#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 0.44 -0.24 6.12 8.00 -1.26 -4.97 116.55 124.64 2igk n ASP 44 Ca 0.00 0.79 0.04 0.00 0.71 0.00 0.00 54.79 56.33 2igk n ASP 44 Cb 0.00 -1.35 0.08 0.00 -0.02 0.00 0.00 41.12 39.84 2igk n ASP 44 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 2igk n ILE 45 N -1.71 1.28 -4.15 0.53 -5.35 -1.26 -5.01 119.36 103.67 2igk n ILE 45 Ca 0.13 -1.31 -0.25 0.00 -0.27 0.00 0.00 62.75 61.06 2igk n ILE 45 Cb 0.47 0.30 -0.17 0.00 -1.74 0.00 0.00 39.64 38.50 2igk n ILE 45 CO 0.00 0.00 0.00 -0.75 -1.76 0.00 0.00 176.55 174.04 2igk s LYS 46 N -1.50 1.39 0.14 6.28 2.47 -1.26 0.21 119.74 127.46 2igk s LYS 46 Ca 0.15 -0.25 -0.01 0.00 -1.56 0.00 0.00 55.97 54.30 2igk s LYS 46 Cb 0.11 -1.35 -0.04 0.00 -1.46 0.00 0.00 37.83 35.09 2igk s LYS 46 CO 0.05 -0.15 0.05 0.71 0.16 0.00 0.00 175.35 176.18 2igk s TYR 47 N 1.27 0.91 -0.01 4.03 1.51 -0.24 -5.01 117.35 119.81 2igk s TYR 47 Ca -0.04 -1.21 -0.22 0.00 -1.01 0.00 0.00 57.07 54.59 2igk s TYR 47 Cb -0.14 -0.51 -0.23 0.00 -0.11 0.00 0.00 41.96 40.97 2igk s TYR 47 CO -0.03 -0.48 1.09 -0.44 -1.11 0.00 0.00 175.55 174.58 2igk h ASP 48 N 2.84 0.40 -3.55 2.29 3.32 -1.09 -3.11 116.42 117.52 2igk h ASP 48 Ca -0.35 -0.75 -0.42 0.00 0.02 0.00 0.00 57.03 55.53 2igk h ASP 48 Cb 1.20 -0.12 -0.33 0.00 0.22 0.00 0.00 39.33 40.30 2igk h ASP 48 CO 0.59 1.09 -0.78 -0.69 -1.72 0.00 0.00 179.24 177.74 2igk s VAL 49 N -3.25 0.64 -0.08 -1.35 1.01 -0.84 -1.15 120.40 115.37 2igk s VAL 49 Ca -0.14 -0.21 0.02 0.00 0.00 0.00 0.00 61.98 61.65 2igk s VAL 49 Cb 0.03 -0.62 -0.02 0.00 0.00 0.00 0.00 36.38 35.76 2igk s VAL 49 CO 0.79 0.23 -0.15 0.68 0.00 0.00 0.00 175.10 176.65 2igk s VAL 50 N 0.66 2.95 -0.14 2.92 -7.23 -0.30 -1.15 120.40 118.10 2igk s VAL 50 Ca -0.10 -0.74 0.02 0.00 -1.81 0.00 0.00 61.98 59.35 2igk s VAL 50 Cb -0.13 -2.18 0.00 0.00 0.56 0.00 0.00 36.38 34.63 2igk s VAL 50 CO 0.01 0.56 -0.19 -0.63 -0.31 0.00 0.00 175.10 174.54 2igk s ILE 51 N -0.22 2.41 -0.36 -0.62 1.01 0.06 -0.77 121.20 122.71 2igk s ILE 51 Ca 0.00 -0.87 -0.15 0.00 0.00 0.00 0.00 60.65 59.63 2igk s ILE 51 Cb -0.13 -1.98 -0.01 0.00 0.01 0.00 0.00 42.46 40.35 2igk s ILE 51 CO 0.03 0.53 0.35 -0.69 0.00 0.00 0.00 174.94 175.17 2igk s VAL 52 N 0.70 5.18 0.00 2.92 1.01 0.03 -1.17 120.40 129.06 2igk s VAL 52 Ca -0.09 -0.07 0.00 0.00 0.00 0.00 0.00 61.98 61.82 2igk s VAL 52 Cb -0.16 -3.84 0.00 0.00 0.00 0.00 0.00 36.38 32.38 2igk s VAL 52 CO 0.01 -0.14 0.00 0.61 0.00 0.00 0.00 175.10 175.59 2igk n GLY 53 N 5.00 2.66 1.02 4.51 0.00 0.70 0.04 105.19 119.12 2igk n GLY 53 Ca -0.09 -1.42 0.01 0.00 0.00 0.00 0.00 46.02 44.52 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 3.10 -3.18 1.61 3.41 -1.26 -4.35 113.62 112.96 2igk n SER 54 Ca 0.00 -3.41 -0.19 0.00 -0.26 0.00 0.00 58.87 55.01 2igk n SER 54 Cb 0.00 -0.59 0.16 0.00 -0.26 0.00 0.00 64.21 63.51 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 -0.88 -2.50 0.27 5.00 0.00 -1.26 -2.40 105.19 103.42 2igk n GLY 55 Ca 0.28 -1.50 0.14 0.00 0.00 0.00 0.00 46.02 44.93 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 0.05 1.61 0.13 -1.92 -0.01 132.00 131.85 2igk h PRO 56 Ca -0.26 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.73 2igk h PRO 56 Cb 0.79 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.94 2igk h PRO 56 CO 0.17 0.10 -0.56 0.82 -0.23 0.00 0.00 178.00 178.30 2igk h ILE 57 N 0.00 1.50 -0.87 -3.56 1.08 -1.91 -1.63 117.51 112.13 2igk h ILE 57 Ca -0.00 -2.22 0.14 0.00 -0.39 0.00 0.00 64.86 62.38 2igk h ILE 57 Cb 0.31 2.89 -0.09 0.00 -3.07 0.00 0.00 36.82 36.86 2igk h ILE 57 CO 0.01 0.63 0.47 1.23 -0.69 0.00 0.00 178.15 179.80 2igk h GLY 58 N -0.33 1.41 2.00 5.37 0.00 -1.69 -1.29 103.07 108.54 2igk h GLY 58 Ca -0.08 -0.28 -0.07 0.00 0.00 0.00 0.00 47.33 46.89 2igk h GLY 58 CO 0.11 0.01 -0.34 0.00 0.00 0.00 0.00 176.54 176.32 2igk h THR 60 N 0.00 1.13 -0.71 0.00 2.02 -0.23 0.16 112.91 115.28 2igk h THR 60 Ca -0.00 -0.40 0.00 0.00 0.77 0.00 0.00 66.41 66.78 2igk h THR 60 Cb 0.81 1.15 -0.03 0.00 -1.74 0.00 0.00 68.15 68.33 2igk h THR 60 CO 0.04 0.12 0.46 1.88 0.37 0.00 0.00 175.52 178.40 2igk h TYR 61 N 0.08 0.90 -0.25 3.16 0.05 -1.16 -2.12 116.97 117.63 2igk h TYR 61 Ca 0.05 0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.83 2igk h TYR 61 Cb 0.14 -0.30 -0.01 0.00 1.01 0.00 0.00 36.73 37.57 2igk h TYR 61 CO -0.02 0.58 0.12 0.00 -1.05 0.00 0.00 178.16 177.79 2igk h ALA 62 N 1.25 0.32 -0.12 3.88 0.00 -1.12 0.66 119.26 124.13 2igk h ALA 62 Ca 0.26 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.09 2igk h ALA 62 Cb -0.09 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2igk h ALA 62 CO -0.05 -0.12 0.04 -0.09 0.00 0.00 0.00 179.25 179.03 2igk h ARG 63 N 0.28 0.10 0.09 0.00 2.43 -0.81 0.14 114.38 116.61 2igk h ARG 63 Ca 0.09 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.25 2igk h ARG 63 Cb 0.12 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.64 2igk h ARG 63 CO -0.01 0.07 -0.05 0.93 -1.51 0.00 0.00 179.97 179.40 2igk h GLU 64 N 0.10 -0.12 0.06 0.20 4.39 -1.25 -2.62 114.58 115.34 2igk h GLU 64 Ca 0.05 0.01 -0.27 0.00 0.34 0.00 0.00 59.36 59.49 2igk h GLU 64 Cb 0.03 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.68 2igk h GLU 64 CO -0.05 0.01 -1.40 -0.07 -1.16 0.00 0.00 179.01 176.34 2igk h LEU 65 N -0.22 0.20 -0.73 1.33 3.38 -0.71 -2.27 115.31 116.28 2igk h LEU 65 Ca -0.01 -0.27 -0.09 0.00 0.09 0.00 0.00 57.88 57.60 2igk h LEU 65 Cb 0.18 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 2igk h LEU 65 CO 0.02 1.22 -0.00 0.58 0.09 0.00 0.00 178.44 180.35 2igk h VAL 66 N 0.03 1.26 0.00 1.22 2.07 -0.85 -0.66 116.25 119.32 2igk h VAL 66 Ca -0.18 -1.11 -0.09 0.00 0.82 0.00 0.00 66.70 66.14 2igk h VAL 66 Cb 1.94 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 32.53 2igk h VAL 66 CO 0.14 0.40 -0.44 1.23 0.02 0.00 0.00 177.57 178.92 2igk h GLY 67 N 1.00 0.00 0.39 2.17 0.00 -1.43 -2.52 103.07 102.68 2igk h GLY 67 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.49 2igk h GLY 67 CO 0.03 0.00 -0.05 0.00 0.00 0.00 0.00 176.54 176.51 2igk n ALA 68 N -2.44 2.70 -0.25 3.60 0.00 -0.86 -4.94 120.51 118.33 2igk n ALA 68 Ca -0.02 -0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.10 2igk n ALA 68 Cb 0.47 -1.31 0.00 0.00 0.00 0.00 0.00 19.45 18.61 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 1.18 0.85 3.84 0.00 0.00 -0.95 -4.94 105.19 105.16 2igk n GLY 69 Ca 0.18 -0.25 -0.32 0.00 0.00 0.00 0.00 46.02 45.63 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 3.39 -0.53 1.61 1.51 -0.27 -4.68 117.35 116.38 2igk s TYR 70 Ca 0.00 1.49 -0.22 0.00 -1.01 0.00 0.00 57.07 57.33 2igk s TYR 70 Cb 0.00 -2.78 0.05 0.00 -0.11 0.00 0.00 41.96 39.11 2igk s TYR 70 CO 0.00 -0.23 0.81 0.21 -1.11 0.00 0.00 175.55 175.23 2igk s LYS 71 N -3.64 3.25 -0.11 -0.62 2.20 -1.26 -4.34 119.74 115.21 2igk s LYS 71 Ca 0.59 -0.50 -0.00 0.00 -0.36 0.00 0.00 55.97 55.70 2igk s LYS 71 Cb -0.10 -4.07 -0.02 0.00 -1.51 0.00 0.00 37.83 32.14 2igk s LYS 71 CO 0.23 -1.36 -0.10 0.08 -0.36 0.00 0.00 175.35 173.83 2igk s VAL 72 N 3.40 3.32 0.04 4.02 1.01 -1.05 -0.49 120.40 130.64 2igk s VAL 72 Ca 0.24 -0.58 0.04 0.00 0.00 0.00 0.00 61.98 61.68 2igk s VAL 72 Cb -0.15 -2.39 -0.04 0.00 0.00 0.00 0.00 36.38 33.81 2igk s VAL 72 CO 0.16 0.54 -0.06 0.00 0.00 0.00 0.00 175.10 175.75 2igk s ALA 73 N 0.02 3.07 -0.05 5.51 0.00 -0.30 -1.90 121.76 128.12 2igk s ALA 73 Ca -0.03 -1.08 0.03 0.00 0.00 0.00 0.00 51.96 50.88 2igk s ALA 73 Cb -0.14 -1.11 0.01 0.00 0.00 0.00 0.00 23.12 21.88 2igk s ALA 73 CO 0.04 0.64 -0.13 1.41 0.00 0.00 0.00 175.76 177.72 2igk s MET 74 N -1.76 1.51 -0.01 0.00 1.75 -0.15 -0.76 119.30 119.89 2igk s MET 74 Ca 0.20 -0.44 0.05 0.00 -1.25 0.00 0.00 55.69 54.24 2igk s MET 74 Cb -0.11 -1.31 -0.03 0.00 2.84 0.00 0.00 34.83 36.22 2igk s MET 74 CO 0.11 0.12 -0.14 -0.06 -0.65 0.00 0.00 175.02 174.40 2igk s PHE 75 N 0.34 2.69 -0.02 4.11 0.08 -0.32 -0.30 117.98 124.56 2igk s PHE 75 Ca -0.08 -0.17 0.01 0.00 0.12 0.00 0.00 56.93 56.81 2igk s PHE 75 Cb -0.12 -1.57 0.01 0.00 -0.57 0.00 0.00 43.02 40.77 2igk s PHE 75 CO 0.02 0.24 -0.03 0.34 -0.10 0.00 0.00 175.22 175.69 2igk s ASP 76 N -1.08 0.64 0.49 1.36 -1.08 -0.77 -0.22 116.67 116.00 2igk s ASP 76 Ca 0.14 -0.08 0.27 0.00 -0.52 0.00 0.00 52.55 52.35 2igk s ASP 76 Cb -0.11 -0.22 1.20 0.00 -1.46 0.00 0.00 42.92 42.33 2igk s ASP 76 CO 0.03 -0.02 1.94 -0.29 0.52 0.00 0.00 175.17 177.36 2igk h ILE 77 N 5.71 0.47 -4.59 4.11 2.10 -1.74 0.16 117.51 123.74 2igk h ILE 77 Ca -0.35 -0.83 -0.37 0.00 1.08 0.00 0.00 64.86 64.39 2igk h ILE 77 Cb 1.16 1.58 0.09 0.00 -1.09 0.00 0.00 36.82 38.56 2igk h ILE 77 CO 0.49 0.15 0.17 0.61 -1.08 0.00 0.00 178.15 178.50 2igk n GLY 78 N -0.17 -0.02 3.50 8.18 0.00 -1.26 -3.74 105.19 111.68 2igk n GLY 78 Ca -0.01 -1.91 -0.24 0.00 0.00 0.00 0.00 46.02 43.86 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 -4.85 1.72 -0.07 1.61 2.02 -1.26 -0.50 118.70 117.38 2igk s GLU 79 Ca 0.56 -1.89 -0.30 0.00 0.02 0.00 0.00 54.97 53.36 2igk s GLU 79 Cb -0.03 -1.46 -0.03 0.00 0.10 0.00 0.00 34.13 32.71 2igk s GLU 79 CO 0.38 0.07 1.28 0.42 0.02 0.00 0.00 175.26 177.43 2igk s ILE 80 N -2.80 4.10 -0.43 -1.63 1.01 -1.26 -1.63 121.20 118.55 2igk s ILE 80 Ca 0.32 1.42 0.08 0.00 0.00 0.00 0.00 60.65 62.46 2igk s ILE 80 Cb 0.04 -3.91 0.35 0.00 0.01 0.00 0.00 42.46 38.94 2igk s ILE 80 CO 0.15 -0.03 1.18 -0.90 0.00 0.00 0.00 174.94 175.34 2igk n ASP 81 N 5.62 -1.98 -0.21 3.58 5.75 -1.26 -4.98 116.55 123.07 2igk n ASP 81 Ca 0.12 -3.24 0.05 0.00 -0.01 0.00 0.00 54.79 51.72 2igk n ASP 81 Cb 0.45 1.47 0.08 0.00 -1.03 0.00 0.00 41.12 42.09 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 0.03 1.43 0.00 -1.12 7.64 -1.26 -5.01 113.62 115.32 2igk n SER 82 Ca 0.04 -2.55 0.00 0.00 1.01 0.00 0.00 58.87 57.37 2igk n SER 82 Cb 0.75 -0.30 0.00 0.00 -1.01 0.00 0.00 64.21 63.65 2igk n SER 82 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2igk n GLY 83 N -0.82 -1.76 0.23 0.23 0.00 -1.26 -4.39 105.19 97.42 2igk n GLY 83 Ca 0.09 -1.70 0.11 0.00 0.00 0.00 0.00 46.02 44.52 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 -8.37 0.99 3.38 -2.03 -3.39 115.31 105.90 2igk h LEU 84 Ca 0.00 0.00 -0.63 0.00 0.09 0.00 0.00 57.88 57.34 2igk h LEU 84 Cb 0.00 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 40.61 2igk h LEU 84 CO 0.00 0.16 0.45 -0.54 0.09 0.00 0.00 178.44 178.60 2igk s LYS 85 N -3.52 3.20 0.02 1.13 1.02 -1.26 -4.99 119.74 115.34 2igk s LYS 85 Ca 0.02 -0.63 -0.30 0.00 0.02 0.00 0.00 55.97 55.08 2igk s LYS 85 Cb 0.09 -4.13 -0.06 0.00 -0.52 0.00 0.00 37.83 33.20 2igk s LYS 85 CO 0.63 -1.56 1.45 0.42 -0.92 0.00 0.00 175.35 175.36 2igk s ILE 86 N 3.71 3.57 -0.02 2.17 1.01 -1.26 -2.53 121.20 127.85 2igk s ILE 86 Ca 0.24 0.97 0.00 0.00 0.00 0.00 0.00 60.65 61.86 2igk s ILE 86 Cb -0.16 -3.62 0.00 0.00 0.01 0.00 0.00 42.46 38.69 2igk s ILE 86 CO 0.14 -0.00 0.00 0.61 0.00 0.00 0.00 174.94 175.69 2igk n GLY 87 N 3.71 0.46 3.95 6.18 0.00 -1.26 -4.35 105.19 113.88 2igk n GLY 87 Ca 0.14 -0.41 -0.26 0.00 0.00 0.00 0.00 46.02 45.48 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 -1.99 3.14 -0.05 4.61 0.00 -1.05 -2.66 121.76 123.75 2igk s ALA 88 Ca 0.00 -1.20 -0.30 0.00 0.00 0.00 0.00 51.96 50.46 2igk s ALA 88 Cb 0.00 -2.47 -0.04 0.00 0.00 0.00 0.00 23.12 20.61 2igk s ALA 88 CO 0.00 -1.55 1.36 -1.58 0.00 0.00 0.00 175.76 173.99 2igk s HIS 89 N -3.33 2.83 0.16 0.00 2.46 -1.26 -4.57 115.29 111.58 2igk s HIS 89 Ca 0.64 0.88 0.35 0.00 0.47 0.00 0.00 55.06 57.40 2igk s HIS 89 Cb -0.08 -3.60 1.61 0.00 -0.13 0.00 0.00 32.58 30.37 2igk s HIS 89 CO 0.46 -2.20 2.04 0.87 -2.47 0.00 0.00 174.74 173.44 2igk h LYS 90 N 8.01 0.00 -0.02 2.88 1.57 -1.30 -2.55 116.57 125.15 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 0.00 0.00 0.36 -0.57 0.00 0.00 179.45 180.16 2igk n LYS 91 N -2.92 1.08 -0.01 3.15 2.85 -1.26 -3.91 118.16 117.14 2igk n LYS 91 Ca -0.00 -0.12 0.10 0.00 -1.05 0.00 0.00 58.31 57.23 2igk n LYS 91 Cb 0.21 -1.26 0.54 0.00 -0.65 0.00 0.00 35.03 33.87 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 -0.62 0.33 -4.82 -5.58 3.02 -0.96 -4.18 115.26 102.45 2igk n ASN 92 Ca 0.12 -1.46 -0.33 0.00 -0.03 0.00 0.00 54.58 52.89 2igk n ASN 92 Cb 0.08 -0.02 -0.04 0.00 -0.61 0.00 0.00 39.78 39.19 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 -1.96 4.21 0.33 3.41 -4.23 -1.25 -4.90 115.64 111.25 2igk s THR 93 Ca 0.30 1.23 0.04 0.00 -1.18 0.00 0.00 61.69 62.08 2igk s THR 93 Cb 0.14 -3.57 0.29 0.00 1.34 0.00 0.00 72.50 70.71 2igk s THR 93 CO 0.23 -0.44 1.91 0.58 -0.54 0.00 0.00 174.62 176.37 2igk h VAL 94 N 1.33 0.99 -0.61 2.29 2.07 -1.97 -0.30 116.25 120.05 2igk h VAL 94 Ca -0.48 -0.29 -0.01 0.00 0.82 0.00 0.00 66.70 66.73 2igk h VAL 94 Cb 1.20 0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 31.00 2igk h VAL 94 CO 0.60 0.16 0.34 -0.08 0.02 0.00 0.00 177.57 178.61 2igk h GLU 95 N 0.86 0.84 0.00 1.57 4.57 -1.94 -1.58 114.58 118.89 2igk h GLU 95 Ca 0.38 -0.09 -0.14 0.00 -1.18 0.00 0.00 59.36 58.33 2igk h GLU 95 Cb 0.35 -0.17 -0.02 0.00 -0.16 0.00 0.00 28.75 28.76 2igk h GLU 95 CO -0.15 0.63 -0.68 1.88 -1.18 0.00 0.00 179.01 179.51 2igk h TYR 96 N 0.82 0.00 -0.04 0.92 0.05 -1.61 -1.07 116.97 116.04 2igk h TYR 96 Ca 0.21 0.00 -0.05 0.00 0.05 0.00 0.00 58.73 58.95 2igk h TYR 96 Cb 0.03 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.76 2igk h TYR 96 CO -0.01 0.68 -0.20 1.96 -1.05 0.00 0.00 178.16 179.54 2igk h GLN 97 N 0.00 0.07 0.11 4.88 1.08 -0.80 -2.60 115.11 117.85 2igk h GLN 97 Ca -0.01 -0.02 -0.33 0.00 -1.45 0.00 0.00 58.65 56.85 2igk h GLN 97 Cb 1.39 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 28.80 2igk h GLN 97 CO 0.09 0.27 -1.72 0.87 -0.95 0.00 0.00 178.83 177.39 2igk h LYS 98 N 0.07 0.24 -2.16 1.46 1.57 -1.11 -3.41 116.57 113.23 2igk h LYS 98 Ca 0.01 -0.41 -0.59 0.00 -1.87 0.00 0.00 60.65 57.79 2igk h LYS 98 Cb 0.39 0.15 -0.41 0.00 0.08 0.00 0.00 32.23 32.44 2igk h LYS 98 CO 0.03 1.08 -0.68 0.09 -0.57 0.00 0.00 179.45 179.40 2igk n ASN 99 N -3.42 3.21 0.17 0.86 3.02 -0.42 -4.96 115.26 113.72 2igk n ASN 99 Ca -0.22 -3.34 0.06 0.00 -0.03 0.00 0.00 54.58 51.05 2igk n ASN 99 Cb 1.05 -0.66 0.53 0.00 -0.61 0.00 0.00 39.78 40.09 2igk n ASN 99 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 2igk h ILE 100 N 2.95 1.07 0.00 2.41 -0.00 -1.70 -2.58 117.51 119.67 2igk h ILE 100 Ca 0.17 -0.27 0.00 0.00 -0.00 0.00 0.00 64.86 64.77 2igk h ILE 100 Cb 0.69 0.97 0.00 0.00 -0.00 0.00 0.00 36.82 38.48 2igk h ILE 100 CO 0.77 0.09 0.00 0.44 -0.00 0.00 0.00 178.15 179.45 2igk h ASP 101 N 0.17 0.00 1.24 2.19 3.32 -1.87 -0.79 116.42 120.68 2igk h ASP 101 Ca 0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.09 2igk h ASP 101 Cb 0.10 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.65 2igk h ASP 101 CO -0.00 0.00 0.00 0.11 -1.72 0.00 0.00 179.24 177.63 2igk h LYS 102 N 0.00 0.00 0.00 3.56 1.79 -1.78 -3.25 116.57 116.89 2igk h LYS 102 Ca 0.00 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.44 2igk h LYS 102 Cb 0.20 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.84 2igk h LYS 102 CO 0.00 0.00 -0.12 0.35 -1.08 0.00 0.00 179.45 178.60 2igk h PHE 103 N 0.00 0.00 -0.78 -1.35 3.57 -1.31 -2.22 116.94 114.85 2igk h PHE 103 Ca 0.00 0.00 0.20 0.00 3.53 0.00 0.00 57.97 61.70 2igk h PHE 103 Cb 0.62 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 39.32 2igk h PHE 103 CO 0.00 0.12 0.54 -0.24 -2.23 0.00 0.00 178.31 176.50 2igk h VAL 104 N 0.00 0.66 -0.17 1.41 3.04 -1.75 -0.67 116.25 118.77 2igk h VAL 104 Ca -0.00 -0.05 -0.18 0.00 -1.01 0.00 0.00 66.70 65.46 2igk h VAL 104 Cb 0.40 0.50 -0.00 0.00 -2.01 0.00 0.00 31.29 30.18 2igk h VAL 104 CO 0.02 0.03 -0.61 0.78 -1.01 0.00 0.00 177.57 176.77 2igk h ASN 105 N 0.15 0.66 -0.23 3.17 4.21 -1.66 -1.44 115.58 120.44 2igk h ASN 105 Ca 0.38 -0.38 0.00 0.00 1.21 0.00 0.00 56.30 57.51 2igk h ASN 105 Cb 1.28 -0.19 -0.01 0.00 -1.12 0.00 0.00 38.32 38.28 2igk h ASN 105 CO -0.06 1.12 0.15 0.58 -1.29 0.00 0.00 177.43 177.92 2igk h VAL 106 N 0.43 1.07 0.09 2.81 2.07 -1.27 -0.41 116.25 121.05 2igk h VAL 106 Ca -0.01 -0.15 0.02 0.00 0.82 0.00 0.00 66.70 67.38 2igk h VAL 106 Cb 1.18 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 31.68 2igk h VAL 106 CO 0.12 0.07 -0.21 0.40 0.02 0.00 0.00 177.57 177.96 2igk h ILE 107 N 0.30 0.52 -0.90 4.57 2.04 -1.20 -2.94 117.51 119.89 2igk h ILE 107 Ca 0.08 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.97 2igk h ILE 107 Cb -0.02 0.52 -0.05 0.00 -0.74 0.00 0.00 36.82 36.53 2igk h ILE 107 CO -0.02 0.00 0.59 1.56 0.00 0.00 0.00 178.15 180.29 2igk h GLN 108 N -0.39 1.12 0.00 2.37 4.20 -1.11 -1.40 115.11 119.90 2igk h GLN 108 Ca 0.03 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.68 2igk h GLN 108 Cb 0.42 -0.25 0.00 0.00 0.30 0.00 0.00 27.48 27.95 2igk h GLN 108 CO -0.13 0.74 0.00 0.78 -0.67 0.00 0.00 178.83 179.55 2igk h GLY 109 N 1.15 0.00 -1.06 3.46 0.00 -0.89 -2.97 103.07 102.76 2igk h GLY 109 Ca 0.35 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.66 2igk h GLY 109 CO -0.10 0.00 -0.47 0.61 0.00 0.00 0.00 176.54 176.58 2igk n GLN 110 N -2.65 1.29 -4.00 4.80 10.64 -0.54 -4.94 117.38 121.99 2igk n GLN 110 Ca -0.01 -2.95 -0.34 0.00 -1.83 0.00 0.00 57.00 51.87 2igk n GLN 110 Cb 0.11 -1.37 -0.15 0.00 -0.86 0.00 0.00 30.24 27.98 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 -2.68 3.25 -0.23 2.61 1.43 -1.12 -3.94 118.68 118.00 2igk s LEU 111 Ca 0.35 -1.06 -0.06 0.00 -1.03 0.00 0.00 54.13 52.34 2igk s LEU 111 Cb 0.34 -1.62 -0.02 0.00 0.03 0.00 0.00 46.19 44.92 2igk s LEU 111 CO -0.06 -0.15 0.02 -0.04 0.23 0.00 0.00 176.35 176.35 2igk s MET 112 N 1.25 3.59 0.26 1.70 -1.94 -0.18 -4.86 119.30 119.12 2igk s MET 112 Ca -0.03 -0.52 -0.30 0.00 -1.71 0.00 0.00 55.69 53.13 2igk s MET 112 Cb -0.18 -3.17 -0.13 0.00 2.01 0.00 0.00 34.83 33.36 2igk s MET 112 CO -0.05 -0.11 1.33 0.43 -0.01 0.00 0.00 175.02 176.61 2igk n SER 113 N 4.64 2.55 -0.04 3.03 7.64 -1.26 -0.94 113.62 129.23 2igk n SER 113 Ca -0.17 1.16 -0.14 0.00 1.01 0.00 0.00 58.87 60.73 2igk n SER 113 Cb 0.51 -1.42 -0.09 0.00 -1.01 0.00 0.00 64.21 62.21 2igk n SER 113 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 2igk h VAL 114 N 2.83 1.41 -2.68 0.44 2.07 -1.39 -3.45 116.25 115.47 2igk h VAL 114 Ca -0.45 -1.53 -0.26 0.00 0.82 0.00 0.00 66.70 65.28 2igk h VAL 114 Cb 1.29 2.19 -0.34 0.00 -1.52 0.00 0.00 31.29 32.91 2igk h VAL 114 CO 0.71 0.44 -0.57 -0.55 0.02 0.00 0.00 177.57 177.62 2igk s SER 115 N -6.21 0.76 -0.22 0.57 0.15 -1.26 -4.65 113.70 102.84 2igk s SER 115 Ca -0.15 0.24 -0.02 0.00 0.70 0.00 0.00 55.95 56.72 2igk s SER 115 Cb 0.04 0.57 0.00 0.00 -1.71 0.00 0.00 66.02 64.92 2igk s SER 115 CO 0.75 -0.28 -0.08 -0.69 1.20 0.00 0.00 173.24 174.15 2igk s VAL 116 N 2.38 3.02 0.86 4.45 1.01 -1.26 -4.76 120.40 126.10 2igk s VAL 116 Ca 0.04 -0.69 -0.11 0.00 0.00 0.00 0.00 61.98 61.22 2igk s VAL 116 Cb -0.14 -2.39 0.11 0.00 0.00 0.00 0.00 36.38 33.96 2igk s VAL 116 CO -0.10 0.40 1.09 -2.16 0.00 0.00 0.00 175.10 174.33 2igk s PRO 117 N 1.41 1.55 0.28 2.72 0.04 -1.26 0.52 135.00 140.25 2igk s PRO 117 Ca 0.04 0.77 -0.30 0.00 0.04 0.00 0.00 61.00 61.55 2igk s PRO 117 Cb -0.14 -1.85 -0.12 0.00 0.04 0.00 0.00 34.50 32.43 2igk s PRO 117 CO -0.05 -2.03 1.63 0.08 0.04 0.00 0.00 177.00 176.66 2igk s VAL 118 N -3.01 2.03 0.05 -0.36 1.01 -1.26 -4.62 120.40 114.25 2igk s VAL 118 Ca 0.62 0.02 -0.29 0.00 0.00 0.00 0.00 61.98 62.34 2igk s VAL 118 Cb -0.17 -3.02 -0.05 0.00 0.00 0.00 0.00 36.38 33.15 2igk s VAL 118 CO 0.56 0.00 0.93 0.21 0.00 0.00 0.00 175.10 176.80 2igk s ASN 119 N 0.63 7.39 -0.12 3.32 3.84 -1.26 -4.95 114.94 123.78 2igk s ASN 119 Ca 0.66 1.66 0.15 0.00 0.21 0.00 0.00 52.86 55.54 2igk s ASN 119 Cb -0.48 -2.56 0.29 0.00 -0.55 0.00 0.00 41.25 37.95 2igk s ASN 119 CO 0.45 -0.12 1.15 0.35 -2.79 0.00 0.00 177.10 176.13 2igk n THR 120 N 3.23 1.59 -2.31 -5.21 -2.24 -1.26 -4.86 114.28 103.22 2igk n THR 120 Ca 0.03 -2.11 -0.41 0.00 -2.27 0.00 0.00 64.05 59.30 2igk n THR 120 Cb 0.50 -0.07 -0.03 0.00 -2.10 0.00 0.00 70.33 68.63 2igk n THR 120 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2igk s LEU 121 N -2.40 4.48 -0.27 3.22 1.43 -1.26 -4.99 118.68 118.90 2igk s LEU 121 Ca 0.29 2.43 -0.15 0.00 -1.03 0.00 0.00 54.13 55.67 2igk s LEU 121 Cb 0.27 -3.63 -0.04 0.00 0.03 0.00 0.00 46.19 42.82 2igk s LEU 121 CO -0.01 -0.34 0.36 -0.69 0.23 0.00 0.00 176.35 175.90 2igk s VAL 122 N -0.90 5.18 -0.38 -1.59 1.01 -1.26 -5.03 120.40 117.43 2igk s VAL 122 Ca 0.48 0.55 -0.07 0.00 0.00 0.00 0.00 61.98 62.95 2igk s VAL 122 Cb -0.35 -3.69 0.07 0.00 0.00 0.00 0.00 36.38 32.41 2igk s VAL 122 CO 0.44 0.17 0.18 -0.69 0.00 0.00 0.00 175.10 175.20 2igk s VAL 123 N 2.02 3.84 -0.15 2.92 1.01 -1.26 -4.94 120.40 123.84 2igk s VAL 123 Ca 0.15 -1.41 0.17 0.00 0.00 0.00 0.00 61.98 60.89 2igk s VAL 123 Cb -0.16 -3.32 0.36 0.00 0.00 0.00 0.00 36.38 33.26 2igk s VAL 123 CO 0.10 -0.39 1.23 -0.90 0.00 0.00 0.00 175.10 175.13 2igk n ASP 124 N 4.81 2.63 -0.84 3.32 5.68 -1.26 -4.46 116.55 126.43 2igk n ASP 124 Ca -0.10 -3.17 0.03 0.00 -0.50 0.00 0.00 54.79 51.05 2igk n ASP 124 Cb 0.43 -0.47 0.21 0.00 -1.14 0.00 0.00 41.12 40.15 2igk n ASP 124 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 2igk n THR 125 N -1.20 2.33 -1.77 2.12 -2.24 -1.26 -5.02 114.28 107.24 2igk n THR 125 Ca 0.18 -2.44 -0.35 0.00 -2.27 0.00 0.00 64.05 59.18 2igk n THR 125 Cb 0.71 -0.28 0.05 0.00 -2.10 0.00 0.00 70.33 68.72 2igk n THR 125 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2igk s LEU 126 N -3.05 3.48 0.49 3.22 1.43 -1.26 -4.98 118.68 118.01 2igk s LEU 126 Ca 0.41 2.26 -0.24 0.00 -1.03 0.00 0.00 54.13 55.53 2igk s LEU 126 Cb 0.36 -4.58 -0.07 0.00 0.03 0.00 0.00 46.19 41.93 2igk s LEU 126 CO 0.03 -1.80 1.40 -0.55 0.23 0.00 0.00 176.35 175.66 2igk s SER 127 N -2.01 5.60 0.62 2.29 0.15 -1.26 -4.89 113.70 114.20 2igk s SER 127 Ca 0.73 2.86 0.30 0.00 0.70 0.00 0.00 55.95 60.55 2igk s SER 127 Cb -0.27 -2.65 1.63 0.00 -1.71 0.00 0.00 66.02 63.02 2igk s SER 127 CO 0.39 -1.36 1.98 -0.65 1.20 0.00 0.00 173.24 174.80 2igk h PRO 128 N 1.94 0.00 0.00 5.44 0.11 -2.00 -1.11 132.00 136.39 2igk h PRO 128 Ca -0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2igk h PRO 128 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 2igk h PRO 128 CO 0.59 0.00 0.00 1.79 -0.21 0.00 0.00 178.00 180.17 2igk h THR 129 N 0.00 0.00 -3.89 -1.15 1.35 -2.04 -3.46 112.91 103.73 2igk h THR 129 Ca 0.09 -0.73 -0.48 0.00 -0.55 0.00 0.00 66.41 64.74 2igk h THR 129 Cb 0.76 1.72 0.00 0.00 -1.73 0.00 0.00 68.15 68.90 2igk h THR 129 CO -0.00 0.00 0.40 -0.44 -0.25 0.00 0.00 175.52 175.23 2igk s SER 130 N -5.40 7.11 0.23 5.36 0.01 -0.42 -5.00 113.70 115.59 2igk s SER 130 Ca 0.08 2.02 -0.31 0.00 1.31 0.00 0.00 55.95 59.06 2igk s SER 130 Cb 0.08 -2.59 -0.11 0.00 0.21 0.00 0.00 66.02 63.61 2igk s SER 130 CO 0.62 -0.24 1.62 0.86 0.41 0.00 0.00 173.24 176.52 2igk s TRP 131 N -1.50 2.90 -0.01 2.43 -0.00 -1.26 -4.94 118.94 116.57 2igk s TRP 131 Ca 0.51 0.61 0.00 0.00 -0.00 0.00 0.00 56.10 57.22 2igk s TRP 131 Cb -0.24 -4.04 0.01 0.00 -0.00 0.00 0.00 33.47 29.20 2igk s TRP 131 CO 0.30 -3.74 -0.00 1.14 -0.00 0.00 0.00 176.95 174.65 2igk s GLN 132 N 0.50 0.08 0.43 5.86 -2.07 -1.26 -5.13 119.66 118.07 2igk s GLN 132 Ca 0.69 0.01 -0.22 0.00 -1.82 0.00 0.00 55.36 54.01 2igk s GLN 132 Cb -0.47 -0.14 -0.09 0.00 -1.09 0.00 0.00 33.01 31.22 2igk s GLN 132 CO 0.38 -0.02 1.02 0.00 -1.32 0.00 0.00 175.29 175.34 2igk s ALA 133 N 0.23 3.02 -0.57 2.60 0.00 -1.26 -4.96 121.76 120.81 2igk s ALA 133 Ca -0.02 0.59 0.23 0.00 0.00 0.00 0.00 51.96 52.76 2igk s ALA 133 Cb -0.03 -3.23 0.08 0.00 0.00 0.00 0.00 23.12 19.93 2igk s ALA 133 CO -0.01 -0.14 1.06 0.43 0.00 0.00 0.00 175.76 177.10 2igk n SER 134 N -0.42 0.62 -4.19 0.00 7.64 -1.26 -5.01 113.62 111.00 2igk n SER 134 Ca 0.07 -0.11 -0.11 0.00 1.01 0.00 0.00 58.87 59.72 2igk n SER 134 Cb 0.51 0.71 -0.10 0.00 -1.01 0.00 0.00 64.21 64.32 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 0.04 -1.19 0.44 -4.23 -1.26 -5.06 115.64 101.17 2igk s THR 135 Ca 0.03 -1.98 -0.13 0.00 -1.18 0.00 0.00 61.69 58.44 2igk s THR 135 Cb 0.14 -2.38 0.20 0.00 1.34 0.00 0.00 72.50 71.79 2igk s THR 135 CO 0.79 -0.13 1.36 -0.36 -0.54 0.00 0.00 174.62 175.74 2igk s PHE 136 N -4.12 3.68 0.81 3.99 0.08 -1.26 -5.00 117.98 116.16 2igk s PHE 136 Ca 0.35 -2.27 -0.12 0.00 0.12 0.00 0.00 56.93 55.01 2igk s PHE 136 Cb 0.07 -4.20 0.08 0.00 -0.57 0.00 0.00 43.02 38.40 2igk s PHE 136 CO 0.09 -1.29 1.18 -0.59 -0.10 0.00 0.00 175.22 174.51 2igk s PHE 137 N 0.92 2.95 -0.29 0.36 -0.71 -1.26 -4.92 117.98 115.02 2igk s PHE 137 Ca 0.40 0.77 -0.29 0.00 -1.04 0.00 0.00 56.93 56.77 2igk s PHE 137 Cb -0.04 -3.48 -0.02 0.00 -1.21 0.00 0.00 43.02 38.27 2igk s PHE 137 CO -0.02 -1.77 1.61 0.08 -1.34 0.00 0.00 175.22 173.78 2igk s VAL 138 N -3.56 3.70 0.11 -2.49 1.01 -1.26 -4.84 120.40 113.07 2igk s VAL 138 Ca 0.62 0.75 0.08 0.00 0.00 0.00 0.00 61.98 63.43 2igk s VAL 138 Cb -0.11 -3.81 -0.04 0.00 0.00 0.00 0.00 36.38 32.42 2igk s VAL 138 CO 0.49 -0.43 -0.20 -0.13 0.00 0.00 0.00 175.10 174.84 2igk s ARG 139 N 4.98 1.10 -1.50 2.72 0.52 -1.26 -4.93 118.95 120.59 2igk s ARG 139 Ca 0.71 -1.17 -0.06 0.00 -0.52 0.00 0.00 55.73 54.69 2igk s ARG 139 Cb -0.21 -1.31 0.01 0.00 0.52 0.00 0.00 34.95 33.96 2igk s ARG 139 CO 0.31 0.30 0.79 0.09 0.02 0.00 0.00 175.30 176.81 2igk n ASN 140 N 1.00 -6.12 0.00 0.23 3.02 -1.26 -1.65 115.26 110.48 2igk n ASN 140 Ca -0.19 -0.38 0.00 0.00 -0.03 0.00 0.00 54.58 53.98 2igk n ASN 140 Cb 0.54 -4.90 0.00 0.00 -0.61 0.00 0.00 39.78 34.81 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 -1.67 0.55 3.74 7.41 0.00 -1.26 -5.02 105.19 108.94 2igk n GLY 141 Ca -0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.26 4.21 -0.40 1.61 1.04 -0.66 -4.79 113.70 112.46 2igk s SER 142 Ca 0.00 2.00 -0.08 0.00 0.48 0.00 0.00 55.95 58.35 2igk s SER 142 Cb 0.00 -2.54 0.07 0.00 0.10 0.00 0.00 66.02 63.65 2igk s SER 142 CO 0.00 -2.24 0.22 0.21 0.98 0.00 0.00 173.24 172.41 2igk s ASN 143 N -2.94 5.51 0.21 7.02 2.47 0.18 -4.79 114.94 122.60 2igk s ASN 143 Ca 0.65 -1.49 0.19 0.00 0.42 0.00 0.00 52.86 52.62 2igk s ASN 143 Cb -0.20 -1.94 0.86 0.00 -1.45 0.00 0.00 41.25 38.52 2igk s ASN 143 CO 0.53 -0.49 1.57 -0.81 -3.72 0.00 0.00 177.10 174.17 2igk n PRO 144 N 4.85 0.12 0.24 0.43 -0.04 -1.26 -2.31 135.00 137.02 2igk n PRO 144 Ca -0.10 0.48 0.13 0.00 -0.04 0.00 0.00 63.50 63.97 2igk n PRO 144 Cb 0.43 -1.80 0.41 0.00 -0.04 0.00 0.00 33.50 32.50 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 -6.01 0.54 4.39 -1.95 -3.46 114.58 108.08 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 28.77 2igk h GLU 145 CO 0.00 0.09 0.64 -1.14 -1.16 0.00 0.00 179.01 177.44 2igk s GLN 146 N -3.45 4.27 -0.19 2.33 2.00 -0.98 -5.00 119.66 118.63 2igk s GLN 146 Ca 0.03 1.22 -0.29 0.00 -2.00 0.00 0.00 55.36 54.32 2igk s GLN 146 Cb 0.08 -3.62 -0.02 0.00 0.80 0.00 0.00 33.01 30.25 2igk s GLN 146 CO 0.62 -0.53 1.41 0.34 -0.50 0.00 0.00 175.29 176.64 2igk s ASP 147 N 1.22 6.70 0.63 6.67 -1.08 -1.26 -4.69 116.67 124.86 2igk s ASP 147 Ca 0.42 1.64 0.41 0.00 -0.52 0.00 0.00 52.55 54.49 2igk s ASP 147 Cb -0.16 -2.54 2.14 0.00 -1.46 0.00 0.00 42.92 40.90 2igk s ASP 147 CO 0.09 -0.98 2.27 1.55 0.52 0.00 0.00 175.17 178.62 2igk h PRO 148 N 9.27 0.00 -0.21 4.34 0.13 -1.96 -2.38 132.00 141.19 2igk h PRO 148 Ca -0.30 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 2igk h PRO 148 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 2igk h PRO 148 CO 0.99 0.01 0.00 1.28 -0.23 0.00 0.00 178.00 180.05 2igk n LEU 149 N -3.16 2.51 -2.56 1.56 4.77 -1.26 -4.13 117.00 114.74 2igk n LEU 149 Ca -0.02 -1.01 -0.11 0.00 -0.03 0.00 0.00 56.01 54.83 2igk n LEU 149 Cb 0.13 -0.13 0.03 0.00 -2.33 0.00 0.00 43.42 41.12 2igk n LEU 149 CO 0.22 0.51 0.04 0.54 -1.33 0.00 0.00 177.39 177.37 2igk n ARG 150 N 0.89 2.27 -3.92 3.23 1.74 -0.90 -4.95 116.66 115.03 2igk n ARG 150 Ca 0.17 -3.74 -0.22 0.00 -0.77 0.00 0.00 57.85 53.30 2igk n ARG 150 Cb 0.48 -1.77 -0.04 0.00 -1.02 0.00 0.00 32.46 30.11 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 -3.56 5.20 -0.94 0.55 2.47 -1.24 -0.89 114.94 116.53 2igk s ASN 151 Ca 0.35 -0.51 -0.03 0.00 0.42 0.00 0.00 52.86 53.09 2igk s ASN 151 Cb 0.38 -0.99 0.23 0.00 -1.45 0.00 0.00 41.25 39.43 2igk s ASN 151 CO -0.02 -0.29 0.84 -0.76 -3.72 0.00 0.00 177.10 173.15 2igk s LEU 152 N -3.94 5.70 0.45 3.21 1.43 -1.26 -4.80 118.68 119.46 2igk s LEU 152 Ca 0.39 -3.71 0.12 0.00 -1.03 0.00 0.00 54.13 49.90 2igk s LEU 152 Cb -0.06 -1.96 0.99 0.00 0.03 0.00 0.00 46.19 45.20 2igk s LEU 152 CO 0.25 -0.20 2.04 0.77 0.23 0.00 0.00 176.35 179.45 2igk h SER 153 N 6.13 0.19 0.79 2.29 4.64 -1.82 -1.72 113.55 124.05 2igk h SER 153 Ca 0.16 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 2igk h SER 153 Cb 0.82 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.86 2igk h SER 153 CO 0.89 0.22 -0.10 0.61 -0.87 0.00 0.00 176.83 177.57 2igk n GLY 154 N -1.28 -1.37 3.74 -0.77 0.00 0.72 -4.82 105.19 101.40 2igk n GLY 154 Ca -0.01 -0.17 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 2igk n GLY 154 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2igk s GLN 155 N -2.90 4.17 0.10 1.61 -1.52 -0.65 -3.53 119.66 116.96 2igk s GLN 155 Ca 0.17 2.48 -0.09 0.00 -1.95 0.00 0.00 55.36 55.96 2igk s GLN 155 Cb 0.19 -3.06 -0.00 0.00 -0.22 0.00 0.00 33.01 29.91 2igk s GLN 155 CO 0.55 -0.57 0.22 0.00 -0.25 0.00 0.00 175.29 175.23 2igk s ALA 156 N 0.19 -0.23 0.20 6.09 0.00 -1.26 -1.00 121.76 125.74 2igk s ALA 156 Ca 0.64 -0.62 0.09 0.00 0.00 0.00 0.00 51.96 52.06 2igk s ALA 156 Cb -0.46 0.56 -0.04 0.00 0.00 0.00 0.00 23.12 23.18 2igk s ALA 156 CO 0.44 -0.54 -0.17 0.14 0.00 0.00 0.00 175.76 175.63 2igk s VAL 157 N -3.87 1.89 -0.12 0.00 -7.23 -0.12 -4.84 120.40 106.11 2igk s VAL 157 Ca 0.07 -2.11 0.02 0.00 -1.81 0.00 0.00 61.98 58.15 2igk s VAL 157 Cb 0.04 -1.99 -0.00 0.00 0.56 0.00 0.00 36.38 34.99 2igk s VAL 157 CO -0.09 -0.44 -0.19 -0.89 -0.31 0.00 0.00 175.10 173.18 2igk s THR 158 N -2.49 2.45 -0.57 5.32 2.01 -1.25 -1.01 115.64 120.10 2igk s THR 158 Ca 0.21 -0.87 0.03 0.00 0.31 0.00 0.00 61.69 61.36 2igk s THR 158 Cb -0.04 -1.98 0.14 0.00 0.01 0.00 0.00 72.50 70.63 2igk s THR 158 CO 0.08 0.54 0.33 -0.13 -0.69 0.00 0.00 174.62 174.75 2igk s ARG 159 N 0.46 2.17 0.03 4.92 0.52 -1.26 -4.70 118.95 121.09 2igk s ARG 159 Ca -0.14 -2.71 -0.19 0.00 -0.52 0.00 0.00 55.73 52.17 2igk s ARG 159 Cb -0.17 -3.42 0.04 0.00 0.52 0.00 0.00 34.95 31.92 2igk s ARG 159 CO 0.06 -1.14 0.43 0.14 0.02 0.00 0.00 175.30 174.80 2igk s VAL 160 N -0.42 0.05 0.19 3.52 -7.23 -1.26 -4.27 120.40 110.98 2igk s VAL 160 Ca 0.18 -0.42 -0.32 0.00 -1.81 0.00 0.00 61.98 59.62 2igk s VAL 160 Cb -0.22 -0.93 -0.11 0.00 0.56 0.00 0.00 36.38 35.68 2igk s VAL 160 CO -0.03 -0.23 1.64 -0.69 -0.31 0.00 0.00 175.10 175.48 2igk s VAL 161 N -2.31 2.31 0.00 1.32 1.01 -0.65 -1.28 120.40 120.81 2igk s VAL 161 Ca -0.06 0.23 0.00 0.00 0.00 0.00 0.00 61.98 62.14 2igk s VAL 161 Cb -0.01 -3.14 0.00 0.00 0.00 0.00 0.00 36.38 33.22 2igk s VAL 161 CO -0.01 0.02 0.00 0.61 0.00 0.00 0.00 175.10 175.72 2igk n GLY 162 N 3.74 0.74 7.00 4.51 0.00 -1.01 -4.21 105.19 115.97 2igk n GLY 162 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 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 2.46 0.00 -0.02 0.00 -0.40 -2.01 105.19 103.22 2igk n GLY 163 Ca 0.00 -0.31 0.12 0.00 0.00 0.00 0.00 46.02 45.82 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 14.00 0.01 0.00 1.61 2.81 -1.26 -2.64 117.12 131.65 2igk n MET 164 Ca 0.00 0.08 0.11 0.00 -1.81 0.00 0.00 57.70 56.08 2igk n MET 164 Cb 0.00 -1.50 0.62 0.00 -0.71 0.00 0.00 33.22 31.63 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 -1.49 0.00 0.04 7.83 3.41 -0.85 -1.16 113.62 121.40 2igk n SER 165 Ca 0.06 -0.36 0.12 0.00 -0.26 0.00 0.00 58.87 58.43 2igk n SER 165 Cb 0.28 -0.15 0.50 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 -1.15 0.42 0.00 6.66 -2.24 -1.08 -4.25 114.28 112.63 2igk n THR 166 Ca 0.14 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.90 2igk n THR 166 Cb 0.13 -0.67 0.00 0.00 -2.10 0.00 0.00 70.33 67.69 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 -1.79 0.00 -0.73 4.78 1.44 -0.70 -0.83 115.22 117.39 2igk n HIS 167 Ca 0.06 0.00 -0.32 0.00 -2.01 0.00 0.00 57.72 55.44 2igk n HIS 167 Cb 0.33 0.00 0.15 0.00 0.12 0.00 0.00 29.99 30.58 2igk n HIS 167 CO 0.00 0.00 0.00 -2.67 -2.81 0.00 0.00 176.34 170.86 2igk n TRP 168 N -0.10 -1.17 0.83 -1.40 4.27 -0.31 -4.92 117.44 114.63 2igk n TRP 168 Ca 0.00 0.20 0.13 0.00 -3.89 0.00 0.00 57.50 53.95 2igk n TRP 168 Cb 0.00 -1.75 0.53 0.00 -1.36 0.00 0.00 31.31 