 39.33 40.82 2igk h ASP 196 CO -0.11 0.83 0.08 -0.09 -2.88 0.00 0.00 179.24 177.07 2igk h ARG 197 N 1.21 0.21 -0.15 0.28 2.43 -1.08 -1.59 114.38 115.68 2igk h ARG 197 Ca 0.31 -0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.42 2igk h ARG 197 Cb -0.02 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 29.49 2igk h ARG 197 CO -0.06 0.22 -0.06 -0.07 -1.51 0.00 0.00 179.97 178.50 2igk h LEU 198 N 0.14 0.31 -1.12 3.80 3.38 -0.96 -2.52 115.31 118.34 2igk h LEU 198 Ca 0.05 -0.40 0.03 0.00 0.09 0.00 0.00 57.88 57.65 2igk h LEU 198 Cb 0.08 -0.09 -0.05 0.00 0.09 0.00 0.00 40.66 40.69 2igk h LEU 198 CO -0.01 0.64 0.60 1.88 0.09 0.00 0.00 178.44 181.64 2igk h TYR 199 N -0.02 1.12 -0.52 1.13 0.05 -0.88 -0.96 116.97 116.89 2igk h TYR 199 Ca 0.04 0.03 -0.09 0.00 0.05 0.00 0.00 58.73 58.75 2igk h TYR 199 Cb 0.51 -0.37 -0.02 0.00 1.01 0.00 0.00 36.73 37.86 2igk h TYR 199 CO 0.06 0.67 -0.03 1.15 -1.05 0.00 0.00 178.16 178.96 2igk h THR 200 N 1.17 1.27 -0.49 -2.88 2.02 -1.18 0.26 112.91 113.08 2igk h THR 200 Ca 0.35 -1.14 -0.05 0.00 0.77 0.00 0.00 66.41 66.34 2igk h THR 200 Cb -0.04 0.97 -0.02 0.00 -1.74 0.00 0.00 68.15 67.32 2igk h THR 200 CO -0.10 0.40 0.10 0.50 0.37 0.00 0.00 175.52 176.80 2igk h LYS 201 N 0.80 0.80 -0.75 6.66 3.64 -1.19 -2.41 116.57 124.12 2igk h LYS 201 Ca 0.14 -0.20 -0.05 0.00 -1.27 0.00 0.00 60.65 59.27 2igk h LYS 201 Cb 0.57 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 32.26 2igk h LYS 201 CO 0.03 0.79 0.27 0.00 -2.27 0.00 0.00 179.45 178.27 2igk h ALA 202 N 0.98 1.07 -0.22 5.00 0.00 -0.83 -1.12 119.26 124.13 2igk h ALA 202 Ca 0.15 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2igk h ALA 202 Cb 0.36 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2igk h ALA 202 CO 0.01 0.65 0.01 0.93 0.00 0.00 0.00 179.25 180.84 2igk h GLU 203 N 1.10 0.32 -0.41 0.00 5.08 -0.45 -1.30 114.58 118.92 2igk h GLU 203 Ca 0.25 -0.05 -0.09 0.00 -1.00 0.00 0.00 59.36 58.46 2igk h GLU 203 Cb 0.24 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 2igk h GLU 203 CO -0.02 0.35 -0.11 1.03 -1.00 0.00 0.00 179.01 179.27 2igk h SER 204 N 0.32 0.81 -0.30 1.42 0.87 -0.75 -0.71 113.55 115.20 2igk h SER 204 Ca 0.07 -0.37 -0.08 0.00 -1.23 0.00 0.00 61.79 60.19 2igk h SER 204 Cb 0.21 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 61.93 2igk h SER 204 CO 0.00 0.99 -0.08 1.88 -0.53 0.00 0.00 176.83 179.09 2igk h TYR 205 N 0.62 0.74 0.00 2.24 0.05 -0.54 -2.93 116.97 117.15 2igk h TYR 205 Ca 0.10 -0.12 0.00 0.00 0.05 0.00 0.00 58.73 58.77 2igk h TYR 205 Cb 0.64 -0.20 0.00 0.00 1.01 0.00 0.00 36.73 38.18 2igk h TYR 205 CO 0.05 0.74 -0.68 1.19 -1.05 0.00 0.00 178.16 178.41 2igk n PHE 206 N -4.19 0.06 -3.64 4.88 3.72 -0.56 -3.79 117.46 113.94 2igk n PHE 206 Ca 0.02 0.02 -0.23 0.00 -0.05 0.00 0.00 57.45 57.20 2igk n PHE 206 Cb 0.33 -0.24 0.06 0.00 -0.94 0.00 0.00 39.48 38.70 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 -1.58 -6.73 -1.87 -1.08 1.13 -0.36 -4.11 117.38 102.78 2igk n GLN 207 Ca 0.05 0.76 -0.41 0.00 -1.94 0.00 0.00 57.00 55.46 2igk n GLN 207 Cb 0.35 -5.70 -0.00 0.00 0.11 0.00 0.00 30.24 25.00 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 -3.38 2.21 0.18 5.09 2.01 -0.71 -2.41 115.64 118.64 2igk s THR 208 Ca 0.38 0.21 -0.20 0.00 0.31 0.00 0.00 61.69 62.38 2igk s THR 208 Cb -0.17 -3.13 0.05 0.00 0.01 0.00 0.00 72.50 69.25 2igk s THR 208 CO 0.76 0.04 0.56 -0.83 -0.69 0.00 0.00 174.62 174.47 2igk s GLY 209 N -0.34 -0.35 -0.09 4.40 0.00 -0.20 -4.93 107.32 105.81 2igk s GLY 209 Ca 0.54 0.10 0.13 0.00 0.00 0.00 0.00 44.72 45.50 2igk s GLY 209 CO 0.59 -0.07 1.13 -1.30 0.00 0.00 0.00 173.10 173.45 2igk n THR 210 N -0.35 1.21 -0.07 0.90 -2.24 -1.26 -1.39 114.28 111.08 2igk n THR 210 Ca -0.13 -1.70 0.00 0.00 -2.27 0.00 0.00 64.05 59.95 2igk n THR 210 Cb 0.63 0.12 0.00 0.00 -2.10 0.00 0.00 70.33 68.98 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 -0.75 0.53 0.14 3.42 5.75 -1.26 -4.63 116.55 119.75 2igk n ASP 211 Ca 0.11 -0.78 0.13 0.00 -0.01 0.00 0.00 54.79 54.24 2igk n ASP 211 Cb 0.73 0.35 0.50 0.00 -1.03 0.00 0.00 41.12 41.67 2igk n ASP 211 CO 0.00 0.00 0.00 1.56 -0.11 0.00 0.00 177.20 178.65 2igk h GLN 212 N 0.00 0.00 0.00 0.11 7.50 -1.93 -2.86 115.11 117.92 2igk h GLN 212 Ca 0.00 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 2igk h GLN 212 Cb 0.04 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.57 2igk h GLN 212 CO 0.00 0.00 -0.02 1.19 -1.50 0.00 0.00 178.83 178.50 2igk n PHE 213 N -2.33 0.00 -0.03 2.96 3.01 -1.26 -4.83 117.46 114.99 2igk n PHE 213 Ca 0.02 -0.81 0.09 0.00 1.01 0.00 0.00 57.45 57.77 2igk n PHE 213 Cb 0.26 -0.12 0.49 0.00 -0.01 0.00 0.00 39.48 40.10 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 0.00 0.41 -0.47 -1.08 2.10 -1.83 -2.64 116.57 113.05 2igk h LYS 214 Ca 0.00 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.63 2igk h LYS 214 Cb 0.88 -0.09 0.00 0.00 -0.90 0.00 0.00 32.23 32.12 2igk h LYS 214 CO 0.00 0.27 0.00 0.39 -2.00 0.00 0.00 179.45 178.11 2igk n GLU 215 N -4.47 4.12 -2.53 0.07 1.02 -1.26 -4.87 120.64 112.72 2igk n GLU 215 Ca 0.07 -3.02 -0.42 0.00 -0.02 0.00 0.00 57.16 53.77 2igk n GLU 215 Cb 0.25 -2.08 -0.03 0.00 -0.02 0.00 0.00 31.44 29.56 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 -1.18 7.20 0.09 1.62 0.15 -1.00 -4.95 113.70 115.63 2igk s SER 216 Ca 0.50 1.93 -0.18 0.00 0.70 0.00 0.00 55.95 58.89 2igk s SER 216 Cb 0.38 -2.58 -0.07 0.00 -1.71 0.00 0.00 66.02 62.04 2igk s SER 216 CO 0.14 -0.35 1.56 0.40 1.20 0.00 0.00 173.24 176.19 2igk h ILE 217 N 4.42 1.23 -0.44 6.45 2.04 -1.91 -2.26 117.51 127.04 2igk h ILE 217 Ca -0.42 -0.80 -0.01 0.00 1.00 0.00 0.00 64.86 64.63 2igk h ILE 217 Cb 1.22 1.25 -0.02 0.00 -0.74 0.00 0.00 36.82 38.52 2igk h ILE 217 CO 0.78 0.26 0.25 0.03 0.00 0.00 0.00 178.15 179.46 2igk h ARG 218 N 0.25 0.61 -0.35 2.37 3.08 -1.93 0.32 114.38 118.73 2igk h ARG 218 Ca 0.08 -0.06 0.07 0.00 0.07 0.00 0.00 59.98 60.14 2igk h ARG 218 Cb 0.35 -0.12 -0.07 0.00 0.08 0.00 0.00 29.97 30.20 2igk h ARG 218 CO 0.01 0.47 -0.13 1.25 -1.07 0.00 0.00 179.97 180.50 2igk h HIS 219 N 0.58 -0.29 -0.01 3.04 2.76 -1.77 -1.14 115.15 118.32 2igk h HIS 219 Ca 0.16 0.04 -0.14 0.00 -2.20 0.00 0.00 60.37 58.22 2igk h HIS 219 Cb 0.03 0.18 -0.02 0.00 1.55 0.00 0.00 27.41 29.15 2igk h HIS 219 CO -0.03 -0.20 -0.65 -0.91 -1.30 0.00 0.00 177.93 174.84 2igk h ASN 220 N -0.05 0.05 -0.30 3.26 2.35 -1.00 -0.01 115.58 119.87 2igk h ASN 220 Ca 0.17 -0.03 -0.00 0.00 -0.55 0.00 0.00 56.30 55.89 2igk h ASN 220 Cb 0.32 -0.02 -0.01 0.00 0.05 0.00 0.00 38.32 38.66 2igk h ASN 220 CO -0.39 0.69 0.19 0.25 -1.65 0.00 0.00 177.43 176.52 2igk h LEU 221 N 0.03 0.36 -0.04 1.61 5.85 0.00 -0.12 115.31 123.00 2igk h LEU 221 Ca -0.01 -0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.63 2igk h LEU 221 Cb 1.16 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.10 2igk h LEU 221 CO 0.09 0.30 -0.14 0.58 -0.34 0.00 0.00 178.44 178.92 2igk h VAL 222 N 0.39 1.46 -0.34 1.05 2.07 -1.03 -2.93 116.25 116.93 2igk h VAL 222 Ca 0.11 -1.58 0.07 0.00 0.82 0.00 0.00 66.70 66.12 2igk h VAL 222 Cb -0.00 2.40 -0.07 0.00 -1.52 0.00 0.00 31.29 32.11 2igk h VAL 222 CO -0.02 0.43 -0.10 0.25 0.02 0.00 0.00 177.57 178.15 2igk h LEU 223 N -0.40 -0.37 -0.68 2.57 5.85 -0.99 -1.45 115.31 119.85 2igk h LEU 223 Ca -0.01 0.11 -0.12 0.00 0.84 0.00 0.00 57.88 58.70 2igk h LEU 223 Cb 0.78 0.23 -0.01 0.00 0.37 0.00 0.00 40.66 42.02 2igk h LEU 223 CO 0.03 -0.13 -0.25 0.78 -0.34 0.00 0.00 178.44 178.52 2igk h ASN 224 N -0.03 0.77 -0.37 1.25 2.35 -1.09 -0.08 115.58 118.39 2igk h ASN 224 Ca 0.17 -0.29 -0.08 0.00 -0.55 0.00 0.00 56.30 55.54 2igk h ASN 224 Cb 0.28 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.42 2igk h ASN 224 CO -0.36 0.99 -0.10 0.50 -1.65 0.00 0.00 177.43 176.81 2igk h LYS 225 N 0.65 0.72 -0.20 0.81 1.63 -1.31 -1.23 116.57 117.64 2igk h LYS 225 Ca 0.08 -0.28 -0.18 0.00 -0.85 0.00 0.00 60.65 59.43 2igk h LYS 225 Cb 0.77 -0.04 -0.00 0.00 -0.60 0.00 0.00 32.23 32.35 2igk h LYS 225 CO 0.06 0.87 -0.60 -0.07 -3.45 0.00 0.00 179.45 176.26 2igk h LEU 226 N 0.52 0.76 -0.35 5.20 3.38 -1.17 0.32 115.31 123.98 2igk h LEU 226 Ca 0.09 -0.43 0.06 0.00 0.09 0.00 0.00 57.88 57.69 2igk h LEU 226 Cb 0.61 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 41.09 2igk h LEU 226 CO 0.04 1.19 0.02 0.74 0.09 0.00 0.00 178.44 180.52 2igk h THR 227 N 0.50 0.77 -0.28 0.22 2.02 -0.98 -0.59 112.91 114.57 2igk h THR 227 Ca -0.00 -0.04 -0.03 0.00 0.77 0.00 0.00 66.41 67.10 2igk h THR 227 Cb 1.18 0.63 -0.01 0.00 -1.74 0.00 0.00 68.15 68.21 2igk h THR 227 CO 0.12 0.02 0.05 -0.08 0.37 0.00 0.00 175.52 176.00 2igk h GLU 228 N 0.13 0.46 -0.53 6.66 4.81 -1.04 -2.25 114.58 122.82 2igk h GLU 228 Ca 0.17 -0.12 0.01 0.00 -0.13 0.00 0.00 59.36 59.29 2igk h GLU 228 Cb 0.22 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.51 2igk h GLU 228 CO -0.26 0.57 0.35 0.93 -0.73 0.00 0.00 179.01 179.87 2igk h GLU 229 N 0.28 0.67 -0.53 1.92 4.39 -0.68 -2.60 114.58 118.03 2igk h GLU 229 Ca 0.09 -0.04 -0.22 0.00 0.34 0.00 0.00 59.36 59.52 2igk h GLU 229 Cb 0.33 -0.15 -0.13 0.00 -0.10 0.00 0.00 28.75 28.70 2igk h GLU 229 CO 0.00 0.44 0.14 0.66 -1.16 0.00 0.00 179.01 179.10 2igk n TYR 230 N -4.46 1.70 -1.67 4.33 4.02 -0.25 -5.01 117.16 115.81 2igk n TYR 230 Ca 0.05 -1.45 -0.49 0.00 -0.01 0.00 0.00 57.90 56.01 2igk n TYR 230 Cb 0.08 -0.59 -0.05 0.00 -0.02 0.00 0.00 39.34 38.76 2igk n TYR 230 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 176.86 177.02 2igk n LYS 231 N -0.85 2.00 -1.01 -0.72 4.81 -0.85 -0.63 118.16 120.91 2igk n LYS 231 Ca 0.38 0.73 -0.00 0.00 -0.87 0.00 0.00 58.31 58.55 2igk n LYS 231 Cb 1.20 -2.53 -0.00 0.00 0.02 0.00 0.00 35.03 33.73 2igk n LYS 231 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2igk n GLY 232 N 3.97 0.47 0.26 3.14 0.00 -1.26 -4.79 105.19 106.97 2igk n GLY 232 Ca 0.21 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.08 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 -2.79 0.00 -3.80 1.61 6.02 0.20 -5.10 117.38 113.51 2igk n GLN 233 Ca -0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 57.00 56.86 2igk n GLN 233 Cb 0.03 -0.75 -0.10 0.00 1.02 0.00 0.00 30.24 30.45 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 -1.75 0.50 -0.05 -1.09 0.52 -0.76 -5.12 118.95 111.21 2igk s ARG 234 Ca 0.00 -0.11 -0.02 0.00 -0.52 0.00 0.00 55.73 55.09 2igk s ARG 234 Cb 0.00 0.22 -0.04 0.00 0.52 0.00 0.00 34.95 35.66 2igk s ARG 234 CO 0.00 -0.12 0.06 -0.51 0.02 0.00 0.00 175.30 174.75 2igk s ASP 235 N -0.94 5.63 0.10 0.23 1.01 -1.26 -4.66 116.67 116.78 2igk s ASP 235 Ca -0.10 0.19 0.10 0.00 0.71 0.00 0.00 52.55 53.44 2igk s ASP 235 Cb -0.05 -1.64 -0.03 0.00 1.01 0.00 0.00 42.92 42.21 2igk s ASP 235 CO 0.02 0.33 -0.25 -0.36 0.21 0.00 0.00 175.17 175.12 2igk s PHE 236 N -1.07 2.12 0.36 4.23 0.40 -1.26 -4.29 117.98 118.47 2igk s PHE 236 Ca 0.19 -0.39 -0.10 0.00 -0.60 0.00 0.00 56.93 56.02 2igk s PHE 236 Cb -0.12 -1.19 0.04 0.00 0.51 0.00 0.00 43.02 42.27 2igk s PHE 236 CO 0.09 0.24 0.65 0.00 0.70 0.00 0.00 175.22 176.89 2igk n GLN 237 N 1.23 0.94 -2.42 0.44 10.64 -0.66 -5.01 117.38 122.54 2igk n GLN 237 Ca -0.18 -2.26 -0.40 0.00 -1.83 0.00 0.00 57.00 52.34 2igk n GLN 237 Cb 0.53 2.58 -0.04 0.00 -0.86 0.00 0.00 30.24 32.45 2igk n GLN 237 CO 0.00 0.00 0.00 -1.14 -1.83 0.00 0.00 177.06 174.09 2igk s GLN 238 N -2.29 4.48 0.19 2.61 0.74 -1.26 -1.23 119.66 122.90 2igk s GLN 238 Ca 0.19 1.81 -0.33 0.00 0.05 0.00 0.00 55.36 57.08 2igk s GLN 238 Cb -0.03 -3.03 -0.14 0.00 1.10 0.00 0.00 33.01 30.91 2igk s GLN 238 CO 0.14 0.06 1.51 -0.89 -0.55 0.00 0.00 175.29 175.56 2igk n ILE 239 N 0.85 0.37 -2.06 -2.34 5.41 -0.24 -4.71 119.36 116.64 2igk n ILE 239 Ca 0.00 -0.09 -0.42 0.00 1.00 0.00 0.00 62.75 63.24 2igk n ILE 239 Cb 0.45 -1.49 -0.03 0.00 -0.71 0.00 0.00 39.64 37.86 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 0.38 4.22 -0.04 0.38 0.02 -1.26 -4.75 135.00 133.95 2igk s PRO 240 Ca 0.75 2.15 0.05 0.00 0.02 0.00 0.00 61.00 63.97 2igk s PRO 240 Cb -0.68 -3.68 -0.01 0.00 0.02 0.00 0.00 34.50 30.16 2igk s PRO 240 CO 0.43 -0.70 -0.19 -0.51 -0.33 0.00 0.00 177.00 175.70 2igk s LEU 241 N 2.89 1.96 -0.94 -5.54 1.43 -0.48 -0.93 118.68 117.05 2igk s LEU 241 Ca 0.70 -0.38 -0.24 0.00 -1.03 0.00 0.00 54.13 53.18 2igk s LEU 241 Cb -0.35 -1.05 0.02 0.00 0.03 0.00 0.00 46.19 44.84 2igk s LEU 241 CO 0.29 0.18 1.58 0.00 0.23 0.00 0.00 176.35 178.63 2igk s ALA 242 N -0.05 2.42 -0.19 4.21 0.00 0.42 -1.03 121.76 127.55 2igk s ALA 242 Ca -0.03 -1.90 -0.32 0.00 0.00 0.00 0.00 51.96 49.71 2igk s ALA 242 Cb -0.11 -4.50 0.15 0.00 0.00 0.00 0.00 23.12 18.65 2igk s ALA 242 CO 0.02 -3.91 1.16 0.00 0.00 0.00 0.00 175.76 173.04 2igk s ALA 243 N 6.55 -2.02 -0.09 0.00 0.00 -1.01 -1.46 121.76 123.72 2igk s ALA 243 Ca 0.52 1.61 -0.00 0.00 0.00 0.00 0.00 51.96 54.09 2igk s ALA 243 Cb -0.03 -0.55 0.02 0.00 0.00 0.00 0.00 23.12 22.56 2igk s ALA 243 CO -0.04 -0.45 -0.06 0.99 0.00 0.00 0.00 175.76 176.21 2igk s THR 244 N -1.82 0.80 0.09 0.00 2.01 -0.55 -4.63 115.64 111.55 2igk s THR 244 Ca 0.06 -0.18 -0.31 0.00 0.31 0.00 0.00 61.69 61.57 2igk s THR 244 Cb -0.01 -0.84 -0.08 0.00 0.01 0.00 0.00 72.50 71.58 2igk s THR 244 CO -0.04 0.32 1.41 -0.60 -0.69 0.00 0.00 174.62 175.01 2igk s ARG 245 N 1.53 4.31 -0.18 4.92 3.52 -1.26 -1.04 118.95 130.75 2igk s ARG 245 Ca 0.00 2.07 0.17 0.00 -0.13 0.00 0.00 55.73 57.84 2igk s ARG 245 Cb -0.13 -3.33 -0.25 0.00 -1.56 0.00 0.00 34.95 29.69 2igk s ARG 245 CO -0.05 -0.48 0.14 0.54 -0.81 0.00 0.00 175.30 174.64 2igk n ARG 246 N 4.30 0.68 -3.86 5.12 5.12 -0.39 -4.92 116.66 122.71 2igk n ARG 246 Ca 0.12 0.03 -0.08 0.00 -1.93 0.00 0.00 57.85 56.00 2igk n ARG 246 Cb 0.42 -1.56 -0.01 0.00 -1.16 0.00 0.00 32.46 30.16 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 -5.60 -0.18 0.01 0.55 1.04 -0.98 -4.97 113.70 103.57 2igk s SER 247 Ca -0.10 -0.74 0.06 0.00 0.48 0.00 0.00 55.95 55.65 2igk s SER 247 Cb 0.06 0.74 0.28 