28.73 2igk n TRP 168 CO 0.00 0.00 0.00 2.41 -2.29 0.00 0.00 177.69 177.81 2igk n THR 169 N -3.96 0.28 -1.00 -1.67 -1.04 -1.26 -4.93 114.28 100.70 2igk n THR 169 Ca 0.06 -0.05 -0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2igk n THR 169 Cb 0.55 -0.59 -0.00 0.00 -1.82 0.00 0.00 70.33 68.47 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 -1.87 3.62 -0.51 0.00 0.00 -1.26 -0.47 121.76 121.28 2igk s ALA 171 Ca 0.00 0.48 0.06 0.00 0.00 0.00 0.00 51.96 52.51 2igk s ALA 171 Cb 0.00 -3.59 0.22 0.00 0.00 0.00 0.00 23.12 19.75 2igk s ALA 171 CO 0.00 -1.06 0.54 0.25 0.00 0.00 0.00 175.76 175.49 2igk n THR 172 N 5.17 0.35 -2.48 0.00 -2.24 0.15 -4.80 114.28 110.43 2igk n THR 172 Ca 0.13 -4.34 -0.32 0.00 -2.27 0.00 0.00 64.05 57.25 2igk n THR 172 Cb 0.45 -1.97 -0.04 0.00 -2.10 0.00 0.00 70.33 66.68 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 -1.32 3.94 0.54 -0.78 0.04 -1.26 -4.76 135.00 131.40 2igk s PRO 173 Ca 0.34 0.90 -0.12 0.00 0.04 0.00 0.00 61.00 62.17 2igk s PRO 173 Cb 0.11 -2.17 -0.06 0.00 0.04 0.00 0.00 34.50 32.42 2igk s PRO 173 CO -0.11 -0.23 0.95 1.03 0.04 0.00 0.00 177.00 178.68 2igk s ARG 174 N -3.99 3.73 0.08 4.56 0.52 -1.26 -4.72 118.95 117.87 2igk s ARG 174 Ca 0.58 0.70 -0.23 0.00 -0.52 0.00 0.00 55.73 56.26 2igk s ARG 174 Cb -0.10 -2.18 -0.06 0.00 0.52 0.00 0.00 34.95 33.12 2igk s ARG 174 CO 0.30 -0.35 0.70 -0.06 0.02 0.00 0.00 175.30 175.92 2igk s PHE 175 N -2.82 3.80 0.99 -0.53 0.40 -1.26 -5.01 117.98 113.54 2igk s PHE 175 Ca 0.55 1.44 -0.15 0.00 -0.60 0.00 0.00 56.93 58.17 2igk s PHE 175 Cb -0.10 -2.71 0.19 0.00 0.51 0.00 0.00 43.02 40.91 2igk s PHE 175 CO 0.42 0.42 1.20 0.16 0.70 0.00 0.00 175.22 178.12 2igk s ASP 176 N -0.63 2.83 0.27 1.36 -4.77 -1.26 -4.85 116.67 109.61 2igk s ASP 176 Ca 0.35 0.64 0.01 0.00 -3.30 0.00 0.00 52.55 50.24 2igk s ASP 176 Cb -0.21 -0.95 0.57 0.00 -1.09 0.00 0.00 42.92 41.23 2igk s ASP 176 CO 0.22 -2.95 1.79 0.03 0.70 0.00 0.00 175.17 174.97 2igk h ARG 177 N -1.78 0.75 0.00 2.11 3.08 -1.98 -2.51 114.38 114.05 2igk h ARG 177 Ca -0.47 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 59.52 2igk h ARG 177 Cb 1.29 -0.17 -0.00 0.00 0.08 0.00 0.00 29.97 31.17 2igk h ARG 177 CO 0.48 0.50 -0.07 1.05 -1.07 0.00 0.00 179.97 180.86 2igk h GLU 178 N 0.78 0.00 -0.01 0.04 4.11 -1.98 -2.39 114.58 115.13 2igk h GLU 178 Ca 0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.92 2igk h GLU 178 Cb 0.63 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.88 2igk h GLU 178 CO -0.33 0.07 -0.73 1.04 0.07 0.00 0.00 179.01 179.13 2igk n GLN 179 N -3.38 0.93 -4.25 1.06 6.02 -0.96 -4.85 117.38 111.96 2igk n GLN 179 Ca -0.01 -0.34 -0.35 0.00 -0.01 0.00 0.00 57.00 56.28 2igk n GLN 179 Cb 0.22 -1.41 -0.09 0.00 1.02 0.00 0.00 30.24 29.98 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 -2.62 3.22 0.51 -1.09 3.52 -0.90 -4.58 118.95 117.01 2igk s ARG 180 Ca 0.11 -0.36 -0.21 0.00 -0.13 0.00 0.00 55.73 55.14 2igk s ARG 180 Cb 0.15 -2.92 -0.06 0.00 -1.56 0.00 0.00 34.95 30.56 2igk s ARG 180 CO 0.69 0.64 1.19 -1.25 -0.81 0.00 0.00 175.30 175.76 2igk s PRO 181 N -0.69 3.47 0.17 5.12 0.04 -1.26 -4.96 135.00 136.89 2igk s PRO 181 Ca 0.11 1.81 -0.30 0.00 0.04 0.00 0.00 61.00 62.67 2igk s PRO 181 Cb -0.12 -2.23 -0.07 0.00 0.04 0.00 0.00 34.50 32.12 2igk s PRO 181 CO 0.02 -0.80 1.08 -0.51 0.04 0.00 0.00 177.00 176.84 2igk s LEU 182 N -3.41 4.49 -0.10 -3.56 1.43 -1.26 -4.94 118.68 111.34 2igk s LEU 182 Ca 0.69 2.05 0.17 0.00 -1.03 0.00 0.00 54.13 56.00 2igk s LEU 182 Cb -0.30 -3.60 -0.24 0.00 0.03 0.00 0.00 46.19 42.08 2igk s LEU 182 CO 0.35 -0.20 0.22 0.18 0.23 0.00 0.00 176.35 177.12 2igk n LEU 183 N 2.44 0.00 -3.97 1.79 4.77 -1.26 -4.94 117.00 115.83 2igk n LEU 183 Ca 0.03 0.00 -0.26 0.00 -0.03 0.00 0.00 56.01 55.75 2igk n LEU 183 Cb 0.47 0.22 -0.17 0.00 -2.33 0.00 0.00 43.42 41.61 2igk n LEU 183 CO 0.53 0.22 -0.46 -0.69 -1.33 0.00 0.00 177.39 175.67 2igk s VAL 184 N -2.80 1.12 0.44 4.08 1.01 -1.26 -5.05 120.40 117.94 2igk s VAL 184 Ca -0.08 -0.41 -0.12 0.00 0.00 0.00 0.00 61.98 61.37 2igk s VAL 184 Cb 0.08 -1.07 -0.07 0.00 0.00 0.00 0.00 36.38 35.32 2igk s VAL 184 CO 0.72 0.37 0.84 -1.59 0.00 0.00 0.00 175.10 175.44 2igk s LYS 185 N 1.15 3.81 -1.65 2.72 -2.85 -1.26 -4.32 119.74 117.35 2igk s LYS 185 Ca -0.05 0.60 -0.08 0.00 -1.00 0.00 0.00 55.97 55.44 2igk s LYS 185 Cb -0.14 -2.31 0.08 0.00 -2.06 0.00 0.00 37.83 33.40 2igk s LYS 185 CO -0.02 -0.12 0.25 -0.25 0.10 0.00 0.00 175.35 175.31 2igk n ASP 186 N -1.44 -0.19 -2.76 0.03 8.00 -1.26 -4.88 116.55 114.05 2igk n ASP 186 Ca 0.04 -1.24 -0.03 0.00 0.71 0.00 0.00 54.79 54.27 2igk n ASP 186 Cb 0.54 -1.76 0.02 0.00 -0.02 0.00 0.00 41.12 39.90 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 -3.99 -0.93 0.45 -2.24 -1.08 -1.26 -5.03 116.67 102.58 2igk s ASP 187 Ca 0.29 -1.01 0.15 0.00 -0.52 0.00 0.00 52.55 51.45 2igk s ASP 187 Cb -0.17 1.22 1.07 0.00 -1.46 0.00 0.00 42.92 43.58 2igk s ASP 187 CO 1.00 -0.04 2.00 0.00 0.52 0.00 0.00 175.17 178.64 2igk h ALA 188 N 4.89 2.04 -0.07 3.66 0.00 -1.90 -1.18 119.26 126.70 2igk h ALA 188 Ca 0.03 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.75 2igk h ALA 188 Cb 1.15 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.88 2igk h ALA 188 CO -0.03 -0.15 -0.65 -0.44 0.00 0.00 0.00 179.25 177.97 2igk h ASP 189 N 0.35 0.70 -0.64 0.00 3.32 -1.97 -0.59 116.42 117.59 2igk h ASP 189 Ca 0.24 -0.68 -0.01 0.00 0.02 0.00 0.00 57.03 56.61 2igk h ASP 189 Cb 0.50 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.81 2igk h ASP 189 CO -0.06 1.28 0.38 0.00 -1.72 0.00 0.00 179.24 179.11 2igk h ALA 190 N 0.44 0.81 0.02 3.45 0.00 -1.86 -0.48 119.26 121.65 2igk h ALA 190 Ca -0.06 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 2igk h ALA 190 Cb 1.31 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.84 2igk h ALA 190 CO 0.13 0.30 -0.01 0.22 0.00 0.00 0.00 179.25 179.89 2igk h ASP 191 N 0.87 -0.02 -0.76 0.00 3.58 -1.22 -0.03 116.42 118.84 2igk h ASP 191 Ca 0.23 -0.06 0.12 0.00 0.42 0.00 0.00 57.03 57.74 2igk h ASP 191 Cb -0.01 0.01 -0.08 0.00 1.72 0.00 0.00 39.33 40.96 2igk h ASP 191 CO -0.04 0.04 0.36 0.44 -2.88 0.00 0.00 179.24 177.17 2igk h ASP 192 N -0.08 0.44 -0.50 2.28 3.32 -0.97 -0.95 116.42 119.96 2igk h ASP 192 Ca -0.00 0.08 -0.11 0.00 0.02 0.00 0.00 57.03 57.01 2igk h ASP 192 Cb 0.07 0.01 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 2igk h ASP 192 CO 0.00 0.22 -0.12 0.00 -1.72 0.00 0.00 179.24 177.62 2igk h ALA 193 N 1.49 0.80 -0.20 3.45 0.00 -0.76 -0.05 119.26 123.98 2igk h ALA 193 Ca 0.39 -0.35 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 2igk h ALA 193 Cb 0.50 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 2igk h ALA 193 CO -0.32 0.66 -0.16 1.49 0.00 0.00 0.00 179.25 180.92 2igk h GLU 194 N 0.87 0.47 -0.98 0.00 4.57 -0.75 -1.67 114.58 117.10 2igk h GLU 194 Ca 0.13 -0.23 0.03 0.00 -1.18 0.00 0.00 59.36 58.11 2igk h GLU 194 Cb 0.68 0.00 -0.06 0.00 -0.16 0.00 0.00 28.75 29.21 2igk h GLU 194 CO 0.05 0.79 0.64 -1.49 -1.18 0.00 0.00 179.01 177.83 2igk h TRP 195 N 0.15 1.21 -0.32 0.92 4.06 -1.06 -1.49 115.95 119.42 2igk h TRP 195 Ca 0.04 0.03 -0.03 0.00 2.06 0.00 0.00 58.89 60.99 2igk h TRP 195 Cb 0.69 -0.40 -0.01 0.00 -1.00 0.00 0.00 29.16 28.43 2igk h TRP 195 CO 0.07 0.71 0.10 0.22 -3.56 0.00 0.00 178.44 175.98 2igk h ASP 196 N 1.26 0.47 -0.25 -3.49 3.58 -0.86 0.35 116.42 117.48 2igk h ASP 196 Ca 0.38 -0.21 0.03 0.00 0.42 0.00 0.00 57.03 57.65 2igk h ASP 196 Cb -0.04 -0.12 -0.03 0.00 1.72 0.00 0.00 39.33 40.86 2igk h ASP 196 CO -0.11 0.56 0.08 -0.09 -2.88 0.00 0.00 179.24 176.80 2igk h ARG 197 N 0.37 0.19 -0.13 0.28 2.43 -1.04 -0.46 114.38 116.02 2igk h ARG 197 Ca 0.10 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.25 2igk h ARG 197 Cb 0.26 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.76 2igk h ARG 197 CO -0.00 0.13 0.03 -0.07 -1.51 0.00 0.00 179.97 178.54 2igk h LEU 198 N 0.20 0.20 -0.63 3.80 3.38 -1.05 -2.62 115.31 118.59 2igk h LEU 198 Ca 0.11 -0.24 -0.03 0.00 0.09 0.00 0.00 57.88 57.81 2igk h LEU 198 Cb 0.08 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 2igk h LEU 198 CO -0.11 0.39 0.29 1.88 0.09 0.00 0.00 178.44 180.97 2igk h TYR 199 N 0.01 0.93 -0.67 1.13 0.05 -0.87 0.23 116.97 117.77 2igk h TYR 199 Ca 0.04 -0.05 0.09 0.00 0.05 0.00 0.00 58.73 58.85 2igk h TYR 199 Cb 0.27 -0.28 -0.07 0.00 1.01 0.00 0.00 36.73 37.66 2igk h TYR 199 CO 0.01 0.71 0.33 1.15 -1.05 0.00 0.00 178.16 179.31 2igk h THR 200 N 0.88 0.86 -0.41 -2.88 2.02 -1.06 1.00 112.91 113.31 2igk h THR 200 Ca 0.22 -0.20 -0.14 0.00 0.77 0.00 0.00 66.41 67.06 2igk h THR 200 Cb 0.14 0.24 -0.01 0.00 -1.74 0.00 0.00 68.15 66.78 2igk h THR 200 CO -0.02 0.10 -0.28 0.50 0.37 0.00 0.00 175.52 176.19 2igk h LYS 201 N 0.57 0.91 -0.83 6.66 3.64 -1.08 -2.29 116.57 124.15 2igk h LYS 201 Ca 0.33 -0.43 -0.00 0.00 -1.27 0.00 0.00 60.65 59.27 2igk h LYS 201 Cb 0.33 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.10 2igk h LYS 201 CO -0.26 1.09 0.51 0.00 -2.27 0.00 0.00 179.45 178.52 2igk h ALA 202 N 0.80 1.06 -0.09 5.00 0.00 -0.49 -1.25 119.26 124.30 2igk h ALA 202 Ca 0.08 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 2igk h ALA 202 Cb 0.86 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2igk h ALA 202 CO 0.08 0.52 -0.29 0.93 0.00 0.00 0.00 179.25 180.48 2igk h GLU 203 N 1.14 0.17 -0.24 0.00 5.08 -0.72 -1.59 114.58 118.42 2igk h GLU 203 Ca 0.30 -0.06 -0.09 0.00 -1.00 0.00 0.00 59.36 58.51 2igk h GLU 203 Cb -0.05 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.18 2igk h GLU 203 CO -0.06 0.45 -0.21 1.03 -1.00 0.00 0.00 179.01 179.23 2igk h SER 204 N 0.15 0.60 -0.75 1.42 0.87 -0.80 0.18 113.55 115.22 2igk h SER 204 Ca 0.02 -0.46 0.04 0.00 -1.23 0.00 0.00 61.79 60.17 2igk h SER 204 Cb 0.60 -0.17 -0.05 0.00 -0.44 0.00 0.00 62.40 62.34 2igk h SER 204 CO 0.04 0.93 0.46 1.88 -0.53 0.00 0.00 176.83 179.62 2igk h TYR 205 N 0.28 0.86 0.00 2.24 -1.99 -0.70 -2.75 116.97 114.90 2igk h TYR 205 Ca 0.04 0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.80 2igk h TYR 205 Cb 0.75 -0.28 0.00 0.00 2.00 0.00 0.00 36.73 39.20 2igk h TYR 205 CO 0.07 0.46 -0.48 1.19 -0.00 0.00 0.00 178.16 179.40 2igk n PHE 206 N -4.66 0.66 -3.37 4.88 3.72 -0.65 -3.91 117.46 114.12 2igk n PHE 206 Ca 0.09 0.19 -0.19 0.00 -0.05 0.00 0.00 57.45 57.49 2igk n PHE 206 Cb 0.13 -0.73 0.07 0.00 -0.94 0.00 0.00 39.48 38.00 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 -2.16 -6.45 -1.84 -1.08 1.13 0.50 -4.20 117.38 103.28 2igk n GLN 207 Ca 0.04 0.69 -0.41 0.00 -1.94 0.00 0.00 57.00 55.38 2igk n GLN 207 Cb 0.44 -5.31 -0.01 0.00 0.11 0.00 0.00 30.24 25.46 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 -3.27 2.18 0.20 5.09 2.01 -0.37 -2.57 115.64 118.91 2igk s THR 208 Ca 0.40 0.16 -0.13 0.00 0.31 0.00 0.00 61.69 62.44 2igk s THR 208 Cb -0.18 -3.10 0.00 0.00 0.01 0.00 0.00 72.50 69.23 2igk s THR 208 CO 0.61 0.03 0.42 -0.83 -0.69 0.00 0.00 174.62 174.16 2igk s GLY 209 N 0.19 0.33 -0.09 4.40 0.00 -0.24 -4.89 107.32 107.01 2igk s GLY 209 Ca 0.58 -0.68 0.15 0.00 0.00 0.00 0.00 44.72 44.77 2igk s GLY 209 CO 0.53 -0.59 1.15 -1.30 0.00 0.00 0.00 173.10 172.89 2igk n THR 210 N -0.31 1.03 -0.10 0.90 -2.24 -1.26 -0.81 114.28 111.49 2igk n THR 210 Ca -0.06 -1.76 0.00 0.00 -2.27 0.00 0.00 64.05 59.96 2igk n THR 210 Cb 0.62 0.30 0.00 0.00 -2.10 0.00 0.00 70.33 69.16 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 -0.44 0.30 0.22 3.42 5.75 -1.26 -4.70 116.55 119.85 2igk n ASP 211 Ca 0.11 -0.63 0.16 0.00 -0.01 0.00 0.00 54.79 54.41 2igk n ASP 211 Cb 0.84 0.44 0.73 0.00 -1.03 0.00 0.00 41.12 42.10 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 -2.83 115.11 117.96 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 0.05 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.58 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 -2.64 0.00 0.25 2.96 3.01 -1.26 -4.83 117.46 114.95 2igk n PHE 213 Ca -0.00 -0.71 0.15 0.00 1.01 0.00 0.00 57.45 57.90 2igk n PHE 213 Cb 0.16 -0.10 0.85 0.00 -0.01 0.00 0.00 39.48 40.38 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 0.00 -0.33 -1.08 2.10 -1.82 -1.82 116.57 113.62 2igk h LYS 214 Ca 0.00 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.64 2igk h LYS 214 Cb 0.79 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.11 2igk h LYS 214 CO 0.00 0.00 0.00 0.39 -2.00 0.00 0.00 179.45 177.84 2igk n GLU 215 N -3.92 3.26 -2.45 0.07 1.02 -1.26 -4.88 120.64 112.46 2igk n GLU 215 Ca -0.01 -2.92 -0.42 0.00 -0.02 0.00 0.00 57.16 53.80 2igk n GLU 215 Cb 0.19 -1.93 -0.03 0.00 -0.02 0.00 0.00 31.44 29.65 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 -1.74 7.14 0.09 1.62 0.15 -0.69 -4.95 113.70 115.33 2igk s SER 216 Ca 0.45 2.05 -0.18 0.00 0.70 0.00 0.00 55.95 58.97 2igk s SER 216 Cb 0.36 -2.59 -0.07 0.00 -1.71 0.00 0.00 66.02 62.01 2igk s SER 216 CO 0.10 -0.38 1.54 0.40 1.20 0.00 0.00 173.24 176.10 2igk h ILE 217 N 4.21 1.25 -0.60 6.45 2.04 -1.90 -2.06 117.51 126.89 2igk h ILE 217 Ca -0.43 -0.88 -0.02 0.00 1.00 0.00 0.00 64.86 64.53 2igk h ILE 217 Cb 1.21 1.29 -0.03 0.00 -0.74 0.00 0.00 36.82 38.56 2igk h ILE 217 CO 0.78 0.28 0.29 0.03 0.00 0.00 0.00 178.15 179.52 2igk h ARG 218 N 0.26 0.87 0.04 2.37 3.08 -1.93 0.18 114.38 119.25 2igk h ARG 218 Ca 0.08 -0.13 0.02 0.00 0.07 0.00 0.00 59.98 60.01 2igk h ARG 218 Cb 0.39 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.27 2igk h ARG 218 CO 0.01 0.70 -0.13 1.25 -1.07 0.00 0.00 179.97 180.74 2igk h HIS 219 N 0.83 -0.33 -0.20 3.04 2.76 -1.76 -2.13 115.15 117.35 2igk h HIS 219 Ca 0.21 0.01 -0.11 0.00 -2.20 0.00 0.00 60.37 58.28 2igk h HIS 219 Cb 0.12 0.14 -0.01 0.00 1.55 0.00 0.00 27.41 29.21 2igk h HIS 219 CO 0.00 -0.19 -0.35 -0.91 -1.30 0.00 0.00 177.93 175.18 2igk h ASN 220 N -0.24 0.45 -0.33 3.26 2.35 -1.04 0.14 115.58 120.17 2igk h ASN 220 Ca 0.03 -0.18 0.05 0.00 -0.55 0.00 0.00 56.30 55.66 2igk h ASN 220 Cb 0.27 -0.12 -0.05 0.00 0.05 0.00 0.00 38.32 38.47 2igk h ASN 220 CO -0.10 0.76 0.05 0.25 -1.65 0.00 0.00 177.43 176.74 2igk h LEU 221 N 0.37 -0.03 -0.12 1.61 5.85 -0.44 0.55 115.31 123.10 2igk h LEU 221 Ca 0.04 0.06 -0.06 0.00 0.84 0.00 0.00 57.88 58.77 2igk h LEU 221 Cb 0.78 0.09 -0.00 0.00 0.37 0.00 0.00 40.66 41.90 2igk h LEU 221 CO 0.06 0.02 -0.15 0.58 -0.34 0.00 0.00 178.44 178.62 2igk h VAL 222 N 0.16 1.36 -0.35 1.05 2.07 -1.20 -2.80 116.25 116.54 2igk h VAL 222 Ca 0.16 -1.34 0.04 0.00 0.82 0.00 0.00 66.70 66.37 2igk h VAL 222 Cb 0.19 1.97 -0.04 0.00 -1.52 0.00 0.00 31.29 31.90 2igk h VAL 222 CO -0.23 0.39 0.13 0.25 0.02 0.00 0.00 177.57 178.13 2igk h LEU 223 N -0.10 0.16 -0.59 2.57 5.85 -0.80 -1.60 115.31 120.81 2igk h LEU 223 Ca 0.02 0.03 -0.15 0.00 0.84 0.00 0.00 57.88 58.62 2igk h LEU 223 Cb 0.69 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.72 2igk h LEU 223 CO 0.03 0.13 -0.45 0.78 -0.34 0.00 0.00 178.44 178.59 2igk h ASN 224 N 0.29 0.65 -0.14 1.25 2.35 -0.96 0.60 115.58 119.61 2igk h ASN 224 Ca 0.16 -0.31 -0.03 0.00 -0.55 0.00 0.00 56.30 55.57 2igk h ASN 224 Cb 0.12 -0.18 -0.00 0.00 0.05 0.00 0.00 38.32 38.30 2igk h ASN 224 CO -0.15 1.01 -0.02 0.50 -1.65 0.00 0.00 177.43 177.12 2igk h LYS 225 N 0.49 0.27 -0.63 0.81 1.63 -1.23 -1.44 116.57 116.46 2igk h LYS 225 Ca 0.03 -0.09 -0.09 0.00 -0.85 0.00 0.00 60.65 59.65 2igk h LYS 225 Cb 0.98 -0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 32.57 2igk h LYS 225 CO 0.09 0.53 0.04 -0.07 -3.45 0.00 0.00 179.45 176.59 2igk h LEU 226 N -0.02 1.06 -0.45 5.20 3.38 -1.22 -0.63 115.31 122.64 2igk h LEU 226 Ca 0.04 -0.29 0.09 0.00 0.09 0.00 0.00 57.88 57.81 2igk h LEU 226 Cb 0.42 -0.28 -0.08 0.00 0.09 0.00 0.00 40.66 40.80 2igk h LEU 226 CO 0.01 1.09 -0.10 0.74 0.09 0.00 0.00 178.44 180.26 2igk h THR 227 N 1.00 0.56 0.13 0.22 2.02 -0.79 -1.10 112.91 114.95 2igk h THR 227 Ca 0.19 -0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.36 2igk h THR 227 Cb 0.52 0.55 0.00 0.00 -1.74 0.00 0.00 68.15 67.48 2igk h THR 227 CO 0.02 0.00 -0.06 -0.08 0.37 0.00 0.00 175.52 175.77 2igk h GLU 228 N 0.01 -0.17 -0.56 6.66 4.81 -1.01 -2.34 114.58 121.97 2igk h GLU 228 Ca 0.22 0.01 0.08 0.00 -0.13 0.00 0.00 59.36 59.54 2igk h GLU 228 Cb 0.33 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.71 2igk h GLU 228 CO -0.46 0.08 0.38 0.93 -0.73 0.00 0.00 179.01 179.21 2igk h GLU 229 N -0.40 0.42 -0.46 1.92 4.39 -0.92 -2.52 114.58 117.01 2igk h GLU 229 Ca -0.02 -0.03 -0.12 0.00 0.34 0.00 0.00 59.36 59.54 2igk h GLU 229 Cb 0.32 -0.09 -0.07 0.00 -0.10 0.00 0.00 28.75 28.81 2igk h GLU 229 CO 0.03 0.28 0.08 0.66 -1.16 0.00 0.00 179.01 178.90 2igk n TYR 230 N -4.47 1.53 -1.68 4.33 4.02 -0.43 -5.02 117.16 115.44 2igk n TYR 230 Ca 0.09 -1.17 -0.46 0.00 -0.01 0.00 0.00 57.90 56.35 2igk n TYR 230 Cb 0.32 -0.49 -0.04 0.00 -0.02 0.00 0.00 39.34 39.11 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 -0.53 2.37 -0.43 -0.72 4.81 -0.89 -0.03 118.16 122.74 2igk n LYS 231 Ca 0.31 0.86 0.00 0.00 -0.87 0.00 0.00 58.31 58.62 2igk n LYS 231 Cb 1.11 -2.71 0.00 0.00 0.02 0.00 0.00 35.03 33.45 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 4.09 1.42 0.49 3.14 0.00 -1.26 -4.81 105.19 108.26 2igk n GLY 232 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 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 -2.00 0.00 -3.94 1.61 6.02 0.96 -5.08 117.38 114.95 2igk n GLN 233 Ca 0.00 0.00 -0.10 0.00 -0.01 0.00 0.00 57.00 56.89 2igk n GLN 233 Cb 0.00 -0.75 -0.11 0.00 1.02 0.00 0.00 30.24 30.40 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 -1.99 0.36 -0.10 -1.09 0.52 -0.55 -5.11 118.95 110.99 2igk s ARG 234 Ca 0.00 -0.50 -0.04 0.00 -0.52 0.00 0.00 55.73 54.66 2igk s ARG 234 Cb 0.00 0.14 -0.04 0.00 0.52 0.00 0.00 34.95 35.57 2igk s ARG 234 CO 0.00 -0.07 0.07 -0.51 0.02 0.00 0.00 175.30 174.81 2igk s ASP 235 N -1.36 5.76 0.12 0.23 1.01 -1.26 -4.64 116.67 116.53 2igk s ASP 235 Ca -0.15 0.29 0.10 0.00 0.71 0.00 0.00 52.55 53.50 2igk s ASP 235 Cb -0.09 -1.74 -0.04 0.00 1.01 0.00 0.00 42.92 42.06 2igk s ASP 235 CO -0.00 0.39 -0.21 -0.36 0.21 0.00 0.00 175.17 175.20 2igk s PHE 236 N -0.96 2.46 0.26 4.23 0.40 -1.26 -4.31 117.98 118.80 2igk s PHE 236 Ca 0.14 -0.30 -0.07 0.00 -0.60 0.00 0.00 56.93 56.10 2igk s PHE 236 Cb -0.12 -1.32 0.03 0.00 0.51 0.00 0.00 43.02 42.12 2igk s PHE 236 CO 0.03 0.37 0.47 0.00 0.70 0.00 0.00 175.22 176.80 2igk n GLN 237 N 0.85 0.68 -2.71 0.44 10.64 -0.63 -5.00 117.38 121.66 2igk n GLN 237 Ca -0.16 -1.69 -0.38 0.00 -1.83 0.00 0.00 57.00 52.94 2igk n GLN 237 Cb 0.53 1.91 -0.06 0.00 -0.86 0.00 0.00 30.24 31.76 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 -2.24 4.55 0.25 2.61 0.74 -1.26 -1.41 119.66 122.90 2igk s GLN 238 Ca 0.14 1.43 -0.31 0.00 0.05 0.00 0.00 55.36 56.67 2igk s GLN 238 Cb -0.02 -2.85 -0.13 0.00 1.10 0.00 0.00 33.01 31.11 2igk s GLN 238 CO 0.11 0.23 1.51 -0.89 -0.55 0.00 0.00 175.29 175.69 2igk n ILE 239 N 0.61 0.86 -2.14 -2.34 5.41 -0.03 -4.71 119.36 117.03 2igk n ILE 239 Ca 0.02 -0.22 -0.42 0.00 1.00 0.00 0.00 62.75 63.13 2igk n ILE 239 Cb 0.49 -1.70 -0.03 0.00 -0.71 0.00 0.00 39.64 37.70 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 -0.28 4.23 -0.04 0.38 0.02 -1.26 -4.76 135.00 133.29 2igk s PRO 240 Ca 0.68 2.05 0.06 0.00 0.02 0.00 0.00 61.00 63.81 2igk s PRO 240 Cb -0.58 -3.72 -0.01 0.00 0.02 0.00 0.00 34.50 30.20 2igk s PRO 240 CO 0.47 -0.70 -0.22 -0.51 -0.33 0.00 0.00 177.00 175.72 2igk s LEU 241 N 3.05 2.02 -0.95 -5.54 1.43 0.01 -0.67 118.68 118.03 2igk s LEU 241 Ca 0.67 -0.43 -0.24 0.00 -1.03 0.00 0.00 54.13 53.11 2igk s LEU 241 Cb -0.32 -1.19 0.05 0.00 0.03 0.00 0.00 46.19 44.76 2igk s LEU 241 CO 0.27 0.23 1.39 0.00 0.23 0.00 0.00 176.35 178.48 2igk s ALA 242 N -0.25 2.75 -0.17 4.21 0.00 0.39 -1.08 121.76 127.61 2igk s ALA 242 Ca 0.01 -2.09 -0.30 0.00 0.00 0.00 0.00 51.96 49.58 2igk s ALA 242 Cb -0.11 -4.44 0.13 0.00 0.00 0.00 0.00 23.12 18.70 2igk s ALA 242 CO 0.02 -3.51 1.05 0.00 0.00 0.00 0.00 175.76 173.31 2igk s ALA 243 N 5.03 -1.96 -0.14 0.00 0.00 -1.06 -1.08 121.76 122.56 2igk s ALA 243 Ca 0.43 1.58 0.00 0.00 0.00 0.00 0.00 51.96 53.98 2igk s ALA 243 Cb -0.02 -0.70 0.02 0.00 0.00 0.00 0.00 23.12 22.42 2igk s ALA 243 CO -0.04 -0.34 -0.14 0.99 0.00 0.00 0.00 175.76 176.23 2igk s THR 244 N -1.33 1.50 0.10 0.00 2.01 -0.10 -4.62 115.64 113.21 2igk s THR 244 Ca 0.01 -0.60 -0.31 0.00 0.31 0.00 0.00 61.69 61.10 2igk s THR 244 Cb -0.01 -1.41 -0.08 0.00 0.01 0.00 0.00 72.50 71.01 2igk s THR 244 CO -0.01 0.45 1.50 -0.60 -0.69 0.00 0.00 174.62 175.26 2igk s ARG 245 N 1.43 4.26 -0.10 4.92 3.52 -1.26 -0.23 118.95 131.49 2igk s ARG 245 Ca 0.03 2.19 0.19 0.00 -0.13 0.00 0.00 55.73 58.01 2igk s ARG 245 Cb -0.13 -3.34 -0.26 0.00 -1.56 0.00 0.00 34.95 29.66 2igk s ARG 245 CO -0.09 -0.57 0.33 0.54 -0.81 0.00 0.00 175.30 174.70 2igk n ARG 246 N 4.51 0.67 -3.74 5.12 5.12 0.14 -4.88 116.66 123.59 2igk n ARG 246 Ca 0.13 -0.02 -0.06 0.00 -1.93 0.00 0.00 57.85 55.98 2igk n ARG 246 Cb 0.41 -1.57 -0.02 0.00 -1.16 0.00 0.00 32.46 30.12 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 -5.27 -0.25 0.60 0.55 1.04 -0.96 -4.97 113.70 104.45 2igk s SER 247 Ca -0.08 -0.40 0.28 0.00 0.48 0.00 0.00 55.95 56.22 2igk s SER 247 Cb 0.09 0.56 1.52 0.00 0.10 0.00 0.00 66.02 68.29 2igk s SER 247 CO 0.85 -1.02 1.84 -0.65 0.98 0.00 0.00 173.24 175.24 2igk h PRO 248 N 2.00 0.00 0.00 4.02 0.11 -2.00 -2.65 132.00 133.48 2igk h PRO 248 Ca -0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.88 2igk h PRO 248 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2igk h PRO 248 CO 0.26 0.00 -0.10 0.25 -0.21 0.00 0.00 178.00 178.20 2igk n THR 249 N -2.75 1.19 -3.69 -1.15 -2.24 -1.26 -4.86 114.28 99.51 2igk n THR 249 Ca -0.02 -1.39 -0.13 0.00 -2.27 0.00 0.00 64.05 60.24 2igk n THR 249 Cb 0.34 0.15 -0.13 0.00 -2.10 0.00 0.00 70.33 68.59 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 -1.71 -0.37 -0.16 4.78 2.19 -1.00 -4.90 117.98 116.82 2igk s PHE 250 Ca 0.17 0.88 0.02 0.00 0.33 0.00 0.00 56.93 58.32 2igk s PHE 250 Cb 0.15 -0.01 0.01 0.00 -1.31 0.00 0.00 43.02 41.86 2igk s PHE 250 CO 0.02 -0.30 -0.21 0.08 1.83 0.00 0.00 175.22 176.64 2igk s VAL 251 N 1.89 2.11 -0.58 3.12 1.01 -1.26 -0.68 120.40 126.01 2igk s VAL 251 Ca -0.03 -0.95 -0.25 0.00 0.00 0.00 0.00 61.98 60.75 2igk s VAL 251 Cb -0.11 -1.86 0.04 0.00 0.00 0.00 0.00 36.38 34.44 2igk s VAL 251 CO -0.08 0.54 1.02 -0.70 0.00 0.00 0.00 175.10 175.88 2igk s GLU 252 N 1.00 3.35 0.24 2.72 2.12 0.68 -4.89 118.70 123.92 2igk s GLU 252 Ca -0.02 -0.18 -0.30 0.00 0.36 0.00 0.00 54.97 54.83 2igk s GLU 252 Cb -0.15 -4.06 -0.09 0.00 0.26 0.00 0.00 34.13 30.09 2igk s GLU 252 CO -0.06 -1.59 1.04 -1.58 -0.54 0.00 0.00 175.26 172.53 2igk s TRP 253 N 4.29 3.73 0.87 5.30 0.52 -1.26 -0.92 118.94 131.47 2igk s TRP 253 Ca 0.33 1.77 -0.12 0.00 0.02 0.00 0.00 56.10 58.10 2igk s TRP 253 Cb -0.11 -3.17 0.11 0.00 -1.15 0.00 0.00 33.47 29.15 2igk s TRP 253 CO 0.20 -0.18 1.13 -1.12 0.02 0.00 0.00 176.95 177.00 2igk s SER 254 N -0.84 3.92 0.17 2.95 0.01 -0.24 -4.53 113.70 115.14 2igk s SER 254 Ca 0.44 1.04 -0.10 0.00 1.31 0.00 0.00 55.95 58.64 2igk s SER 254 Cb -0.29 -1.65 0.04 0.00 0.21 0.00 0.00 66.02 64.32 2igk s SER 254 CO 0.37 -2.30 0.49 -1.54 0.41 0.00 0.00 173.24 170.66 2igk n SER 255 N -3.61 -1.13 -0.32 2.44 3.41 -1.26 -4.67 113.62 108.47 2igk n SER 255 Ca 0.07 -1.72 0.13 0.00 -0.26 0.00 0.00 58.87 57.09 2igk n SER 255 Cb 0.59 1.87 0.32 0.00 -0.26 0.00 0.00 64.21 66.73 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 1.52 -0.95 7.33 0.00 -1.78 -2.11 119.26 125.26 2igk h ALA 256 Ca -0.17 0.14 0.08 0.00 0.00 0.00 0.00 54.91 54.96 2igk h ALA 256 Cb 0.67 0.08 -0.07 0.00 0.00 0.00 0.00 17.79 18.47 2igk h ALA 256 CO 0.22 -0.27 0.60 -0.97 0.00 0.00 0.00 179.25 178.83 2igk h ASN 257 N 0.50 0.93 -0.96 0.00 -0.73 -1.61 0.85 115.58 114.55 2igk h ASN 257 Ca 0.57 0.03 0.06 0.00 1.87 0.00 0.00 56.30 58.83 2igk h ASN 257 Cb 1.04 -0.17 -0.07 0.00 0.27 0.00 0.00 38.32 39.40 2igk h ASN 257 CO -0.48 0.56 0.61 0.74 -0.37 0.00 0.00 177.43 178.49 2igk h THR 258 N 1.04 1.07 -0.01 -3.57 2.02 -1.70 -3.09 112.91 108.67 2igk h THR 258 Ca 0.43 -0.38 -0.01 0.00 0.77 0.00 0.00 66.41 67.22 2igk h THR 258 Cb 0.27 -0.14 0.00 0.00 -1.74 0.00 0.00 68.15 66.54 2igk h THR 258 CO -0.21 0.20 -0.04 0.58 0.37 0.00 0.00 175.52 176.43 2igk h VAL 259 N 1.12 1.49 -2.74 3.16 2.07 -1.04 -3.46 116.25 116.85 2igk h VAL 259 Ca 0.42 -1.50 -0.14 0.00 0.82 0.00 0.00 66.70 66.30 2igk h VAL 259 Cb 0.17 2.48 -0.28 0.00 -1.52 0.00 0.00 31.29 32.14 2igk h VAL 259 CO -0.17 0.40 -0.36 0.12 0.02 0.00 0.00 177.57 177.58 2igk s PHE 260 N -3.70 -0.54 -1.05 1.57 5.36 0.12 -4.80 117.98 114.94 2igk s PHE 260 Ca -0.16 1.16 0.20 0.00 -0.96 0.00 0.00 56.93 57.16 2igk s PHE 260 Cb 0.01 0.20 0.86 0.00 -0.34 0.00 0.00 43.02 43.75 2igk s PHE 260 CO 0.69 -0.32 1.63 -0.40 -1.46 0.00 0.00 175.22 175.36 2igk n ASP 261 N 4.34 0.00 0.00 6.13 5.68 -1.20 -3.85 116.55 127.65 2igk n ASP 261 Ca -0.23 0.44 0.00 0.00 -0.50 0.00 0.00 54.79 54.50 2igk n ASP 261 Cb 0.54 -0.47 0.00 0.00 -1.14 0.00 0.00 41.12 40.05 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 -1.47 0.67 -4.72 -2.12 4.77 -1.26 -4.33 117.00 108.53 2igk n LEU 262 Ca 0.05 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.62 2igk n LEU 262 Cb 0.22 -1.75 -0.03 0.00 -2.33 0.00 0.00 43.42 39.53 2igk n LEU 262 CO 0.18 -0.63 0.92 -1.10 -1.33 0.00 0.00 177.39 175.42 2igk s GLN 263 N -1.27 4.43 0.14 3.23 -1.52 -1.26 -4.74 119.66 118.68 2igk s GLN 263 Ca 0.00 1.87 -0.34 0.00 -1.95 0.00 0.00 55.36 54.95 2igk s GLN 263 Cb 0.00 -3.28 -0.16 0.00 -0.22 0.00 0.00 33.01 29.34 2igk s GLN 263 CO 0.00 -0.22 1.13 0.09 -0.25 0.00 0.00 175.29 176.03 2igk n ASN 264 N 3.32 1.03 -4.20 5.90 3.02 -1.26 -4.89 115.26 118.18 2igk n ASN 264 Ca 0.07 1.14 -0.21 0.00 -0.03 0.00 0.00 54.58 55.56 2igk n ASN 264 Cb 0.45 -1.16 -0.13 0.00 -0.61 0.00 0.00 39.78 38.33 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 -0.28 0.97 0.56 3.52 0.52 0.50 -4.37 118.95 120.37 2igk s ARG 265 Ca 0.76 -0.97 -0.19 0.00 -0.52 0.00 0.00 55.73 54.81 2igk s ARG 265 Cb -0.92 -1.06 -0.05 0.00 0.52 0.00 0.00 34.95 33.44 2igk s ARG 265 CO 0.52 0.25 1.14 -1.25 0.02 0.00 0.00 175.30 175.98 2igk s PRO 266 N -1.62 3.26 0.31 3.54 0.04 -0.46 -1.70 135.00 138.38 2igk s PRO 266 Ca 0.02 1.61 0.03 0.00 0.04 0.00 0.00 61.00 62.70 2igk s PRO 266 Cb -0.09 -1.99 -0.02 0.00 0.04 0.00 0.00 34.50 32.43 2igk s PRO 266 CO 0.03 -0.92 0.31 0.54 0.04 0.00 0.00 177.00 176.99 2igk s ASN 267 N -1.83 1.14 0.25 6.66 2.20 -1.12 -4.96 114.94 117.28 2igk s ASN 267 Ca 0.73 -1.59 -0.04 0.00 -0.94 0.00 0.00 52.86 51.02 2igk s ASN 267 Cb -0.24 0.55 0.46 0.00 -2.00 0.00 0.00 41.25 40.02 2igk s ASN 267 CO 0.29 -1.08 1.73 0.74 -2.94 0.00 0.00 177.10 175.84 2igk h THR 268 N 2.22 0.67 0.00 0.54 2.02 -1.97 -0.90 112.91 115.49 2igk h THR 268 Ca -0.28 -0.16 -0.12 0.00 0.77 0.00 0.00 66.41 66.62 2igk h THR 268 Cb 1.24 0.16 -0.02 0.00 -1.74 0.00 0.00 68.15 67.79 2igk h THR 268 CO 0.40 0.08 -0.57 0.44 0.37 0.00 0.00 175.52 176.25 2igk h ASP 269 N 0.46 0.00 -2.07 4.18 3.32 -2.00 -3.38 116.42 116.94 2igk h ASP 269 Ca 0.42 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.90 2igk h ASP 269 Cb 0.63 0.00 -0.39 0.00 0.22 0.00 0.00 39.33 39.79 2igk h ASP 269 CO -0.40 0.57 -1.07 0.00 -1.72 0.00 0.00 179.24 176.62 2igk n ALA 270 N -2.29 2.54 0.30 3.45 0.00 -0.48 -4.99 120.51 119.04 2igk n ALA 270 Ca 0.01 -3.39 0.17 0.00 0.00 0.00 0.00 53.44 50.22 2igk n ALA 270 Cb 0.69 -0.80 0.66 0.00 0.00 0.00 0.00 19.45 20.00 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 4.27 0.00 -0.57 0.00 0.13 -1.40 -2.58 132.00 131.84 2igk h PRO 271 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 2igk h PRO 271 Cb 0.88 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.01 2igk h PRO 271 CO 0.46 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.62 2igk n GLU 272 N -2.94 2.62 -4.13 0.86 1.02 -1.26 -4.72 120.64 112.08 2igk n GLU 272 Ca 0.01 -2.49 -0.22 0.00 -0.02 0.00 0.00 57.16 54.44 2igk n GLU 272 Cb 0.29 -1.55 -0.05 0.00 -0.02 0.00 0.00 31.44 30.11 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 -1.25 2.85 -0.12 3.49 2.02 -0.99 -4.95 118.70 119.75 2igk s GLU 273 Ca 0.44 -1.09 -0.02 0.00 0.02 0.00 0.00 54.97 54.33 2igk s GLU 273 Cb 0.24 -2.52 0.04 0.00 0.10 0.00 0.00 34.13 31.99 2igk s GLU 273 CO 0.33 0.40 0.01 1.03 0.02 0.00 0.00 175.26 177.05 2igk s ARG 274 N -3.79 0.64 -0.25 1.61 0.52 -1.26 -1.35 118.95 115.07 2igk s ARG 274 Ca 0.33 -0.12 -0.14 0.00 -0.52 0.00 0.00 55.73 55.28 2igk s ARG 274 Cb -0.08 -1.47 0.08 0.00 0.52 0.00 0.00 34.95 34.00 2igk s ARG 274 CO 0.24 -0.45 0.61 0.12 0.02 0.00 0.00 175.30 175.85 2igk s PHE 275 N 1.92 -0.97 -0.09 -0.53 5.36 -0.69 -2.52 117.98 120.47 2igk s PHE 275 Ca 0.03 1.93 0.03 0.00 -0.96 0.00 0.00 56.93 57.95 2igk s PHE 275 Cb -0.14 0.55 0.01 0.00 -0.34 0.00 0.00 43.02 43.10 2igk s PHE 275 CO -0.07 -0.49 -0.17 -0.80 -1.46 0.00 0.00 175.22 172.24 2igk s ASN 276 N 1.69 2.36 -0.17 6.13 -0.87 -0.80 -0.37 114.94 122.90 2igk s ASN 276 Ca -0.09 -0.41 -0.12 0.00 -1.57 0.00 0.00 52.86 50.66 2igk s ASN 276 Cb -0.06 -1.08 -0.05 0.00 -0.02 0.00 0.00 41.25 40.04 2igk s ASN 276 CO -0.18 0.07 0.23 -0.22 -2.57 0.00 0.00 177.10 174.43 2igk s LEU 277 N 0.65 4.24 -0.44 0.60 2.96 -1.26 -0.97 118.68 124.45 2igk s LEU 277 Ca -0.14 0.42 0.04 0.00 -0.22 0.00 0.00 54.13 54.23 2igk s LEU 277 Cb -0.16 -2.27 0.12 0.00 0.50 0.00 0.00 46.19 44.38 2igk s LEU 277 CO 0.04 0.14 0.18 -0.36 -1.32 0.00 0.00 176.35 175.03 2igk s PHE 278 N 0.36 3.19 0.82 5.38 0.08 0.59 -4.97 117.98 123.43 2igk s PHE 278 Ca 0.14 -2.99 -0.12 0.00 0.12 0.00 0.00 56.93 54.08 2igk s PHE 278 Cb -0.12 -2.71 0.08 0.00 -0.57 0.00 0.00 43.02 39.69 2igk s PHE 278 CO 0.02 -0.82 1.13 -2.14 -0.10 0.00 0.00 175.22 173.32 2igk s PRO 279 N 0.24 1.92 -1.52 0.24 0.02 -1.26 -1.85 135.00 132.78 2igk s PRO 279 Ca 0.15 0.34 -0.12 0.00 0.02 0.00 0.00 61.00 61.38 2igk s PRO 279 Cb -0.23 -1.93 0.08 0.00 0.02 0.00 0.00 34.50 32.44 2igk s PRO 279 CO -0.04 -1.67 0.92 0.00 -0.33 0.00 0.00 177.00 175.88 2igk n ALA 280 N -3.41 -1.39 -3.96 -1.55 0.00 0.35 -4.84 120.51 105.70 2igk n ALA 280 Ca 0.07 0.12 -0.30 0.00 0.00 0.00 0.00 53.44 53.34 2igk n ALA 280 Cb 0.59 -4.01 -0.16 0.00 0.00 0.00 0.00 19.45 15.87 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 -3.37 1.44 -0.35 0.00 1.01 0.20 -1.01 120.40 118.33 2igk s VAL 281 Ca 0.57 -0.84 -0.28 0.00 0.00 0.00 0.00 61.98 61.43 2igk s VAL 281 Cb -0.29 -1.54 0.02 0.00 0.00 0.00 0.00 36.38 34.56 2igk s VAL 281 CO 0.84 0.18 1.04 0.00 0.00 0.00 0.00 175.10 177.16 2igk s ALA 282 N 1.49 3.44 -0.20 5.51 0.00 0.55 -2.14 121.76 130.40 2igk s ALA 282 Ca -0.00 -0.20 -0.23 0.00 0.00 0.00 0.00 51.96 51.54 2igk s ALA 282 Cb -0.16 -3.66 -0.02 0.00 0.00 0.00 0.00 23.12 19.29 2igk s ALA 282 CO -0.08 -1.59 0.71 0.00 0.00 0.00 0.00 175.76 174.80 2igk n GLU 284 N 5.27 0.49 -3.64 0.00 1.02 -0.09 -4.95 120.64 118.73 2igk n GLU 284 Ca 0.01 0.16 -0.16 0.00 -0.02 0.00 0.00 57.16 57.16 2igk n GLU 284 Cb 0.49 -1.34 -0.07 0.00 -0.02 0.00 0.00 31.44 30.49 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 -2.40 0.86 -0.07 3.49 1.70 -1.18 -4.72 118.95 116.63 2igk s ARG 285 Ca -0.29 0.05 -0.07 0.00 -0.47 0.00 0.00 55.73 54.95 2igk s ARG 285 Cb 0.09 0.39 -0.04 0.00 -0.57 0.00 0.00 34.95 34.83 2igk s ARG 285 CO 0.43 -0.25 0.20 0.14 -1.08 0.00 0.00 175.30 174.74 2igk s VAL 286 N -1.22 5.40 -0.23 4.99 -7.23 -1.26 -0.32 120.40 120.53 2igk s VAL 286 Ca -0.12 0.24 -0.13 0.00 -1.81 0.00 0.00 61.98 60.16 2igk s VAL 286 Cb -0.03 -3.49 -0.04 0.00 0.56 0.00 0.00 36.38 33.38 2igk s VAL 286 CO 0.07 0.53 0.29 -0.69 -0.31 0.00 0.00 175.10 174.99 2igk s VAL 287 N -1.12 5.26 0.25 1.32 1.01 -0.36 -4.73 120.40 122.03 2igk s VAL 287 Ca 0.20 0.45 -0.15 0.00 0.00 0.00 0.00 61.98 62.48 2igk s VAL 287 Cb -0.13 -3.62 -0.08 0.00 0.00 0.00 0.00 36.38 32.55 2igk s VAL 287 CO 0.09 0.27 0.67 -0.13 0.00 0.00 0.00 175.10 176.01 2igk s ARG 288 N 1.34 4.02 0.76 2.72 0.52 -1.26 -0.43 118.95 126.62 2igk s ARG 288 Ca 0.13 0.61 -0.11 0.00 -0.52 0.00 0.00 55.73 55.84 2igk s ARG 288 Cb -0.14 -2.65 0.05 0.00 0.52 0.00 0.00 34.95 32.72 2igk s ARG 288 CO 0.07 0.29 1.09 0.54 0.02 0.00 0.00 175.30 177.32 2igk s ASN 289 N -2.06 4.86 0.44 0.23 4.22 -0.85 -4.87 114.94 116.91 2igk s ASN 289 Ca 0.48 1.27 0.15 0.00 -2.14 0.00 0.00 52.86 52.62 2igk s ASN 289 Cb -0.13 -2.04 1.05 0.00 1.28 0.00 0.00 41.25 41.42 2igk s ASN 289 CO 0.19 -1.73 1.97 0.00 -2.04 0.00 0.00 177.10 175.49 2igk h ALA 290 N -0.92 2.06 0.00 3.54 0.00 -1.98 -1.70 119.26 120.25 2igk h ALA 290 Ca -0.46 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2igk h ALA 290 Cb 1.26 