0.00 0.10 0.00 0.00 66.02 67.21 2igk s SER 247 CO 0.82 -1.40 1.21 -2.65 0.98 0.00 0.00 173.24 172.20 2igk n PRO 248 N -0.47 0.01 0.00 4.02 -0.02 -1.26 -2.71 135.00 134.57 2igk n PRO 248 Ca -0.05 0.40 0.00 0.00 -2.02 0.00 0.00 63.50 61.84 2igk n PRO 248 Cb 0.59 -1.51 0.00 0.00 -0.02 0.00 0.00 33.50 32.56 2igk n PRO 248 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2igk n THR 249 N -1.52 0.65 -3.69 3.45 -2.24 -1.26 -4.84 114.28 104.83 2igk n THR 249 Ca 0.01 -0.67 -0.21 0.00 -2.27 0.00 0.00 64.05 60.91 2igk n THR 249 Cb 0.07 0.69 -0.18 0.00 -2.10 0.00 0.00 70.33 68.81 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 -0.65 0.23 -0.21 4.78 2.19 -1.10 -4.89 117.98 118.33 2igk s PHE 250 Ca 0.00 0.09 -0.04 0.00 0.33 0.00 0.00 56.93 57.31 2igk s PHE 250 Cb 0.00 -0.58 -0.02 0.00 -1.31 0.00 0.00 43.02 41.11 2igk s PHE 250 CO 0.00 -0.26 -0.02 0.08 1.83 0.00 0.00 175.22 176.85 2igk s VAL 251 N 2.12 3.71 -0.68 3.12 1.01 -1.26 -1.27 120.40 127.15 2igk s VAL 251 Ca 0.05 -0.39 -0.26 0.00 0.00 0.00 0.00 61.98 61.38 2igk s VAL 251 Cb -0.13 -2.68 0.04 0.00 0.00 0.00 0.00 36.38 33.61 2igk s VAL 251 CO -0.04 0.42 1.15 -0.70 0.00 0.00 0.00 175.10 175.93 2igk s GLU 252 N 1.20 3.22 0.32 2.72 2.12 -0.20 -4.86 118.70 123.22 2igk s GLU 252 Ca 0.03 -0.34 -0.28 0.00 0.36 0.00 0.00 54.97 54.74 2igk s GLU 252 Cb -0.15 -4.16 -0.10 0.00 0.26 0.00 0.00 34.13 29.99 2igk s GLU 252 CO 0.00 -1.93 1.16 -1.58 -0.54 0.00 0.00 175.26 172.37 2igk s TRP 253 N 5.02 3.34 0.79 5.30 0.52 -1.26 -1.48 118.94 131.16 2igk s TRP 253 Ca 0.32 1.60 -0.12 0.00 0.02 0.00 0.00 56.10 57.92 2igk s TRP 253 Cb -0.11 -3.40 0.06 0.00 -1.15 0.00 0.00 33.47 28.87 2igk s TRP 253 CO 0.15 -1.03 1.12 -1.12 0.02 0.00 0.00 176.95 176.09 2igk s SER 254 N -0.84 4.67 0.12 2.95 0.01 -0.54 -4.53 113.70 115.54 2igk s SER 254 Ca 0.48 1.12 -0.12 0.00 1.31 0.00 0.00 55.95 58.74 2igk s SER 254 Cb -0.33 -1.82 0.04 0.00 0.21 0.00 0.00 66.02 64.12 2igk s SER 254 CO 0.43 -1.84 0.57 -1.54 0.41 0.00 0.00 173.24 171.28 2igk n SER 255 N -3.32 -1.02 -0.34 2.44 3.41 -1.26 -4.67 113.62 108.85 2igk n SER 255 Ca 0.07 -1.56 0.17 0.00 -0.26 0.00 0.00 58.87 57.29 2igk n SER 255 Cb 0.58 1.67 0.38 0.00 -0.26 0.00 0.00 64.21 66.57 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 1.76 -0.40 7.33 0.00 -1.78 -1.77 119.26 126.41 2igk h ALA 256 Ca -0.16 0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 2igk h ALA 256 Cb 0.69 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 2igk h ALA 256 CO 0.21 -0.25 0.18 -0.97 0.00 0.00 0.00 179.25 178.42 2igk h ASN 257 N 0.59 0.49 -0.67 0.00 -0.73 -1.64 -0.43 115.58 113.19 2igk h ASN 257 Ca 0.64 -0.04 -0.07 0.00 1.87 0.00 0.00 56.30 58.70 2igk h ASN 257 Cb 1.19 -0.13 -0.03 0.00 0.27 0.00 0.00 38.32 39.63 2igk h ASN 257 CO -0.47 0.43 0.16 0.74 -0.37 0.00 0.00 177.43 177.93 2igk h THR 258 N 0.55 1.26 -0.12 -3.57 2.02 -1.64 -3.05 112.91 108.36 2igk h THR 258 Ca 0.14 -0.96 -0.07 0.00 0.77 0.00 0.00 66.41 66.29 2igk h THR 258 Cb 0.08 0.56 -0.00 0.00 -1.74 0.00 0.00 68.15 67.05 2igk h THR 258 CO -0.02 0.37 -0.19 0.58 0.37 0.00 0.00 175.52 176.62 2igk h VAL 259 N 1.03 1.38 -2.23 3.16 2.07 -1.37 -3.46 116.25 116.83 2igk h VAL 259 Ca 0.22 -1.44 -0.02 0.00 0.82 0.00 0.00 66.70 66.27 2igk h VAL 259 Cb 0.37 2.04 -0.23 0.00 -1.52 0.00 0.00 31.29 31.94 2igk h VAL 259 CO 0.00 0.42 -0.13 0.12 0.02 0.00 0.00 177.57 178.00 2igk s PHE 260 N -4.07 -0.96 -1.46 1.57 5.36 -0.23 -4.79 117.98 113.40 2igk s PHE 260 Ca -0.14 1.87 0.21 0.00 -0.96 0.00 0.00 56.93 57.91 2igk s PHE 260 Cb 0.05 0.53 1.07 0.00 -0.34 0.00 0.00 43.02 44.33 2igk s PHE 260 CO 0.76 -0.50 1.67 -0.40 -1.46 0.00 0.00 175.22 175.29 2igk n ASP 261 N 4.60 0.00 0.00 6.13 5.68 -1.21 -3.96 116.55 127.79 2igk n ASP 261 Ca -0.18 -0.05 0.00 0.00 -0.50 0.00 0.00 54.79 54.06 2igk n ASP 261 Cb 0.55 -0.27 0.00 0.00 -1.14 0.00 0.00 41.12 40.26 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 -1.27 0.89 -4.75 -2.12 4.77 -1.26 -4.22 117.00 109.04 2igk n LEU 262 Ca 0.10 0.00 -0.41 0.00 -0.03 0.00 0.00 56.01 55.68 2igk n LEU 262 Cb 0.16 -2.19 -0.03 0.00 -2.33 0.00 0.00 43.42 39.03 2igk n LEU 262 CO 0.16 -0.85 0.88 -1.10 -1.33 0.00 0.00 177.39 175.15 2igk s GLN 263 N -1.69 4.51 0.41 3.23 -1.52 -1.26 -4.74 119.66 118.59 2igk s GLN 263 Ca 0.00 1.94 -0.26 0.00 -1.95 0.00 0.00 55.36 55.08 2igk s GLN 263 Cb 0.00 -3.18 -0.10 0.00 -0.22 0.00 0.00 33.01 29.51 2igk s GLN 263 CO 0.00 0.00 1.39 0.09 -0.25 0.00 0.00 175.29 176.52 2igk n ASN 264 N 1.58 3.18 -4.21 5.90 3.02 -1.26 -4.90 115.26 118.57 2igk n ASN 264 Ca 0.01 1.16 -0.22 0.00 -0.03 0.00 0.00 54.58 55.51 2igk n ASN 264 Cb 0.44 -1.57 -0.13 0.00 -0.61 0.00 0.00 39.78 37.91 2igk n ASN 264 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 2igk s ARG 265 N -2.21 1.04 0.56 3.52 0.52 -0.25 -4.20 118.95 117.93 2igk s ARG 265 Ca 0.58 -0.96 -0.19 0.00 -0.52 0.00 0.00 55.73 54.65 2igk s ARG 265 Cb -0.49 -1.14 -0.05 0.00 0.52 0.00 0.00 34.95 33.79 2igk s ARG 265 CO 0.60 0.27 1.12 -2.14 0.02 0.00 0.00 175.30 175.18 2igk s PRO 266 N -1.52 3.27 0.28 3.54 0.02 -0.59 -1.42 135.00 138.59 2igk s PRO 266 Ca 0.03 1.57 0.01 0.00 0.02 0.00 0.00 61.00 62.63 2igk s PRO 266 Cb -0.09 -2.00 -0.00 0.00 0.02 0.00 0.00 34.50 32.43 2igk s PRO 266 CO 0.02 -0.91 0.35 0.27 -0.33 0.00 0.00 177.00 176.41 2igk n ASN 267 N -1.48 -0.96 -0.29 2.53 0.23 -1.13 -4.99 115.26 109.17 2igk n ASN 267 Ca 0.11 -2.63 0.01 0.00 -0.53 0.00 0.00 54.58 51.54 2igk n ASN 267 Cb 0.51 1.88 0.14 0.00 -2.08 0.00 0.00 39.78 40.23 2igk n ASN 267 CO 0.00 0.00 0.00 0.74 -0.93 0.00 0.00 177.26 177.07 2igk h THR 268 N 1.85 1.00 0.00 5.53 2.02 -1.97 -1.84 112.91 119.50 2igk h THR 268 Ca -0.21 -0.31 -0.01 0.00 0.77 0.00 0.00 66.41 66.65 2igk h THR 268 Cb 0.98 0.03 -0.00 0.00 -1.74 0.00 0.00 68.15 67.42 2igk h THR 268 CO 0.30 0.16 -0.07 0.44 0.37 0.00 0.00 175.52 176.72 2igk h ASP 269 N 0.89 0.00 -2.03 4.18 3.32 -2.00 -3.38 116.42 117.41 2igk h ASP 269 Ca 0.37 0.00 -0.55 0.00 0.02 0.00 0.00 57.03 56.87 2igk h ASP 269 Cb 0.22 0.00 -0.40 0.00 0.22 0.00 0.00 39.33 39.37 2igk h ASP 269 CO -0.19 0.07 -1.05 0.00 -1.72 0.00 0.00 179.24 176.34 2igk n ALA 270 N -2.12 2.61 0.27 3.45 0.00 -0.84 -4.99 120.51 118.89 2igk n ALA 270 Ca 0.04 -3.59 0.16 0.00 0.00 0.00 0.00 53.44 50.06 2igk n ALA 270 Cb 0.56 -0.83 0.68 0.00 0.00 0.00 0.00 19.45 19.85 2igk n ALA 270 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2igk h PRO 271 N 3.86 0.00 -0.01 0.00 0.13 -1.54 -2.95 132.00 131.48 2igk h PRO 271 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 2igk h PRO 271 Cb 0.86 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.99 2igk h PRO 271 CO 0.52 0.03 -0.41 0.39 -0.23 0.00 0.00 178.00 178.30 2igk n GLU 272 N -3.15 1.16 -3.63 0.86 1.02 -1.26 -4.72 120.64 110.91 2igk n GLU 272 Ca 0.00 -0.91 -0.26 0.00 -0.02 0.00 0.00 57.16 55.97 2igk n GLU 272 Cb 0.31 -1.48 -0.03 0.00 -0.02 0.00 0.00 31.44 30.22 2igk n GLU 272 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2igk s GLU 273 N -2.47 3.52 -0.15 3.49 2.02 -1.13 -4.96 118.70 119.01 2igk s GLU 273 Ca 0.20 -0.35 -0.01 0.00 0.02 0.00 0.00 54.97 54.83 2igk s GLU 273 Cb 0.18 -2.80 0.04 0.00 0.10 0.00 0.00 34.13 31.66 2igk s GLU 273 CO 0.55 0.34 -0.02 1.03 0.02 0.00 0.00 175.26 177.18 2igk s ARG 274 N -3.58 1.08 -0.18 1.61 0.52 -1.26 -1.54 118.95 115.59 2igk s ARG 274 Ca 0.39 -0.37 -0.09 0.00 -0.52 0.00 0.00 55.73 55.14 2igk s ARG 274 Cb -0.11 -1.83 0.07 0.00 0.52 0.00 0.00 34.95 33.60 2igk s ARG 274 CO 0.30 -0.46 0.42 0.12 0.02 0.00 0.00 175.30 175.71 2igk s PHE 275 N 1.75 -0.66 -0.09 -0.53 5.36 -0.50 -1.76 117.98 121.55 2igk s PHE 275 Ca 0.01 1.37 0.03 0.00 -0.96 0.00 0.00 56.93 57.37 2igk s PHE 275 Cb -0.15 0.29 0.01 0.00 -0.34 0.00 0.00 43.02 42.83 2igk s PHE 275 CO -0.07 -0.38 -0.17 -0.80 -1.46 0.00 0.00 175.22 172.34 2igk s ASN 276 N 1.65 2.42 -0.20 6.13 -0.87 -0.53 -1.08 114.94 122.46 2igk s ASN 276 Ca -0.08 -0.43 -0.12 0.00 -1.57 0.00 0.00 52.86 50.66 2igk s ASN 276 Cb -0.09 -1.11 -0.05 0.00 -0.02 0.00 0.00 41.25 39.99 2igk s ASN 276 CO -0.13 0.07 0.22 -0.22 -2.57 0.00 0.00 177.10 174.47 2igk s LEU 277 N 0.66 4.18 -0.42 0.60 2.96 -1.26 -0.91 118.68 124.49 2igk s LEU 277 Ca -0.13 0.32 0.02 0.00 -0.22 0.00 0.00 54.13 54.11 2igk s LEU 277 Cb -0.16 -2.24 0.12 0.00 0.50 0.00 0.00 46.19 44.41 2igk s LEU 277 CO 0.04 0.09 0.17 -0.36 -1.32 0.00 0.00 176.35 174.97 2igk s PHE 278 N 0.72 3.56 0.82 5.38 0.08 0.20 -4.97 117.98 123.78 2igk s PHE 278 Ca 0.12 -2.88 -0.12 0.00 0.12 0.00 0.00 56.93 54.17 2igk s PHE 278 Cb -0.13 -3.00 0.08 0.00 -0.57 0.00 0.00 43.02 39.40 2igk s PHE 278 CO 0.03 -0.90 1.13 -2.14 -0.10 0.00 0.00 175.22 173.24 2igk s PRO 279 N 0.60 1.90 -1.44 0.24 0.02 -1.26 -1.53 135.00 133.52 2igk s PRO 279 Ca 0.12 0.37 -0.07 0.00 0.02 0.00 0.00 61.00 61.44 2igk s PRO 279 Cb -0.21 -1.92 0.05 0.00 0.02 0.00 0.00 34.50 32.43 2igk s PRO 279 CO -0.05 -1.69 0.80 0.00 -0.33 0.00 0.00 177.00 175.73 2igk n ALA 280 N -3.43 -1.64 -3.87 -1.55 0.00 -0.09 -4.85 120.51 105.08 2igk n ALA 280 Ca 0.07 -0.01 -0.29 0.00 0.00 0.00 0.00 53.44 53.21 2igk n ALA 280 Cb 0.59 -3.13 -0.16 0.00 0.00 0.00 0.00 19.45 16.75 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 -3.52 1.13 -0.24 0.00 1.01 -0.63 -0.71 120.40 117.45 2igk s VAL 281 Ca 0.34 -0.90 -0.29 0.00 0.00 0.00 0.00 61.98 61.13 2igk s VAL 281 Cb -0.17 -1.46 0.00 0.00 0.00 0.00 0.00 36.38 34.75 2igk s VAL 281 CO 0.84 -0.09 1.17 0.00 0.00 0.00 0.00 175.10 177.01 2igk s ALA 282 N 1.58 3.58 -0.18 5.51 0.00 -0.11 -2.63 121.76 129.51 2igk s ALA 282 Ca -0.03 0.21 -0.21 0.00 0.00 0.00 0.00 51.96 51.93 2igk s ALA 282 Cb -0.18 -3.64 -0.03 0.00 0.00 0.00 0.00 23.12 19.27 2igk s ALA 282 CO -0.07 -1.32 0.61 0.00 0.00 0.00 0.00 175.76 174.98 2igk n GLU 284 N 4.83 1.54 -3.59 0.00 1.02 -0.07 -4.95 120.64 119.42 2igk n GLU 284 Ca -0.02 0.02 -0.07 0.00 -0.02 0.00 0.00 57.16 57.07 2igk n GLU 284 Cb 0.50 -1.32 -0.04 0.00 -0.02 0.00 0.00 31.44 30.56 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 -2.31 0.43 -0.11 3.49 1.70 -1.18 -4.69 118.95 116.28 2igk s ARG 285 Ca -0.10 0.04 -0.08 0.00 -0.47 0.00 0.00 55.73 55.11 2igk s ARG 285 Cb 0.04 0.20 -0.04 0.00 -0.57 0.00 0.00 34.95 34.58 2igk s ARG 285 CO 0.47 -0.15 0.17 0.14 -1.08 0.00 0.00 175.30 174.86 2igk s VAL 286 N -1.42 5.44 -0.22 4.99 -7.23 -1.26 -0.62 120.40 120.07 2igk s VAL 286 Ca 0.03 0.29 -0.14 0.00 -1.81 0.00 0.00 61.98 60.35 2igk s VAL 286 Cb -0.01 -3.45 -0.04 0.00 0.56 0.00 0.00 36.38 33.44 2igk s VAL 286 CO -0.03 0.59 0.31 -0.69 -0.31 0.00 0.00 175.10 174.97 2igk s VAL 287 N -0.88 5.26 0.13 1.32 1.01 0.38 -4.74 120.40 122.88 2igk s VAL 287 Ca 0.15 0.50 -0.20 0.00 0.00 0.00 0.00 61.98 62.44 2igk s VAL 287 Cb -0.12 -3.64 -0.07 0.00 0.00 0.00 0.00 36.38 32.54 2igk s VAL 287 CO 0.05 0.28 0.63 -0.13 0.00 0.00 0.00 175.10 175.93 2igk s ARG 288 N 1.25 4.25 0.84 2.72 0.52 -1.26 -0.81 118.95 126.46 2igk s ARG 288 Ca 0.14 0.81 -0.11 0.00 -0.52 0.00 0.00 55.73 56.05 2igk s ARG 288 Cb -0.14 -3.13 0.10 0.00 0.52 0.00 0.00 34.95 32.29 2igk s ARG 288 CO 0.07 0.56 1.09 0.54 0.02 0.00 0.00 175.30 177.58 2igk s ASN 289 N -1.31 3.99 0.48 0.23 4.22 -0.75 -4.86 114.94 116.94 2igk s ASN 289 Ca 0.34 1.50 0.14 0.00 -2.14 0.00 0.00 52.86 52.69 2igk s ASN 289 Cb -0.19 -2.20 1.13 0.00 1.28 0.00 0.00 41.25 41.27 2igk s ASN 289 CO 0.21 -2.32 2.10 0.00 -2.04 0.00 0.00 177.10 175.05 2igk h ALA 290 N -1.33 1.94 0.00 3.54 0.00 -1.98 -1.49 119.26 119.94 2igk h ALA 290 Ca -0.48 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.42 2igk h ALA 290 Cb 1.27 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.00 2igk h ALA 290 CO 0.55 0.04 0.00 1.28 0.00 0.00 0.00 179.25 181.12 2igk n LEU 291 N -4.51 0.00 -3.57 0.00 4.77 -1.26 -4.93 117.00 107.51 2igk n LEU 291 Ca 0.00 0.32 -0.20 0.00 -0.03 0.00 0.00 56.01 56.10 2igk n LEU 291 Cb 0.13 -0.32 0.07 0.00 -2.33 0.00 0.00 43.42 40.96 2igk n LEU 291 CO 0.35 -0.00 0.08 0.59 -1.33 0.00 0.00 177.39 177.07 2igk n ASN 292 N -1.32 -2.55 0.00 -1.43 3.02 -0.56 -4.89 115.26 107.53 2igk n ASN 292 Ca 0.13 -0.68 0.00 0.00 -0.03 0.00 0.00 54.58 54.00 2igk n ASN 292 Cb 0.25 -4.71 0.00 0.00 -0.61 0.00 0.00 39.78 34.72 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 -3.07 0.03 -3.65 6.41 3.41 -1.26 -4.52 113.62 110.96 2igk n SER 293 Ca -0.23 -0.27 -0.15 0.00 -0.26 0.00 0.00 58.87 57.96 2igk n SER 293 Cb 0.65 0.41 -0.08 0.00 -0.26 0.00 0.00 64.21 64.93 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 -0.41 0.79 -0.08 4.33 2.12 -1.26 -1.36 118.70 122.83 2igk s GLU 294 Ca 0.00 0.29 -0.18 0.00 0.36 0.00 0.00 54.97 55.44 2igk s GLU 294 Cb 0.00 0.37 -0.05 0.00 0.26 0.00 0.00 34.13 34.71 2igk s GLU 294 CO 0.00 -0.20 0.49 0.42 -0.54 0.00 0.00 175.26 175.43 2igk s ILE 295 N -0.72 5.12 -0.13 -3.70 -1.09 -1.26 -1.81 121.20 117.60 2igk s ILE 295 Ca -0.08 0.99 0.19 0.00 -2.23 0.00 0.00 60.65 59.52 2igk s ILE 295 Cb -0.03 -3.83 -0.25 0.00 -1.58 0.00 0.00 42.46 36.77 2igk s ILE 295 CO 0.05 0.38 0.34 -0.62 -1.23 0.00 0.00 174.94 173.86 2igk n GLU 296 N 3.26 0.67 -3.72 2.79 -0.58 0.01 -4.96 120.64 118.11 2igk n GLU 296 Ca -0.08 -0.01 -0.03 0.00 -0.42 0.00 0.00 57.16 56.62 2igk n GLU 296 Cb 0.52 -1.58 -0.01 0.00 -0.57 0.00 0.00 31.44 29.79 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 -5.29 -0.17 -0.22 1.62 1.04 -1.26 -4.73 113.70 104.70 2igk s SER 297 Ca -0.08 -0.35 0.00 0.00 0.48 0.00 0.00 55.95 56.01 2igk s SER 297 Cb 0.09 0.44 0.03 0.00 0.10 0.00 0.00 66.02 66.68 2igk s SER 297 CO 0.85 -0.81 -0.13 -0.22 0.98 0.00 0.00 173.24 173.90 2igk s LEU 298 N -2.92 2.74 -0.13 2.42 2.96 0.15 -0.47 118.68 123.44 2igk s LEU 298 Ca 0.12 -0.86 -0.26 0.00 -0.22 0.00 0.00 54.13 52.92 2igk s LEU 298 Cb -0.01 -1.56 -0.02 0.00 0.50 0.00 0.00 46.19 45.11 2igk s LEU 298 CO 0.01 -0.08 0.83 -2.28 -1.32 0.00 0.00 176.35 173.51 2igk s HIS 299 N 1.27 3.48 0.18 5.38 5.65 0.20 -0.07 115.29 131.37 2igk s HIS 299 Ca 0.01 1.32 0.07 0.00 0.25 0.00 0.00 55.06 56.71 2igk s HIS 299 Cb -0.16 -3.00 -0.04 0.00 -1.18 0.00 0.00 32.58 28.21 2igk s HIS 299 CO -0.08 -0.16 -0.15 0.96 -0.65 0.00 0.00 174.74 174.66 2igk s ILE 300 N 1.78 1.66 -0.20 0.89 -4.36 -0.34 -0.89 121.20 119.74 2igk s ILE 300 Ca 0.40 -2.04 -0.02 0.00 -0.26 0.00 0.00 60.65 58.73 2igk s ILE 300 Cb -0.17 -1.89 0.06 0.00 1.25 0.00 0.00 42.46 41.70 2igk s ILE 300 CO 0.15 -0.50 0.01 -2.28 0.24 0.00 0.00 174.94 172.56 2igk s HIS 301 N -2.61 1.41 -0.13 1.37 2.46 0.00 -1.93 115.29 115.86 2igk s HIS 301 Ca 0.18 -1.10 -0.29 0.00 0.47 0.00 0.00 55.06 54.31 2igk s HIS 301 Cb -0.03 -1.18 -0.03 0.00 -0.13 0.00 0.00 32.58 31.22 2igk s HIS 301 CO 0.06 -0.65 1.41 0.34 -2.47 0.00 0.00 174.74 173.43 2igk s ASP 302 N 1.73 6.82 0.20 9.88 -1.08 0.80 -0.93 116.67 134.09 2igk s ASP 302 Ca -0.02 1.86 0.25 0.00 -0.52 0.00 0.00 52.55 54.12 2igk s ASP 302 Cb -0.17 -2.54 0.63 0.00 -1.46 0.00 0.00 42.92 39.37 2igk s ASP 302 CO -0.07 -0.85 1.62 -0.07 0.52 0.00 0.00 175.17 176.32 2igk h LEU 303 N 10.02 0.00 0.00 -1.34 3.38 -1.23 0.11 115.31 126.26 2igk h LEU 303 Ca -0.31 -0.06 -0.05 0.00 0.09 0.00 0.00 57.88 57.55 2igk h LEU 303 Cb 1.13 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.87 2igk h LEU 303 CO 0.97 0.03 -0.40 0.40 0.09 0.00 0.00 178.44 179.52 2igk h ILE 304 N 0.00 0.68 0.00 1.22 1.08 -1.91 -3.40 117.51 115.18 2igk h ILE 304 Ca 0.00 -1.62 -0.22 0.00 -0.39 0.00 0.00 64.86 62.62 2igk h ILE 304 Cb 0.77 1.40 -0.03 0.00 -3.07 0.00 0.00 36.82 35.89 2igk h ILE 304 CO 0.00 0.23 -1.13 0.77 -0.69 0.00 0.00 178.15 177.33 2igk h SER 305 N -1.00 0.00 0.00 1.72 4.64 -1.93 -3.47 113.55 113.50 2igk h SER 305 Ca -0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.24 2igk h SER 305 Cb 0.68 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.77 2igk h SER 305 CO -0.05 0.98 0.00 0.61 -0.87 0.00 0.00 176.83 177.50 2igk n GLY 306 N 1.39 1.04 3.78 -0.77 0.00 0.39 -5.04 105.19 105.97 2igk n GLY 306 Ca -0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.92 6.45 -0.06 1.61 1.01 -1.24 -4.75 116.67 116.76 2igk s ASP 307 Ca 0.00 2.18 0.00 0.00 0.71 0.00 0.00 52.55 55.44 2igk s ASP 307 Cb 0.00 -2.59 -0.03 0.00 1.01 0.00 0.00 42.92 41.30 2igk s ASP 307 CO 0.00 -0.72 -0.04 -0.13 0.21 0.00 0.00 175.17 174.49 2igk s ARG 308 N -2.62 2.80 0.19 8.23 0.52 -1.26 -0.14 118.95 126.68 2igk s ARG 308 Ca 0.61 -0.52 0.04 0.00 -0.52 0.00 0.00 55.73 55.34 2igk s ARG 308 Cb -0.25 -2.65 -0.05 0.00 0.52 0.00 0.00 34.95 32.52 2igk s ARG 308 CO 0.31 0.67 -0.06 -0.06 0.02 0.00 0.00 175.30 176.18 2igk s PHE 309 N -0.86 1.44 -0.19 -0.53 0.08 -0.82 -5.00 117.98 112.10 2igk s PHE 309 Ca 0.13 -0.82 -0.03 0.00 0.12 0.00 0.00 56.93 56.34 2igk s PHE 309 Cb -0.11 -0.78 -0.01 0.00 -0.57 0.00 0.00 43.02 41.55 2igk s PHE 309 CO 0.03 0.05 -0.06 -1.21 -0.10 0.00 0.00 175.22 173.93 2igk s GLU 310 N -3.79 3.40 -0.09 0.44 0.41 -1.26 -1.20 118.70 116.61 2igk s GLU 310 Ca 0.22 -0.63 -0.02 0.00 -0.41 0.00 0.00 54.97 54.13 2igk s GLU 310 Cb 0.04 -2.91 -0.03 0.00 -1.78 0.00 0.00 34.13 29.44 2igk s GLU 310 CO 0.05 -0.07 -0.00 0.42 -0.49 0.00 0.00 175.26 175.17 2igk s ILE 311 N 1.12 4.27 -0.02 -1.63 -1.09 0.90 -4.90 121.20 119.85 2igk s ILE 311 Ca 0.01 -0.26 0.07 0.00 -2.23 0.00 0.00 60.65 58.25 2igk s ILE 311 Cb -0.15 -2.80 -0.02 0.00 -1.58 0.00 0.00 42.46 37.91 2igk s ILE 311 CO -0.01 0.59 -0.24 -0.75 -1.23 0.00 0.00 174.94 173.30 2igk s LYS 312 N -0.74 2.16 0.19 2.79 2.20 -0.73 -0.67 119.74 124.93 2igk s LYS 312 Ca 0.12 -0.90 -0.15 0.00 -0.36 0.00 0.00 55.97 54.68 2igk s LYS 312 Cb -0.12 -2.09 0.01 0.00 -1.51 0.00 0.00 37.83 34.13 2igk s LYS 312 CO 0.02 0.57 0.46 0.00 -0.36 0.00 0.00 175.35 176.04 2igk s ALA 313 N -0.64 -0.63 0.14 3.13 0.00 -1.26 -1.55 121.76 120.95 2igk s ALA 313 Ca 0.10 -0.46 -0.04 0.00 0.00 0.00 0.00 51.96 51.56 2igk s ALA 313 Cb -0.10 0.87 -0.05 0.00 0.00 0.00 0.00 23.12 23.84 2igk s ALA 313 CO -0.01 -0.77 1.35 -0.44 0.00 0.00 0.00 175.76 175.89 2igk h ASP 314 N 2.29 0.54 -3.70 0.00 3.32 -1.31 -3.46 116.42 114.10 2igk h ASP 314 Ca -0.29 -0.40 -0.42 0.00 0.02 0.00 0.00 57.03 55.94 2igk h ASP 314 Cb 1.25 -0.16 -0.32 0.00 0.22 0.00 0.00 39.33 40.32 2igk h ASP 314 CO 0.40 1.18 -0.78 -0.69 -1.72 0.00 0.00 179.24 177.63 2igk s VAL 315 N -3.41 0.71 -0.15 -1.35 1.01 -0.63 -4.79 120.40 111.78 2igk s VAL 315 Ca -0.06 -0.29 0.01 0.00 0.00 0.00 0.00 61.98 61.63 2igk s VAL 315 Cb 0.09 -0.65 -0.00 0.00 0.00 0.00 0.00 36.38 35.82 2igk s VAL 315 CO 0.86 0.24 -0.16 -0.31 0.00 0.00 0.00 175.10 175.72 2igk s TYR 316 N 0.39 2.77 -0.15 5.22 1.51 -0.32 -1.04 117.35 125.73 2igk s TYR 316 Ca -0.06 -1.08 0.02 0.00 -1.01 0.00 0.00 57.07 54.94 2igk s TYR 316 Cb -0.10 -1.88 0.01 0.00 -0.11 0.00 0.00 41.96 39.88 2igk s TYR 316 CO 0.01 -0.49 -0.21 0.08 -1.11 0.00 0.00 175.55 173.82 2igk s VAL 317 N 0.82 2.04 -0.33 0.71 1.01 0.14 -1.52 120.40 123.27 2igk s VAL 317 Ca -0.05 -0.96 -0.10 0.00 0.00 0.00 0.00 61.98 60.86 2igk s VAL 317 Cb -0.15 -1.82 0.00 0.00 0.00 0.00 0.00 36.38 34.41 2igk s VAL 317 CO -0.00 0.55 0.18 -0.76 0.00 0.00 0.00 175.10 175.06 2igk s LEU 318 N 0.92 4.32 -0.36 3.92 1.43 -0.41 -0.58 118.68 127.92 2igk s LEU 318 Ca -0.04 -0.64 0.13 0.00 -1.03 0.00 0.00 54.13 52.55 2igk s LEU 318 Cb -0.15 -2.02 0.45 0.00 0.03 0.00 0.00 46.19 44.49 2igk s LEU 318 CO -0.04 -0.25 1.01 0.35 0.23 0.00 0.00 176.35 177.64 2igk n THR 319 N 5.00 1.48 0.29 5.49 -2.24 0.32 -0.84 114.28 123.78 2igk n THR 319 Ca -0.13 -3.72 0.08 0.00 -2.27 0.00 0.00 64.05 58.01 2igk n THR 319 Cb 0.48 -0.01 0.23 0.00 -2.10 0.00 0.00 70.33 68.93 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 -0.21 2.52 0.00 6.98 0.00 -1.14 -4.30 120.51 124.37 2igk n ALA 320 Ca 0.20 -0.95 0.00 0.00 0.00 0.00 0.00 53.44 52.69 2igk n ALA 320 Cb 0.76 -0.97 0.00 0.00 0.00 0.00 0.00 19.45 19.24 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 1.23 0.96 0.29 0.00 0.00 -1.26 -4.05 105.19 102.36 2igk n GLY 321 Ca 0.17 -1.83 0.05 0.00 0.00 0.00 0.00 46.02 44.41 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 1.75 0.10 4.61 0.00 -1.91 0.17 119.26 123.98 2igk h ALA 322 Ca 0.00 -0.05 -0.20 0.00 0.00 0.00 0.00 54.91 54.66 2igk h ALA 322 Cb 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.68 2igk h ALA 322 CO 0.00 0.21 -1.00 0.28 0.00 0.00 0.00 179.25 178.74 2igk h VAL 323 N 0.37 1.29 0.00 0.00 2.07 -1.95 -3.32 116.25 114.72 2igk h VAL 323 Ca 0.10 -2.43 -0.18 0.00 0.82 0.00 0.00 66.70 65.01 2igk h VAL 323 Cb 0.02 2.94 -0.02 0.00 -1.52 0.00 0.00 31.29 32.70 2igk h VAL 323 CO -0.02 0.66 -0.87 0.45 0.02 0.00 0.00 177.57 177.82 2igk h HIS 324 N -0.47 0.05 -0.51 1.57 -0.00 -1.64 -0.67 115.15 113.47 2igk h HIS 324 Ca -0.21 -0.03 0.08 0.00 -0.00 0.00 0.00 60.37 60.22 2igk h HIS 324 Cb 1.59 -0.00 -0.07 0.00 -0.00 0.00 0.00 27.41 28.92 2igk h HIS 324 CO 0.17 0.88 0.13 -0.91 -0.00 0.00 0.00 177.93 178.19 2igk h ASN 325 N 0.01 0.05 -0.55 2.45 2.35 -0.84 -1.75 115.58 117.31 2igk h ASN 325 Ca -0.02 0.08 -0.05 0.00 -0.55 0.00 0.00 56.30 55.77 2igk h ASN 325 Cb 1.52 0.10 -0.02 0.00 0.05 0.00 0.00 38.32 39.97 2igk h ASN 325 CO 0.12 0.05 0.16 0.74 -1.65 0.00 0.00 177.43 176.85 2igk h THR 326 N 0.27 1.24 -0.51 2.81 2.02 -1.51 -1.70 112.91 115.53 2igk h THR 326 Ca 0.25 -0.82 0.02 0.00 0.77 0.00 0.00 66.41 66.64 2igk h THR 326 Cb 0.33 0.73 -0.03 0.00 -1.74 0.00 0.00 68.15 67.43 2igk h THR 326 CO -0.31 0.31 0.30 -0.61 0.37 0.00 0.00 175.52 175.57 2igk h GLN 327 N 0.77 0.58 -0.41 6.66 4.15 -0.95 -1.22 115.11 124.70 2igk h GLN 327 Ca 0.18 -0.04 -0.04 0.00 0.77 0.00 0.00 58.65 59.52 2igk h GLN 327 Cb 0.30 -0.13 -0.02 0.00 0.21 0.00 0.00 27.48 27.84 2igk h GLN 327 CO -0.00 0.39 0.09 1.25 -1.93 0.00 0.00 178.83 178.62 2igk h LEU 328 N 0.60 0.63 0.08 -2.39 6.46 -1.00 0.54 115.31 120.22 2igk h LEU 328 Ca 0.20 -0.24 -0.00 0.00 -0.12 0.00 0.00 57.88 57.72 2igk h LEU 328 Cb 0.02 -0.17 0.00 0.00 -0.73 0.00 0.00 40.66 39.78 2igk h LEU 328 CO -0.09 0.71 -0.04 -0.07 -0.62 0.00 0.00 178.44 178.33 2igk h LEU 329 N 0.52 -0.09 -1.02 2.25 3.38 -1.14 -1.51 115.31 117.71 2igk h LEU 329 Ca 0.13 -0.05 0.05 0.00 0.09 0.00 0.00 57.88 58.10 2igk h LEU 329 Cb 0.33 0.02 -0.06 0.00 0.09 0.00 0.00 40.66 41.04 2igk h LEU 329 CO 0.00 -0.01 0.65 0.58 0.09 0.00 0.00 178.44 179.75 2igk h VAL 330 N -0.15 1.13 0.00 1.22 2.07 -1.10 -0.07 116.25 119.35 2igk h VAL 330 Ca -0.01 -0.42 0.00 0.00 0.82 0.00 0.00 66.70 67.09 2igk h VAL 330 Cb 0.13 -0.19 0.00 0.00 -1.52 0.00 0.00 31.29 29.70 2igk h VAL 330 CO 0.02 0.22 0.00 -3.20 0.02 0.00 0.00 177.57 174.63 2igk n ASN 331 N -4.47 0.00 -1.01 0.57 5.15 0.17 -2.44 115.26 113.23 2igk n ASN 331 Ca 0.14 0.37 0.11 0.00 -0.60 0.00 0.00 54.58 54.61 2igk n ASN 331 Cb 0.14 -0.45 0.15 0.00 -0.53 0.00 0.00 39.78 39.09 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 -1.45 3.15 0.00 1.20 7.64 -0.11 -4.87 113.62 119.18 2igk n SER 332 Ca 0.06 -1.96 0.00 0.00 1.01 0.00 0.00 58.87 57.97 2igk n SER 332 Cb 0.20 -0.12 0.00 0.00 -1.01 0.00 0.00 64.21 63.28 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 1.36 0.89 3.88 0.23 0.00 -1.02 -4.71 105.19 105.82 2igk n GLY 333 Ca 0.16 -0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.00 3.51 0.00 1.61 0.40 -0.75 -4.74 117.98 116.01 2igk s PHE 334 Ca 0.00 1.09 0.00 0.00 -0.60 0.00 0.00 56.93 57.42 2igk s PHE 334 Cb 0.00 -2.51 0.00 0.00 0.51 0.00 0.00 43.02 41.02 2igk s PHE 334 CO 0.00 -0.28 0.00 0.41 0.70 0.00 0.00 175.22 176.05 2igk n GLY 335 N -1.79 2.76 2.79 4.36 0.00 -0.24 -3.96 105.19 109.11 2igk n GLY 335 Ca 0.03 -0.35 -0.15 0.00 0.00 0.00 0.00 46.02 45.56 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 0.00 0.23 1.61 0.74 -1.26 -4.63 119.66 116.35 2igk s GLN 336 Ca 0.00 0.14 -0.18 0.00 0.05 0.00 0.00 55.36 55.37 2igk s GLN 336 Cb 0.00 -0.23 -0.08 0.00 1.10 0.00 0.00 33.01 33.80 2igk s GLN 336 CO 0.00 -0.13 0.70 -1.17 -0.55 0.00 0.00 175.29 174.14 2igk s LEU 337 N 0.87 4.29 0.00 3.68 2.96 -1.26 -4.69 118.68 124.53 2igk s LEU 337 Ca -0.07 1.34 0.00 0.00 -0.22 0.00 0.00 54.13 55.18 2igk s LEU 337 Cb -0.11 -3.63 0.00 0.00 0.50 0.00 0.00 46.19 42.95 2igk s LEU 337 CO -0.02 -0.00 0.00 0.61 -1.32 0.00 0.00 176.35 175.62 2igk n GLY 338 N 0.53 -2.76 3.70 7.98 0.00 0.89 -4.86 105.19 110.68 2igk n GLY 338 Ca -0.02 -1.69 -0.43 0.00 0.00 0.00 0.00 46.02 43.88 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 -0.61 2.68 -1.58 1.61 0.63 -1.26 -4.50 116.66 113.64 2igk n ARG 339 Ca 0.00 0.97 -0.48 0.00 -0.92 0.00 0.00 57.85 57.43 2igk n ARG 339 Cb 0.00 -2.82 -0.03 0.00 0.45 0.00 0.00 32.46 30.06 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 4.46 1.18 -3.67 -0.14 -0.02 -1.26 -4.97 135.00 130.59 2igk n PRO 340 Ca 0.17 0.42 -0.29 0.00 -2.02 0.00 0.00 63.50 61.77 2igk n PRO 340 Cb 0.35 -1.86 -0.15 0.00 -0.02 0.00 0.00 33.50 31.81 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 -0.20 3.84 0.00 2.55 3.04 -1.26 -5.01 114.94 117.90 2igk s ASN 341 Ca 0.69 -1.50 0.23 0.00 0.04 0.00 0.00 52.86 52.31 2igk s ASN 341 Cb -0.81 -0.68 1.20 0.00 -1.54 0.00 0.00 41.25 39.41 2igk s ASN 341 CO 0.54 -0.42 1.75 -0.81 -3.04 0.00 0.00 177.10 175.12 2igk n PRO 342 N 4.99 0.41 0.00 0.43 -0.04 -1.26 -1.96 135.00 137.56 2igk n PRO 342 Ca -0.04 0.06 0.12 0.00 -0.04 0.00 0.00 63.50 63.60 2igk n PRO 342 Cb 0.42 -1.50 0.17 0.00 -0.04 0.00 0.00 33.50 32.55 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 -1.23 3.81 -3.57 0.55 0.00 -1.26 -4.48 120.51 114.34 2igk n ALA 343 Ca 0.12 -0.40 -0.27 0.00 0.00 0.00 0.00 53.44 52.89 2igk n ALA 343 Cb 0.16 -1.04 -0.10 0.00 0.00 0.00 0.00 19.45 18.47 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 -1.50 2.02 -4.77 0.00 2.85 -0.83 -5.11 115.26 107.92 2igk n ASN 344 Ca 0.05 -3.01 -0.40 0.00 -0.11 0.00 0.00 54.58 51.12 2igk n ASN 344 Cb 0.33 -0.67 0.00 0.00 1.24 0.00 0.00 39.78 40.68 2igk n ASN 344 CO 0.00 0.00 0.00 -2.16 -2.11 0.00 0.00 177.26 172.99 2igk s PRO 345 N -1.34 3.85 0.47 1.20 0.04 -1.26 -4.80 135.00 133.16 2igk s PRO 345 Ca 0.32 2.26 -0.22 0.00 0.04 0.00 0.00 61.00 63.40 2igk s PRO 345 Cb 0.05 -2.71 -0.07 0.00 0.04 0.00 0.00 34.50 31.81 2igk s PRO 345 CO -0.13 -0.63 1.14 -1.25 0.04 0.00 0.00 177.00 176.17 2igk s PRO 346 N -2.33 3.74 0.14 0.56 0.04 -1.26 -4.98 135.00 130.91 2igk s PRO 346 Ca 0.59 1.70 -0.15 0.00 0.04 0.00 0.00 61.00 63.17 2igk s PRO 346 Cb -0.40 -2.34 0.01 0.00 0.04 0.00 0.00 34.50 31.80 2igk s PRO 346 CO 0.52 -0.55 1.67 1.49 0.04 0.00 0.00 177.00 180.17 2igk h GLU 347 N 1.93 0.67 -6.55 4.56 4.81 -1.93 -3.43 114.58 114.65 2igk h GLU 347 Ca -0.49 -0.14 -0.69 0.00 -0.13 0.00 0.00 59.36 57.91 2igk h GLU 347 Cb 1.24 -0.10 -0.23 0.00 0.63 0.00 0.00 28.75 30.30 2igk h GLU 347 CO 0.60 0.64 -0.81 -0.51 -0.73 0.00 0.00 179.01 178.20 2igk s LEU 348 N -9.72 2.59 -1.03 1.64 1.43 -1.26 -4.83 118.68 107.50 2igk s LEU 348 Ca -0.13 -0.40 -0.18 0.00 -1.03 0.00 0.00 54.13 52.39 2igk s LEU 348 Cb 0.11 -1.51 0.02 0.00 0.03 0.00 0.00 46.19 44.84 2igk s LEU 348 CO 0.77 0.27 0.64 0.18 0.23 0.00 0.00 176.35 178.44 2igk n LEU 349 N 1.69 -0.98 0.30 1.79 4.77 -1.26 -1.08 117.00 122.23 2igk n LEU 349 Ca -0.16 -1.15 0.20 0.00 -0.03 0.00 0.00 56.01 54.87 2igk n LEU 349 Cb 0.52 -1.61 0.96 0.00 -2.33 0.00 0.00 43.42 40.97 2igk n LEU 349 CO 0.26 0.62 1.08 1.55 -1.33 0.00 0.00 177.39 179.58 2igk h PRO 350 N -1.52 0.00 -0.00 3.23 0.13 -1.88 -1.46 132.00 130.50 2igk h PRO 350 Ca -0.68 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.45 2igk h PRO 350 Cb 1.41 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.54 2igk h PRO 350 CO 0.45 0.00 -0.13 0.43 -0.23 0.00 0.00 178.00 178.52 2igk n SER 351 N -2.99 0.57 -4.71 1.44 7.64 -1.26 -4.85 113.62 109.45 2igk n SER 351 Ca -0.01 -0.65 -0.42 0.00 1.01 0.00 0.00 58.87 58.80 2igk n SER 351 Cb 0.16 -0.04 -0.03 0.00 -1.01 0.00 0.00 64.21 63.29 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 -0.55 -1.43 118.68 118.14 2igk s LEU 352 Ca 0.29 2.63 0.00 0.00 -0.22 0.00 0.00 54.13 56.83 2igk s LEU 352 Cb 0.20 -3.59 0.00 0.00 0.50 0.00 0.00 46.19 43.30 2igk s LEU 352 CO 0.48 -0.86 0.00 0.61 -1.32 0.00 0.00 