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2igk h ALA 290 CO 0.61 -0.21 0.00 1.28 0.00 0.00 0.00 179.25 180.93 2igk n LEU 291 N -4.47 0.00 -3.68 0.00 4.77 -1.26 -4.93 117.00 107.43 2igk n LEU 291 Ca 0.11 0.46 -0.21 0.00 -0.03 0.00 0.00 56.01 56.33 2igk n LEU 291 Cb 0.41 -0.46 0.04 0.00 -2.33 0.00 0.00 43.42 41.08 2igk n LEU 291 CO 0.34 -0.01 -0.03 0.59 -1.33 0.00 0.00 177.39 176.94 2igk n ASN 292 N -1.46 -1.51 0.00 -1.43 3.02 -0.64 -4.91 115.26 108.34 2igk n ASN 292 Ca 0.08 -0.79 0.00 0.00 -0.03 0.00 0.00 54.58 53.84 2igk n ASN 292 Cb 0.31 -4.18 0.00 0.00 -0.61 0.00 0.00 39.78 35.30 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 -3.05 0.24 -3.64 6.41 3.41 -1.26 -4.53 113.62 111.20 2igk n SER 293 Ca -0.28 -0.58 -0.14 0.00 -0.26 0.00 0.00 58.87 57.61 2igk n SER 293 Cb 0.67 0.35 -0.08 0.00 -0.26 0.00 0.00 64.21 64.89 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 -0.35 0.79 0.09 4.33 2.12 -1.26 -0.97 118.70 123.45 2igk s GLU 294 Ca 0.00 0.76 -0.21 0.00 0.36 0.00 0.00 54.97 55.88 2igk s GLU 294 Cb 0.00 0.38 -0.07 0.00 0.26 0.00 0.00 34.13 34.70 2igk s GLU 294 CO 0.00 -0.13 0.63 0.42 -0.54 0.00 0.00 175.26 175.64 2igk s ILE 295 N 0.05 4.66 -0.05 -3.70 -1.09 -1.26 -2.01 121.20 117.80 2igk s ILE 295 Ca -0.02 1.35 0.13 0.00 -2.23 0.00 0.00 60.65 59.88 2igk s ILE 295 Cb -0.04 -3.97 -0.20 0.00 -1.58 0.00 0.00 42.46 36.68 2igk s ILE 295 CO 0.02 0.53 0.31 -0.62 -1.23 0.00 0.00 174.94 173.95 2igk n GLU 296 N 1.81 0.55 -3.64 2.79 -0.58 0.43 -4.95 120.64 117.03 2igk n GLU 296 Ca -0.09 -0.11 -0.01 0.00 -0.42 0.00 0.00 57.16 56.53 2igk n GLU 296 Cb 0.50 -1.30 -0.01 0.00 -0.57 0.00 0.00 31.44 30.06 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 -3.44 -0.12 -0.17 1.62 1.04 -1.25 -4.77 113.70 106.60 2igk s SER 297 Ca -0.04 -0.18 0.01 0.00 0.48 0.00 0.00 55.95 56.21 2igk s SER 297 Cb 0.09 0.27 0.01 0.00 0.10 0.00 0.00 66.02 66.48 2igk s SER 297 CO 0.55 -0.48 -0.18 -0.22 0.98 0.00 0.00 173.24 173.88 2igk s LEU 298 N -2.82 2.23 -0.09 2.42 2.96 -0.28 -1.22 118.68 121.88 2igk s LEU 298 Ca 0.12 -0.60 -0.22 0.00 -0.22 0.00 0.00 54.13 53.21 2igk s LEU 298 Cb 0.02 -1.51 -0.04 0.00 0.50 0.00 0.00 46.19 45.17 2igk s LEU 298 CO -0.03 0.02 0.66 -1.00 -1.32 0.00 0.00 176.35 174.68 2igk s HIS 299 N 1.18 3.54 0.21 5.38 3.76 0.57 -0.48 115.29 129.45 2igk s HIS 299 Ca 0.02 1.15 0.09 0.00 -0.15 0.00 0.00 55.06 56.17 2igk s HIS 299 Cb -0.14 -2.76 -0.05 0.00 1.11 0.00 0.00 32.58 30.74 2igk s HIS 299 CO -0.09 0.07 -0.17 0.96 -0.85 0.00 0.00 174.74 174.66 2igk s ILE 300 N 0.92 1.96 -0.21 0.60 -4.36 -0.18 -0.91 121.20 119.02 2igk s ILE 300 Ca 0.34 -2.18 -0.01 0.00 -0.26 0.00 0.00 60.65 58.55 2igk s ILE 300 Cb -0.17 -2.06 0.06 0.00 1.25 0.00 0.00 42.46 41.54 2igk s ILE 300 CO 0.16 -0.46 -0.03 -2.28 0.24 0.00 0.00 174.94 172.57 2igk s HIS 301 N -2.58 1.88 -0.22 1.37 2.46 0.10 -2.20 115.29 116.10 2igk s HIS 301 Ca 0.23 -1.38 -0.29 0.00 0.47 0.00 0.00 55.06 54.08 2igk s HIS 301 Cb -0.03 -1.37 -0.01 0.00 -0.13 0.00 0.00 32.58 31.03 2igk s HIS 301 CO 0.09 -0.70 1.37 0.34 -2.47 0.00 0.00 174.74 173.37 2igk s ASP 302 N 1.57 6.72 0.45 9.88 -1.08 -0.01 -0.33 116.67 133.87 2igk s ASP 302 Ca -0.03 1.54 0.24 0.00 -0.52 0.00 0.00 52.55 53.78 2igk s ASP 302 Cb -0.18 -2.54 0.51 0.00 -1.46 0.00 0.00 42.92 39.25 2igk s ASP 302 CO -0.07 -0.98 1.67 -0.07 0.52 0.00 0.00 175.17 176.24 2igk h LEU 303 N 10.54 0.00 0.00 -1.34 3.38 -1.39 0.13 115.31 126.63 2igk h LEU 303 Ca -0.29 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.64 2igk h LEU 303 Cb 1.12 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.86 2igk h LEU 303 CO 1.00 0.03 -0.34 0.40 0.09 0.00 0.00 178.44 179.62 2igk h ILE 304 N 0.00 0.83 0.00 1.22 1.08 -1.92 -3.38 117.51 115.34 2igk h ILE 304 Ca -0.00 -1.73 -0.08 0.00 -0.39 0.00 0.00 64.86 62.66 2igk h ILE 304 Cb 0.93 1.68 -0.01 0.00 -3.07 0.00 0.00 36.82 36.35 2igk h ILE 304 CO 0.00 0.28 -0.73 0.77 -0.69 0.00 0.00 178.15 177.79 2igk h SER 305 N -1.00 0.00 0.00 1.72 4.64 -1.94 -3.47 113.55 113.49 2igk h SER 305 Ca -0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.25 2igk h SER 305 Cb 0.70 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.79 2igk h SER 305 CO -0.04 0.33 0.00 0.61 -0.87 0.00 0.00 176.83 176.86 2igk n GLY 306 N 1.24 0.98 3.79 -0.77 0.00 0.44 -5.04 105.19 105.83 2igk n GLY 306 Ca -0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.65 2igk n GLY 306 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2igk s ASP 307 N -3.03 6.97 -0.03 1.61 1.01 -1.23 -4.79 116.67 117.19 2igk s ASP 307 Ca 0.00 1.88 -0.01 0.00 0.71 0.00 0.00 52.55 55.14 2igk s ASP 307 Cb 0.00 -2.57 -0.04 0.00 1.01 0.00 0.00 42.92 41.32 2igk s ASP 307 CO 0.00 -0.33 0.05 -0.13 0.21 0.00 0.00 175.17 174.96 2igk s ARG 308 N -2.55 3.00 0.05 8.23 0.52 -1.26 -0.83 118.95 126.12 2igk s ARG 308 Ca 0.57 -0.48 0.00 0.00 -0.52 0.00 0.00 55.73 55.30 2igk s ARG 308 Cb -0.17 -2.82 -0.03 0.00 0.52 0.00 0.00 34.95 32.44 2igk s ARG 308 CO 0.22 0.66 -0.04 -0.06 0.02 0.00 0.00 175.30 176.10 2igk s PHE 309 N -1.09 0.56 -0.30 -0.53 0.08 -0.93 -5.01 117.98 110.76 2igk s PHE 309 Ca 0.19 -0.85 -0.08 0.00 0.12 0.00 0.00 56.93 56.31 2igk s PHE 309 Cb -0.12 -0.37 -0.00 0.00 -0.57 0.00 0.00 43.02 41.96 2igk s PHE 309 CO 0.10 -0.25 0.12 -1.21 -0.10 0.00 0.00 175.22 173.88 2igk s GLU 310 N -3.07 3.26 -0.15 0.44 2.02 -1.26 -1.01 118.70 118.92 2igk s GLU 310 Ca 0.01 -0.76 -0.12 0.00 0.02 0.00 0.00 54.97 54.12 2igk s GLU 310 Cb 0.01 -3.47 -0.05 0.00 0.10 0.00 0.00 34.13 30.72 2igk s GLU 310 CO -0.06 -0.41 0.23 0.42 0.02 0.00 0.00 175.26 175.46 2igk s ILE 311 N 1.57 5.35 -0.16 -1.63 -1.09 0.37 -4.89 121.20 120.71 2igk s ILE 311 Ca 0.04 0.41 -0.08 0.00 -2.23 0.00 0.00 60.65 58.79 2igk s ILE 311 Cb -0.17 -3.55 -0.04 0.00 -1.58 0.00 0.00 42.46 37.11 2igk s ILE 311 CO 0.05 0.46 0.12 -0.75 -1.23 0.00 0.00 174.94 173.58 2igk s LYS 312 N 0.06 3.84 0.10 2.79 2.47 0.13 -1.12 119.74 128.02 2igk s LYS 312 Ca 0.14 -0.21 -0.05 0.00 -1.56 0.00 0.00 55.97 54.29 2igk s LYS 312 Cb -0.13 -3.28 -0.02 0.00 -1.46 0.00 0.00 37.83 32.94 2igk s LYS 312 CO 0.03 0.48 0.12 0.00 0.16 0.00 0.00 175.35 176.15 2igk s ALA 313 N -0.18 0.21 0.09 3.13 0.00 -1.26 -1.08 121.76 122.67 2igk s ALA 313 Ca 0.10 -0.98 -0.10 0.00 0.00 0.00 0.00 51.96 50.98 2igk s ALA 313 Cb -0.12 0.57 -0.20 0.00 0.00 0.00 0.00 23.12 23.37 2igk s ALA 313 CO 0.01 -0.49 1.21 -0.44 0.00 0.00 0.00 175.76 176.04 2igk h ASP 314 N 2.84 0.76 -3.63 0.00 3.32 -1.19 -3.46 116.42 115.05 2igk h ASP 314 Ca -0.34 -0.63 -0.61 0.00 0.02 0.00 0.00 57.03 55.47 2igk h ASP 314 Cb 1.19 -0.23 -0.32 0.00 0.22 0.00 0.00 39.33 40.18 2igk h ASP 314 CO 0.58 1.44 -0.85 -0.69 -1.72 0.00 0.00 179.24 177.99 2igk s VAL 315 N -3.20 1.68 -0.17 -1.35 1.01 -0.30 -4.81 120.40 113.26 2igk s VAL 315 Ca -0.08 -0.83 -0.00 0.00 0.00 0.00 0.00 61.98 61.07 2igk s VAL 315 Cb 0.07 -1.46 0.00 0.00 0.00 0.00 0.00 36.38 35.00 2igk s VAL 315 CO 0.90 0.48 -0.15 -0.31 0.00 0.00 0.00 175.10 176.02 2igk s TYR 316 N 0.24 2.80 -0.15 5.22 1.51 -0.16 -1.15 117.35 125.65 2igk s TYR 316 Ca -0.11 -1.16 0.02 0.00 -1.01 0.00 0.00 57.07 54.81 2igk s TYR 316 Cb -0.15 -1.92 0.01 0.00 -0.11 0.00 0.00 41.96 39.79 2igk s TYR 316 CO 0.05 -0.56 -0.22 0.08 -1.11 0.00 0.00 175.55 173.80 2igk s VAL 317 N 0.99 2.06 -0.34 0.71 1.01 0.05 -1.21 120.40 123.68 2igk s VAL 317 Ca -0.02 -0.97 -0.10 0.00 0.00 0.00 0.00 61.98 60.89 2igk s VAL 317 Cb -0.15 -1.83 0.01 0.00 0.00 0.00 0.00 36.38 34.41 2igk s VAL 317 CO -0.03 0.55 0.17 -0.76 0.00 0.00 0.00 175.10 175.03 2igk s LEU 318 N 0.92 4.35 -0.37 3.92 1.43 0.14 -0.79 118.68 128.28 2igk s LEU 318 Ca -0.04 -0.71 0.13 0.00 -1.03 0.00 0.00 54.13 52.48 2igk s LEU 318 Cb -0.15 -2.01 0.44 0.00 0.03 0.00 0.00 46.19 44.50 2igk s LEU 318 CO -0.04 -0.27 1.00 0.35 0.23 0.00 0.00 176.35 177.61 2igk n THR 319 N 4.99 1.45 1.04 5.49 -2.24 0.11 -0.87 114.28 124.24 2igk n THR 319 Ca -0.13 -3.76 0.09 0.00 -2.27 0.00 0.00 64.05 57.97 2igk n THR 319 Cb 0.48 -0.03 0.28 0.00 -2.10 0.00 0.00 70.33 68.95 2igk n THR 319 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2igk n ALA 320 N -0.19 2.48 0.00 6.98 0.00 -1.10 -4.21 120.51 124.47 2igk n ALA 320 Ca 0.20 -0.58 0.00 0.00 0.00 0.00 0.00 53.44 53.06 2igk n ALA 320 Cb 0.76 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 19.17 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 1.11 0.95 0.25 0.00 0.00 -1.26 -4.06 105.19 102.19 2igk n GLY 321 Ca 0.14 -1.82 0.02 0.00 0.00 0.00 0.00 46.02 44.36 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 1.48 0.04 4.61 0.00 -1.91 -0.24 119.26 123.23 2igk h ALA 322 Ca 0.00 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.65 2igk h ALA 322 Cb 0.00 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 17.70 2igk h ALA 322 CO 0.00 0.37 -0.28 0.28 0.00 0.00 0.00 179.25 179.63 2igk h VAL 323 N 0.30 1.68 0.00 0.00 2.07 -1.94 -3.33 116.25 115.04 2igk h VAL 323 Ca 0.06 -2.36 -0.07 0.00 0.82 0.00 0.00 66.70 65.16 2igk h VAL 323 Cb 0.35 3.27 -0.01 0.00 -1.52 0.00 0.00 31.29 33.38 2igk h VAL 323 CO 0.02 0.63 -0.32 0.45 0.02 0.00 0.00 177.57 178.37 2igk h HIS 324 N -0.75 0.00 -0.54 1.57 -0.00 -1.66 -1.57 115.15 112.19 2igk h HIS 324 Ca -0.05 0.00 -0.01 0.00 -0.00 0.00 0.00 60.37 60.31 2igk h HIS 324 Cb 1.19 0.00 -0.03 0.00 -0.00 0.00 0.00 27.41 28.58 2igk h HIS 324 CO 0.24 0.32 0.29 -0.91 -0.00 0.00 0.00 177.93 177.88 2igk h ASN 325 N 0.00 0.68 -0.80 2.45 2.35 -1.22 -1.88 115.58 117.16 2igk h ASN 325 Ca -0.00 -0.10 -0.03 0.00 -0.55 0.00 0.00 56.30 55.62 2igk h ASN 325 Cb 1.22 -0.17 -0.04 0.00 0.05 0.00 0.00 38.32 39.38 2igk h ASN 325 CO 0.04 0.58 0.37 0.74 -1.65 0.00 0.00 177.43 177.52 2igk h THR 326 N 0.73 1.25 -0.49 2.81 2.02 -1.59 -1.33 112.91 116.31 2igk h THR 326 Ca 0.19 -0.72 -0.08 0.00 0.77 0.00 0.00 66.41 66.57 2igk h THR 326 Cb 0.06 0.25 -0.02 0.00 -1.74 0.00 0.00 68.15 66.70 2igk h THR 326 CO -0.03 0.30 -0.00 -0.61 0.37 0.00 0.00 175.52 175.55 2igk h GLN 327 N 1.13 0.87 -0.62 6.66 4.15 -1.05 -0.58 115.11 125.68 2igk h GLN 327 Ca 0.27 -0.28 -0.09 0.00 0.77 0.00 0.00 58.65 59.32 2igk h GLN 327 Cb 0.13 -0.08 -0.02 0.00 0.21 0.00 0.00 27.48 27.72 2igk h GLN 327 CO -0.03 0.91 0.04 1.25 -1.93 0.00 0.00 178.83 179.07 2igk h LEU 328 N 0.73 1.03 -0.37 -2.39 6.46 -1.01 -0.38 115.31 119.39 2igk h LEU 328 Ca 0.14 -0.29 -0.04 0.00 -0.12 0.00 0.00 57.88 57.57 2igk h LEU 328 Cb 0.52 -0.28 -0.01 0.00 -0.73 0.00 0.00 40.66 40.16 2igk h LEU 328 CO 0.03 1.06 0.07 -0.07 -0.62 0.00 0.00 178.44 178.91 2igk h LEU 329 N 0.97 0.58 -0.75 2.25 3.38 -0.99 -1.74 115.31 119.01 2igk h LEU 329 Ca 0.18 -0.25 -0.08 0.00 0.09 0.00 0.00 57.88 57.82 2igk h LEU 329 Cb 0.51 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.08 2igk h LEU 329 CO 0.02 0.69 0.09 0.58 0.09 0.00 0.00 178.44 179.91 2igk h VAL 330 N 0.45 1.26 0.00 1.22 2.07 -0.94 -0.81 116.25 119.50 2igk h VAL 330 Ca 0.11 -1.02 0.00 0.00 0.82 0.00 0.00 66.70 66.61 2igk h VAL 330 Cb 0.35 0.67 0.00 0.00 -1.52 0.00 0.00 31.29 30.79 2igk h VAL 330 CO 0.01 0.38 0.00 -1.13 0.02 0.00 0.00 177.57 176.85 2igk h ASN 331 N 0.98 0.00 -0.59 0.57 -1.24 -0.82 -2.90 115.58 111.58 2igk h ASN 331 Ca 0.19 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.20 2igk h ASN 331 Cb 0.43 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.48 2igk h ASN 331 CO 0.01 0.00 0.00 -1.20 -1.29 0.00 0.00 177.43 174.95 2igk n SER 332 N -2.74 4.06 0.00 1.15 7.64 -0.40 -4.90 113.62 118.42 2igk n SER 332 Ca -0.02 -2.24 0.00 0.00 1.01 0.00 0.00 58.87 57.63 2igk n SER 332 Cb 0.10 -0.47 0.00 0.00 -1.01 0.00 0.00 64.21 62.82 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 1.08 0.73 3.87 0.23 0.00 -1.09 -4.75 105.19 105.25 2igk n GLY 333 Ca 0.22 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.22 3.46 0.00 1.61 0.40 -0.64 -4.67 117.98 115.92 2igk s PHE 334 Ca 0.00 1.04 0.00 0.00 -0.60 0.00 0.00 56.93 57.37 2igk s PHE 334 Cb 0.00 -2.43 0.00 0.00 0.51 0.00 0.00 43.02 41.10 2igk s PHE 334 CO 0.00 -0.08 0.00 0.41 0.70 0.00 0.00 175.22 176.25 2igk n GLY 335 N -1.20 2.10 2.88 4.36 0.00 -0.09 -3.97 105.19 109.27 2igk n GLY 335 Ca 0.02 -0.44 -0.20 0.00 0.00 0.00 0.00 46.02 45.41 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 0.78 0.27 1.61 0.74 -1.26 -4.59 119.66 117.21 2igk s GLN 336 Ca 0.00 -0.09 -0.22 0.00 0.05 0.00 0.00 55.36 55.10 2igk s GLN 336 Cb 0.00 -0.81 -0.09 0.00 1.10 0.00 0.00 33.01 33.21 2igk s GLN 336 CO 0.00 -0.09 0.82 -1.17 -0.55 0.00 0.00 175.29 174.31 2igk s LEU 337 N 0.94 4.33 0.00 3.68 2.96 -1.26 -4.69 118.68 124.65 2igk s LEU 337 Ca -0.11 1.60 0.00 0.00 -0.22 0.00 0.00 54.13 55.41 2igk s LEU 337 Cb -0.14 -3.80 0.00 0.00 0.50 0.00 0.00 46.19 42.75 2igk s LEU 337 CO -0.00 -0.02 0.00 0.61 -1.32 0.00 0.00 176.35 175.62 2igk n GLY 338 N 0.61 -0.24 3.71 7.98 0.00 0.75 -4.88 105.19 113.13 2igk n GLY 338 Ca -0.00 -1.87 -0.43 0.00 0.00 0.00 0.00 46.02 43.71 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 -0.34 2.46 -1.64 1.61 0.63 -1.26 -4.46 116.66 113.66 2igk n ARG 339 Ca 0.00 0.88 -0.46 0.00 -0.92 0.00 0.00 57.85 57.35 2igk n ARG 339 Cb 0.00 -2.64 -0.03 0.00 0.45 0.00 0.00 32.46 30.24 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 2.54 1.79 -3.59 -0.14 -0.02 -1.26 -4.98 135.00 129.34 2igk n PRO 340 Ca 0.11 0.64 -0.29 0.00 -2.02 0.00 0.00 63.50 61.94 2igk n PRO 340 Cb 0.34 -2.27 -0.14 0.00 -0.02 0.00 0.00 33.50 31.41 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 0.28 3.54 0.49 2.55 3.04 -1.26 -5.01 114.94 118.57 2igk s ASN 341 Ca 0.71 -1.73 0.32 0.00 0.04 0.00 0.00 52.86 52.20 2igk s ASN 341 Cb -0.71 -0.56 1.41 0.00 -1.54 0.00 0.00 41.25 39.84 2igk s ASN 341 CO 0.49 -0.38 1.96 -0.65 -3.04 0.00 0.00 177.10 175.47 2igk h PRO 342 N 7.82 0.00 0.00 0.43 0.11 -2.02 -2.46 132.00 135.88 2igk h PRO 342 Ca -0.10 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.01 2igk h PRO 342 Cb 0.99 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.10 2igk h PRO 342 CO 0.41 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.20 2igk h ALA 343 N 2.06 1.00 -2.56 -0.75 0.00 -2.02 -3.37 119.26 113.62 2igk h ALA 343 Ca 0.00 0.00 -0.61 0.00 0.00 0.00 0.00 54.91 54.30 2igk h ALA 343 Cb 0.39 0.00 -0.42 0.00 0.00 0.00 0.00 17.79 17.77 2igk h ALA 343 CO 0.00 0.00 -0.63 -1.71 0.00 0.00 0.00 179.25 176.91 2igk n ASN 344 N -2.97 3.06 -4.77 0.00 2.85 -0.93 -5.10 115.26 107.40 2igk n ASN 344 Ca 0.01 -3.26 -0.41 0.00 -0.11 0.00 0.00 54.58 50.82 2igk n ASN 344 Cb 0.34 -0.70 0.00 0.00 1.24 0.00 0.00 39.78 40.66 2igk n ASN 344 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 2igk n PRO 345 N 1.43 2.55 -2.31 1.20 -0.04 -1.26 -4.88 135.00 131.70 2igk n PRO 345 Ca 0.25 0.90 -0.40 0.00 -0.04 0.00 0.00 63.50 64.21 2igk n PRO 345 Cb 0.40 -2.64 -0.03 0.00 -0.04 0.00 0.00 33.50 31.18 2igk n PRO 345 CO 0.00 0.00 0.00 -2.14 -0.04 0.00 0.00 175.50 173.32 2igk s PRO 346 N -2.17 4.49 0.31 0.54 0.02 -1.26 -4.95 135.00 131.98 2igk s PRO 346 Ca 0.55 1.99 -0.01 0.00 0.02 0.00 0.00 61.00 63.55 2igk s PRO 346 Cb -0.47 -3.12 0.48 0.00 0.02 0.00 0.00 34.50 31.41 2igk s PRO 346 CO 0.62 0.01 1.95 1.49 -0.33 0.00 0.00 177.00 180.74 2igk h GLU 347 N 3.58 0.97 -5.54 5.54 4.81 -1.91 -3.43 114.58 118.60 2igk h GLU 347 Ca -0.48 -0.09 -0.50 0.00 -0.13 0.00 0.00 59.36 58.16 2igk h GLU 347 Cb 1.22 -0.20 -0.27 0.00 0.63 0.00 0.00 28.75 30.13 2igk h GLU 347 CO 0.66 0.69 -0.81 -0.51 -0.73 0.00 0.00 179.01 178.30 2igk s LEU 348 N -9.74 2.12 -0.93 1.64 1.43 -1.26 -4.89 118.68 107.04 2igk s LEU 348 Ca -0.11 -0.41 -0.09 0.00 -1.03 0.00 0.00 54.13 52.49 2igk s LEU 348 Cb 0.17 -0.76 0.01 0.00 0.03 0.00 0.00 46.19 45.64 2igk s LEU 348 CO 0.79 0.12 0.67 0.18 0.23 0.00 0.00 176.35 178.33 2igk n LEU 349 N 2.18 -2.58 0.24 1.79 4.77 -1.26 -0.92 117.00 121.22 2igk n LEU 349 Ca -0.16 -0.89 0.16 0.00 -0.03 0.00 0.00 56.01 55.09 2igk n LEU 349 Cb 0.54 -2.03 0.71 0.00 -2.33 0.00 0.00 43.42 40.31 2igk n LEU 349 CO 0.23 0.23 0.97 1.55 -1.33 0.00 0.00 177.39 179.04 2igk h PRO 350 N -0.83 0.00 -0.01 3.23 0.13 -1.90 -1.50 132.00 131.11 2igk h PRO 350 Ca -0.55 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.58 2igk h PRO 350 Cb 1.33 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.46 2igk h PRO 350 CO 0.40 0.00 -0.09 0.43 -0.23 0.00 0.00 178.00 178.51 2igk n SER 351 N -2.78 0.77 -4.72 1.44 7.64 -1.26 -4.85 113.62 109.85 2igk n SER 351 Ca 0.00 -0.93 -0.42 0.00 1.01 0.00 0.00 58.87 58.53 2igk n SER 351 Cb 0.22 -0.01 -0.03 0.00 -1.01 0.00 0.00 64.21 63.38 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 -2.28 4.37 0.00 -3.43 2.96 -0.57 -1.53 118.68 118.20 2igk s LEU 352 Ca 0.33 2.67 0.00 0.00 -0.22 0.00 0.00 54.13 56.91 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 0.43 -0.86 0.00 0.61 -1.32 0.00 0.00 176.35 175.21 2igk n GLY 353 N 3.82 0.75 3.67 7.98 0.00 0.33 -4.87 105.19 116.86 2igk n GLY 353 Ca 0.14 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.50 4.33 -1.45 1.61 0.01 -0.58 -0.87 113.70 114.25 2igk s SER 354 Ca 0.00 -0.94 0.00 0.00 1.31 0.00 0.00 55.95 56.32 2igk s SER 354 Cb 0.00 -0.58 0.00 0.00 0.21 0.00 0.00 66.02 65.65 2igk s SER 354 CO 0.00 -0.28 0.00 -1.22 0.41 0.00 0.00 173.24 172.15 2igk n TYR 355 N -1.03 -0.45 -2.28 2.43 4.02 -0.70 -4.62 117.16 114.54 2igk n TYR 355 Ca -0.04 0.00 -0.37 0.00 -0.01 0.00 0.00 57.90 57.48 2igk n TYR 355 Cb 0.62 -3.01 -0.01 0.00 -0.02 0.00 0.00 39.34 36.92 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 -2.69 3.14 0.05 -0.72 -4.36 -0.95 -4.48 121.20 111.18 2igk s ILE 356 Ca 0.00 0.89 0.07 0.00 -0.26 0.00 0.00 60.65 61.35 2igk s ILE 356 Cb 0.00 -3.47 -0.03 0.00 1.25 0.00 0.00 42.46 40.22 2igk s ILE 356 CO 0.00 0.02 -0.20 0.42 0.24 0.00 0.00 174.94 175.42 2igk s THR 357 N -1.51 1.63 -0.01 8.37 -4.23 -0.31 -4.59 115.64 114.99 2igk s THR 357 Ca 0.61 -1.22 -0.03 0.00 -1.18 0.00 0.00 61.69 59.86 2igk s THR 357 Cb -0.29 -1.43 -0.00 0.00 1.34 0.00 0.00 72.50 72.12 2igk s THR 357 CO 0.36 0.16 0.07 -0.70 -0.54 0.00 0.00 174.62 173.96 2igk s GLU 358 N -1.26 0.26 0.30 3.99 2.56 -1.26 -1.07 118.70 122.21 2igk s GLU 358 Ca 0.07 -0.22 -0.28 0.00 0.00 0.00 0.00 54.97 54.54 2igk s GLU 358 Cb -0.09 0.11 -0.09 0.00 2.00 0.00 0.00 34.13 36.05 2igk s GLU 358 CO 0.02 -0.05 1.05 -0.65 -0.56 0.00 0.00 175.26 175.07 2igk s GLN 359 N -0.74 4.59 0.46 4.30 -0.21 -1.26 -4.50 119.66 122.30 2igk s GLN 359 Ca -0.08 1.65 -0.23 0.00 0.02 0.00 0.00 55.36 56.72 2igk s GLN 359 Cb -0.05 -3.06 -0.07 0.00 1.00 0.00 0.00 33.01 30.83 2igk s GLN 359 CO 0.00 0.21 1.16 -1.12 -2.12 0.00 0.00 175.29 173.43 2igk s SER 360 N -1.12 6.14 -0.04 5.90 0.01 -1.25 -4.65 113.70 118.69 2igk s SER 360 Ca 0.47 2.30 -0.00 0.00 1.31 0.00 0.00 55.95 60.03 2igk s SER 360 Cb -0.28 -2.60 0.03 0.00 0.21 0.00 0.00 66.02 63.38 2igk s SER 360 CO 0.35 -0.94 0.01 -0.22 0.41 0.00 0.00 173.24 172.85 2igk s LEU 361 N -3.07 0.95 0.06 2.44 2.96 -1.26 -1.01 118.68 119.74 2igk s LEU 361 Ca 0.64 -0.03 0.06 0.00 -0.22 0.00 0.00 54.13 54.58 2igk s LEU 361 Cb -0.28 -0.26 -0.04 0.00 0.50 0.00 0.00 46.19 46.11 2igk s LEU 361 CO 0.34 -0.13 -0.11 0.68 -1.32 0.00 0.00 176.35 175.81 2igk s VAL 362 N 1.32 3.28 -0.02 1.68 -7.23 -0.56 -0.90 120.40 117.96 2igk s VAL 362 Ca -0.06 -1.11 -0.03 0.00 -1.81 0.00 0.00 61.98 58.97 2igk s VAL 362 Cb -0.13 -2.46 0.00 0.00 0.56 0.00 0.00 36.38 34.35 2igk s VAL 362 CO -0.02 0.25 0.08 0.12 -0.31 0.00 0.00 175.10 175.22 2igk s PHE 363 N -1.07 -0.05 0.28 2.82 5.36 -0.42 -1.68 117.98 123.22 2igk s PHE 363 Ca 0.18 0.12 -0.08 0.00 -0.96 0.00 0.00 56.93 56.20 2igk s PHE 363 Cb -0.11 0.00 -0.01 0.00 -0.34 0.00 0.00 43.02 42.57 2igk s PHE 363 CO 0.10 -0.08 0.44 0.00 -1.46 0.00 0.00 175.22 174.21 2igk s GLN 365 N -3.68 1.46 0.23 0.00 -0.21 -0.54 -1.03 119.66 115.89 2igk s GLN 365 Ca 0.27 -1.53 0.10 0.00 0.02 0.00 0.00 55.36 54.22 2igk s GLN 365 Cb 0.00 -1.65 -0.05 0.00 1.00 0.00 0.00 33.01 32.32 2igk s GLN 365 CO 0.13 0.34 -0.17 0.95 -2.12 0.00 0.00 175.29 174.42 2igk s THR 366 N -1.96 2.04 -0.20 -0.19 -4.23 -0.36 -0.31 115.64 110.43 2igk s THR 366 Ca 0.21 -2.24 -0.03 0.00 -1.18 0.00 0.00 61.69 58.44 2igk s THR 366 Cb -0.07 -2.11 -0.01 0.00 1.34 0.00 0.00 72.50 71.65 2igk s THR 366 CO 0.10 -0.47 -0.05 -0.69 -0.54 0.00 0.00 174.62 172.96 2igk s VAL 367 N -2.64 3.36 0.25 2.29 1.01 -0.36 -2.04 120.40 122.28 2igk s VAL 367 Ca 0.24 -0.51 -0.30 0.00 0.00 0.00 0.00 61.98 61.42 2igk s VAL 367 Cb -0.03 -2.51 -0.14 0.00 0.00 0.00 0.00 36.38 33.70 2igk s VAL 367 CO 0.10 0.44 1.12 0.80 0.00 0.00 0.00 175.10 177.56 2igk n MET 368 N 4.54 1.43 -1.93 2.72 1.56 0.96 -3.36 117.12 123.05 2igk n MET 368 Ca -0.18 0.51 -0.37 0.00 -0.27 0.00 0.00 57.70 57.39 2igk n MET 368 Cb 0.51 -1.96 0.04 0.00 2.15 0.00 0.00 33.22 33.96 2igk n MET 368 CO 0.00 0.00 0.00 -1.54 -0.73 0.00 0.00 175.97 173.70 2igk s SER 369 N -0.27 5.16 0.25 6.12 1.04 -0.12 -4.85 113.70 121.03 2igk s SER 369 Ca 0.64 2.51 -0.03 0.00 0.48 0.00 0.00 55.95 59.55 2igk s SER 369 Cb -0.73 -2.61 0.41 0.00 0.10 0.00 0.00 66.02 63.19 2igk s SER 369 CO 0.56 -1.62 1.83 0.74 0.98 0.00 0.00 173.24 175.73 2igk h THR 370 N 1.01 0.96 -0.38 2.02 2.02 -1.91 -1.06 112.91 115.57 2igk h THR 370 Ca -0.51 -0.31 0.03 0.00 0.77 0.00 0.00 66.41 66.40 2igk h THR 370 Cb 1.30 -0.02 -0.03 0.00 -1.74 0.00 0.00 68.15 67.66 2igk h THR 370 CO 0.56 0.16 0.18 -0.33 0.37 0.00 0.00 175.52 176.46 2igk h GLU 371 N 0.90 0.36 -0.45 6.66 5.08 -1.96 0.37 114.58 125.54 2igk h GLU 371 Ca 0.41 -0.02 -0.06 0.00 -1.00 0.00 0.00 59.36 58.69 2igk h GLU 371 Cb 0.32 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 2igk h GLU 371 CO -0.22 0.24 0.04 -0.07 -1.00 0.00 0.00 179.01 177.99 2igk h LEU 372 N 0.37 0.74 -0.24 1.33 3.38 -1.79 -1.31 115.31 117.79 2igk h LEU 372 Ca 0.16 -0.28 -0.00 0.00 0.09 0.00 0.00 57.88 57.85 2igk h LEU 372 Cb 0.08 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 2igk h LEU 372 CO -0.12 0.84 0.14 0.40 0.09 0.00 0.00 178.44 179.79 2igk h ILE 373 N 0.62 1.10 -0.29 1.22 1.08 -0.96 -2.18 117.51 118.09 2igk h ILE 373 Ca 0.13 -0.26 -0.04 0.00 -0.39 0.00 0.00 64.86 64.31 2igk h ILE 373 Cb 0.44 0.84 -0.02 0.00 -3.07 0.00 0.00 36.82 35.01 2igk h ILE 373 CO 0.02 0.10 0.00 0.44 -0.69 0.00 0.00 178.15 178.02 2igk h ASP 374 N 0.29 0.41 0.16 1.72 3.32 -0.83 -1.71 116.42 119.78 2igk h ASP 374 Ca 0.09 -0.07 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 2igk h ASP 374 Cb 0.04 -0.11 -0.00 0.00 0.22 0.00 0.00 39.33 39.48 2igk h ASP 374 CO -0.02 0.47 -0.06 0.77 -1.72 0.00 0.00 179.24 178.69 2igk h SER 375 N 0.43 0.00 -0.44 6.45 4.64 -0.61 -2.12 113.55 121.89 2igk h SER 375 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 2igk h SER 375 Cb 0.28 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.35 2igk h SER 375 CO 0.01 0.06 0.29 0.58 -0.87 0.00 0.00 176.83 176.89 2igk h VAL 376 N 0.00 1.11 -0.46 0.95 2.07 -0.93 -2.54 116.25 116.46 2igk h VAL 376 Ca -0.00 -0.20 -0.11 0.00 0.82 0.00 0.00 66.70 67.21 2igk h VAL 376 Cb 0.15 0.47 -0.06 0.00 -1.52 0.00 0.00 31.29 30.33 2igk h VAL 376 CO 0.01 0.11 0.08 2.29 0.02 0.00 0.00 177.57 180.07 2igk n LYS 377 N -4.47 3.12 0.30 1.57 2.85 -0.80 -4.72 118.16 116.00 2igk n LYS 377 Ca 0.04 -3.01 0.15 0.00 -1.05 0.00 0.00 58.31 54.43 2igk n LYS 377 Cb 0.06 -2.00 0.92 0.00 -0.65 0.00 0.00 35.03 33.36 2igk n LYS 377 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2igk h SER 378 N 2.08 0.00 0.08 -5.58 4.64 -1.40 -1.78 113.55 111.59 2igk h SER 378 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 2igk h SER 378 Cb 1.82 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.91 2igk h SER 378 CO 0.45 0.00 -0.15 0.47 -0.87 0.00 0.00 176.83 176.73 2igk n ASP 379 N -3.85 1.55 -4.80 4.97 8.00 -1.26 -4.94 116.55 116.23 2igk n ASP 379 Ca -0.03 -1.33 -0.38 0.00 0.71 0.00 0.00 54.79 53.75 2igk n ASP 379 Cb 0.08 0.10 -0.06 0.00 -0.02 0.00 0.00 41.12 41.22 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 -2.24 4.34 -0.24 -1.24 -1.94 -0.67 -4.54 119.30 112.77 2igk s MET 380 Ca 0.30 0.91 -0.09 0.00 -1.71 0.00 0.00 55.69 55.09 2igk s MET 380 Cb 0.20 -3.19 -0.04 0.00 2.01 0.00 0.00 34.83 33.81 2igk s MET 380 CO 0.42 0.57 0.13 0.99 -0.01 0.00 0.00 175.02 177.13 2igk s THR 381 N -1.20 4.98 -0.17 2.05 2.01 0.16 -4.95 115.64 118.53 2igk s THR 381 Ca 0.34 0.05 -0.00 0.00 0.31 0.00 0.00 61.69 62.39 2igk s THR 381 Cb -0.20 -3.32 0.00 0.00 0.01 0.00 0.00 72.50 68.98 2igk s THR 381 CO 0.22 0.34 -0.15 -0.63 -0.69 0.00 0.00 174.62 173.72 2igk s ILE 382 N 1.24 2.63 -0.11 1.82 1.01 -1.26 -1.50 121.20 125.02 2igk s ILE 382 Ca 0.06 -0.77 0.03 0.00 0.00 0.00 0.00 60.65 59.98 2igk s ILE 382 Cb -0.14 -2.13 0.00 0.00 0.01 0.00 0.00 42.46 40.20 2igk s ILE 382 CO 0.05 0.51 -0.22 -0.60 0.00 0.00 0.00 174.94 174.68 2igk s ARG 383 N 1.03 3.08 1.70 2.79 3.00 -0.42 -5.01 118.95 125.11 2igk s ARG 383 Ca -0.01 -0.85 0.00 0.00 -1.00 0.00 0.00 55.73 53.87 2igk s ARG 383 Cb -0.15 -2.37 0.00 0.00 0.00 0.00 0.00 34.95 32.43 2igk s ARG 383 CO -0.03 0.14 0.00 0.41 0.00 0.00 0.00 175.30 175.81 2igk n GLY 384 N 3.66 -1.51 3.18 8.12 0.00 -1.26 -1.65 105.19 115.73 2igk n GLY 384 Ca -0.19 -1.30 -0.24 0.00 0.00 0.00 0.00 46.02 44.29 2igk n GLY 384 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2igk s THR 385 N 0.00 1.37 0.39 2.61 -4.23 -1.26 -4.89 115.64 109.63 2igk s THR 385 Ca 0.00 -0.93 -0.26 0.00 -1.18 0.00 0.00 61.69 59.32 2igk s THR 385 Cb 0.00 -1.18 -0.11 0.00 1.34 0.00 0.00 72.50 72.55 2igk s THR 385 CO 0.00 0.23 1.23 -2.65 -0.54 0.00 0.00 174.62 172.89 2igk n PRO 386 N 2.23 1.89 0.00 3.99 -0.02 -1.26 -3.10 135.00 138.73 2igk n PRO 386 Ca -0.16 0.67 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 2igk n PRO 386 Cb 0.54 -2.30 0.00 0.00 -0.02 0.00 0.00 33.50 31.72 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 0.86 3.23 1.99 -1.23 0.00 -1.26 -5.03 105.19 103.74 2igk n GLY 387 Ca 0.06 0.00 -0.16 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 -0.98 -1.12 0.04 1.61 1.02 -1.18 -5.02 120.64 115.01 2igk n GLU 388 Ca 0.00 -1.04 -0.16 0.00 -0.02 0.00 0.00 57.16 55.94 2igk n GLU 388 Cb 0.00 -0.77 -0.14 0.00 -0.02 0.00 0.00 31.44 30.51 2igk n GLU 388 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 2igk h LEU 389 N 0.00 0.34 -2.04 -4.62 5.85 -1.96 -3.35 115.31 109.53 2igk h LEU 389 Ca -0.23 -0.53 0.00 0.00 0.84 0.00 0.00 57.88 57.96 2igk h LEU 389 Cb 0.64 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.56 2igk h LEU 389 CO 0.16 1.45 0.00 0.35 -0.34 0.00 0.00 178.44 180.06 2igk n THR 390 N -3.40 0.77 -1.94 1.05 -2.24 -1.26 -4.93 114.28 102.33 2igk n THR 390 Ca -0.19 -0.74 -0.42 0.00 -2.27 0.00 0.00 64.05 60.43 2igk n THR 390 Cb 1.04 0.34 -0.03 0.00 -2.10 0.00 0.00 70.33 69.59 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 -1.30 2.27 -0.03 4.78 5.04 -1.26 -4.48 117.35 122.37 2igk s TYR 391 Ca 0.37 0.26 0.02 0.00 -2.44 0.00 0.00 57.07 55.27 2igk s TYR 391 Cb 0.19 -3.96 0.01 0.00 0.35 0.00 0.00 41.96 38.55 2igk s TYR 391 CO 0.24 -3.94 -0.06 0.45 -1.34 0.00 0.00 175.55 170.91 2igk s SER 392 N 2.72 0.95 -0.19 4.32 0.15 -0.66 -5.02 113.70 115.98 2igk s SER 392 Ca 0.74 -0.14 0.01 0.00 0.70 0.00 0.00 55.95 57.27 2igk s SER 392 Cb -0.38 -0.34 0.04 0.00 -1.71 0.00 0.00 66.02 63.63 2igk s SER 392 CO 0.32 0.01 -0.13 -0.69 1.20 0.00 0.00 173.24 173.95 2igk s VAL 393 N 0.48 1.78 0.08 4.45 1.01 -1.26 -1.30 120.40 125.63 2igk s VAL 393 Ca -0.07 -1.00 0.01 0.00 0.00 0.00 0.00 61.98 60.93 2igk s VAL 393 Cb -0.10 -1.77 -0.04 0.00 0.00 0.00 0.00 36.38 34.47 2igk s VAL 393 CO 0.00 0.28 -0.06 0.42 0.00 0.00 0.00 175.10 175.74 2igk s THR 394 N 1.36 0.59 0.18 3.92 -4.23 -0.56 -4.95 115.64 111.94 2igk s THR 394 Ca 0.00 -1.70 0.01 0.00 -1.18 0.00 0.00 61.69 58.82 2igk s THR 394 Cb -0.15 -1.38 -0.04 0.00 1.34 0.00 0.00 72.50 72.26 2igk s THR 394 CO -0.09 -0.77 0.05 -0.72 -0.54 0.00 0.00 174.62 172.55 2igk s TYR 395 N -3.09 1.15 -0.38 3.99 1.13 -1.26 0.38 117.35 119.27 2igk s TYR 395 Ca 0.06 -1.15 -0.13 0.00 -1.41 0.00 0.00 57.07 54.43 2igk s TYR 395 Cb 0.02 -0.65 0.02 0.00 -1.10 0.00 0.00 41.96 40.25 2igk s TYR 395 CO -0.04 -0.37 0.25 0.99 -2.51 0.00 0.00 175.55 173.87 2igk s THR 396 N -3.85 4.99 0.28 -3.49 2.01 -1.26 -5.05 115.64 109.27 2igk s THR 396 Ca 0.28 -0.67 -0.30 0.00 0.31 0.00 0.00 61.69 61.31 2igk s THR 396 Cb 0.07 -3.74 -0.12 0.00 0.01 0.00 0.00 72.50 68.71 2igk s THR 396 CO 0.06 -0.23 1.48 -2.65 -0.69 0.00 0.00 174.62 172.59 2igk n PRO 397 N 5.09 2.36 -0.71 4.92 -0.02 -1.26 -2.77 135.00 142.62 2igk n PRO 397 Ca -0.12 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.20 2igk n PRO 397 Cb 0.47 -2.55 0.00 0.00 -0.02 0.00 0.00 33.50 31.40 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 1.95 1.10 3.76 -1.23 0.00 -1.26 -4.97 105.19 104.54 2igk n GLY 398 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 2igk n GLY 398 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2igk s ALA 399 N -3.18 3.71 0.05 4.61 0.00 -1.11 -4.88 121.76 120.96 2igk s ALA 399 Ca 0.00 1.56 0.33 0.00 0.00 0.00 0.00 51.96 53.85 2igk s ALA 399 Cb 0.00 -3.64 1.30 0.00 0.00 0.00 0.00 23.12 20.78 2igk s ALA 399 CO 0.00 -0.99 1.96 0.66 0.00 0.00 0.00 175.76 177.39 2igk h SER 400 N 4.52 0.00 -0.00 0.00 4.64 -1.93 -2.08 113.55 118.69 2igk h SER 400 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 2igk h SER 400 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 2igk h SER 400 CO 0.76 0.00 -0.01 0.35 -0.87 0.00 0.00 176.83 177.07 2igk n THR 401 N -3.07 0.00 -2.15 2.95 -2.24 -1.26 -4.90 114.28 103.61 2igk n THR 401 Ca 0.01 -0.21 -0.39 0.00 -2.27 0.00 0.00 64.05 61.19 2igk n THR 401 Cb 0.32 0.35 -0.01 0.00 -2.10 0.00 0.00 70.33 68.88 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 -2.02 6.44 0.21 3.42 0.01 -0.79 -4.93 114.94 117.29 2igk s ASN 402 Ca 0.39 2.54 0.15 0.00 -0.71 0.00 0.00 52.86 55.23 2igk s ASN 402 Cb 0.21 -2.63 -0.00 0.00 0.41 0.00 0.00 41.25 39.24 2igk s ASN 402 CO 0.35 -0.75 1.27 0.11 -1.51 0.00 0.00 177.10 176.56 2igk h LYS 403 N 2.74 0.00 -6.43 -0.60 6.56 -1.90 -3.48 116.57 113.47 2igk h LYS 403 Ca -0.49 0.00 -0.61 0.00 -1.06 0.00 0.00 60.65 58.49 2igk h LYS 403 Cb 1.24 0.00 -0.21 0.00 -0.57 0.00 0.00 32.23 32.69 2igk h LYS 403 CO 0.63 0.46 -0.84 -1.01 -2.06 0.00 0.00 179.45 176.63 2igk s HIS 404 N -2.94 2.00 0.95 -1.35 3.76 -1.26 -5.14 115.29 111.31 2igk s HIS 404 Ca 0.02 -0.41 -0.11 0.00 -0.15 0.00 0.00 55.06 54.41 2igk s HIS 404 Cb 0.08 -1.08 0.16 0.00 1.11 0.00 0.00 32.58 32.86 2igk s HIS 404 CO 0.77 0.28 1.10 -1.25 -0.85 0.00 0.00 174.74 174.79 2igk s PRO 405 N -2.08 0.79 0.21 8.40 0.04 -1.26 -4.81 135.00 136.29 2igk s PRO 405 Ca 0.11 1.16 -0.09 0.00 0.04 0.00 0.00 61.00 62.22 2igk s PRO 405 Cb -0.10 -1.73 0.25 0.00 0.04 0.00 0.00 34.50 32.96 2igk s PRO 405 CO 0.05 -2.66 1.81 -0.44 0.04 0.00 0.00 177.00 175.81 2igk h ASP 406 N -1.87 0.59 -0.58 6.66 3.32 -1.99 -2.31 116.42 120.24 2igk h ASP 406 Ca -0.49 0.03 0.06 0.00 0.02 0.00 0.00 57.03 56.65 2igk h ASP 406 Cb 1.28 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 40.71 2igk h ASP 406 CO 0.48 0.38 0.38 4.11 -1.72 0.00 0.00 179.24 182.87 2igk h TRP 407 N 0.72 0.53 -0.01 4.55 5.08 -1.99 0.81 115.95 125.64 2igk h TRP 407 Ca 0.31 0.01 -0.03 0.00 1.08 0.00 0.00 58.89 60.26 2igk h TRP 407 Cb 0.18 -0.18 0.00 0.00 -3.00 0.00 0.00 29.16 26.16 2igk h TRP 407 CO -0.07 0.28 -0.12 2.35 -1.28 0.00 0.00 178.44 179.60 2igk h TRP 408 N 0.53 0.15 -0.24 0.12 2.91 -1.84 -2.84 115.95 114.74 2igk h TRP 408 Ca 0.25 -0.07 -0.04 0.00 1.13 0.00 0.00 58.89 60.16 2igk h TRP 408 Cb 0.31 -0.02 -0.01 0.00 -0.51 0.00 0.00 29.16 28.92 2igk h TRP 408 CO -0.00 0.81 -0.03 -0.91 -1.03 0.00 0.00 178.44 177.28 2igk h ASN 409 N -0.56 0.33 -0.45 2.65 2.35 -0.86 -1.48 115.58 117.57 2igk h ASN 409 Ca -0.01 -0.06 -0.13 0.00 -0.55 0.00 0.00 56.30 55.55 2igk h ASN 409 Cb 0.84 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 39.11 2igk h ASN 409 CO 0.02 0.42 -0.22 -0.08 -1.65 0.00 0.00 177.43 175.92 2igk h GLU 410 N 0.35 0.96 -0.45 0.81 4.57 -0.92 0.17 114.58 120.07 2igk h GLU 410 Ca 0.08 -0.41 -0.12 0.00 -1.18 0.00 0.00 59.36 57.73 2igk h GLU 410 Cb 0.29 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.83 2igk h GLU 410 CO 0.01 1.08 -0.19 0.87 -1.18 0.00 0.00 179.01 179.60 2igk h LYS 411 N 0.83 0.90 -0.05 1.92 1.57 -1.08 -1.53 116.57 119.12 2igk h LYS 411 Ca 0.11 -0.36 -0.01 0.00 -1.87 0.00 0.00 60.65 58.52 2igk h LYS 411 Cb 0.79 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 33.06 2igk h LYS 411 CO 0.07 1.01 -0.01 0.28 -0.57 0.00 0.00 179.45 180.22 2igk h VAL 412 N 0.78 1.30 -0.45 0.50 2.07 -1.17 -1.76 116.25 117.52 2igk h VAL 412 Ca 0.11 -0.93 0.08 0.00 0.82 0.00 0.00 66.70 66.78 2igk h VAL 412 Cb 0.73 1.81 -0.07 0.00 -1.52 0.00 0.00 31.29 32.25 2igk h VAL 412 CO 0.06 0.25 0.05 0.50 0.02 0.00 0.00 177.57 178.45 2igk