176.35 175.25 2igk n GLY 353 N 3.85 0.70 3.79 7.98 0.00 0.12 -4.90 105.19 116.73 2igk n GLY 353 Ca 0.15 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.40 4.75 -1.78 1.61 0.01 -0.52 -0.40 113.70 114.97 2igk s SER 354 Ca 0.00 -0.86 0.00 0.00 1.31 0.00 0.00 55.95 56.40 2igk s SER 354 Cb 0.00 -0.60 0.00 0.00 0.21 0.00 0.00 66.02 65.63 2igk s SER 354 CO 0.00 -0.51 0.00 -1.22 0.41 0.00 0.00 173.24 171.92 2igk n TYR 355 N -1.33 -0.80 -2.20 2.43 4.02 -0.87 -4.57 117.16 113.85 2igk n TYR 355 Ca -0.00 0.00 -0.40 0.00 -0.01 0.00 0.00 57.90 57.49 2igk n TYR 355 Cb 0.63 -3.77 -0.02 0.00 -0.02 0.00 0.00 39.34 36.15 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 -2.96 2.91 0.05 -0.72 -4.36 -0.84 -4.46 121.20 110.82 2igk s ILE 356 Ca 0.00 0.88 0.08 0.00 -0.26 0.00 0.00 60.65 61.35 2igk s ILE 356 Cb 0.00 -3.54 -0.03 0.00 1.25 0.00 0.00 42.46 40.14 2igk s ILE 356 CO 0.00 0.18 -0.24 0.42 0.24 0.00 0.00 174.94 175.54 2igk s THR 357 N -1.21 1.91 -0.03 8.37 -4.23 -0.47 -4.57 115.64 115.40 2igk s THR 357 Ca 0.51 -1.31 -0.02 0.00 -1.18 0.00 0.00 61.69 59.69 2igk s THR 357 Cb -0.37 -1.65 0.01 0.00 1.34 0.00 0.00 72.50 71.84 2igk s THR 357 CO 0.48 0.28 0.08 -0.70 -0.54 0.00 0.00 174.62 174.21 2igk s GLU 358 N -1.23 0.07 0.45 3.99 2.56 -1.26 -0.98 118.70 122.29 2igk s GLU 358 Ca 0.10 0.15 -0.23 0.00 0.00 0.00 0.00 54.97 54.98 2igk s GLU 358 Cb -0.09 -0.02 -0.08 0.00 2.00 0.00 0.00 34.13 35.93 2igk s GLU 358 CO 0.02 -0.05 1.15 -0.65 -0.56 0.00 0.00 175.26 175.17 2igk s GLN 359 N 0.31 3.84 0.33 4.30 -0.21 -1.26 -4.57 119.66 122.40 2igk s GLN 359 Ca -0.02 1.74 -0.27 0.00 0.02 0.00 0.00 55.36 56.82 2igk s GLN 359 Cb -0.03 -2.44 -0.09 0.00 1.00 0.00 0.00 33.01 31.44 2igk s GLN 359 CO -0.01 -0.47 1.07 -1.12 -2.12 0.00 0.00 175.29 172.64 2igk s SER 360 N -1.38 7.08 -0.06 5.90 0.01 -1.22 -4.67 113.70 119.36 2igk s SER 360 Ca 0.62 2.16 0.03 0.00 1.31 0.00 0.00 55.95 60.07 2igk s SER 360 Cb -0.28 -2.61 0.01 0.00 0.21 0.00 0.00 66.02 63.35 2igk s SER 360 CO 0.34 -0.27 -0.13 -0.22 0.41 0.00 0.00 173.24 173.37 2igk s LEU 361 N -1.92 1.71 0.17 2.44 2.96 -1.26 -0.52 118.68 122.27 2igk s LEU 361 Ca 0.50 -0.29 0.09 0.00 -0.22 0.00 0.00 54.13 54.20 2igk s LEU 361 Cb -0.28 -0.82 -0.04 0.00 0.50 0.00 0.00 46.19 45.56 2igk s LEU 361 CO 0.35 0.06 -0.14 0.68 -1.32 0.00 0.00 176.35 175.98 2igk s VAL 362 N 0.48 2.99 -0.07 1.68 -7.23 -0.39 -1.21 120.40 116.65 2igk s VAL 362 Ca -0.11 -1.67 -0.11 0.00 -1.81 0.00 0.00 61.98 58.28 2igk s VAL 362 Cb -0.14 -2.45 0.02 0.00 0.56 0.00 0.00 36.38 34.37 2igk s VAL 362 CO 0.03 -0.06 0.29 0.12 -0.31 0.00 0.00 175.10 175.17 2igk s PHE 363 N -1.56 -0.25 0.30 2.82 5.36 -0.19 -1.54 117.98 122.92 2igk s PHE 363 Ca 0.23 0.56 -0.12 0.00 -0.96 0.00 0.00 56.93 56.64 2igk s PHE 363 Cb -0.09 0.09 0.01 0.00 -0.34 0.00 0.00 43.02 42.69 2igk s PHE 363 CO 0.13 -0.23 0.58 0.00 -1.46 0.00 0.00 175.22 174.23 2igk s GLN 365 N -3.42 1.51 0.25 0.00 -0.21 -0.53 -0.93 119.66 116.33 2igk s GLN 365 Ca 0.21 -1.62 0.07 0.00 0.02 0.00 0.00 55.36 54.04 2igk s GLN 365 Cb -0.02 -1.59 -0.05 0.00 1.00 0.00 0.00 33.01 32.34 2igk s GLN 365 CO 0.12 0.31 -0.09 0.95 -2.12 0.00 0.00 175.29 174.46 2igk s THR 366 N -2.34 1.63 -0.18 -0.19 -4.23 0.05 -0.09 115.64 110.29 2igk s THR 366 Ca 0.24 -2.15 -0.01 0.00 -1.18 0.00 0.00 61.69 58.60 2igk s THR 366 Cb -0.05 -2.29 0.01 0.00 1.34 0.00 0.00 72.50 71.50 2igk s THR 366 CO 0.11 -0.41 -0.14 -0.69 -0.54 0.00 0.00 174.62 172.95 2igk s VAL 367 N -3.03 2.60 0.23 2.29 1.01 -0.30 -1.87 120.40 121.33 2igk s VAL 367 Ca 0.27 -0.77 -0.31 0.00 0.00 0.00 0.00 61.98 61.17 2igk s VAL 367 Cb 0.02 -2.12 -0.14 0.00 0.00 0.00 0.00 36.38 34.14 2igk s VAL 367 CO 0.10 0.50 1.30 0.80 0.00 0.00 0.00 175.10 177.80 2igk n MET 368 N 4.52 1.72 -1.70 2.72 1.56 -0.23 -3.38 117.12 122.33 2igk n MET 368 Ca -0.20 0.61 -0.37 0.00 -0.27 0.00 0.00 57.70 57.47 2igk n MET 368 Cb 0.51 -2.20 0.07 0.00 2.15 0.00 0.00 33.22 33.75 2igk n MET 368 CO 0.00 0.00 0.00 -1.13 -0.73 0.00 0.00 175.97 174.11 2igk n SER 369 N 1.99 1.78 -0.28 6.12 3.41 0.27 -4.85 113.62 122.07 2igk n SER 369 Ca 0.12 0.82 0.04 0.00 -0.26 0.00 0.00 58.87 59.60 2igk n SER 369 Cb 0.30 -1.52 0.18 0.00 -0.26 0.00 0.00 64.21 62.91 2igk n SER 369 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 2igk h THR 370 N 0.51 0.79 -0.34 6.66 2.02 -1.91 -1.37 112.91 119.27 2igk h THR 370 Ca -0.50 -0.22 0.02 0.00 0.77 0.00 0.00 66.41 66.47 2igk h THR 370 Cb 1.35 0.10 -0.02 0.00 -1.74 0.00 0.00 68.15 67.84 2igk h THR 370 CO 0.52 0.12 0.20 -0.33 0.37 0.00 0.00 175.52 176.40 2igk h GLU 371 N 0.63 0.39 -0.61 6.66 5.08 -1.96 -0.04 114.58 124.72 2igk h GLU 371 Ca 0.41 -0.02 -0.05 0.00 -1.00 0.00 0.00 59.36 58.69 2igk h GLU 371 Cb 0.51 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.64 2igk h GLU 371 CO -0.32 0.26 0.17 -0.07 -1.00 0.00 0.00 179.01 178.05 2igk h LEU 372 N 0.40 0.92 -0.08 1.33 3.38 -1.77 -1.33 115.31 118.15 2igk h LEU 372 Ca 0.14 -0.22 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 2igk h LEU 372 Cb 0.01 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.51 2igk h LEU 372 CO -0.07 0.90 0.03 0.40 0.09 0.00 0.00 178.44 179.79 2igk h ILE 373 N 0.89 1.14 -0.71 1.22 1.08 -0.77 -1.57 117.51 118.79 2igk h ILE 373 Ca 0.20 -0.42 0.12 0.00 -0.39 0.00 0.00 64.86 64.36 2igk h ILE 373 Cb 0.32 1.27 -0.05 0.00 -3.07 0.00 0.00 36.82 35.29 2igk h ILE 373 CO -0.00 0.12 0.47 0.44 -0.69 0.00 0.00 178.15 178.49 2igk h ASP 374 N -0.02 0.45 0.23 1.72 3.32 -0.93 -2.22 116.42 118.97 2igk h ASP 374 Ca 0.03 0.02 -0.02 0.00 0.02 0.00 0.00 57.03 57.08 2igk h ASP 374 Cb 0.16 -0.08 -0.00 0.00 0.22 0.00 0.00 39.33 39.63 2igk h ASP 374 CO -0.00 0.26 -0.07 0.77 -1.72 0.00 0.00 179.24 178.47 2igk h SER 375 N 0.49 0.00 0.28 6.45 4.64 -0.21 -2.11 113.55 123.09 2igk h SER 375 Ca 0.33 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.61 2igk h SER 375 Cb 0.63 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.72 2igk h SER 375 CO -0.11 0.07 -0.21 0.58 -0.87 0.00 0.00 176.83 176.29 2igk h VAL 376 N 0.00 1.02 -0.27 0.95 2.07 -1.14 -2.40 116.25 116.48 2igk h VAL 376 Ca -0.00 -0.76 -0.02 0.00 0.82 0.00 0.00 66.70 66.74 2igk h VAL 376 Cb 0.21 1.43 -0.01 0.00 -1.52 0.00 0.00 31.29 31.39 2igk h VAL 376 CO 0.01 0.21 0.00 2.29 0.02 0.00 0.00 177.57 180.10 2igk n LYS 377 N -4.09 2.79 0.15 1.57 2.85 -0.80 -4.74 118.16 115.89 2igk n LYS 377 Ca -0.02 -2.87 0.15 0.00 -1.05 0.00 0.00 58.31 54.52 2igk n LYS 377 Cb 0.28 -1.84 0.72 0.00 -0.65 0.00 0.00 35.03 33.54 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 1.69 0.00 -0.01 -5.58 4.64 -1.33 -2.26 113.55 110.69 2igk h SER 378 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 2igk h SER 378 Cb 1.47 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.56 2igk h SER 378 CO 0.24 0.00 -0.01 0.47 -0.87 0.00 0.00 176.83 176.66 2igk n ASP 379 N -4.27 1.90 -4.85 4.97 8.00 -1.26 -4.94 116.55 116.11 2igk n ASP 379 Ca 0.03 -1.62 -0.35 0.00 0.71 0.00 0.00 54.79 53.56 2igk n ASP 379 Cb 0.34 0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 41.39 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 -2.01 3.97 -0.19 -1.24 -1.94 -0.85 -4.51 119.30 112.52 2igk s MET 380 Ca 0.35 0.49 -0.04 0.00 -1.71 0.00 0.00 55.69 54.78 2igk s MET 380 Cb 0.21 -2.86 -0.02 0.00 2.01 0.00 0.00 34.83 34.17 2igk s MET 380 CO 0.33 0.43 -0.04 0.99 -0.01 0.00 0.00 175.02 176.72 2igk s THR 381 N -1.55 3.60 -0.17 2.05 2.01 0.14 -4.96 115.64 116.76 2igk s THR 381 Ca 0.40 -0.44 0.00 0.00 0.31 0.00 0.00 61.69 61.97 2igk s THR 381 Cb -0.14 -2.61 0.00 0.00 0.01 0.00 0.00 72.50 69.76 2igk s THR 381 CO 0.20 0.45 -0.15 -0.63 -0.69 0.00 0.00 174.62 173.79 2igk s ILE 382 N 1.02 2.59 -0.12 1.82 1.01 -1.26 -1.55 121.20 124.70 2igk s ILE 382 Ca 0.01 -0.79 0.03 0.00 0.00 0.00 0.00 60.65 59.90 2igk s ILE 382 Cb -0.15 -2.10 0.01 0.00 0.01 0.00 0.00 42.46 40.23 2igk s ILE 382 CO 0.01 0.51 -0.22 -0.13 0.00 0.00 0.00 174.94 175.11 2igk s ARG 383 N 0.98 2.96 0.20 2.79 0.52 0.26 -4.98 118.95 121.68 2igk s ARG 383 Ca -0.02 -0.84 0.00 0.00 -0.52 0.00 0.00 55.73 54.35 2igk s ARG 383 Cb -0.15 -2.35 0.00 0.00 0.52 0.00 0.00 34.95 32.98 2igk s ARG 383 CO -0.03 0.04 0.00 0.41 0.02 0.00 0.00 175.30 175.75 2igk n GLY 384 N 3.90 -0.23 2.89 -3.53 0.00 -1.26 -0.07 105.19 106.89 2igk n GLY 384 Ca -0.20 -1.79 -0.21 0.00 0.00 0.00 0.00 46.02 43.82 2igk n GLY 384 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2igk s THR 385 N 0.00 0.61 0.10 2.61 2.01 -1.26 -4.97 115.64 114.74 2igk s THR 385 Ca 0.00 -0.13 -0.36 0.00 0.31 0.00 0.00 61.69 61.51 2igk s THR 385 Cb 0.00 -0.64 -0.17 0.00 0.01 0.00 0.00 72.50 71.70 2igk s THR 385 CO 0.00 0.26 1.28 -2.65 -0.69 0.00 0.00 174.62 172.82 2igk n PRO 386 N 4.26 1.09 0.00 4.92 -0.02 -1.26 -1.59 135.00 142.39 2igk n PRO 386 Ca -0.21 0.39 0.00 0.00 -2.02 0.00 0.00 63.50 61.66 2igk n PRO 386 Cb 0.51 -1.99 0.00 0.00 -0.02 0.00 0.00 33.50 31.99 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 2.36 3.39 3.38 -1.23 0.00 -1.26 -4.99 105.19 106.84 2igk n GLY 387 Ca 0.18 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.93 2igk n GLY 387 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2igk n GLU 388 N -1.87 -1.88 -0.00 1.61 1.02 -0.62 -5.01 120.64 113.88 2igk n GLU 388 Ca 0.00 -1.76 -0.11 0.00 -0.02 0.00 0.00 57.16 55.27 2igk n GLU 388 Cb 0.00 -1.34 -0.14 0.00 -0.02 0.00 0.00 31.44 29.94 2igk n GLU 388 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 2igk h LEU 389 N 0.00 0.10 -3.01 -4.62 -0.00 -1.96 -3.34 115.31 102.47 2igk h LEU 389 Ca -0.38 -0.20 -0.02 0.00 -0.00 0.00 0.00 57.88 57.28 2igk h LEU 389 Cb 1.10 -0.03 -0.01 0.00 -0.00 0.00 0.00 40.66 41.72 2igk h LEU 389 CO 0.26 1.17 0.02 0.35 -0.00 0.00 0.00 178.44 180.24 2igk n THR 390 N -3.18 2.18 -2.41 0.22 -2.24 -1.26 -4.92 114.28 102.66 2igk n THR 390 Ca -0.17 -1.10 -0.42 0.00 -2.27 0.00 0.00 64.05 60.08 2igk n THR 390 Cb 1.04 -0.34 -0.03 0.00 -2.10 0.00 0.00 70.33 68.90 2igk n THR 390 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2igk s TYR 391 N -2.38 3.43 -0.02 4.78 5.04 -1.26 -4.31 117.35 122.63 2igk s TYR 391 Ca 0.43 1.29 -0.00 0.00 -2.44 0.00 0.00 57.07 56.34 2igk s TYR 391 Cb 0.33 -3.43 0.03 0.00 0.35 0.00 0.00 41.96 39.23 2igk s TYR 391 CO 0.12 -1.32 0.03 0.45 -1.34 0.00 0.00 175.55 173.49 2igk s SER 392 N 1.06 0.28 -0.14 4.32 0.15 0.90 -4.99 113.70 115.27 2igk s SER 392 Ca 0.59 0.03 0.01 0.00 0.70 0.00 0.00 55.95 57.28 2igk s SER 392 Cb -0.30 -0.11 0.02 0.00 -1.71 0.00 0.00 66.02 63.92 2igk s SER 392 CO 0.29 -0.14 -0.18 -0.69 1.20 0.00 0.00 173.24 173.72 2igk s VAL 393 N 1.21 1.82 0.05 4.45 1.01 -1.26 -0.57 120.40 127.11 2igk s VAL 393 Ca -0.07 -0.81 -0.04 0.00 0.00 0.00 0.00 61.98 61.05 2igk s VAL 393 Cb -0.13 -1.65 -0.02 0.00 0.00 0.00 0.00 36.38 34.58 2igk s VAL 393 CO -0.03 0.50 0.07 0.42 0.00 0.00 0.00 175.10 176.06 2igk s THR 394 N 1.13 0.16 0.08 3.92 -4.23 -0.60 -4.96 115.64 111.14 2igk s THR 394 Ca -0.01 -1.33 -0.02 0.00 -1.18 0.00 0.00 61.69 59.15 2igk s THR 394 Cb -0.14 -1.14 -0.03 0.00 1.34 0.00 0.00 72.50 72.52 2igk s THR 394 CO -0.07 -0.73 0.03 -0.72 -0.54 0.00 0.00 174.62 172.59 2igk s TYR 395 N -3.20 0.56 -0.43 3.99 1.13 -1.26 0.24 117.35 118.38 2igk s TYR 395 Ca 0.00 -1.04 -0.18 0.00 -1.41 0.00 0.00 57.07 54.44 2igk s TYR 395 Cb 0.02 -0.36 0.03 0.00 -1.10 0.00 0.00 41.96 40.55 2igk s TYR 395 CO -0.07 -0.45 0.47 0.99 -2.51 0.00 0.00 175.55 173.98 2igk s THR 396 N -3.95 5.05 0.44 -3.49 2.01 -1.26 -5.05 115.64 109.39 2igk s THR 396 Ca 0.12 -0.33 -0.25 0.00 0.31 0.00 0.00 61.69 61.53 2igk s THR 396 Cb 0.07 -4.08 -0.09 0.00 0.01 0.00 0.00 72.50 68.41 2igk s THR 396 CO -0.07 -0.48 1.37 -2.65 -0.69 0.00 0.00 174.62 172.10 2igk n PRO 397 N 5.71 2.10 -0.41 4.92 -0.02 -1.26 -2.67 135.00 143.37 2igk n PRO 397 Ca -0.07 0.75 0.00 0.00 -2.02 0.00 0.00 63.50 62.16 2igk n PRO 397 Cb 0.47 -2.53 0.00 0.00 -0.02 0.00 0.00 33.50 31.42 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 0.68 0.93 3.66 -1.23 0.00 -1.26 -4.97 105.19 102.99 2igk n GLY 398 Ca 0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.68 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 0.78 0.77 0.20 4.61 0.00 -1.09 -4.89 120.51 120.89 2igk n ALA 399 Ca 0.00 0.19 0.07 0.00 0.00 0.00 0.00 53.44 53.70 2igk n ALA 399 Cb 0.00 -2.19 0.36 0.00 0.00 0.00 0.00 19.45 17.62 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 1.55 0.00 1.42 0.00 4.64 -1.93 -2.94 113.55 116.28 2igk h SER 400 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 2igk h SER 400 Cb 1.