h LYS 413 N -0.25 0.16 -0.30 1.57 3.64 -0.57 -0.49 116.57 120.34 2igk h LYS 413 Ca 0.01 -0.01 -0.18 0.00 -1.27 0.00 0.00 60.65 59.20 2igk h LYS 413 Cb 0.41 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 32.19 2igk h LYS 413 CO 0.01 0.11 -0.52 -0.91 -2.27 0.00 0.00 179.45 175.87 2igk h ASN 414 N 0.17 0.97 -0.31 4.20 2.35 -1.25 -1.34 115.58 120.38 2igk h ASN 414 Ca 0.22 -0.51 0.00 0.00 -0.55 0.00 0.00 56.30 55.47 2igk h ASN 414 Cb 0.31 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.38 2igk h ASN 414 CO -0.33 1.30 0.21 -0.74 -1.65 0.00 0.00 177.43 176.22 2igk h HIS 415 N 0.68 0.39 -0.12 1.19 -0.00 -0.87 -0.54 115.15 115.89 2igk h HIS 415 Ca 0.02 0.01 -0.12 0.00 -0.00 0.00 0.00 60.37 60.28 2igk h HIS 415 Cb 1.12 -0.13 -0.01 0.00 -0.00 0.00 0.00 27.41 28.39 2igk h HIS 415 CO 0.07 0.24 -0.48 0.52 -0.00 0.00 0.00 177.93 178.29 2igk h MET 416 N 0.42 0.29 0.02 5.26 2.86 -0.97 -1.58 114.93 121.23 2igk h MET 416 Ca 0.11 -0.16 -0.20 0.00 -2.06 0.00 0.00 59.70 57.39 2igk h MET 416 Cb -0.05 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.61 2igk h MET 416 CO -0.03 0.71 -0.93 1.98 1.06 0.00 0.00 176.91 179.70 2igk h MET 417 N 0.23 0.14 0.00 1.72 -1.53 -1.14 -3.33 114.93 111.02 2igk h MET 417 Ca 0.01 -0.17 0.00 0.00 -3.44 0.00 0.00 59.70 56.10 2igk h MET 417 Cb 0.93 0.05 0.00 0.00 -0.55 0.00 0.00 31.60 32.03 2igk h MET 417 CO 0.08 0.97 -1.13 1.04 0.14 0.00 0.00 176.91 178.00 2igk n GLN 418 N -3.57 0.27 -3.16 0.39 6.02 -0.22 -4.47 117.38 112.64 2igk n GLN 418 Ca -0.03 -0.03 -0.22 0.00 -0.01 0.00 0.00 57.00 56.71 2igk n GLN 418 Cb 0.85 -1.56 -0.05 0.00 1.02 0.00 0.00 30.24 30.50 2igk n GLN 418 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 2igk n HIS 419 N -1.90 1.17 0.46 1.08 8.25 -0.60 -4.94 115.22 118.75 2igk n HIS 419 Ca 0.02 -3.83 0.09 0.00 -0.26 0.00 0.00 57.72 53.74 2igk n HIS 419 Cb 0.43 -0.43 0.38 0.00 1.12 0.00 0.00 29.99 31.49 2igk n HIS 419 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 2igk n GLN 420 N 0.49 0.08 0.16 -0.41 6.02 -1.25 -1.14 117.38 121.32 2igk n GLN 420 Ca 0.26 0.31 0.13 0.00 -0.01 0.00 0.00 57.00 57.69 2igk n GLN 420 Cb 0.55 -1.64 0.35 0.00 1.02 0.00 0.00 30.24 30.51 2igk n GLN 420 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.06 177.10 2igk h GLU 421 N 0.00 0.00 -5.65 -1.09 9.09 -1.92 -3.41 114.58 111.60 2igk h GLU 421 Ca 0.00 0.00 -0.58 0.00 0.05 0.00 0.00 59.36 58.83 2igk h GLU 421 Cb 0.30 0.00 -0.09 0.00 -1.65 0.00 0.00 28.75 27.31 2igk h GLU 421 CO 0.00 0.00 -0.18 0.34 0.05 0.00 0.00 179.01 179.22 2igk s ASP 422 N -5.15 6.60 0.00 3.06 2.15 -0.29 -4.99 116.67 118.05 2igk s ASP 422 Ca 0.08 0.72 0.29 0.00 0.43 0.00 0.00 52.55 54.07 2igk s ASP 422 Cb 0.09 -2.26 1.27 0.00 -0.30 0.00 0.00 42.92 41.72 2igk s ASP 422 CO 0.60 0.01 1.91 -0.81 -0.17 0.00 0.00 175.17 176.71 2igk n PRO 423 N 3.76 0.33 -3.98 4.34 -0.04 -1.26 -4.88 135.00 133.26 2igk n PRO 423 Ca -0.08 -0.06 -0.30 0.00 -0.04 0.00 0.00 63.50 63.01 2igk n PRO 423 Cb 0.52 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.43 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 -2.71 4.09 0.00 1.53 1.43 -1.26 -5.03 118.68 116.73 2igk s LEU 424 Ca 0.23 0.13 0.28 0.00 -1.03 0.00 0.00 54.13 53.74 2igk s LEU 424 Cb 0.20 -2.72 1.12 0.00 0.03 0.00 0.00 46.19 44.81 2igk s LEU 424 CO 0.51 0.16 1.79 -0.81 0.23 0.00 0.00 176.35 178.23 2igk n PRO 425 N 0.30 0.95 -3.04 1.29 -0.04 -1.26 -4.84 135.00 128.36 2igk n PRO 425 Ca -0.07 -0.43 -0.40 0.00 -0.04 0.00 0.00 63.50 62.56 2igk n PRO 425 Cb 0.52 -1.49 -0.05 0.00 -0.04 0.00 0.00 33.50 32.43 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 -2.35 4.99 0.54 0.52 1.01 -1.26 -4.60 121.20 120.06 2igk s ILE 426 Ca 0.31 1.38 -0.21 0.00 0.00 0.00 0.00 60.65 62.12 2igk s ILE 426 Cb 0.20 -4.02 -0.05 0.00 0.01 0.00 0.00 42.46 38.60 2igk s ILE 426 CO 0.45 0.13 1.25 -2.65 0.00 0.00 0.00 174.94 174.12 2igk n PRO 427 N 4.69 1.50 -0.31 2.79 -0.02 -1.26 -4.90 135.00 137.49 2igk n PRO 427 Ca 0.00 0.55 0.01 0.00 -2.02 0.00 0.00 63.50 62.04 2igk n PRO 427 Cb 0.50 -2.44 0.19 0.00 -0.02 0.00 0.00 33.50 31.73 2igk n PRO 427 CO 0.00 0.00 0.00 0.74 1.98 0.00 0.00 175.50 178.22 2igk h PHE 428 N 1.25 1.11 -0.53 6.00 0.04 -1.97 -1.86 116.94 120.98 2igk h PHE 428 Ca -0.50 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.30 2igk h PHE 428 Cb 1.32 -0.37 0.00 0.00 2.20 0.00 0.00 35.95 39.10 2igk h PHE 428 CO 0.44 0.66 0.00 0.39 -0.60 0.00 0.00 178.31 179.20 2igk n GLU 429 N -4.43 4.36 -1.69 1.51 1.02 -1.26 -4.95 120.64 115.21 2igk n GLU 429 Ca 0.12 -2.81 -0.43 0.00 -0.02 0.00 0.00 57.16 54.02 2igk n GLU 429 Cb 0.08 -2.14 -0.03 0.00 -0.02 0.00 0.00 31.44 29.33 2igk n GLU 429 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 2igk n ASP 430 N 0.65 4.04 -4.70 1.62 2.03 -0.70 -4.95 116.55 114.53 2igk n ASP 430 Ca 0.25 0.98 -0.31 0.00 0.52 0.00 0.00 54.79 56.22 2igk n ASP 430 Cb 1.06 -1.54 0.15 0.00 -0.72 0.00 0.00 41.12 40.07 2igk n ASP 430 CO 0.00 0.00 0.00 -2.84 -1.92 0.00 0.00 177.20 172.44 2igk s PRO 431 N 3.00 1.31 0.77 -0.67 0.02 -1.26 -4.97 135.00 133.20 2igk s PRO 431 Ca 0.83 1.48 -0.11 0.00 0.02 0.00 0.00 61.00 63.22 2igk s PRO 431 Cb -0.48 -1.77 0.06 0.00 0.02 0.00 0.00 34.50 32.33 2igk s PRO 431 CO 0.38 -2.40 1.09 -1.83 -0.33 0.00 0.00 177.00 173.91 2igk s GLU 432 N -4.69 2.28 0.59 5.54 1.03 -1.26 -4.42 118.70 117.77 2igk s GLU 432 Ca 0.66 0.71 -0.17 0.00 0.03 0.00 0.00 54.97 56.19 2igk s GLU 432 Cb -0.22 -1.94 -0.03 0.00 -0.80 0.00 0.00 34.13 31.14 2igk s GLU 432 CO 0.57 -1.50 1.11 -2.14 -1.33 0.00 0.00 175.26 171.97 2igk s PRO 433 N -5.13 3.15 -0.42 -4.83 0.02 -1.26 -4.45 135.00 122.07 2igk s PRO 433 Ca 0.60 1.47 0.06 0.00 0.02 0.00 0.00 61.00 63.15 2igk s PRO 433 Cb -0.14 -1.99 0.20 0.00 0.02 0.00 0.00 34.50 32.59 2igk s PRO 433 CO 0.54 -0.99 0.46 1.04 -0.33 0.00 0.00 177.00 177.72 2igk n GLN 434 N -1.81 0.41 -4.70 5.54 1.13 -1.25 -3.20 117.38 113.51 2igk n GLN 434 Ca 0.11 -3.02 -0.33 0.00 -1.94 0.00 0.00 57.00 51.81 2igk n GLN 434 Cb 0.52 -1.49 -0.12 0.00 0.11 0.00 0.00 30.24 29.25 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 -0.24 3.41 0.02 5.09 1.01 0.32 -0.85 120.40 129.15 2igk s VAL 435 Ca 0.33 -0.66 0.00 0.00 0.00 0.00 0.00 61.98 61.66 2igk s VAL 435 Cb 0.09 -2.39 -0.02 0.00 0.00 0.00 0.00 36.38 34.06 2igk s VAL 435 CO -0.16 0.55 -0.03 0.28 0.00 0.00 0.00 175.10 175.74 2igk s THR 436 N -0.82 0.10 -0.24 3.92 -1.32 -0.50 -0.37 115.64 116.42 2igk s THR 436 Ca 0.13 -0.78 -0.02 0.00 -1.21 0.00 0.00 61.69 59.81 2igk s THR 436 Cb -0.11 -0.23 0.02 0.00 -1.51 0.00 0.00 72.50 70.67 2igk s THR 436 CO 0.02 -0.42 -0.06 0.28 -2.21 0.00 0.00 174.62 172.23 2igk s THR 437 N -1.24 2.95 0.58 5.08 -1.32 -1.26 -1.60 115.64 118.83 2igk s THR 437 Ca -0.13 -0.88 -0.18 0.00 -1.21 0.00 0.00 61.69 59.28 2igk s THR 437 Cb -0.08 -2.44 -0.04 0.00 -1.51 0.00 0.00 72.50 68.42 2igk s THR 437 CO -0.01 0.28 1.13 -0.76 -2.21 0.00 0.00 174.62 173.05 2igk s LEU 438 N 1.36 3.63 0.06 9.08 1.43 -1.26 -3.82 118.68 129.15 2igk s LEU 438 Ca 0.02 2.14 -0.37 0.00 -1.03 0.00 0.00 54.13 54.89 2igk s LEU 438 Cb -0.16 -4.57 -0.19 0.00 0.03 0.00 0.00 46.19 41.30 2igk s LEU 438 CO -0.05 -1.39 0.95 0.33 0.23 0.00 0.00 176.35 176.43 2igk n PHE 439 N -1.68 0.43 -3.97 0.29 -0.00 -1.19 -4.95 117.46 106.38 2igk n PHE 439 Ca 0.11 1.01 -0.09 0.00 -0.00 0.00 0.00 57.45 58.49 2igk n PHE 439 Cb 0.51 -2.07 -0.08 0.00 -0.00 0.00 0.00 39.48 37.84 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 -0.23 0.88 0.30 -4.13 -1.52 -0.89 -4.92 119.66 109.14 2igk s GLN 440 Ca 0.84 -1.13 0.03 0.00 -1.95 0.00 0.00 55.36 53.15 2igk s GLN 440 Cb -1.16 0.31 0.62 0.00 -0.22 0.00 0.00 33.01 32.56 2igk s GLN 440 CO 0.56 -0.27 1.84 -1.35 -0.25 0.00 0.00 175.29 175.82 2igk h PRO 441 N 2.80 0.89 0.00 2.91 0.11 -1.98 -0.84 132.00 135.89 2igk h PRO 441 Ca -0.34 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.72 2igk h PRO 441 Cb 1.19 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 32.10 2igk h PRO 441 CO 0.57 0.59 0.00 -1.13 -0.21 0.00 0.00 178.00 177.82 2igk n SER 442 N -4.62 0.00 -3.15 -2.05 3.41 -1.26 -4.05 113.62 101.91 2igk n SER 442 Ca 0.19 0.40 -0.20 0.00 -0.26 0.00 0.00 58.87 59.00 2igk n SER 442 Cb 0.39 -0.47 -0.05 0.00 -0.26 0.00 0.00 64.21 63.82 2igk n SER 442 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2igk n HIS 443 N -1.47 -1.65 -1.56 7.33 -0.00 -0.47 -5.07 115.22 112.33 2igk n HIS 443 Ca 0.08 -2.81 -0.41 0.00 -0.00 0.00 0.00 57.72 54.59 2igk n HIS 443 Cb 0.31 0.50 -0.01 0.00 -0.00 0.00 0.00 29.99 30.79 2igk n HIS 443 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.34 175.99 2igk n PRO 444 N 2.39 3.33 -3.68 -1.40 -0.04 -0.44 -2.11 135.00 133.05 2igk n PRO 444 Ca 0.23 -2.46 -0.14 0.00 -0.04 0.00 0.00 63.50 61.09 2igk n PRO 444 Cb 0.52 -3.03 -0.07 0.00 -0.04 0.00 0.00 33.50 30.88 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 2.51 -0.30 0.38 0.54 -2.14 -1.26 -4.30 118.94 114.37 2igk s TRP 445 Ca 0.58 0.40 -0.13 0.00 2.66 0.00 0.00 56.10 59.61 2igk s TRP 445 Cb 0.16 0.21 -0.07 0.00 -3.10 0.00 0.00 33.47 30.66 2igk s TRP 445 CO -0.07 -0.51 0.77 -1.58 -2.66 0.00 0.00 176.95 172.89 2igk s HIS 446 N -1.82 3.43 -0.01 1.66 5.65 -0.08 -3.19 115.29 120.93 2igk s HIS 446 Ca -0.09 1.13 0.03 0.00 0.25 0.00 0.00 55.06 56.38 2igk s HIS 446 Cb -0.02 -2.50 -0.01 0.00 -1.18 0.00 0.00 32.58 28.87 2igk s HIS 446 CO 0.02 -0.04 -0.09 0.95 -0.65 0.00 0.00 174.74 174.93 2igk s THR 447 N -2.23 0.73 -0.07 0.89 -4.23 -1.25 -0.80 115.64 108.67 2igk s THR 447 Ca 0.53 -0.39 0.00 0.00 -1.18 0.00 0.00 61.69 60.65 2igk s THR 447 Cb -0.10 -0.61 0.02 0.00 1.34 0.00 0.00 72.50 73.15 2igk s THR 447 CO 0.26 0.21 -0.05 -1.10 -0.54 0.00 0.00 174.62 173.39 2igk s GLN 448 N -0.20 1.06 -0.38 3.99 -0.21 0.11 -4.40 119.66 119.63 2igk s GLN 448 Ca 0.03 -0.12 0.02 0.00 0.02 0.00 0.00 55.36 55.31 2igk s GLN 448 Cb -0.04 -1.14 0.11 0.00 1.00 0.00 0.00 33.01 32.94 2igk s GLN 448 CO -0.00 -0.18 0.14 0.42 -2.12 0.00 0.00 175.29 173.55 2igk s ILE 449 N 1.39 1.69 0.00 1.08 1.01 0.50 -1.15 121.20 125.72 2igk s ILE 449 Ca -0.03 -2.26 0.00 0.00 0.00 0.00 0.00 60.65 58.36 2igk s ILE 449 Cb -0.13 -2.23 0.00 0.00 0.01 0.00 0.00 42.46 40.11 2igk s ILE 449 CO -0.03 -0.73 0.00 0.00 0.00 0.00 0.00 174.94 174.18 2igk n HIS 450 N 4.08 -0.13 -4.14 3.97 1.44 -0.09 -0.52 115.22 119.83 2igk n HIS 450 Ca 0.03 0.00 -0.17 0.00 -2.01 0.00 0.00 57.72 55.57 2igk n HIS 450 Cb 0.39 0.00 -0.15 0.00 0.12 0.00 0.00 29.99 30.34 2igk n HIS 450 CO 0.00 0.00 0.00 1.03 -2.81 0.00 0.00 176.34 174.56 2igk s ARG 451 N 0.55 0.55 0.00 -1.40 1.81 -1.19 -0.02 118.95 119.26 2igk s ARG 451 Ca 0.00 -0.13 0.00 0.00 -1.72 0.00 0.00 55.73 53.88 2igk s ARG 451 Cb 0.00 -0.57 0.00 0.00 -0.45 0.00 0.00 34.95 33.93 2igk s ARG 451 CO 0.00 0.02 0.00 -0.40 -0.68 0.00 0.00 175.30 174.24 2igk n ASP 452 N 3.46 0.69 -4.66 0.23 5.75 -1.26 -5.01 116.55 115.75 2igk n ASP 452 Ca -0.19 -0.50 -0.47 0.00 -0.01 0.00 0.00 54.79 53.61 2igk n ASP 452 Cb 0.55 0.00 -0.04 0.00 -1.03 0.00 0.00 41.12 40.59 2igk n ASP 452 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2igk n ALA 453 N -3.00 1.01 -3.38 2.12 0.00 -1.26 -4.98 120.51 111.02 2igk n ALA 453 Ca 0.00 0.44 -0.13 0.00 0.00 0.00 0.00 53.44 53.75 2igk n ALA 453 Cb 0.00 -2.33 -0.12 0.00 0.00 0.00 0.00 19.45 17.00 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 1.17 -0.29 -0.57 0.00 5.36 -1.26 -4.82 117.98 117.56 2igk s PHE 454 Ca 0.81 0.71 -0.22 0.00 -0.96 0.00 0.00 56.93 57.27 2igk s PHE 454 Cb -0.72 0.07 0.06 0.00 -0.34 0.00 0.00 43.02 42.09 2igk s PHE 454 CO 0.41 -0.17 0.83 -1.54 -1.46 0.00 0.00 175.22 173.28 2igk s SER 455 N 0.61 6.25 0.04 6.13 1.04 -1.26 -4.75 113.70 121.76 2igk s SER 455 Ca -0.04 -0.79 -0.28 0.00 0.48 0.00 0.00 55.95 55.32 2igk s SER 455 Cb -0.05 -2.38 -0.05 0.00 0.10 0.00 0.00 66.02 63.65 2igk s SER 455 CO -0.03 -1.17 0.91 -0.31 0.98 0.00 0.00 173.24 173.61 2igk s TYR 456 N 3.47 3.72 0.80 5.02 2.02 -1.26 -5.06 117.35 126.06 2igk s TYR 456 Ca 0.22 1.65 -0.14 0.00 -0.37 0.00 0.00 57.07 58.44 2igk s TYR 456 Cb -0.17 -3.01 0.07 0.00 -0.40 0.00 0.00 41.96 38.45 2igk s TYR 456 CO 0.13 0.13 1.15 0.41 -1.57 0.00 0.00 175.55 175.81 2igk n GLY 457 N 2.58 -0.12 0.35 0.71 0.00 -1.26 -4.78 105.19 102.67 2igk n GLY 457 Ca 0.02 -0.47 0.17 0.00 0.00 0.00 0.00 46.02 45.74 2igk n GLY 457 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2igk h ALA 458 N -0.82 2.32 -0.02 4.61 0.00 -1.98 -1.18 119.26 122.19 2igk h ALA 458 Ca -0.46 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.33 2igk h ALA 458 Cb 1.30 0.03 0.01 0.00 0.00 0.00 0.00 17.79 19.13 2igk h ALA 458 CO 0.46 -0.46 -0.40 0.28 0.00 0.00 0.00 179.25 179.13 2igk h VAL 459 N 0.00 1.46 -0.71 0.00 2.07 -2.00 -3.20 116.25 113.87 2igk h VAL 459 Ca 0.18 -1.92 0.03 0.00 0.82 0.00 0.00 66.70 65.80 2igk h VAL 459 Cb 0.72 2.56 -0.04 0.00 -1.52 0.00 0.00 31.29 33.01 2igk h VAL 459 CO -0.00 0.55 0.47 1.56 0.02 0.00 0.00 177.57 180.16 2igk h GLN 460 N -0.25 0.85 0.00 1.57 4.20 -1.75 -2.12 115.11 117.61 2igk h GLN 460 Ca -0.04 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.62 2igk h GLN 460 Cb 1.10 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 28.69 2igk h GLN 460 CO 0.08 0.56 0.00 1.04 -0.67 0.00 0.00 178.83 179.84 2igk n GLN 461 N -4.45 0.02 0.17 1.46 6.02 -0.49 0.15 117.38 120.26 2igk n GLN 461 Ca 0.09 0.32 0.13 0.00 -0.01 0.00 0.00 57.00 57.53 2igk n GLN 461 Cb 0.11 -1.50 0.39 0.00 1.02 0.00 0.00 30.24 30.26 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 -3.27 1.08 0.87 -1.42 -3.44 113.55 107.36 2igk h SER 462 Ca 0.00 0.00 -0.59 0.00 -1.23 0.00 0.00 61.79 59.97 2igk h SER 462 Cb 0.02 0.00 -0.10 0.00 -0.44 0.00 0.00 62.40 61.89 2igk h SER 462 CO 0.00 0.00 -0.31 -0.63 -0.53 0.00 0.00 176.83 175.36 2igk s ILE 463 N -3.26 5.29 0.15 2.23 -1.09 0.12 -5.03 121.20 119.61 2igk s ILE 463 Ca 0.07 0.59 -0.33 0.00 -2.23 0.00 0.00 60.65 58.75 2igk s ILE 463 Cb 0.09 -3.65 -0.12 0.00 -1.58 0.00 0.00 42.46 37.20 2igk s ILE 463 CO 0.58 0.39 1.71 -0.67 -1.23 0.00 0.00 174.94 175.72 2igk n ASP 464 N 3.50 3.62 0.23 3.58 -0.08 -1.26 -4.84 116.55 121.29 2igk n ASP 464 Ca -0.12 1.05 0.13 0.00 -1.51 0.00 0.00 54.79 54.34 2igk n ASP 464 Cb 0.52 -1.49 0.76 0.00 2.34 0.00 0.00 41.12 43.24 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 7.04 0.00 0.33 1.67 0.87 -1.94 -1.48 113.55 120.05 2igk h SER 465 Ca -0.45 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.11 2igk h SER 465 Cb 1.23 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 63.19 2igk h SER 465 CO 0.93 0.00 -0.01 0.03 -0.53 0.00 0.00 176.83 177.25 2igk h ARG 466 N 0.00 0.00 0.00 2.24 3.08 -1.98 -2.41 114.38 115.31 2igk h ARG 466 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.10 2igk h ARG 466 Cb 0.22 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.27 2igk h ARG 466 CO -0.00 0.01 -0.62 -0.07 -1.07 0.00 0.00 179.97 178.22 2igk h LEU 467 N 0.00 0.00 -9.51 3.04 3.38 -1.63 -3.48 115.31 107.11 2igk h LEU 467 Ca -0.00 -0.12 -0.59 0.00 0.09 0.00 0.00 57.88 57.27 2igk h LEU 467 Cb 0.17 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.86 2igk h LEU 467 CO 0.00 0.06 -0.14 -0.63 0.09 0.00 0.00 178.44 177.82 2igk s ILE 468 N -3.22 5.05 -0.03 1.22 1.01 -0.91 -0.03 121.20 124.30 2igk s ILE 468 Ca 0.05 0.97 0.04 0.00 0.00 0.00 0.00 60.65 61.70 2igk s ILE 468 Cb 0.11 -3.80 -0.00 0.00 0.01 0.00 0.00 42.46 38.78 2igk s ILE 468 CO 0.73 0.45 -0.14 -0.69 0.00 0.00 0.00 174.94 175.29 2igk s VAL 469 N -0.26 1.12 0.09 2.92 1.01 -0.86 -4.95 120.40 119.46 2igk s VAL 469 Ca 0.26 -0.56 -0.14 0.00 0.00 0.00 0.00 61.98 61.53 2igk s VAL 469 Cb -0.16 -0.96 -0.06 0.00 0.00 0.00 0.00 36.38 35.19 2igk s VAL 469 CO 0.13 0.33 0.49 -1.81 0.00 0.00 0.00 175.10 174.23 2igk s ASP 470 N -0.03 6.81 -0.10 3.32 1.11 0.98 -1.22 116.67 127.53 2igk s ASP 470 Ca -0.00 1.01 0.02 0.00 0.18 0.00 0.00 52.55 53.76 2igk s ASP 470 Cb -0.09 -2.26 0.01 0.00 1.07 0.00 0.00 42.92 41.65 2igk s ASP 470 CO 0.01 0.19 -0.16 0.26 1.18 0.00 0.00 175.17 176.65 2igk s TRP 471 N -1.32 1.98 -0.06 4.23 0.52 -0.20 -0.91 118.94 123.19 2igk s TRP 471 Ca 0.32 -0.91 -0.02 0.00 0.02 0.00 0.00 56.10 55.52 2igk s TRP 471 Cb -0.16 -1.42 0.03 0.00 -1.15 0.00 0.00 33.47 30.77 2igk s TRP 471 CO 0.18 -0.46 0.03 1.03 0.02 0.00 0.00 176.95 177.74 2igk s ARG 472 N 0.92 0.29 -0.06 4.98 0.52 -0.30 -1.91 118.95 123.39 