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.41 2igk h SER 400 CO 0.57 0.33 0.00 0.35 -0.87 0.00 0.00 176.83 177.21 2igk n THR 401 N -3.48 0.64 -1.82 2.95 -2.24 -1.26 -4.86 114.28 104.21 2igk n THR 401 Ca -0.00 -0.24 -0.42 0.00 -2.27 0.00 0.00 64.05 61.12 2igk n THR 401 Cb 0.49 -0.65 -0.03 0.00 -2.10 0.00 0.00 70.33 68.05 2igk n THR 401 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2igk s ASN 402 N -4.57 6.46 0.05 3.42 -0.87 -1.11 -4.92 114.94 113.39 2igk s ASN 402 Ca 0.10 2.81 0.25 0.00 -1.57 0.00 0.00 52.86 54.45 2igk s ASN 402 Cb 0.12 -2.61 0.48 0.00 -0.02 0.00 0.00 41.25 39.22 2igk s ASN 402 CO 0.58 -0.89 1.40 0.29 -2.57 0.00 0.00 177.10 175.91 2igk n LYS 403 N 3.29 0.13 -4.36 -0.60 4.01 -1.26 -4.93 118.16 114.43 2igk n LYS 403 Ca 0.12 0.03 -0.23 0.00 -0.51 0.00 0.00 58.31 57.73 2igk n LYS 403 Cb 0.37 -1.58 -0.11 0.00 -0.51 0.00 0.00 35.03 33.20 2igk n LYS 403 CO 0.00 0.00 0.00 -1.01 -1.11 0.00 0.00 177.40 175.28 2igk s HIS 404 N -3.07 1.95 0.75 2.13 3.76 -1.26 -5.12 115.29 114.43 2igk s HIS 404 Ca 0.09 -0.44 -0.12 0.00 -0.15 0.00 0.00 55.06 54.44 2igk s HIS 404 Cb 0.16 -0.96 0.05 0.00 1.11 0.00 0.00 32.58 32.94 2igk s HIS 404 CO 0.70 0.39 1.11 -1.25 -0.85 0.00 0.00 174.74 174.84 2igk s PRO 405 N -2.84 2.28 0.29 8.40 0.04 -1.26 -4.85 135.00 137.06 2igk s PRO 405 Ca 0.18 1.30 0.03 0.00 0.04 0.00 0.00 61.00 62.56 2igk s PRO 405 Cb -0.06 -1.89 0.69 0.00 0.04 0.00 0.00 34.50 33.28 2igk s PRO 405 CO 0.08 -1.65 1.73 -0.44 0.04 0.00 0.00 177.00 176.76 2igk h ASP 406 N -0.83 0.49 0.09 6.66 5.19 -1.99 -2.10 116.42 123.93 2igk h ASP 406 Ca -0.45 0.13 -0.07 0.00 -0.62 0.00 0.00 57.03 56.02 2igk h ASP 406 Cb 1.24 0.06 -0.01 0.00 0.18 0.00 0.00 39.33 40.80 2igk h ASP 406 CO 0.51 0.11 -0.23 4.11 -3.12 0.00 0.00 179.24 180.62 2igk h TRP 407 N 0.53 0.27 -0.13 4.55 5.08 -2.00 -1.37 115.95 122.88 2igk h TRP 407 Ca 0.54 -0.04 -0.12 0.00 1.08 0.00 0.00 58.89 60.34 2igk h TRP 407 Cb 0.94 -0.07 0.00 0.00 -3.00 0.00 0.00 29.16 27.04 2igk h TRP 407 CO -0.09 0.46 -0.41 2.35 -1.28 0.00 0.00 178.44 179.48 2igk h TRP 408 N 0.23 0.66 -0.01 0.12 2.91 -1.77 -2.79 115.95 115.30 2igk h TRP 408 Ca 0.04 -0.27 -0.12 0.00 1.13 0.00 0.00 58.89 59.68 2igk h TRP 408 Cb 0.53 -0.11 -0.02 0.00 -0.51 0.00 0.00 29.16 29.06 2igk h TRP 408 CO 0.01 1.02 -0.54 -0.91 -1.03 0.00 0.00 178.44 176.99 2igk h ASN 409 N 0.11 0.02 -0.30 2.65 2.35 -1.05 -1.66 115.58 117.70 2igk h ASN 409 Ca -0.01 -0.01 -0.07 0.00 -0.55 0.00 0.00 56.30 55.65 2igk h ASN 409 Cb 1.03 -0.01 -0.01 0.00 0.05 0.00 0.00 38.32 39.39 2igk h ASN 409 CO 0.09 0.56 -0.09 -0.08 -1.65 0.00 0.00 177.43 176.25 2igk h GLU 410 N 0.02 0.59 -0.61 0.81 4.57 -1.29 -0.71 114.58 117.95 2igk h GLU 410 Ca -0.00 -0.24 -0.02 0.00 -1.18 0.00 0.00 59.36 57.92 2igk h GLU 410 Cb 0.96 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 29.50 2igk h GLU 410 CO 0.07 0.80 0.29 0.87 -1.18 0.00 0.00 179.01 179.86 2igk h LYS 411 N 0.35 0.89 -0.03 1.92 1.57 -1.17 -0.13 116.57 119.98 2igk h LYS 411 Ca 0.07 -0.13 -0.01 0.00 -1.87 0.00 0.00 60.65 58.71 2igk h LYS 411 Cb 0.59 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.74 2igk h LYS 411 CO 0.03 0.71 -0.03 0.28 -0.57 0.00 0.00 179.45 179.87 2igk h VAL 412 N 0.84 1.40 -0.43 0.50 2.07 -1.27 -1.63 116.25 117.74 2igk h VAL 412 Ca 0.21 -1.24 0.06 0.00 0.82 0.00 0.00 66.70 66.55 2igk h VAL 412 Cb 0.12 2.17 -0.05 0.00 -1.52 0.00 0.00 31.29 32.01 2igk h VAL 412 CO -0.03 0.33 0.13 0.50 0.02 0.00 0.00 177.57 178.53 2igk h LYS 413 N -0.42 0.28 -0.75 1.57 3.64 -1.09 0.16 116.57 119.97 2igk h LYS 413 Ca 0.00 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.32 2igk h LYS 413 Cb 0.55 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 32.28 2igk h LYS 413 CO 0.01 0.19 0.28 -0.91 -2.27 0.00 0.00 179.45 176.75 2igk h ASN 414 N 0.29 1.05 -0.38 4.20 2.35 -0.99 -0.74 115.58 121.36 2igk h ASN 414 Ca 0.20 -0.18 -0.03 0.00 -0.55 0.00 0.00 56.30 55.73 2igk h ASN 414 Cb 0.21 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.29 2igk h ASN 414 CO -0.22 0.95 0.10 -0.74 -1.65 0.00 0.00 177.43 175.87 2igk h HIS 415 N 1.09 0.62 -0.20 1.19 -0.00 -0.70 0.54 115.15 117.69 2igk h HIS 415 Ca 0.25 -0.07 -0.10 0.00 -0.00 0.00 0.00 60.37 60.45 2igk h HIS 415 Cb 0.24 -0.18 -0.01 0.00 -0.00 0.00 0.00 27.41 27.46 2igk h HIS 415 CO 0.02 0.61 -0.29 0.52 -0.00 0.00 0.00 177.93 178.78 2igk h MET 416 N 0.46 0.39 0.22 5.26 2.86 -0.72 -0.43 114.93 122.97 2igk h MET 416 Ca 0.12 -0.15 -0.30 0.00 -2.06 0.00 0.00 59.70 57.30 2igk h MET 416 Cb 0.29 -0.02 0.04 0.00 0.06 0.00 0.00 31.60 31.97 2igk h MET 416 CO -0.00 0.65 -1.33 1.98 1.06 0.00 0.00 176.91 179.27 2igk h MET 417 N 0.34 0.51 0.00 1.72 -1.53 -1.01 -3.33 114.93 111.63 2igk h MET 417 Ca 0.05 -0.84 0.00 0.00 -3.44 0.00 0.00 59.70 55.46 2igk h MET 417 Cb 0.69 0.31 0.00 0.00 -0.55 0.00 0.00 31.60 32.06 2igk h MET 417 CO 0.05 1.40 -0.36 1.96 0.14 0.00 0.00 176.91 180.11 2igk h GLN 418 N 0.06 0.00 -2.24 0.39 4.20 -0.77 -3.39 115.11 113.36 2igk h GLN 418 Ca -0.23 0.00 -0.59 0.00 0.06 0.00 0.00 58.65 57.90 2igk h GLN 418 Cb 2.05 0.00 -0.40 0.00 0.30 0.00 0.00 27.48 29.42 2igk h GLN 418 CO 0.25 0.00 -0.84 0.72 -0.67 0.00 0.00 178.83 178.29 2igk n HIS 419 N -2.67 1.48 0.57 2.96 8.25 -0.18 -4.96 115.22 120.68 2igk n HIS 419 Ca 0.03 -3.84 0.13 0.00 -0.26 0.00 0.00 57.72 53.78 2igk n HIS 419 Cb 0.50 -0.38 0.44 0.00 1.12 0.00 0.00 29.99 31.67 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 1.44 0.22 0.07 -0.41 6.02 -1.25 -1.68 117.38 121.79 2igk n GLN 420 Ca 0.25 0.27 0.13 0.00 -0.01 0.00 0.00 57.00 57.65 2igk n GLN 420 Cb 0.46 -1.80 0.47 0.00 1.02 0.00 0.00 30.24 30.38 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 -2.20 0.18 -3.32 -1.09 0.00 -1.26 -4.58 120.64 108.37 2igk n GLU 421 Ca 0.05 0.15 -0.38 0.00 0.00 0.00 0.00 57.16 56.97 2igk n GLU 421 Cb 0.36 -1.71 -0.06 0.00 0.00 0.00 0.00 31.44 30.02 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 -4.06 6.60 0.00 -1.84 2.15 -0.68 -4.97 116.67 113.87 2igk s ASP 422 Ca 0.12 0.71 0.31 0.00 0.43 0.00 0.00 52.55 54.12 2igk s ASP 422 Cb 0.14 -2.27 1.61 0.00 -0.30 0.00 0.00 42.92 42.10 2igk s ASP 422 CO 0.58 -0.05 2.09 -0.81 -0.17 0.00 0.00 175.17 176.80 2igk n PRO 423 N 4.08 0.62 -4.29 4.34 -0.04 -1.26 -4.87 135.00 133.58 2igk n PRO 423 Ca -0.07 -0.03 -0.31 0.00 -0.04 0.00 0.00 63.50 63.05 2igk n PRO 423 Cb 0.51 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.38 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 -2.40 3.28 0.00 1.53 1.43 -1.26 -5.04 118.68 116.22 2igk s LEU 424 Ca 0.34 -0.18 0.29 0.00 -1.03 0.00 0.00 54.13 53.55 2igk s LEU 424 Cb 0.21 -1.97 1.23 0.00 0.03 0.00 0.00 46.19 45.70 2igk s LEU 424 CO 0.44 0.23 1.85 -0.81 0.23 0.00 0.00 176.35 178.28 2igk n PRO 425 N 1.06 1.31 -3.18 1.29 -0.04 -1.26 -4.84 135.00 129.33 2igk n PRO 425 Ca -0.13 -0.61 -0.39 0.00 -0.04 0.00 0.00 63.50 62.32 2igk n PRO 425 Cb 0.52 -1.49 -0.06 0.00 -0.04 0.00 0.00 33.50 32.44 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 -2.11 5.09 0.62 0.52 1.01 -1.26 -4.60 121.20 120.46 2igk s ILE 426 Ca 0.38 1.13 -0.19 0.00 0.00 0.00 0.00 60.65 61.97 2igk s ILE 426 Cb 0.21 -3.91 -0.02 0.00 0.01 0.00 0.00 42.46 38.75 2igk s ILE 426 CO 0.38 0.21 1.23 -2.65 0.00 0.00 0.00 174.94 174.11 2igk n PRO 427 N 4.41 1.15 0.12 2.79 -0.02 -1.26 -4.89 135.00 137.30 2igk n PRO 427 Ca -0.03 0.45 0.03 0.00 -2.02 0.00 0.00 63.50 61.92 2igk n PRO 427 Cb 0.51 -2.46 0.41 0.00 -0.02 0.00 0.00 33.50 31.93 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 0.65 0.25 -0.72 6.00 0.04 -1.97 -1.95 116.94 119.23 2igk h PHE 428 Ca -0.50 -0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.24 2igk h PHE 428 Cb 1.34 -0.07 0.00 0.00 2.20 0.00 0.00 35.95 39.42 2igk h PHE 428 CO 0.41 0.34 0.00 0.39 -0.60 0.00 0.00 178.31 178.85 2igk n GLU 429 N -4.30 2.83 -1.73 1.51 1.02 -1.26 -4.95 120.64 113.76 2igk n GLU 429 Ca -0.01 -2.65 -0.42 0.00 -0.02 0.00 0.00 57.16 54.07 2igk n GLU 429 Cb 0.24 -1.61 -0.03 0.00 -0.02 0.00 0.00 31.44 30.02 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 -0.98 6.41 0.91 1.62 2.15 -0.74 -4.95 116.67 121.09 2igk s ASP 430 Ca 0.49 2.79 -0.10 0.00 0.43 0.00 0.00 52.55 56.16 2igk s ASP 430 Cb 0.26 -2.58 0.14 0.00 -0.30 0.00 0.00 42.92 40.45 2igk s ASP 430 CO 0.32 -0.99 1.13 -2.84 -0.17 0.00 0.00 175.17 172.62 2igk s PRO 431 N 2.18 1.10 0.80 4.34 0.02 -1.26 -4.97 135.00 137.20 2igk s PRO 431 Ca 0.79 1.46 -0.11 0.00 0.02 0.00 0.00 61.00 63.16 2igk s PRO 431 Cb -0.47 -1.74 0.07 0.00 0.02 0.00 0.00 34.50 32.37 2igk s PRO 431 CO 0.35 -2.55 1.09 -1.83 -0.33 0.00 0.00 177.00 173.73 2igk s GLU 432 N -4.68 2.10 0.61 5.54 1.03 -1.26 -4.47 118.70 117.58 2igk s GLU 432 Ca 0.66 0.81 -0.15 0.00 0.03 0.00 0.00 54.97 56.32 2igk s GLU 432 Cb -0.22 -1.91 -0.02 0.00 -0.80 0.00 0.00 34.13 31.18 2igk s GLU 432 CO 0.58 -1.65 1.07 -2.14 -1.33 0.00 0.00 175.26 171.79 2igk s PRO 433 N -5.05 3.16 -0.43 -4.83 0.02 -1.26 -4.45 135.00 122.16 2igk s PRO 433 Ca 0.61 1.24 0.07 0.00 0.02 0.00 0.00 61.00 62.94 2igk s PRO 433 Cb -0.15 -2.01 0.22 0.00 0.02 0.00 0.00 34.50 32.58 2igk s PRO 433 CO 0.55 -0.94 0.58 1.04 -0.33 0.00 0.00 177.00 177.90 2igk n GLN 434 N -2.18 0.59 -4.61 5.54 1.13 -1.25 -3.23 117.38 113.38 2igk n GLN 434 Ca 0.09 -2.78 -0.33 0.00 -1.94 0.00 0.00 57.00 52.03 2igk n GLN 434 Cb 0.53 -1.39 -0.11 0.00 0.11 0.00 0.00 30.24 29.38 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 -0.32 3.60 0.03 5.09 1.01 -0.15 -1.08 120.40 128.58 2igk s VAL 435 Ca 0.33 -0.60 -0.05 0.00 0.00 0.00 0.00 61.98 61.66 2igk s VAL 435 Cb 0.14 -2.49 -0.01 0.00 0.00 0.00 0.00 36.38 34.02 2igk s VAL 435 CO -0.15 0.54 0.09 0.28 0.00 0.00 0.00 175.10 175.86 2igk s THR 436 N -0.85 0.12 -0.17 3.92 -1.32 -0.36 -0.22 115.64 116.76 2igk s THR 436 Ca 0.14 -1.02 0.01 0.00 -1.21 0.00 0.00 61.69 59.60 2igk s THR 436 Cb -0.11 -0.79 0.01 0.00 -1.51 0.00 0.00 72.50 70.10 2igk s THR 436 CO 0.03 -0.56 -0.17 0.28 -2.21 0.00 0.00 174.62 171.98 2igk s THR 437 N -2.35 2.37 0.61 5.08 -1.32 -1.26 -1.65 115.64 117.11 2igk s THR 437 Ca -0.07 -0.86 -0.15 0.00 -1.21 0.00 0.00 61.69 59.40 2igk s THR 437 Cb -0.03 -2.00 -0.03 0.00 -1.51 0.00 0.00 72.50 68.94 2igk s THR 437 CO -0.03 0.52 1.06 -0.76 -2.21 0.00 0.00 174.62 173.20 2igk s LEU 438 N 1.07 3.47 -0.06 9.08 1.43 -1.26 -3.81 118.68 128.60 2igk s LEU 438 Ca -0.01 1.83 -0.41 0.00 -1.03 0.00 0.00 54.13 54.52 2igk s LEU 438 Cb -0.14 -4.53 -0.20 0.00 0.03 0.00 0.00 46.19 41.35 2igk s LEU 438 CO -0.06 -1.23 1.17 0.33 0.23 0.00 0.00 176.35 176.79 2igk n PHE 439 N -2.12 0.87 -4.13 0.29 -0.00 -1.20 -4.96 117.46 106.21 2igk n PHE 439 Ca 0.09 1.03 -0.09 0.00 -0.00 0.00 0.00 57.45 58.48 2igk n PHE 439 Cb 0.53 -2.13 -0.10 0.00 -0.00 0.00 0.00 39.48 37.78 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 0.47 0.75 0.45 -4.13 -1.52 -1.05 -4.93 119.66 109.71 2igk s GLN 440 Ca 0.92 -1.31 0.17 0.00 -1.95 0.00 0.00 55.36 53.20 2igk s GLN 440 Cb -1.27 0.09 1.12 0.00 -0.22 0.00 0.00 33.01 32.72 2igk s GLN 440 CO 0.60 -0.12 1.95 -1.35 -0.25 0.00 0.00 175.29 176.12 2igk h PRO 441 N 3.03 0.32 -0.01 2.91 0.11 -1.98 0.92 132.00 137.29 2igk h PRO 441 Ca -0.35 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.74 2igk h PRO 441 Cb 1.16 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.20 2igk h PRO 441 CO 0.64 0.21 -0.12 -1.13 -0.21 0.00 0.00 178.00 177.40 2igk n SER 442 N -4.46 0.66 -3.04 -2.05 3.41 -1.26 -4.16 113.62 102.73 2igk n SER 442 Ca 0.12 -0.77 -0.16 0.00 -0.26 0.00 0.00 58.87 57.79 2igk n SER 442 Cb 0.50 -0.02 -0.03 0.00 -0.26 0.00 0.00 64.21 64.40 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 -0.76 -2.04 -1.54 7.33 1.44 0.21 -5.06 115.22 114.78 2igk n HIS 443 Ca 0.15 -2.55 -0.40 0.00 -2.01 0.00 0.00 57.72 52.91 2igk n HIS 443 Cb 0.29 0.70 -0.02 0.00 0.12 0.00 0.00 29.99 31.08 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 2.21 3.38 -3.76 -1.40 -0.04 -0.54 -2.52 135.00 132.34 2igk n PRO 444 Ca 0.20 -2.45 -0.12 0.00 -0.04 0.00 0.00 63.50 61.09 2igk n PRO 444 Cb 0.55 -3.00 -0.08 0.00 -0.04 0.00 0.00 33.50 30.93 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 2.43 -0.12 0.39 0.54 -2.14 -1.26 -4.28 118.94 114.50 2igk s TRP 445 Ca 0.59 0.07 -0.08 0.00 2.66 0.00 0.00 56.10 59.33 2igk s TRP 445 Cb 0.16 0.09 -0.06 0.00 -3.10 0.00 0.00 33.47 30.56 2igk s TRP 445 CO -0.07 -0.46 0.73 -1.58 -2.66 0.00 0.00 176.95 172.91 2igk s HIS 446 N -2.08 3.49 0.04 1.66 5.65 -0.32 -3.25 115.29 120.48 2igk s HIS 446 Ca -0.08 0.92 0.04 0.00 0.25 0.00 0.00 55.06 56.19 2igk s HIS 446 Cb -0.03 -2.35 -0.02 0.00 -1.18 0.00 0.00 32.58 29.00 2igk s HIS 446 CO -0.00 -0.08 -0.11 0.95 -0.65 0.00 0.00 174.74 174.84 2igk s THR 447 N -2.38 0.86 -0.05 0.89 -4.23 -1.25 -1.12 115.64 108.37 2igk s THR 447 Ca 0.49 -0.95 -0.00 0.00 -1.18 0.00 0.00 61.69 60.05 2igk s THR 447 Cb -0.10 -0.82 0.03 0.00 1.34 0.00 0.00 72.50 72.95 2igk s THR 447 CO 0.33 -0.11 0.00 -1.10 -0.54 0.00 0.00 174.62 173.20 2igk s GLN 448 N -1.19 0.44 -0.43 3.99 -0.21 0.04 -4.44 119.66 117.87 2igk s GLN 448 Ca -0.02 0.09 0.03 0.00 0.02 0.00 0.00 55.36 55.48 2igk s GLN 448 Cb -0.08 -0.71 0.12 0.00 1.00 0.00 0.00 33.01 33.35 2igk s GLN 448 CO 0.01 -0.21 0.19 0.42 -2.12 0.00 0.00 175.29 173.58 2igk s ILE 449 N 1.46 1.95 0.00 1.08 1.01 0.69 -1.25 121.20 126.15 2igk s ILE 449 Ca -0.03 -2.65 0.00 0.00 0.00 0.00 0.00 60.65 57.97 2igk s ILE 449 Cb -0.13 -2.39 0.00 0.00 0.01 0.00 0.00 42.46 39.95 2igk s ILE 449 CO -0.03 -0.77 0.00 0.00 0.00 0.00 0.00 174.94 174.14 2igk n HIS 450 N 3.69 0.00 -4.07 3.97 1.44 0.21 -0.97 115.22 119.49 2igk n HIS 450 Ca 0.05 0.00 -0.20 0.00 -2.01 0.00 0.00 57.72 55.56 2igk n HIS 450 Cb 0.36 0.00 -0.16 0.00 0.12 0.00 0.00 29.99 30.31 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 1.00 0.68 0.24 -1.40 1.81 -1.20 -0.08 118.95 120.01 2igk s ARG 451 Ca 0.00 -0.04 0.00 0.00 -1.72 0.00 0.00 55.73 53.97 2igk s ARG 451 Cb 0.00 -0.77 -0.00 0.00 -0.45 0.00 0.00 34.95 33.73 2igk s ARG 451 CO 0.00 -0.12 0.01 -0.40 -0.68 0.00 0.00 175.30 174.12 2igk n ASP 452 N 4.18 2.41 -4.65 0.23 5.75 -1.26 -5.00 116.55 118.20 2igk n ASP 452 Ca -0.23 -2.10 -0.51 0.00 -0.01 0.00 0.00 54.79 51.94 2igk n ASP 452 Cb 0.51 0.24 -0.05 0.00 -1.03 0.00 0.00 41.12 40.78 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 -2.17 0.14 -2.85 2.12 0.00 -1.26 -4.98 120.51 111.50 2igk n ALA 453 Ca -0.10 0.44 -0.13 0.00 0.00 0.00 0.00 53.44 53.65 2igk n ALA 453 Cb 0.32 -2.25 -0.13 0.00 0.00 0.00 0.00 19.45 17.38 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 1.70 0.25 -0.99 0.00 5.36 -1.26 -4.80 117.98 118.24 2igk s PHE 454 Ca 0.86 -0.16 -0.18 0.00 -0.96 0.00 0.00 56.93 56.50 2igk s PHE 454 Cb -0.85 -0.16 0.14 0.00 -0.34 0.00 0.00 43.02 41.80 2igk s PHE 454 CO 0.48 -0.04 1.19 0.45 -1.46 0.00 0.00 175.22 175.84 2igk s SER 455 N -0.42 6.73 0.14 6.13 0.15 -1.26 -4.77 113.70 120.40 2igk s SER 455 Ca -0.03 -2.27 -0.30 0.00 0.70 0.00 0.00 55.95 54.05 2igk s SER 455 Cb -0.03 -2.40 -0.07 0.00 -1.71 0.00 0.00 66.02 61.81 2igk s SER 455 CO -0.00 -0.98 1.14 -0.31 1.20 0.00 0.00 173.24 174.29 2igk s TYR 456 N 2.39 3.52 0.80 3.44 2.02 -1.26 -5.03 117.35 123.24 2igk s TYR 456 Ca 0.35 1.49 -0.12 0.00 -0.37 0.00 0.00 57.07 58.41 2igk s TYR 456 Cb -0.04 -3.34 0.08 0.00 -0.40 0.00 0.00 41.96 38.26 2igk s TYR 456 CO -0.07 -0.88 1.15 0.20 -1.57 0.00 0.00 175.55 174.38 2igk s GLY 457 N 0.33 1.96 0.53 0.71 0.00 -1.26 -4.79 107.32 104.79 2igk s GLY 457 Ca 0.53 0.63 0.20 0.00 0.00 0.00 0.00 44.72 46.08 2igk s GLY 457 CO 0.33 1.02 2.14 0.00 0.00 0.00 0.00 173.10 176.60 2igk h ALA 458 N -1.03 1.76 -0.06 3.20 0.00 -1.99 -1.09 119.26 120.05 2igk h ALA 458 Ca -0.45 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.35 2igk h ALA 458 Cb 1.27 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2igk h ALA 458 CO 0.47 0.05 -0.22 0.28 0.00 0.00 0.00 179.25 179.84 2igk h VAL 459 N 0.00 1.43 -0.88 0.00 2.07 -2.00 -3.22 116.25 113.66 2igk h VAL 459 Ca -0.00 -1.61 0.06 0.00 0.82 0.00 0.00 66.70 65.97 2igk h VAL 459 Cb 0.09 2.31 -0.06 0.00 -1.52 0.00 0.00 31.29 32.11 2igk h VAL 459 CO 0.01 0.46 0.57 1.56 0.02 0.00 0.00 177.57 180.19 2igk h GLN 460 N -0.24 0.96 0.00 1.57 4.20 -1.70 -1.46 115.11 118.44 2igk h GLN 460 Ca -0.01 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.64 2igk h GLN 460 Cb 0.85 -0.22 0.00 0.00 0.30 0.00 0.00 27.48 28.41 2igk h GLN 460 CO 0.05 0.64 0.05 1.04 -0.67 0.00 0.00 178.83 179.93 2igk n GLN 461 N -4.49 0.02 0.22 1.46 6.02 -0.47 0.06 117.38 120.20 2igk n GLN 461 Ca 0.13 0.48 0.09 0.00 -0.01 0.00 0.00 57.00 57.69 2igk n GLN 461 Cb 0.20 -1.60 0.48 0.00 1.02 0.00 0.00 30.24 30.34 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 -3.29 1.08 0.87 -1.32 -3.44 113.55 107.46 2igk h SER 462 Ca 0.00 0.00 -0.58 0.00 -1.23 0.00 0.00 61.79 59.98 2igk h SER 462 Cb 0.09 0.00 -0.08 0.00 -0.44 0.00 0.00 62.40 61.97 2igk h SER 462 CO 0.00 0.25 -0.16 -0.63 -0.53 0.00 0.00 176.83 175.76 2igk s ILE 463 N -3.78 5.17 0.22 2.23 -1.09 0.11 -5.02 121.20 119.03 2igk s ILE 463 Ca -0.00 0.90 -0.32 0.00 -2.23 0.00 0.00 60.65 59.00 2igk s ILE 463 Cb 0.11 -3.79 -0.13 0.00 -1.58 0.00 0.00 42.46 37.08 2igk s ILE 463 CO 0.64 0.37 1.62 -0.67 -1.23 0.00 0.00 174.94 175.67 2igk n ASP 464 N 3.40 3.60 0.00 3.58 -0.08 -1.26 -4.86 116.55 120.93 2igk n ASP 464 Ca -0.08 1.09 0.09 0.00 -1.51 0.00 0.00 54.79 54.38 2igk n ASP 464 Cb 0.52 -1.52 0.51 0.00 2.34 0.00 0.00 41.12 42.96 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 5.83 0.32 -0.07 1.67 0.87 -1.95 -1.29 113.55 118.93 2igk h SER 465 Ca -0.45 -0.00 0.02 0.00 -1.23 0.00 0.00 61.79 60.13 2igk h SER 465 Cb 1.23 -0.07 -0.00 0.00 -0.44 0.00 0.00 62.40 63.12 2igk h SER 465 CO 0.88 0.21 0.15 0.03 -0.53 0.00 0.00 176.83 177.57 2igk h ARG 466 N 0.36 0.00 0.00 2.24 3.08 -1.98 -1.93 114.38 116.16 2igk h ARG 466 Ca 0.19 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.24 2igk h ARG 466 Cb 0.30 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.35 2igk h ARG 466 CO -0.04 0.00 -0.51 1.28 -1.07 0.00 0.00 179.97 179.62 2igk n LEU 467 N -3.38 0.65 -4.79 3.04 4.77 -0.49 -4.92 117.00 111.88 2igk n LEU 467 Ca -0.01 0.24 -0.37 0.00 -0.03 0.00 0.00 56.01 55.84 2igk n LEU 467 Cb 0.24 -0.22 -0.06 0.00 -2.33 0.00 0.00 43.42 41.04 2igk n LEU 467 CO 0.22 -0.04 0.02 -0.63 -1.33 0.00 0.00 177.39 175.63 2igk s ILE 468 N -3.13 5.23 -0.03 -0.08 1.01 -0.73 -1.07 121.20 122.41 2igk s ILE 468 Ca 0.08 0.63 0.03 0.00 0.00 0.00 0.00 60.65 61.39 2igk s ILE 468 Cb 0.14 -3.64 0.00 0.00 0.01 0.00 0.00 42.46 38.98 2igk s ILE 468 CO 0.70 0.49 -0.11 -0.69 0.00 0.00 0.00 174.94 175.32 2igk s VAL 469 N -0.32 0.96 0.06 2.92 1.01 -0.78 -4.95 120.40 119.30 2igk s VAL 469 Ca 0.20 -0.47 -0.10 0.00 0.00 0.00 0.00 61.98 61.61 2igk s VAL 469 Cb -0.14 -0.84 -0.06 0.00 0.00 0.00 0.00 36.38 35.34 2igk s VAL 469 CO 0.08 0.29 0.38 -1.81 0.00 0.00 0.00 175.10 174.03 2igk s ASP 470 N 0.10 6.63 -0.13 3.32 1.01 0.89 -0.77 116.67 127.71 2igk s ASP 470 Ca -0.02 0.76 0.01 0.00 0.71 0.00 0.00 52.55 54.01 2igk s ASP 470 Cb -0.09 -2.17 0.02 0.00 1.01 0.00 0.00 42.92 41.69 2igk s ASP 470 CO 0.01 0.20 -0.15 0.26 0.21 0.00 0.00 175.17 175.70 2igk s TRP 471 N -1.35 2.10 -0.12 4.23 0.52 -0.10 -0.62 118.94 123.59 2igk s TRP 471 Ca 0.31 -1.10 -0.02 0.00 0.02 0.00 0.00 56.10 55.31 2igk s TRP 471 Cb -0.14 -1.53 0.04 0.00 -1.15 0.00 0.00 33.47 30.69 2igk s TRP 471 CO 0.17 -0.59 0.03 1.03 0.02 0.00 0.00 176.95 177.61 2igk s ARG 472 N 1.27 0.52 -0.10 4.98 0.52 -0.38 -1.72 118.95 124.03 2igk s ARG 472 Ca 0.00 -0.06 0.00 0.00 -0.52 0.00 0.00 55.73 55.15 2igk s ARG 472 Cb -0.14 -1.40 -0.02 0.00 0.52 0.00 0.00 34.95 33.91 2igk s ARG 472 CO -0.07 -0.45 -0.11 -0.06 0.02 0.00 0.00 175.30 174.63 2igk s PHE 473 N 1.97 2.84 -0.16 -0.53 0.40 -0.59 -0.78 117.98 121.13 2igk s PHE 473 Ca 0.03 -0.36 0.01 0.00 -0.60 0.00 0.00 56.93 56.01 2igk s PHE 473 Cb -0.14 -1.79 0.01 0.00 0.51 0.00 0.00 43.02 41.61 2igk s PHE 473 CO -0.06 0.00 -0.19 -0.06 0.70 0.00 0.00 175.22 175.61 2igk s PHE 474 N -0.11 2.74 0.33 0.36 0.40 -0.28 -1.26 117.98 120.16 2igk s PHE 474 Ca -0.01 -1.36 -0.02 0.00 -0.60 0.00 0.00 56.93 54.94 2igk s PHE 474 Cb -0.14 -1.88 -0.04 0.00 0.51 0.00 0.00 43.02 41.48 2igk s PHE 474 CO 0.03 -0.64 0.57 0.20 0.70 0.00 0.00 175.22 176.07 2igk s GLY 475 N 1.00 1.60 0.26 4.36 0.00 0.33 -1.17 107.32 113.69 2igk s GLY 475 Ca -0.02 -0.72 -0.15 0.00 0.00 0.00 0.00 44.72 43.83 2igk s GLY 475 CO -0.05 -0.63 0.68 1.09 0.00 0.00 0.00 173.10 174.19 2igk s ARG 476 N -3.98 4.03 -0.13 2.90 1.70 -1.26 -3.45 118.95 118.76 2igk s ARG 476 Ca 0.42 0.63 0.02 0.00 -0.47 0.00 0.00 55.73 56.32 2igk s ARG 476 Cb -0.10 -2.65 0.01 0.00 -0.57 0.00 0.00 34.95 31.65 2igk s ARG 476 CO 0.34 0.29 -0.17 0.99 -1.08 0.00 0.00 175.30 175.66 2igk s THR 477 N -1.77 1.73 0.16 4.99 2.01 -1.26 -4.74 115.64 116.76 2igk s THR 477 Ca 0.48 -0.77 -0.31 0.00 0.31 0.00 0.00 61.69 61.40 2igk s THR 477 Cb -0.13 -1.56 -0.11 0.00 0.01 0.00 0.00 72.50 70.71 2igk s THR 477 CO 0.19 0.49 1.79 -0.70 -0.69 0.00 0.00 174.62 175.69 2igk s GLU 478 N 1.04 4.13 0.02 4.92 2.12 -1.26 -4.18 118.70 125.49 2igk s GLU 478 Ca -0.04 2.61 -0.30 0.00 0.36 0.00 0.00 54.97 57.59 2igk s GLU 478 Cb -0.15 -3.37 -0.07 0.00 0.26 0.00 0.00 34.13 30.81 2igk s GLU 478 CO -0.04 -0.81 1.57 -1.25 -0.54 0.00 0.00 175.26 174.20 2igk s PRO 479 N 2.07 4.22 -0.02 4.30 0.04 -1.26 -4.82 135.00 139.53 2igk s PRO 479 Ca 0.78 2.19 0.03 0.00 0.04 0.00 0.00 61.00 64.04 2igk s PRO 479 Cb -0.48 -3.67 -0.00 0.00 0.04 0.00 0.00 34.50 30.39 2igk s PRO 479 CO 0.35 -0.71 -0.11 0.15 0.04 0.00 0.00 177.00 176.71 2igk s LYS 480 N 2.86 1.11 0.32 4.56 -0.14 -1.26 -4.98 119.74 122.22 2igk s LYS 480 Ca 0.71 -0.40 0.03 0.00 -1.36 0.00 0.00 55.97 54.95 2igk s LYS 480 Cb -0.36 -1.03 0.63 0.00 -1.68 0.00 0.00 37.83 35.40 2igk s LYS 480 CO 0.30 0.19 1.91 1.49 -0.76 0.00 0.00 175.35 178.47 2igk h GLU 481 N 6.18 0.87 0.00 1.68 4.81 -1.94 -1.56 114.58 124.63 2igk h GLU 481 Ca -0.33 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.85 2igk h GLU 481 Cb 1.17 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 30.35 2igk h GLU 481 CO 0.49 0.58 0.00 1.05 -0.73 0.00 0.00 179.01 180.39 2igk h GLU 482 N 0.90 0.00 -5.97 1.92 9.09 -1.96 -3.34 114.58 115.22 2igk h GLU 482 Ca 0.39 0.00 -0.60 0.00 0.05 0.00 0.00 59.36 59.20 2igk h GLU 482 Cb 0.33 0.00 -0.10 0.00 -1.65 0.00 0.00 28.75 27.32 2igk h GLU 482 CO -0.15 0.00 0.51 -0.80 0.05 0.00 0.00 179.01 178.61 2igk s ASN 483 N -5.06 6.60 0.08 3.06 0.01 -0.60 -4.79 114.94 114.24 2igk s ASN 483 Ca 0.00 0.43 0.06 0.00 -0.71 0.00 0.00 52.86 52.64 2igk s ASN 483 Cb 0.10 -2.43 -0.03 0.00 0.41 0.00 0.00 41.25 39.29 2igk s ASN 483 CO 0.44 -0.83 -0.17 -0.54 -1.51 0.00 0.00 177.10 174.49 2igk s LYS 484 N 3.35 0.95 -0.21 -0.60 1.02 -0.06 -1.98 119.74 122.20 2igk s LYS 484 Ca 0.35 -1.01 -0.04 0.00 0.02 0.00 0.00 55.97 55.29 2igk s LYS 484 Cb -0.12 -1.05 -0.01 0.00 -0.52 0.00 0.00 37.83 36.13 2igk s LYS 484 CO 0.19 0.24 -0.04 -1.17 -0.92 0.00 0.00 175.35 173.65 2igk s LEU 485 N -1.74 2.96 0.37 3.17 2.96 0.46 -1.18 118.68 125.69 2igk s LEU 485 Ca 0.01 -0.34 0.03 0.00 -0.22 0.00 0.00 54.13 53.61 2igk s LEU 485 Cb -0.10 -1.75 -0.04 0.00 0.50 0.00 0.00 46.19 44.81 2igk s LEU 485 CO 0.03 0.01 0.11 -1.66 -1.32 0.00 0.00 176.35 173.52 2igk s TRP 486 N 1.29 1.81 -0.03 5.38 1.48 0.06 -4.59 118.94 124.33 2igk s TRP 486 Ca 0.04 -1.19 0.02 0.00 -1.06 0.00 0.00 56.10 53.91 2igk s TRP 486 Cb -0.14 -1.16 0.01 0.00 -1.16 0.00 0.00 33.47 31.01 2igk s TRP 486 CO -0.01 -0.22 -0.09 -0.06 -4.06 0.00 0.00 176.95 172.51 2igk s PHE 487 N -3.29 0.99 0.51 1.66 0.08 -1.26 -0.01 117.98 116.66 2igk s PHE 487 Ca 0.29 -0.27 -0.21 0.00 0.12 0.00 0.00 56.93 56.86 2igk s PHE 487 Cb 0.05 -0.73 -0.07 0.00 -0.57 0.00 0.00 43.02 41.70 2igk s PHE 487 CO 0.15 -0.13 1.13 0.45 -0.10 0.00 0.00 175.22 176.71 2igk s SER 488 N 0.35 5.96 0.00 1.36 0.15 -0.31 -0.08 113.70 121.14 2igk s SER 488 Ca -0.06 2.18 0.17 0.00 0.70 0.00 0.00 55.95 58.95 2igk s SER 488 Cb -0.10 -2.59 0.49 0.00 -1.71 0.00 0.00 66.02 62.11 2igk s SER 488 CO 0.01 -1.05 1.40 -0.90 1.20 0.00 0.00 173.24 173.89 2igk n ASP 489 N -0.97 2.53 0.00 5.45 5.68 -1.26 -4.16 116.55 123.81 2igk n ASP 489 Ca 0.10 -1.95 0.00 0.00 -0.50 0.00 0.00 54.79 52.44 2igk n ASP 489 Cb 0.50 -0.28 0.00 0.00 -1.14 0.00 0.00 41.12 40.20 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 0.88 0.00 -3.20 0.11 0.00 -1.26 -5.04 118.16 109.65 2igk n LYS 490 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 58.31 58.10 2igk n LYS 490 Cb 0.42 -0.52 -0.06 0.00 0.00 0.00 0.00 35.03 34.87 2igk n LYS 490 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 2igk s ILE 491 N -1.31 4.66 0.23 3.15 -1.09 -1.26 -5.01 121.20 120.56 2igk s ILE 491 Ca 0.00 1.22 0.09 0.00 -2.23 0.00 0.00 60.65 59.74 2igk s ILE 491 Cb 0.00 -3.89 -0.05 0.00 -1.58 0.00 0.00 42.46 36.95 2igk s ILE 491 CO 0.00 0.38 -0.17 0.42 -1.23 0.00 0.00 174.94 174.34 2igk s THR 492 N -1.32 1.99 0.00 2.92 -4.23 -1.26 -1.50 115.64 112.25 2igk s THR 492 Ca 0.36 -2.26 0.00 0.00 -1.18 0.00 0.00 61.69 58.61 2igk s THR 492 Cb -0.18 -2.12 0.00 0.00 1.34 0.00 0.00 72.50 71.54 2igk s THR 492 CO 0.21 -0.51 0.00 -0.90 -0.54 0.00 0.00 174.62 172.88 2igk n ASP 493 N -0.41 0.00 0.27 3.99 5.68 0.88 -4.76 116.55 122.20 2igk n ASP 493 Ca -0.07 -0.82 0.16 0.00 -0.50 0.00 0.00 54.79 53.56 2igk n ASP 493 Cb 0.60 0.00 0.73 0.00 -1.14 0.00 0.00 41.12 41.31 2igk n ASP 493 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2igk h ALA 494 N -0.72 1.07 -0.59 2.12 0.00 -1.98 -1.85 119.26 117.32 2igk h ALA 494 Ca 0.00 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 2igk h ALA 494 Cb 0.00 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 2igk h ALA 494 CO 0.00 0.09 0.08 0.66 0.00 0.00 0.00 179.25 180.08 2igk n TYR 495 N -3.29 2.08 -2.49 0.00 4.02 -1.26 -4.94 117.16 111.28 2igk n TYR 495 Ca -0.01 -0.89 -0.20 0.00 -0.01 0.00 0.00 57.90 56.79 2igk n TYR 495 Cb 0.28 -0.55 -0.00 0.00 -0.02 0.00 0.00 39.34 39.05 2igk n TYR 495 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 2igk n ASN 496 N 0.27 -5.62 -4.89 7.72 5.15 -0.69 -5.00 115.26 112.19 2igk n ASN 496 Ca 0.31 -0.02 -0.22 0.00 -0.60 0.00 0.00 54.58 54.05 2igk n ASN 496 Cb 1.23 -4.67 -0.03 0.00 -0.53 0.00 0.00 39.78 35.78 2igk n ASN 496 CO 0.00 0.00 0.00 -0.04 1.40 0.00 0.00 177.26 178.62 2igk s MET 497 N -5.13 3.18 0.23 1.20 -1.94 -1.26 -4.80 119.30 110.78 2igk s MET 497 Ca 0.04 -0.89 -0.32 0.00 -1.71 0.00 0.00 55.69 52.81 2igk s MET 497 Cb -0.02 -2.73 -0.13 0.00 2.01 0.00 0.00 34.83 33.96 2igk s MET 497 CO 0.05 0.42 1.57 -2.30 -0.01 0.00 0.00 175.02 174.75 2igk n PRO 498 N -1.22 2.38 -2.47 2.03 -0.02 -1.26 -0.09 135.00 134.36 2igk n PRO 498 Ca -0.08 0.85 -0.42 0.00 -2.02 0.00 0.00 63.50 61.83 2igk n PRO 498 Cb 0.57 -2.61 -0.03 0.00 -0.02 0.00 0.00 33.50 31.41 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 0.25 4.37 0.32 -0.52 2.00 -0.56 -4.59 119.66 120.92 2igk s GLN 499 Ca 0.71 1.67 -0.29 0.00 -2.00 0.00 0.00 55.36 55.45 2igk s GLN 499 Cb -0.59 -3.53 -0.10 0.00 0.80 0.00 0.00 33.01 29.59 2igk s GLN 499 CO 0.43 -0.41 1.37 -1.25 -0.50 0.00 0.00 175.29 174.94 2igk s PRO 500 N 2.02 4.29 -0.03 1.67 0.04 -1.26 -1.16 135.00 140.57 2igk s PRO 500 Ca 0.56 2.30 0.01 0.00 0.04 0.00 0.00 61.00 63.91 2igk s PRO 500 Cb -0.25 -3.06 0.02 0.00 0.04 0.00 0.00 34.50 31.24 2igk s PRO 500 CO 0.23 -0.31 -0.03 0.99 0.04 0.00 0.00 177.00 177.92 2igk s THR 501 N -0.82 0.35 -0.01 1.26 2.01 0.99 -4.62 115.64 114.81 2igk s THR 501 Ca 0.52 -0.07 -0.03 0.00 0.31 0.00 0.00 61.69 62.43 2igk s THR 501 Cb -0.41 -0.38 -0.04 0.00 0.01 0.00 0.00 72.50 71.67 2igk s THR 501 CO 0.52 0.16 0.20 -0.36 -0.69 0.00 0.00 174.62 174.45 2igk s PHE 502 N 0.66 3.55 -0.38 4.92 0.08 -1.26 -0.76 117.98 124.79 2igk s PHE 502 Ca -0.07 0.39 0.01 0.00 0.12 0.00 0.00 56.93 57.38 2igk s PHE 502 Cb -0.11 -1.85 0.12 0.00 -0.57 0.00 0.00 43.02 40.61 2igk s PHE 502 CO -0.01 0.64 0.16 0.34 -0.10 0.00 0.00 175.22 176.26 2igk s ASP 503 N -1.90 3.89 -0.06 1.36 -1.08 -0.32 -4.63 116.67 113.93 2igk s ASP 503 Ca 0.27 -2.17 -0.03 0.00 -0.52 0.00 0.00 52.55 50.10 2igk s ASP 503 Cb -0.13 -1.01 0.03 0.00 -1.46 0.00 0.00 42.92 40.36 2igk s ASP 503 CO 0.18 -0.34 0.14 0.12 0.52 0.00 0.00 175.17 175.79 2igk s PHE 504 N 0.93 -0.15 0.04 -5.34 2.19 0.06 -0.88 117.98 114.83 2igk s PHE 504 Ca 0.14 0.44 0.02 0.00 0.33 0.00 0.00 56.93 57.85 2igk s PHE 504 Cb -0.21 -0.06 -0.02 0.00 -1.31 0.00 0.00 43.02 41.41 2igk s PHE 504 CO -0.11 -0.14 -0.07 1.03 1.83 0.00 0.00 175.22 177.76 2igk s ARG 505 N 0.93 0.52 0.08 10.12 1.81 -1.26 -3.90 118.95 127.25 2igk s ARG 505 Ca -0.07 -0.76 -0.31 0.00 -1.72 0.00 0.00 55.73 52.87 2igk s ARG 505 Cb -0.09 -0.26 -0.08 0.00 -0.45 0.00 0.00 34.95 34.07 2igk s ARG 505 CO -0.05 0.04 1.61 -0.06 -0.68 0.00 0.00 175.30 176.16 2igk s PHE 506 N -1.44 2.59 0.41 -0.53 0.08 -1.26 -4.90 117.98 112.93 2igk s PHE 506 Ca -0.10 0.44 -0.27 0.00 0.12 0.00 0.00 56.93 57.12 2igk s PHE 506 Cb -0.10 -3.92 -0.10 0.00 -0.57 0.00 0.00 43.02 38.34 2igk s PHE 506 CO 0.00 -3.60 1.39 -2.30 -0.10 0.00 0.00 175.22 170.61 2igk n PRO 507 N 5.27 2.28 -0.77 0.24 -0.02 -1.26 -4.92 135.00 135.82 2igk n PRO 507 Ca 0.15 0.81 -0.31 0.00 -2.02 0.00 0.00 63.50 62.13 2igk n PRO 507 Cb 0.41 -2.54 0.16 0.00 -0.02 0.00 0.00 33.50 31.50 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 -1.16 1.56 0.00 3.55 0.00 -1.26 -3.11 121.76 121.34 2igk s ALA 508 Ca 0.58 0.58 0.00 0.00 0.00 0.00 0.00 51.96 53.12 2igk s ALA 508 Cb -0.49 -3.44 0.00 0.00 0.00 0.00 0.00 23.12 19.19 2igk s ALA 508 CO 0.60 -2.65 0.00 0.41 0.00 0.00 0.00 175.76 174.12 2igk n GLY 509 N 0.11 0.75 0.25 0.00 0.00 -1.26 -4.54 105.19 100.49 2igk n GLY 509 Ca 0.12 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.74 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 0.49 -0.60 1.61 2.43 -1.99 -1.57 114.38 114.75 2igk h ARG 510 Ca 0.00 -0.03 0.06 0.00 -0.81 0.00 0.00 59.98 59.20 2igk h ARG 510 Cb 0.00 -0.11 -0.05 0.00 -0.42 0.00 0.00 29.97 29.39 2igk h ARG 510 CO 0.00 0.32 0.31 1.15 -1.51 0.00 0.00 179.97 180.24 2igk h THR 511 N 0.50 0.94 -0.09 0.20 2.02 -1.80 0.23 112.91 114.92 2igk h THR 511 Ca 0.32 -0.20 -0.16 0.00 0.77 0.00 0.00 66.41 67.15 2igk h THR 511 Cb 0.36 0.31 0.01 0.00 -1.74 0.00 0.00 68.15 67.09 2igk h THR 511 CO -0.28 0.11 -0.55 0.28 0.37 0.00 0.00 175.52 175.44 2igk h SER 512 N 0.58 0.64 -0.45 4.18 0.02 -1.28 -1.68 113.55 115.56 2igk h SER 512 Ca 0.27 -0.66 -0.03 0.00 -0.84 0.00 0.00 61.79 60.52 2igk h SER 512 Cb 0.18 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.51 2igk h SER 512 CO -0.18 1.20 0.15 0.50 -1.14 0.00 0.00 176.83 177.36 2igk h LYS 513 N 0.12 0.69 -0.64 3.45 3.64 -1.09 -2.20 116.57 120.53 2igk h LYS 513 Ca -0.04 -0.14 -0.03 0.00 -1.27 0.00 0.00 60.65 59.17 2igk h LYS 513 Cb 1.21 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 32.89 2igk h LYS 513 CO 0.11 0.65 0.29 0.93 -2.27 0.00 0.00 179.45 179.16 2igk h GLU 514 N 0.58 0.92 -0.47 1.90 5.08 -0.54 -0.79 114.58 121.26 2igk h GLU 514 Ca 0.15 -0.13 -0.04 0.00 -1.00 0.00 0.00 59.36 58.33 2igk h GLU 514 Cb 0.24 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.30 2igk h GLU 514 CO -0.01 0.73 0.13 0.00 -1.00 0.00 0.00 179.01 178.86 2igk h ALA 515 N 1.40 0.62 -0.23 3.43 0.00 -0.86 0.26 119.26 123.89 2igk h ALA 515 Ca 0.22 -0.19 -0.18 0.00 0.00 0.00 0.00 54.91 54.76 2igk h ALA 515 Cb 0.13 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2igk h ALA 515 CO -0.03 0.29 -0.57 1.49 0.00 0.00 0.00 179.25 180.43 2igk h GLU 516 N 0.64 0.79 -0.66 0.00 4.57 -1.29 -2.24 114.58 116.39 2igk h GLU 516 Ca 0.15 -0.55 0.08 0.00 -1.18 0.00 0.00 59.36 57.86 2igk h GLU 516 Cb 0.30 0.08 -0.04 0.00 -0.16 0.00 0.00 28.75 28.93 2igk h GLU 516 CO -0.00 1.17 0.43 -0.44 -1.18 0.00 0.00 179.01 178.99 2igk h ASP 517 N 0.54 0.53 -0.35 1.04 3.32 -0.93 -2.31 116.42 118.26 2igk h ASP 517 Ca -0.01 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 2igk h ASP 517 Cb 1.19 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.62 2igk h ASP 517 CO 0.12 0.34 0.12 -0.03 -1.72 0.00 0.00 179.24 178.07 2igk h MET 518 N 0.60 0.53 -0.43 3.56 4.05 -0.19 -0.83 114.93 122.21 2igk h MET 518 Ca 0.29 -0.11 0.02 0.00 -0.28 0.00 0.00 59.70 59.63 2igk h MET 518 Cb 0.36 -0.08 -0.03 0.00 -0.80 0.00 0.00 31.60 31.05 2igk h MET 518 CO -0.09 0.54 0.25 1.98 0.23 0.00 0.00 176.91 179.82 2igk h MET 519 N 0.41 0.49 -0.47 0.39 1.85 -1.08 -1.82 114.93 114.71 2igk h MET 519 Ca 0.11 -0.03 0.02 0.00 -0.61 0.00 0.00 59.70 59.19 2igk h MET 519 Cb 0.22 -0.11 -0.03 0.00 0.43 0.00 0.00 31.60 32.11 2igk h MET 519 CO -0.01 0.33 0.28 1.15 -0.40 0.00 0.00 176.91 178.26 2igk h THR 520 N 0.51 1.06 -0.88 -0.77 2.02 -1.28 -1.92 112.91 111.66 2igk h THR 520 Ca 0.17 -0.20 0.07 0.00 0.77 0.00 0.00 66.41 67.23 2igk h THR 520 Cb 0.02 0.44 -0.07 0.00 -1.74 0.00 0.00 68.15 66.80 2igk h THR 520 CO -0.08 0.10 0.54 -0.78 0.37 0.00 0.00 175.52 175.67 2igk h ASP 521 N 0.57 0.83 -0.54 4.18 3.58 -0.76 0.75 116.42 125.04 2igk h ASP 521 Ca 0.18 0.02 -0.07 0.00 0.42 0.00 0.00 57.03 57.59 2igk h ASP 521 Cb -0.00 -0.15 -0.02 0.00 1.72 0.00 0.00 39.33 40.88 2igk h ASP 521 CO -0.08 0.52 0.09 -0.03 -2.88 0.00 0.00 179.24 176.86 2igk h MET 522 N 0.96 0.94 -0.29 0.28 4.05 -0.81 0.37 114.93 120.43 2igk h MET 522 Ca 0.40 -0.23 -0.04 0.00 -0.28 0.00 0.00 59.70 59.54 2igk h MET 522 Cb 0.24 -0.12 -0.01 0.00 -0.80 0.00 0.00 31.60 30.91 2igk h MET 522 CO -0.20 0.88 0.03 0.00 0.23 0.00 0.00 176.91 177.85 2igk h VAL 524 N 0.30 1.18 -0.17 0.00 2.07 -0.72 -3.02 116.25 115.89 2igk h VAL 524 Ca 0.09 -0.57 -0.10 0.00 0.82 0.00 0.00 66.70 66.94 2igk h VAL 524 Cb 0.38 1.12 0.00 0.00 -1.52 0.00 0.00 31.29 31.27 2igk h VAL 524 CO 0.01 0.19 -0.29 -0.03 0.02 0.00 0.00 177.57 177.46 2igk h MET 525 N 0.22 0.49 -0.25 1.57 -1.53 -0.84 -3.15 114.93 111.44 2igk h MET 525 Ca 0.08 -0.30 -0.02 0.00 -3.44 0.00 0.00 59.70 56.01 2igk h MET 525 Cb 0.21 0.03 -0.01 0.00 -0.55 0.00 0.00 31.60 31.28 2igk h MET 525 CO -0.00 0.91 0.07 0.66 0.14 0.00 0.00 176.91 178.68 2igk h SER 526 N 0.12 0.32 0.06 1.39 4.64 -1.02 -1.04 113.55 118.02 2igk h SER 526 Ca 0.01 -0.03 -0.00 0.00 -0.47 0.00 0.00 61.79 61.30 2igk h SER 526 Cb 0.88 -0.08 -0.00 0.00 -0.31 0.00 0.00 62.40 62.88 2igk h SER 526 CO 0.07 0.33 -0.01 0.00 -0.87 0.00 0.00 176.83 176.34 2igk h ALA 527 N 1.72 1.20 0.00 5.18 0.00 -1.48 -0.46 119.26 125.42 2igk h ALA 527 Ca 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2igk h ALA 527 Cb 0.13 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2igk h ALA 527 CO -0.00 0.01 0.00 0.87 0.00 0.00 0.00 179.25 180.12 2igk h LYS 528 N 0.00 0.00 0.00 0.00 1.57 -1.28 -3.30 116.57 113.57 2igk h LYS 528 Ca -0.00 0.00 -0.38 0.00 -1.87 0.00 0.00 60.65 58.40 2igk h LYS 528 Cb 0.04 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.28 2igk h LYS 528 CO 0.00 0.00 -2.43 -0.89 -0.57 0.00 0.00 179.45 175.56 2igk n ILE 529 N -2.83 1.44 0.00 1.86 2.08 -0.25 -4.97 119.36 116.69 2igk n ILE 529 Ca 0.03 -0.56 0.00 0.00 0.56 0.00 0.00 62.75 62.78 2igk n ILE 529 Cb 0.38 -1.38 0.00 0.00 -0.75 0.00 0.00 39.64 37.89 2igk n ILE 529 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2igk n GLY 530 N 2.29 0.32 3.85 7.39 0.00 -0.79 -0.57 105.19 117.68 2igk n GLY 530 Ca -0.44 -0.91 -0.31 0.00 0.00 0.00 0.00 46.02 44.36 2igk n GLY 530 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2igk s GLY 531 N 0.00 1.65 0.55 -0.02 0.00 -1.22 -3.96 107.32 104.33 2igk s GLY 531 Ca 0.00 -0.09 -0.21 0.00 0.00 0.00 0.00 44.72 44.42 2igk s GLY 531 CO 0.00 0.23 1.32 0.69 0.00 0.00 0.00 173.10 175.34 2igk n PHE 532 N -3.02 2.17 -2.81 1.90 3.72 -1.26 -1.15 117.46 117.01 2igk n PHE 532 Ca 0.07 0.43 -0.42 0.00 -0.05 0.00 0.00 57.45 57.48 2igk n PHE 532 Cb 0.55 -2.34 -0.03 0.00 -0.94 0.00 0.00 39.48 36.71 2igk n PHE 532 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 2igk s LEU 533 N -3.36 4.21 0.34 4.37 2.96 0.87 -4.66 118.68 123.41 2igk s LEU 533 Ca 0.73 1.33 -0.27 0.00 -0.22 0.00 0.00 54.13 55.69 2igk s LEU 533 Cb -0.42 -3.36 -0.13 0.00 0.50 0.00 0.00 46.19 42.78 2igk s LEU 533 CO 0.48 -0.41 1.15 -2.65 -1.32 0.00 0.00 176.35 173.61 2igk n PRO 534 N 5.07 1.73 0.00 0.98 -0.02 -1.26 -0.57 135.00 140.93 2igk n PRO 534 Ca 0.06 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 62.15 2igk n PRO 534 Cb 0.49 -2.11 0.00 0.00 -0.02 0.00 0.00 33.50 31.86 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 0.99 2.46 2.53 -1.23 0.00 -1.26 -4.80 105.19 103.88 2igk n GLY 535 Ca 0.07 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.89 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 2.51 -4.87 1.61 7.64 0.26 -5.07 113.62 115.71 2igk n SER 536 Ca 0.00 -3.23 -0.31 0.00 1.01 0.00 0.00 58.87 56.34 2igk n SER 536 Cb 0.00 -0.56 0.00 0.00 -1.01 0.00 0.00 64.21 62.64 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 -3.02 3.34 0.20 -3.43 1.43 -1.25 -1.45 118.68 114.49 2igk s LEU 537 Ca 0.41 1.36 -0.33 0.00 -1.03 0.00 0.00 54.13 54.54 2igk s LEU 537 Cb 0.36 -4.38 -0.13 0.00 0.03 0.00 0.00 46.19 42.08 2igk s LEU 537 CO -0.09 -0.79 1.68 -0.81 0.23 0.00 0.00 176.35 176.57 2igk n PRO 538 N -2.54 2.58 -3.47 1.29 -0.04 -1.26 -4.62 135.00 126.94 2igk n PRO 538 Ca 0.05 0.93 -0.15 0.00 -0.04 0.00 0.00 63.50 64.30 2igk n PRO 538 Cb 0.54 -2.75 -0.04 0.00 -0.04 0.00 0.00 33.50 31.21 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 1.04 1.15 0.13 0.54 -2.07 -0.78 -4.98 119.66 114.69 2igk s GLN 539 Ca 0.76 -0.10 -0.30 0.00 -1.82 0.00 0.00 55.36 53.90 2igk s GLN 539 Cb -0.56 0.54 -0.06 0.00 -1.09 0.00 0.00 33.01 31.83 2igk s GLN 539 CO 0.34 -0.44 0.98 -0.06 -1.32 0.00 0.00 175.29 174.79 2igk s PHE 540 N -2.44 3.80 0.60 9.60 0.08 -1.26 -1.02 117.98 127.33 2igk s PHE 540 Ca -0.05 1.79 -0.16 0.00 0.12 0.00 0.00 56.93 58.63 2igk s PHE 540 Cb -0.01 -3.08 -0.04 0.00 -0.57 0.00 0.00 43.02 39.33 2igk s PHE 540 CO -0.01 0.13 1.06 -1.64 -0.10 0.00 0.00 175.22 174.65 2igk s MET 541 N -0.16 3.30 0.11 0.44 -1.94 -0.35 -4.97 119.30 115.74 2igk s MET 541 Ca 0.47 1.21 -0.36 0.00 -1.71 0.00 0.00 55.69 55.30 2igk s MET 541 Cb -0.24 -2.03 -0.16 0.00 2.01 0.00 0.00 34.83 34.40 2igk s MET 541 CO 0.31 -0.82 1.31 -1.91 -0.01 0.00 0.00 175.02 173.89 2igk n GLU 542 N -2.05 1.20 -1.68 2.03 2.13 -1.26 -4.77 120.64 116.24 2igk n GLU 542 Ca 0.09 0.43 -0.45 0.00 0.66 0.00 0.00 57.16 57.89 2igk n GLU 542 Cb 0.53 -2.05 -0.04 0.00 0.27 0.00 0.00 31.44 30.15 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 2.37 2.53 0.00 5.31 -0.02 -1.26 -1.76 135.00 142.17 2igk n PRO 543 Ca 0.17 0.92 0.00 0.00 -2.02 0.00 0.00 63.50 62.58 2igk n PRO 543 Cb 0.21 -2.80 0.00 0.00 -0.02 0.00 0.00 33.50 30.89 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 4.25 2.07 0.30 -1.23 0.00 -1.26 -0.20 105.19 109.12 2igk n GLY 544 Ca 0.20 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.35 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 -1.77 0.99 5.85 -1.42 -0.01 115.31 118.95 2igk h LEU 545 Ca 0.00 0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.75 2igk h LEU 545 Cb 0.00 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.01 2igk h LEU 545 CO 0.00 0.00 0.21 1.62 -0.34 0.00 0.00 178.44 179.93 2igk h VAL 546 N 0.00 1.01 -5.68 1.05 3.04 -1.88 -3.48 116.25 110.32 2igk h VAL 546 Ca 0.05 -0.10 -0.33 0.00 -1.01 0.00 0.00 66.70 65.30 2igk h VAL 546 Cb 0.21 0.68 0.16 0.00 -2.01 0.00 0.00 31.29 30.34 2igk h VAL 546 CO -0.00 0.05 -0.78 0.18 -1.01 0.00 0.00 177.57 176.02 2igk n LEU 547 N -4.49 -4.03 -1.21 3.16 4.77 -0.02 -4.91 117.00 110.27 2igk n LEU 547 Ca 0.02 -0.64 -0.02 0.00 -0.03 0.00 0.00 56.01 55.35 2igk n LEU 547 Cb 0.16 -3.10 0.13 0.00 -2.33 0.00 0.00 43.42 38.28 2igk n LEU 547 CO 0.35 0.37 0.25 1.41 -1.33 0.00 0.00 177.39 178.44 2igk n HIS 548 N -4.11 0.74 -1.64 -1.77 8.25 -1.26 -5.06 115.22 110.37 2igk n HIS 548 Ca -0.28 -1.57 -0.51 0.00 -0.26 0.00 0.00 57.72 55.10 2igk n HIS 548 Cb 0.67 -0.26 -0.06 0.00 1.12 0.00 0.00 29.99 31.47 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 -0.76 2.32 -4.28 2.41 7.94 -1.26 -4.58 117.00 118.79 2igk n LEU 549 Ca 0.22 1.09 -0.15 0.00 -1.11 0.00 0.00 56.01 56.06 2igk n LEU 549 Cb 0.83 -1.26 -0.10 0.00 0.53 0.00 0.00 43.42 43.42 2igk n LEU 549 CO 0.07 -0.65 -0.30 -0.83 -1.11 0.00 0.00 177.39 174.57 2igk s GLY 550 N 1.48 1.46 0.00 -3.96 0.00 -0.15 -4.23 107.32 101.91 2igk s GLY 550 Ca 0.86 -1.72 0.00 0.00 0.00 0.00 0.00 44.72 43.86 2igk s GLY 550 CO 0.48 -1.58 0.00 0.61 0.00 0.00 0.00 173.10 172.61 2igk n GLY 551 N -0.35 0.71 0.26 0.20 0.00 -0.95 -1.37 105.19 103.69 2igk n GLY 551 Ca -0.04 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.12 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 0.33 -1.44 2.61 1.35 -1.76 -3.29 112.91 110.71 2igk h THR 552 Ca 0.00 -0.63 -0.41 0.00 -0.55 0.00 0.00 66.41 64.82 2igk h THR 552 Cb 0.04 1.47 -0.35 0.00 -1.73 0.00 0.00 68.15 67.59 2igk h THR 552 CO 0.00 0.10 -1.04 0.00 -0.25 0.00 0.00 175.52 174.33 2igk n HIS 553 N -3.34 -0.32 -2.04 4.73 1.44 -0.47 0.10 115.22 115.32 2igk n HIS 553 Ca -0.01 -3.31 -0.34 0.00 -2.01 0.00 0.00 57.72 52.06 2igk n HIS 553 Cb 0.29 0.02 0.02 0.00 0.12 0.00 0.00 29.99 30.44 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 -1.96 3.18 0.15 -1.40 1.70 -1.10 -3.95 118.95 115.57 2igk s ARG 554 Ca 0.34 1.40 -0.11 0.00 -0.47 0.00 0.00 55.73 56.90 2igk s ARG 554 Cb 0.36 -2.00 -0.07 0.00 -0.57 0.00 0.00 34.95 32.67 2igk s ARG 554 CO -0.06 -0.95 0.49 1.41 -1.08 0.00 0.00 175.30 175.11 2igk s MET 555 N -3.78 3.83 0.12 3.89 -2.45 0.63 0.25 119.30 121.78 2igk s MET 555 Ca 0.68 0.29 -0.24 0.00 -1.25 0.00 0.00 55.69 55.16 2igk s MET 555 Cb -0.20 -2.85 0.08 0.00 1.25 0.00 0.00 34.83 33.11 2igk s MET 555 CO 0.34 0.45 1.12 0.20 1.05 0.00 0.00 175.02 178.19 2igk s GLY 556 N -1.99 0.04 0.07 2.11 0.00 -0.34 -4.53 107.32 102.68 2igk s GLY 556 Ca 0.40 -0.22 -0.14 0.00 0.00 0.00 0.00 44.72 44.75 2igk s GLY 556 CO 0.20 3.60 1.16 0.74 0.00 0.00 0.00 173.10 178.80 2igk h PHE 557 N 2.00 1.03 -3.30 1.90 0.04 -1.92 -3.34 116.94 113.35 2igk h PHE 557 Ca -0.26 -0.59 -0.55 0.00 2.80 0.00 0.00 57.97 59.37 2igk h PHE 557 Cb 1.21 -0.10 -0.35 0.00 2.20 0.00 0.00 35.95 38.90 2igk h PHE 557 CO 1.40 1.43 -0.82 0.34 -0.60 0.00 0.00 178.31 180.06 2igk s ASP 558 N -7.34 2.16 0.18 2.17 2.15 -1.26 -4.90 116.67 109.82 2igk s ASP 558 Ca -0.10 -0.36 -0.20 0.00 0.43 0.00 0.00 52.55 52.33 2igk s ASP 558 Cb 0.06 -0.95 0.11 0.00 -0.30 0.00 0.00 42.92 41.85 2igk s ASP 558 CO 0.93 -0.01 1.62 -0.08 -0.17 0.00 0.00 175.17 177.45 2igk h GLU 559 N 7.44 -0.15 0.02 4.34 4.81 -1.87 0.39 114.58 129.57 2igk h GLU 559 Ca -0.31 0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 58.90 2igk h GLU 559 Cb 1.17 0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.59 2igk h GLU 559 CO 0.47 -0.10 -0.15 -0.22 -0.73 0.00 0.00 179.01 178.28 2igk h LYS 560 N -0.15 0.06 -0.27 1.92 3.64 -1.97 -2.07 116.57 117.73 2igk h LYS 560 Ca 0.21 -0.09 -0.11 0.00 -1.27 0.00 0.00 60.65 59.38 2igk h LYS 560 Cb 0.49 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.33 2igk h LYS 560 CO -0.55 0.99 -0.31 0.93 -2.27 0.00 0.00 179.45 178.24 2igk h GLU 561 N -0.81 0.57 -0.51 1.90 5.08 -1.98 -3.06 114.58 115.76 2igk h GLU 561 Ca -0.02 -0.25 0.00 0.00 -1.00 0.00 0.00 59.36 58.09 2igk h GLU 561 Cb 1.06 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.29 2igk h GLU 561 CO 0.03 0.81 0.00 -0.25 -1.00 0.00 0.00 179.01 178.60 2igk n ASP 562 N -4.08 3.47 -3.67 1.42 8.00 0.12 -5.00 116.55 116.80 2igk n ASP 562 Ca -0.01 -1.97 -0.25 0.00 0.71 0.00 0.00 54.79 53.27 2igk n ASP 562 Cb 0.46 -0.34 0.01 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 1.27 -5.42 -3.54 -2.24 4.13 -0.99 -4.88 115.26 103.59 2igk n ASN 563 Ca 0.19 -0.87 -0.17 0.00 1.68 0.00 0.00 54.58 55.41 2igk n ASN 563 Cb 0.55 -2.77 -0.08 0.00 -1.54 0.00 0.00 39.78 35.93 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 -1.87 1.05 0.39 0.00 -7.23 -1.00 -2.51 120.40 109.24 2igk s VAL 566 Ca 0.00 -1.61 0.01 0.00 -1.81 0.00 0.00 61.98 58.57 2igk s VAL 566 Cb 0.00 -1.35 0.08 0.00 0.56 0.00 0.00 36.38 35.67 2igk s VAL 566 CO 0.00 -0.48 0.54 -0.46 -0.31 0.00 0.00 175.10 174.39 2igk n ASN 567 N 0.66 0.79 0.00 4.85 0.23 -0.81 -1.20 115.26 119.78 2igk n ASN 567 Ca -0.17 -1.65 0.07 0.00 -0.53 0.00 0.00 54.58 52.30 2igk n ASN 567 Cb 0.57 -0.34 0.35 0.00 -2.08 0.00 0.00 39.78 38.28 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 -2.13 0.67 0.26 5.53 -2.24 -1.25 -0.18 114.28 114.94 2igk n THR 568 Ca 0.09 0.17 0.10 0.00 -2.27 0.00 0.00 64.05 62.14 2igk n THR 568 Cb 0.33 -0.93 0.26 0.00 -2.10 0.00 0.00 70.33 67.89 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 -1.32 3.07 -1.16 3.42 8.00 -1.26 -4.67 116.55 122.63 2igk n ASP 569 Ca 0.06 -1.97 -0.14 0.00 0.71 0.00 0.00 54.79 53.45 2igk n ASP 569 Cb 0.12 -0.34 -0.06 0.00 -0.02 0.00 0.00 41.12 40.82 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 1.19 -4.69 -4.77 -2.24 7.64 0.75 -4.25 113.62 107.25 2igk n SER 570 Ca 0.19 0.31 -0.39 0.00 1.01 0.00 0.00 58.87 60.00 2igk n SER 570 Cb 0.50 -3.49 -0.06 0.00 -1.01 0.00 0.00 64.21 60.15 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 -3.37 4.26 0.10 1.43 3.52 -1.26 -1.49 118.95 122.13 2igk s ARG 571 Ca 0.00 0.65 -0.31 0.00 -0.13 0.00 0.00 55.73 55.95 2igk s ARG 571 Cb 0.00 -3.33 -0.09 0.00 -1.56 0.00 0.00 34.95 29.97 2igk s ARG 571 CO 0.00 0.41 1.64 0.08 -0.81 0.00 0.00 175.30 176.63 2igk s VAL 572 N -0.30 2.90 0.14 7.11 1.01 -0.33 -1.92 120.40 129.02 2igk s VAL 572 Ca 0.29 0.45 -0.35 0.00 0.00 0.00 0.00 61.98 62.37 2igk s VAL 572 Cb -0.18 -3.29 -0.15 0.00 0.00 0.00 0.00 36.38 32.76 2igk s VAL 572 CO 0.16 0.01 1.39 0.49 0.00 0.00 0.00 175.10 177.14 2igk n PHE 573 N 5.21 1.78 0.00 5.22 3.72 -1.04 -1.34 117.46 131.01 2igk n PHE 573 Ca 0.15 0.51 0.00 0.00 -0.05 0.00 0.00 57.45 58.07 2igk n PHE 573 Cb 0.40 -2.40 0.00 0.00 -0.94 0.00 0.00 39.48 36.54 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 2.65 3.17 3.46 1.37 0.00 -1.26 -4.99 105.19 109.59 2igk n GLY 574 Ca 0.16 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.09 3.07 0.27 1.61 0.40 -0.45 -4.19 117.98 116.60 2igk s PHE 575 Ca 0.00 -0.40 0.18 0.00 -0.60 0.00 0.00 56.93 56.11 2igk s PHE 575 Cb 0.00 -2.12 0.79 0.00 0.51 0.00 0.00 43.02 42.20 2igk s PHE 575 CO 0.00 -0.23 1.80 0.87 0.70 0.00 0.00 175.22 178.36 2igk h LYS 576 N 7.61 0.00 0.00 0.44 1.79 -1.50 -3.38 116.57 121.53 2igk h LYS 576 Ca -0.37 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.07 2igk h LYS 576 Cb 1.18 0.00 -0.06 0.00 -1.58 0.00 0.00 32.23 31.76 2igk h LYS 576 CO 0.61 0.35 -0.45 0.27 -1.08 0.00 0.00 179.45 179.15 2igk n ASN 577 N -3.71 1.02 -3.99 0.86 6.94 -1.26 -5.02 115.26 110.11 2igk n ASN 577 Ca -0.01 -2.52 -0.29 0.00 -0.02 0.00 0.00 54.58 51.75 2igk n ASN 577 Cb 0.45 -0.32 -0.17 0.00 -2.36 0.00 0.00 39.78 37.38 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 -1.17 1.52 0.14 -4.53 2.96 -1.26 -1.17 118.68 115.17 2igk s LEU 578 Ca 0.19 -0.41 0.08 0.00 -0.22 0.00 0.00 54.13 53.77 2igk s LEU 578 Cb 0.18 -1.04 -0.04 0.00 0.50 0.00 0.00 46.19 45.79 2igk s LEU 578 CO -0.03 -0.06 -0.19 -0.36 -1.32 0.00 0.00 176.35 174.39 2igk s PHE 579 N 1.46 1.79 -0.03 5.38 0.40 -0.58 -1.18 117.98 125.22 2igk s PHE 579 Ca 0.03 -0.46 0.06 0.00 -0.60 0.00 0.00 56.93 55.96 2igk s PHE 579 Cb -0.13 -0.92 -0.01 0.00 0.51 0.00 0.00 43.02 42.46 2igk s PHE 579 CO -0.08 0.28 -0.21 -0.51 0.70 0.00 0.00 175.22 175.40 2igk s LEU 580 N -2.41 2.02 0.12 -0.37 1.43 -0.56 -1.29 118.68 117.62 2igk s LEU 580 Ca 0.12 -0.39 0.08 0.00 -1.03 0.00 0.00 54.13 52.91 2igk s LEU 580 Cb -0.07 -1.10 -0.04 0.00 0.03 0.00 0.00 46.19 45.01 2igk s LEU 580 CO 0.06 0.23 -0.19 -0.83 0.23 0.00 0.00 176.35 175.85 2igk s GLY 581 N -0.33 1.24 0.00 -3.19 0.00 -0.02 -4.81 107.32 100.21 2igk s GLY 581 Ca 0.04 -1.29 0.00 0.00 0.00 0.00 0.00 44.72 43.46 2igk s GLY 581 CO 0.00 -1.31 0.00 0.61 0.00 0.00 0.00 173.10 172.40 2igk n GLY 582 N 0.86 0.91 0.32 0.20 0.00 -1.26 -4.43 105.19 101.80 2igk n GLY 582 Ca -0.18 -2.22 0.15 0.00 0.00 0.00 0.00 46.02 43.78 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 0.00 0.00 2.00 0.00 0.00 -1.88 -1.21 103.07 101.98 2igk h GLY 584 Ca 0.09 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.35 2igk h GLY 584 CO -0.00 0.00 -0.37 3.43 0.00 0.00 0.00 176.54 179.60 2igk h ASN 585 N 0.00 0.00 -2.81 0.19 2.35 -1.39 -1.20 115.58 112.72 2igk h ASN 585 Ca 0.00 0.00 -0.56 0.00 -0.55 0.00 0.00 56.30 55.19 2igk h ASN 585 Cb 0.00 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.35 2igk h ASN 585 CO -0.00 0.37 1.02 -0.63 -1.65 0.00 0.00 177.43 176.54 2igk s ILE 586 N -3.75 3.92 -1.86 2.81 1.01 -0.46 -0.27 121.20 122.59 2igk s ILE 586 Ca -0.01 1.09 0.25 0.00 0.00 0.00 0.00 60.65 61.97 2igk s ILE 586 Cb 0.12 -3.78 0.14 0.00 0.01 0.00 0.00 42.46 38.94 2igk s ILE 586 CO 0.69 -0.19 1.35 -0.81 0.00 0.00 0.00 174.94 175.98 2igk n PRO 587 N 7.09 0.98 -2.62 2.79 -0.04 -1.26 -2.24 135.00 139.71 2igk n PRO 587 Ca 0.16 -0.70 -0.22 0.00 -0.04 0.00 0.00 63.50 62.70 2igk n PRO 587 Cb 0.44 -1.49 0.06 0.00 -0.04 0.00 0.00 33.50 32.48 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 -2.50 2.47 -0.45 0.52 -4.23 -1.26 -4.78 115.64 105.40 2igk s THR 588 Ca 0.21 -0.64 -0.26 0.00 -1.18 0.00 0.00 61.69 59.83 2igk s THR 588 Cb 0.19 -2.83 0.03 0.00 1.34 0.00 0.00 72.50 71.22 2igk s THR 588 CO 0.55 0.00 0.94 0.00 -0.54 0.00 0.00 174.62 175.57 2igk s ALA 589 N -2.90 3.25 0.05 3.99 0.00 -1.26 -4.81 121.76 120.08 2igk s ALA 589 Ca 0.60 -0.74 0.07 0.00 0.00 0.00 0.00 51.96 51.90 2igk s ALA 589 Cb -0.09 -3.65 -0.03 0.00 0.00 0.00 0.00 23.12 19.36 2igk s ALA 589 CO 0.40 -2.03 -0.20 1.52 0.00 0.00 0.00 175.76 175.45 2igk s TYR 590 N 3.78 1.77 -0.23 0.00 1.13 -1.26 -4.56 117.35 117.97 2igk s TYR 590 Ca 0.38 -0.38 0.09 0.00 -1.41 0.00 0.00 57.07 55.75 2igk s TYR 590 Cb -0.10 -1.05 -0.21 0.00 -1.10 0.00 0.00 41.96 39.51 2igk s TYR 590 CO 0.26 0.09 -0.08 0.41 -2.51 0.00 0.00 175.55 173.72 2igk n GLY 591 N 1.80 -0.65 3.78 5.49 0.00 -1.26 -4.01 105.19 110.33 2igk n GLY 591 Ca -0.17 -0.25 -0.31 0.00 0.00 0.00 0.00 46.02 45.29 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 -2.51 2.34 0.15 4.61 0.00 -1.26 -4.42 121.76 120.68 2igk s ALA 592 Ca -0.23 0.20 -0.31 0.00 0.00 0.00 0.00 51.96 51.61 2igk s ALA 592 Cb 0.08 -3.24 -0.10 0.00 0.00 0.00 0.00 23.12 19.86 2igk s ALA 592 CO 0.71 -1.64 1.53 -0.80 0.00 0.00 0.00 175.76 175.55 2igk s ASN 593 N -3.51 6.64 0.01 0.00 -0.87 -1.26 -4.91 114.94 111.04 2igk s ASN 593 Ca 0.60 2.54 0.26 0.00 -1.57 0.00 0.00 52.86 54.70 2igk s ASN 593 Cb -0.16 -2.59 0.71 0.00 -0.02 0.00 0.00 41.25 39.19 2igk s ASN 593 CO 0.56 -0.78 1.56 -0.81 -2.57 0.00 0.00 177.10 175.06 2igk n PRO 594 N 3.99 0.02 -0.27 -0.60 -0.04 -1.26 -4.42 135.00 132.42 2igk n PRO 594 Ca 0.13 0.01 -0.02 0.00 -0.04 0.00 0.00 63.50 63.58 2igk n PRO 594 Cb 0.39 -1.52 0.10 0.00 -0.04 0.00 0.00 33.50 32.44 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 0.00 1.06 -0.50 0.52 2.02 -1.91 -0.83 112.91 113.28 2igk h THR 595 Ca 0.00 -0.31 -0.04 0.00 0.77 0.00 0.00 66.41 66.83 2igk h THR 595 Cb 0.52 0.10 -0.02 0.00 -1.74 0.00 0.00 68.15 67.00 2igk h THR 595 CO 0.00 0.16 0.14 0.25 0.37 0.00 0.00 175.52 176.44 2igk h LEU 596 N 0.89 0.68 -0.36 2.58 5.85 -1.87 0.81 115.31 123.89 2igk h LEU 596 Ca 0.32 -0.11 -0.07 0.00 0.84 0.00 0.00 57.88 58.86 2igk h LEU 596 Cb 0.09 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 40.93 2igk h LEU 596 CO -0.14 0.66 -0.06 0.74 -0.34 0.00 0.00 178.44 179.31 2igk h THR 597 N 0.72 1.27 -0.93 1.05 2.02 -1.62 -1.00 112.91 114.42 2igk h THR 597 Ca 0.16 -1.10 0.00 0.00 0.77 0.00 0.00 66.41 66.25 2igk h THR 597 Cb 0.24 1.25 -0.05 0.00 -1.74 0.00 0.00 68.15 67.85 2igk h THR 597 CO -0.01 0.36 0.60 0.00 0.37 0.00 0.00 175.52 176.84 2igk h ALA 598 N 0.84 1.18 -0.37 6.16 0.00 -0.27 -1.67 119.26 125.13 2igk h ALA 598 Ca 0.10 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 2igk h ALA 598 Cb 0.55 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2igk h ALA 598 CO 0.03 0.60 0.15 1.98 0.00 0.00 0.00 179.25 182.01 2igk h MET 599 N 1.27 0.55 -0.57 0.00 -1.53 -0.74 -1.18 114.93 112.72 2igk h MET 599 Ca 0.34 -0.10 0.08 0.00 -3.44 0.00 0.00 59.70 56.58 2igk h MET 599 Cb -0.11 -0.09 -0.06 0.00 -0.55 0.00 0.00 31.60 30.78 2igk h MET 599 CO -0.07 0.52 0.23 0.77 0.14 0.00 0.00 176.91 178.51 2igk h SER 600 N 0.45 0.26 -0.91 1.39 0.02 -0.86 -0.49 113.55 113.41 2igk h SER 600 Ca 0.12 0.06 0.01 0.00 -0.84 0.00 0.00 61.79 61.14 2igk h SER 600 Cb 0.18 0.03 -0.04 0.00 0.14 0.00 0.00 62.40 62.70 2igk h SER 600 CO -0.01 0.17 0.60 -0.07 -1.14 0.00 0.00 176.83 176.37 2igk h LEU 601 N 0.43 1.05 -0.61 5.07 3.38 -1.09 -2.67 115.31 120.87 2igk h LEU 601 Ca 0.28 -0.03 -0.07 0.00 0.09 0.00 0.00 57.88 58.14 2igk h LEU 601 Cb 0.30 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 2igk h LEU 601 CO -0.26 0.77 0.11 0.00 0.09 0.00 0.00 178.44 179.15 2igk h ALA 602 N 1.42 0.82 -0.24 1.53 0.00 -0.43 -0.72 119.26 121.63 2igk h ALA 602 Ca 0.33 -0.26 0.04 0.00 0.00 0.00 0.00 54.91 55.02 2igk h ALA 602 Cb -0.13 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.39 2igk h ALA 602 CO -0.07 0.57 0.01 0.82 0.00 0.00 0.00 179.25 180.58 2igk h ILE 603 N 0.92 0.84 -0.52 0.00 2.04 -0.95 -1.01 117.51 118.83 2igk h ILE 603 Ca 0.19 -0.03 0.02 0.00 1.00 0.00 0.00 64.86 66.04 2igk h ILE 603 Cb 0.42 0.74 -0.03 0.00 -0.74 0.00 0.00 36.82 37.21 2igk h ILE 603 CO 0.01 0.02 0.32 0.50 0.00 0.00 0.00 178.15 179.00 2igk h LYS 604 N 0.09 0.62 -0.59 2.37 3.64 -1.23 -2.05 116.57 119.43 2igk h LYS 604 Ca 0.11 -0.04 0.11 0.00 -1.27 0.00 0.00 60.65 59.57 2igk h LYS 604 Cb 0.14 -0.14 -0.09 0.00 -0.41 0.00 0.00 32.23 31.73 2igk h LYS 604 CO -0.18 0.41 0.08 1.03 -2.27 0.00 0.00 179.45 178.52 2igk h SER 605 N 0.64 -0.08 -0.49 4.20 0.87 -0.82 -2.25 113.55 115.61 2igk h SER 605 Ca 0.21 0.12 -0.02 0.00 -1.23 0.00 0.00 61.79 60.87 2igk h SER 605 Cb 0.01 0.19 -0.03 0.00 -0.44 0.00 0.00 62.40 62.13 2igk h SER 605 CO -0.09 -0.03 0.25 0.00 -0.53 0.00 0.00 176.83 176.44 2igk h GLU 607 N 0.73 0.78 -0.79 0.00 5.08 -0.81 0.21 114.58 119.77 2igk h GLU 607 Ca 0.18 -0.05 0.01 0.00 -1.00 0.00 0.00 59.36 58.50 2igk h GLU 607 Cb 0.07 -0.17 -0.04 0.00 0.50 0.00 0.00 28.75 29.11 2igk h GLU 607 CO -0.03 0.53 0.52 -0.92 -1.00 0.00 0.00 179.01 178.11 2igk h TYR 608 N 0.79 1.00 -0.46 4.33 5.03 -1.05 -2.45 116.97 124.15 2igk h TYR 608 Ca 0.21 0.02 -0.05 0.00 2.58 0.00 0.00 58.73 61.49 2igk h TYR 608 Cb -0.07 -0.34 -0.02 0.00 1.55 0.00 0.00 36.73 37.85 2igk h TYR 608 CO -0.03 0.63 0.08 0.82 -1.32 0.00 0.00 178.16 178.34 2igk h ILE 609 N 1.07 1.25 0.00 1.81 2.04 -0.74 -1.99 117.51 120.95 2igk h ILE 609 Ca 0.29 -0.90 -0.01 0.00 1.00 0.00 0.00 64.86 65.24 2igk h ILE 609 Cb -0.12 0.94 -0.00 0.00 -0.74 0.00 0.00 36.82 36.90 2igk h ILE 609 CO -0.06 0.32 -0.05 0.11 0.00 0.00 0.00 178.15 178.46 2igk h LYS 610 N 0.63 0.00 -0.01 2.37 1.57 -0.42 -1.79 116.57 118.91 2igk h LYS 610 Ca 0.14 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 2igk h LYS 610 Cb 0.38 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.69 2igk h LYS 610 CO 0.01 0.05 -0.29 1.04 -0.57 0.00 0.00 179.45 179.69 2igk n GLN 611 N -3.43 1.08 0.00 3.15 6.02 -0.78 -4.48 117.38 118.93 2igk n GLN 611 Ca -0.02 -0.74 0.00 0.00 -0.01 0.00 0.00 57.00 56.23 2igk n GLN 611 Cb 0.18 -1.48 0.00 0.00 1.02 0.00 0.00 30.24 29.96 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 -0.32 0.19 -3.83 1.08 3.02 -0.88 -5.03 115.26 109.49 2igk n ASN 612 Ca 0.12 -0.79 -0.13 0.00 -0.03 0.00 0.00 54.58 53.75 2igk n ASN 612 Cb 0.39 0.06 -0.15 0.00 -0.61 0.00 0.00 39.78 39.48 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 -0.06 0.00 -0.21 3.10 0.08 -0.73 -5.06 117.98 115.11 2igk s PHE 613 Ca 0.00 0.07 -0.10 0.00 0.12 0.00 0.00 56.93 57.03 2igk s PHE 613 Cb 0.00 -0.09 -0.05 0.00 -0.57 0.00 0.00 43.02 42.31 2igk s PHE 613 CO 0.00 -0.04 0.13 0.99 -0.10 0.00 0.00 175.22 176.20 2igk s THR 614 N 0.44 5.33 0.31 0.64 2.01 -1.26 -4.73 115.64 118.38 2igk s THR 614 Ca -0.04 0.16 -0.29 0.00 0.31 0.00 0.00 61.69 61.84 2igk s THR 614 Cb -0.05 -3.45 -0.11 0.00 0.01 0.00 0.00 72.50 68.91 2igk s THR 614 CO -0.01 0.42 1.44 -2.16 -0.69 0.00 0.00 174.62 173.62 2igk s PRO 615 N 0.56 4.23 0.56 4.92 0.04 -1.26 -4.97 135.00 139.07 2igk s PRO 615 Ca 0.07 2.39 -0.21 0.00 0.04 0.00 0.00 61.00 63.30 2igk s PRO 615 Cb -0.12 -3.05 -0.05 0.00 0.04 0.00 0.00 34.50 31.32 2igk s PRO 615 CO -0.00 -0.42 1.19 -1.13 0.04 0.00 0.00 177.00 176.68 2igk n SER 616 N 1.42 1.87 -4.77 6.66 3.41 -1.26 -4.97 113.62 115.98 2igk n SER 616 Ca 0.04 0.92 -0.37 0.00 -0.26 0.00 0.00 58.87 59.19 2igk n SER 616 Cb 0.40 -1.49 -0.02 0.00 -0.26 0.00 0.00 64.21 62.83 2igk n SER 616 CO 0.00 0.00 0.00 -2.84 -0.16 0.00 0.00 175.04 172.04 2igk s PRO 617 N -2.80 4.01 -0.46 4.33 0.02 -1.26 -4.88 135.00 133.96 2igk s PRO 617 Ca 0.73 1.70 -0.27 0.00 0.02 0.00 0.00 61.00 63.18 2igk s PRO 617 Cb -0.43 -2.55 -0.08 0.00 0.02 0.00 0.00 34.50 31.46 2igk s PRO 617 CO 0.48 -0.32 2.38 0.34 -0.33 0.00 0.00 177.00 179.56 2igk n PHE 618 N -0.13 1.49 -0.04 6.54 -0.00 -1.26 -5.14 117.46 118.92 2igk n PHE 618 Ca 0.05 0.10 0.00 0.00 -0.00 0.00 0.00 57.45 57.60 2igk n PHE 618 Cb 0.48 -2.63 0.00 0.00 -0.00 0.00 0.00 39.48 37.33 2igk n PHE 618 CO 0.00 0.00 0.00 -2.37 -0.00 0.00 0.00 176.76 174.39