2igk s ARG 472 Ca -0.08 0.23 0.05 0.00 -0.52 0.00 0.00 55.73 55.41 2igk s ARG 472 Cb -0.15 -0.75 -0.02 0.00 0.52 0.00 0.00 34.95 34.55 2igk s ARG 472 CO -0.00 -0.31 -0.20 -0.06 0.02 0.00 0.00 175.30 174.74 2igk s PHE 473 N 2.05 2.56 -0.12 -0.53 0.40 -0.68 -0.71 117.98 120.95 2igk s PHE 473 Ca 0.05 -0.49 0.03 0.00 -0.60 0.00 0.00 56.93 55.91 2igk s PHE 473 Cb -0.12 -1.63 0.00 0.00 0.51 0.00 0.00 43.02 41.78 2igk s PHE 473 CO -0.04 -0.06 -0.21 -0.06 0.70 0.00 0.00 175.22 175.54 2igk s PHE 474 N -0.33 2.65 0.35 0.36 0.40 0.02 -1.50 117.98 119.92 2igk s PHE 474 Ca 0.02 -1.11 0.05 0.00 -0.60 0.00 0.00 56.93 55.29 2igk s PHE 474 Cb -0.13 -1.78 -0.01 0.00 0.51 0.00 0.00 43.02 41.61 2igk s PHE 474 CO 0.02 -0.47 0.50 0.20 0.70 0.00 0.00 175.22 176.16 2igk s GLY 475 N 0.56 1.56 0.01 4.36 0.00 -0.18 -0.90 107.32 112.73 2igk s GLY 475 Ca -0.12 -1.37 -0.07 0.00 0.00 0.00 0.00 44.72 43.15 2igk s GLY 475 CO 0.04 -1.28 0.28 1.09 0.00 0.00 0.00 173.10 173.23 2igk s ARG 476 N -4.22 3.60 -0.17 2.90 1.70 -1.26 -3.76 118.95 117.74 2igk s ARG 476 Ca 0.45 -0.05 -0.00 0.00 -0.47 0.00 0.00 55.73 55.66 2igk s ARG 476 Cb -0.10 -3.07 0.00 0.00 -0.57 0.00 0.00 34.95 31.22 2igk s ARG 476 CO 0.32 0.64 -0.15 0.99 -1.08 0.00 0.00 175.30 176.02 2igk s THR 477 N -1.31 2.55 0.24 4.99 2.01 -1.26 -4.75 115.64 118.10 2igk s THR 477 Ca 0.28 -0.79 -0.31 0.00 0.31 0.00 0.00 61.69 61.17 2igk s THR 477 Cb -0.13 -2.09 -0.12 0.00 0.01 0.00 0.00 72.50 70.17 2igk s THR 477 CO 0.16 0.51 1.68 1.21 -0.69 0.00 0.00 174.62 177.49 2igk n GLU 478 N 4.36 2.74 -2.21 4.92 2.13 -1.26 -4.24 120.64 127.08 2igk n GLU 478 Ca -0.20 0.99 -0.42 0.00 0.66 0.00 0.00 57.16 58.19 2igk n GLU 478 Cb 0.51 -2.81 -0.03 0.00 0.27 0.00 0.00 31.44 29.38 2igk n GLU 478 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 2igk s PRO 479 N 0.62 4.25 -0.02 5.31 0.04 -1.26 -4.82 135.00 139.12 2igk s PRO 479 Ca 0.72 1.96 0.04 0.00 0.04 0.00 0.00 61.00 63.76 2igk s PRO 479 Cb -0.51 -3.72 -0.01 0.00 0.04 0.00 0.00 34.50 30.31 2igk s PRO 479 CO 0.38 -0.67 -0.15 0.15 0.04 0.00 0.00 177.00 176.74 2igk s LYS 480 N 3.05 1.36 0.41 4.56 -0.14 -1.26 -4.97 119.74 122.75 2igk s LYS 480 Ca 0.64 -0.53 0.10 0.00 -1.36 0.00 0.00 55.97 54.82 2igk s LYS 480 Cb -0.30 -1.26 0.91 0.00 -1.68 0.00 0.00 37.83 35.50 2igk s LYS 480 CO 0.25 0.27 2.01 1.49 -0.76 0.00 0.00 175.35 178.61 2igk h GLU 481 N 6.00 0.52 0.00 1.68 4.81 -1.94 -1.73 114.58 123.91 2igk h GLU 481 Ca -0.34 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.86 2igk h GLU 481 Cb 1.16 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.43 2igk h GLU 481 CO 0.48 0.34 0.00 1.05 -0.73 0.00 0.00 179.01 180.15 2igk h GLU 482 N 0.53 0.00 -5.90 1.92 9.09 -1.96 -3.35 114.58 114.91 2igk h GLU 482 Ca 0.23 0.00 -0.60 0.00 0.05 0.00 0.00 59.36 59.04 2igk h GLU 482 Cb 0.25 0.00 -0.10 0.00 -1.65 0.00 0.00 28.75 27.25 2igk h GLU 482 CO -0.06 0.00 0.48 -0.80 0.05 0.00 0.00 179.01 178.67 2igk s ASN 483 N -4.84 6.65 0.03 3.06 0.01 -0.67 -4.78 114.94 114.41 2igk s ASN 483 Ca 0.05 0.58 0.03 0.00 -0.71 0.00 0.00 52.86 52.81 2igk s ASN 483 Cb 0.09 -2.43 -0.02 0.00 0.41 0.00 0.00 41.25 39.31 2igk s ASN 483 CO 0.49 -0.73 -0.09 -0.54 -1.51 0.00 0.00 177.10 174.72 2igk s LYS 484 N 3.19 0.65 -0.21 -0.60 1.02 -0.39 -1.72 119.74 121.67 2igk s LYS 484 Ca 0.35 -0.63 -0.03 0.00 0.02 0.00 0.00 55.97 55.68 2igk s LYS 484 Cb -0.13 -0.55 0.00 0.00 -0.52 0.00 0.00 37.83 36.63 2igk s LYS 484 CO 0.16 0.13 -0.08 -1.17 -0.92 0.00 0.00 175.35 173.46 2igk s LEU 485 N -1.09 2.73 0.27 3.17 2.96 -0.05 -0.88 118.68 125.78 2igk s LEU 485 Ca -0.03 -0.48 0.02 0.00 -0.22 0.00 0.00 54.13 53.42 2igk s LEU 485 Cb -0.07 -1.67 -0.05 0.00 0.50 0.00 0.00 46.19 44.89 2igk s LEU 485 CO 0.01 -0.02 0.09 -1.66 -1.32 0.00 0.00 176.35 173.44 2igk s TRP 486 N 1.43 1.61 -0.05 5.38 1.48 -0.34 -4.53 118.94 123.92 2igk s TRP 486 Ca 0.05 -1.14 0.03 0.00 -1.06 0.00 0.00 56.10 53.99 2igk s TRP 486 Cb -0.14 -0.96 0.00 0.00 -1.16 0.00 0.00 33.47 31.21 2igk s TRP 486 CO -0.06 -0.28 -0.14 -0.06 -4.06 0.00 0.00 176.95 172.35 2igk s PHE 487 N -3.68 1.51 0.46 1.66 0.08 -1.26 0.26 117.98 117.01 2igk s PHE 487 Ca 0.38 -0.46 -0.23 0.00 0.12 0.00 0.00 56.93 56.74 2igk s PHE 487 Cb 0.08 -1.04 -0.07 0.00 -0.57 0.00 0.00 43.02 41.41 2igk s PHE 487 CO 0.14 -0.18 1.15 0.45 -0.10 0.00 0.00 175.22 176.68 2igk s SER 488 N 0.21 6.21 0.00 1.36 0.15 -0.14 -0.18 113.70 121.32 2igk s SER 488 Ca -0.06 2.26 0.21 0.00 0.70 0.00 0.00 55.95 59.05 2igk s SER 488 Cb -0.12 -2.60 0.56 0.00 -1.71 0.00 0.00 66.02 62.15 2igk s SER 488 CO 0.02 -0.88 1.45 -0.90 1.20 0.00 0.00 173.24 174.13 2igk n ASP 489 N -0.50 2.59 0.00 5.45 5.68 -1.26 -4.12 116.55 124.39 2igk n ASP 489 Ca 0.07 -1.88 0.00 0.00 -0.50 0.00 0.00 54.79 52.48 2igk n ASP 489 Cb 0.48 -0.20 0.00 0.00 -1.14 0.00 0.00 41.12 40.26 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 0.92 0.00 -2.81 0.11 0.00 -1.26 -5.04 118.16 110.08 2igk n LYS 490 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 58.31 58.08 2igk n LYS 490 Cb 0.46 -0.48 -0.06 0.00 0.00 0.00 0.00 35.03 34.96 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 -1.89 4.27 0.29 3.15 -1.09 -1.26 -5.01 121.20 119.66 2igk s ILE 491 Ca 0.00 1.98 0.11 0.00 -2.23 0.00 0.00 60.65 60.50 2igk s ILE 491 Cb 0.00 -4.27 -0.05 0.00 -1.58 0.00 0.00 42.46 36.55 2igk s ILE 491 CO 0.00 0.46 -0.16 0.42 -1.23 0.00 0.00 174.94 174.43 2igk s THR 492 N -0.84 2.29 0.00 2.92 -4.23 -1.26 -1.49 115.64 113.03 2igk s THR 492 Ca 0.41 -2.32 0.00 0.00 -1.18 0.00 0.00 61.69 58.60 2igk s THR 492 Cb -0.24 -2.39 0.00 0.00 1.34 0.00 0.00 72.50 71.21 2igk s THR 492 CO 0.30 -0.36 0.00 -0.90 -0.54 0.00 0.00 174.62 173.12 2igk n ASP 493 N -0.65 0.00 0.29 3.99 5.68 0.57 -4.74 116.55 121.70 2igk n ASP 493 Ca -0.05 -0.92 0.16 0.00 -0.50 0.00 0.00 54.79 53.48 2igk n ASP 493 Cb 0.61 0.00 0.89 0.00 -1.14 0.00 0.00 41.12 41.48 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 -0.38 1.28 -0.70 2.12 0.00 -1.98 -2.03 119.26 117.57 2igk h ALA 494 Ca 0.00 -0.04 -0.26 0.00 0.00 0.00 0.00 54.91 54.61 2igk h ALA 494 Cb 0.00 -0.01 -0.15 0.00 0.00 0.00 0.00 17.79 17.63 2igk h ALA 494 CO 0.00 0.06 0.28 0.66 0.00 0.00 0.00 179.25 180.25 2igk n TYR 495 N -3.55 2.27 -2.47 0.00 4.02 -1.26 -4.95 117.16 111.22 2igk n TYR 495 Ca -0.02 -1.37 -0.17 0.00 -0.01 0.00 0.00 57.90 56.32 2igk n TYR 495 Cb 0.16 -0.69 -0.01 0.00 -0.02 0.00 0.00 39.34 38.78 2igk n TYR 495 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 2igk n ASN 496 N -0.54 -5.02 -4.78 7.72 4.13 -0.76 -4.99 115.26 111.01 2igk n ASN 496 Ca 0.42 0.05 -0.22 0.00 1.68 0.00 0.00 54.58 56.51 2igk n ASN 496 Cb 1.36 -4.20 -0.05 0.00 -1.54 0.00 0.00 39.78 35.35 2igk n ASN 496 CO 0.00 0.00 0.00 -0.04 0.28 0.00 0.00 177.26 177.50 2igk s MET 497 N -5.10 2.77 0.22 3.52 -1.94 -1.26 -4.82 119.30 112.69 2igk s MET 497 Ca 0.03 -1.14 -0.32 0.00 -1.71 0.00 0.00 55.69 52.54 2igk s MET 497 Cb -0.01 -2.46 -0.12 0.00 2.01 0.00 0.00 34.83 34.24 2igk s MET 497 CO 0.03 0.39 1.68 -2.30 -0.01 0.00 0.00 175.02 174.82 2igk n PRO 498 N -1.10 2.68 -2.30 2.03 -0.02 -1.26 -0.31 135.00 134.72 2igk n PRO 498 Ca -0.07 0.96 -0.42 0.00 -2.02 0.00 0.00 63.50 61.95 2igk n PRO 498 Cb 0.58 -2.79 -0.03 0.00 -0.02 0.00 0.00 33.50 31.24 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 0.88 4.32 0.30 -0.52 2.00 -0.55 -4.63 119.66 121.45 2igk s GLN 499 Ca 0.74 1.88 -0.29 0.00 -2.00 0.00 0.00 55.36 55.69 2igk s GLN 499 Cb -0.53 -3.52 -0.10 0.00 0.80 0.00 0.00 33.01 29.66 2igk s GLN 499 CO 0.35 -0.50 1.34 -1.25 -0.50 0.00 0.00 175.29 174.74 2igk s PRO 500 N 2.12 4.33 -0.02 1.67 0.04 -1.26 -0.97 135.00 140.92 2igk s PRO 500 Ca 0.61 2.23 0.01 0.00 0.04 0.00 0.00 61.00 63.89 2igk s PRO 500 Cb -0.30 -3.09 0.01 0.00 0.04 0.00 0.00 34.50 31.16 2igk s PRO 500 CO 0.26 -0.26 -0.03 0.99 0.04 0.00 0.00 177.00 178.00 2igk s THR 501 N -0.74 0.35 0.04 1.26 2.01 0.14 -4.61 115.64 114.09 2igk s THR 501 Ca 0.52 -0.09 -0.05 0.00 0.31 0.00 0.00 61.69 62.38 2igk s THR 501 Cb -0.40 -0.36 -0.05 0.00 0.01 0.00 0.00 72.50 71.70 2igk s THR 501 CO 0.49 0.15 0.29 -0.36 -0.69 0.00 0.00 174.62 174.50 2igk s PHE 502 N 0.48 3.55 -0.36 4.92 0.08 -1.26 -1.19 117.98 124.20 2igk s PHE 502 Ca -0.05 0.53 0.00 0.00 0.12 0.00 0.00 56.93 57.53 2igk s PHE 502 Cb -0.09 -1.97 0.11 0.00 -0.57 0.00 0.00 43.02 40.51 2igk s PHE 502 CO -0.01 0.57 0.15 0.34 -0.10 0.00 0.00 175.22 176.18 2igk s ASP 503 N -1.96 3.85 -0.03 1.36 -1.08 -0.06 -4.64 116.67 114.12 2igk s ASP 503 Ca 0.31 -2.02 -0.02 0.00 -0.52 0.00 0.00 52.55 50.30 2igk s ASP 503 Cb -0.13 -0.91 0.01 0.00 -1.46 0.00 0.00 42.92 40.43 2igk s ASP 503 CO 0.19 -0.36 0.07 0.12 0.52 0.00 0.00 175.17 175.71 2igk s PHE 504 N 1.14 -0.07 0.01 -5.34 2.19 -0.07 -1.27 117.98 114.57 2igk s PHE 504 Ca 0.13 0.18 -0.02 0.00 0.33 0.00 0.00 56.93 57.56 2igk s PHE 504 Cb -0.20 0.00 -0.01 0.00 -1.31 0.00 0.00 43.02 41.50 2igk s PHE 504 CO -0.14 -0.04 0.02 1.03 1.83 0.00 0.00 175.22 177.91 2igk s ARG 505 N 0.17 0.29 0.04 10.12 1.81 -1.26 -3.90 118.95 126.21 2igk s ARG 505 Ca -0.01 -0.43 -0.30 0.00 -1.72 0.00 0.00 55.73 53.27 2igk s ARG 505 Cb -0.02 0.11 -0.08 0.00 -0.45 0.00 0.00 34.95 34.51 2igk s ARG 505 CO -0.00 -0.05 1.66 -0.06 -0.68 0.00 0.00 175.30 176.16 2igk s PHE 506 N -1.13 2.27 0.47 -0.53 0.08 -1.26 -4.90 117.98 112.98 2igk s PHE 506 Ca -0.12 0.26 -0.24 0.00 0.12 0.00 0.00 56.93 56.95 2igk s PHE 506 Cb -0.07 -3.96 -0.08 0.00 -0.57 0.00 0.00 43.02 38.34 2igk s PHE 506 CO -0.00 -3.91 1.23 -2.30 -0.10 0.00 0.00 175.22 170.14 2igk n PRO 507 N 6.06 1.70 -0.86 0.24 -0.02 -1.26 -4.90 135.00 135.96 2igk n PRO 507 Ca 0.16 0.61 -0.30 0.00 -2.02 0.00 0.00 63.50 61.95 2igk n PRO 507 Cb 0.41 -2.37 0.16 0.00 -0.02 0.00 0.00 33.50 31.68 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 -1.27 1.27 0.00 3.55 0.00 -1.26 -3.13 121.76 120.92 2igk s ALA 508 Ca 0.65 0.29 0.00 0.00 0.00 0.00 0.00 51.96 52.90 2igk s ALA 508 Cb -0.48 -3.34 0.00 0.00 0.00 0.00 0.00 23.12 19.30 2igk s ALA 508 CO 0.55 -2.72 0.00 0.41 0.00 0.00 0.00 175.76 174.00 2igk n GLY 509 N -0.17 0.62 0.30 0.00 0.00 -1.26 -4.42 105.19 100.25 2igk n GLY 509 Ca 0.09 -1.42 0.06 0.00 0.00 0.00 0.00 46.02 44.75 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 0.57 -0.39 1.61 2.43 -1.99 -1.40 114.38 115.21 2igk h ARG 510 Ca 0.00 -0.03 0.02 0.00 -0.81 0.00 0.00 59.98 59.15 2igk h ARG 510 Cb 0.00 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.39 2igk h ARG 510 CO 0.00 0.38 0.22 1.15 -1.51 0.00 0.00 179.97 180.21 2igk h THR 511 N 0.59 1.03 -0.03 0.20 2.02 -1.77 0.35 112.91 115.29 2igk h THR 511 Ca 0.44 -0.15 -0.03 0.00 0.77 0.00 0.00 66.41 67.44 2igk h THR 511 Cb 0.61 0.54 0.00 0.00 -1.74 0.00 0.00 68.15 67.57 2igk h THR 511 CO -0.36 0.08 -0.10 0.28 0.37 0.00 0.00 175.52 175.80 2igk h SER 512 N 0.44 0.14 -0.73 4.18 0.02 -1.32 -0.95 113.55 115.33 2igk h SER 512 Ca 0.16 -0.61 0.08 0.00 -0.84 0.00 0.00 61.79 60.57 2igk h SER 512 Cb 0.02 -0.04 -0.06 0.00 0.14 0.00 0.00 62.40 62.46 2igk h SER 512 CO -0.08 0.73 0.40 0.50 -1.14 0.00 0.00 176.83 177.24 2igk h LYS 513 N -0.44 0.69 -0.35 3.45 3.64 -1.15 -2.54 116.57 119.87 2igk h LYS 513 Ca -0.00 -0.04 -0.11 0.00 -1.27 0.00 0.00 60.65 59.23 2igk h LYS 513 Cb 0.72 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.37 2igk h LYS 513 CO 0.02 0.46 -0.24 0.93 -2.27 0.00 0.00 179.45 178.35 2igk h GLU 514 N 0.71 0.69 -0.48 1.90 5.08 -0.88 -0.36 114.58 121.25 2igk h GLU 514 Ca 0.34 -0.28 0.05 0.00 -1.00 0.00 0.00 59.36 58.47 2igk h GLU 514 Cb 0.27 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.44 2igk h GLU 514 CO -0.22 0.86 0.23 0.00 -1.00 0.00 0.00 179.01 178.88 2igk h ALA 515 N 1.14 0.60 -0.13 3.43 0.00 -0.84 0.77 119.26 124.22 2igk h ALA 515 Ca 0.08 0.03 -0.18 0.00 0.00 0.00 0.00 54.91 54.84 2igk h ALA 515 Cb 0.72 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 2igk h ALA 515 CO 0.06 -0.13 -0.66 1.49 0.00 0.00 0.00 179.25 180.00 2igk h GLU 516 N 0.45 0.53 -0.28 0.00 4.57 -1.20 -2.14 114.58 116.51 2igk h GLU 516 Ca 0.21 -0.39 -0.02 0.00 -1.18 0.00 0.00 59.36 57.98 2igk h GLU 516 Cb 0.14 0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.79 2igk h GLU 516 CO -0.16 1.01 0.07 -0.44 -1.18 0.00 0.00 179.01 178.31 2igk h ASP 517 N 0.38 0.36 -0.33 1.04 3.32 -0.70 -1.05 116.42 119.44 2igk h ASP 517 Ca -0.02 -0.04 -0.08 0.00 0.02 0.00 0.00 57.03 56.92 2igk h ASP 517 Cb 1.24 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.68 2igk h ASP 517 CO 0.12 0.37 -0.09 -0.03 -1.72 0.00 0.00 179.24 177.89 2igk h MET 518 N 0.39 0.65 -0.33 3.56 4.05 -0.66 0.70 114.93 123.29 2igk h MET 518 Ca 0.10 -0.25 0.04 0.00 -0.28 0.00 0.00 59.70 59.30 2igk h MET 518 Cb 0.16 -0.03 -0.04 0.00 -0.80 0.00 0.00 31.60 30.89 2igk h MET 518 CO -0.00 0.82 0.11 1.98 0.23 0.00 0.00 176.91 180.05 2igk h MET 519 N 0.43 0.24 -0.75 0.39 1.85 -0.73 0.01 114.93 116.37 2igk h MET 519 Ca 0.08 -0.01 -0.02 0.00 -0.61 0.00 0.00 59.70 59.14 2igk h MET 519 Cb 0.59 -0.05 -0.03 0.00 0.43 0.00 0.00 31.60 32.53 2igk h MET 519 CO 0.03 0.16 0.39 1.15 -0.40 0.00 0.00 176.91 178.24 2igk h THR 520 N 0.25 1.23 -0.79 -0.77 2.02 -0.99 -1.84 112.91 112.02 2igk h THR 520 Ca 0.15 -0.63 -0.00 0.00 0.77 0.00 0.00 66.41 66.70 2igk h THR 520 Cb 0.12 0.27 -0.04 0.00 -1.74 0.00 0.00 68.15 66.77 2igk h THR 520 CO -0.16 0.27 0.48 -0.78 0.37 0.00 0.00 175.52 175.70 2igk h ASP 521 N 1.05 0.95 -0.74 4.18 3.58 -0.18 -0.46 116.42 124.80 2igk h ASP 521 Ca 0.26 -0.07 0.02 0.00 0.42 0.00 0.00 57.03 57.67 2igk h ASP 521 Cb 0.08 -0.24 -0.04 0.00 1.72 0.00 0.00 39.33 40.85 2igk h ASP 521 CO -0.04 0.74 0.48 -0.03 -2.88 0.00 0.00 179.24 177.51 2igk h MET 522 N 1.09 0.93 -0.48 0.28 4.05 -0.50 0.14 114.93 120.43 2igk h MET 522 Ca 0.28 -0.06 -0.01 0.00 -0.28 0.00 0.00 59.70 59.64 2igk h MET 522 Cb -0.04 -0.21 -0.02 0.00 -0.80 0.00 0.00 31.60 30.53 2igk h MET 522 CO -0.05 0.61 0.25 0.00 0.23 0.00 0.00 176.91 177.95 2igk h VAL 524 N 0.63 1.34 -0.23 0.00 2.07 -0.91 -3.12 116.25 116.04 2igk h VAL 524 Ca 0.17 -1.12 -0.20 0.00 0.82 0.00 0.00 66.70 66.37 2igk h VAL 524 Cb 0.07 1.95 0.00 0.00 -1.52 0.00 0.00 31.29 31.79 2igk h VAL 524 CO -0.02 0.31 -0.63 -0.03 0.02 0.00 0.00 177.57 177.22 2igk h MET 525 N -0.25 0.81 0.00 1.57 -1.53 -0.66 -3.11 114.93 111.75 2igk h MET 525 Ca 0.01 -0.56 -0.04 0.00 -3.44 0.00 0.00 59.70 55.67 2igk h MET 525 Cb 0.52 0.09 -0.01 0.00 -0.55 0.00 0.00 31.60 31.65 2igk h MET 525 CO 0.01 1.19 -0.18 0.66 0.14 0.00 0.00 176.91 178.73 2igk h SER 526 N 0.60 0.00 0.35 1.39 4.64 -1.10 -2.13 113.55 117.30 2igk h SER 526 Ca -0.01 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.28 2igk h SER 526 Cb 1.24 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.32 2igk h SER 526 CO 0.13 0.18 -0.15 0.00 -0.87 0.00 0.00 176.83 176.13 2igk h ALA 527 N 1.82 1.35 0.00 5.18 0.00 -1.47 -0.36 119.26 125.78 2igk h ALA 527 Ca -0.00 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2igk h ALA 527 Cb 0.38 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.14 2igk h ALA 527 CO 0.02 0.18 0.00 0.87 0.00 0.00 0.00 179.25 180.33 2igk h LYS 528 N 0.00 0.00 0.00 0.00 1.57 -1.48 -3.29 116.57 113.37 2igk h LYS 528 Ca -0.00 0.00 -0.33 0.00 -1.87 0.00 0.00 60.65 58.45 2igk h LYS 528 Cb 0.36 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.61 2igk h LYS 528 CO 0.02 0.00 -2.24 -0.89 -0.57 0.00 0.00 179.45 175.77 2igk n ILE 529 N -2.95 1.24 0.00 1.86 2.08 -0.24 -4.98 119.36 116.37 2igk n ILE 529 Ca 0.00 -0.48 0.00 0.00 0.56 0.00 0.00 62.75 62.84 2igk n ILE 529 Cb 0.27 -1.27 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 2.46 0.46 3.81 7.39 0.00 -0.63 -0.94 105.19 117.75 2igk n GLY 530 Ca -0.38 -0.92 -0.30 0.00 0.00 0.00 0.00 46.02 44.42 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 1.62 0.50 -0.02 0.00 -1.21 -4.00 107.32 104.21 2igk s GLY 531 Ca 0.00 -0.22 -0.23 0.00 0.00 0.00 0.00 44.72 44.27 2igk s GLY 531 CO 0.00 0.21 1.35 -1.36 0.00 0.00 0.00 173.10 173.30 2igk s PHE 532 N -3.17 2.43 -0.17 1.90 0.08 -1.26 -1.22 117.98 116.56 2igk s PHE 532 Ca 0.61 1.37 -0.26 0.00 0.12 0.00 0.00 56.93 58.76 2igk s PHE 532 Cb -0.14 -3.77 -0.01 0.00 -0.57 0.00 0.00 43.02 38.52 2igk s PHE 532 CO 0.54 -2.70 0.88 -1.17 -0.10 0.00 0.00 175.22 172.67 2igk s LEU 533 N -3.20 4.17 0.24 -0.37 2.96 0.58 -4.67 118.68 118.39 2igk s LEU 533 Ca 0.67 1.23 -0.31 0.00 -0.22 0.00 0.00 54.13 55.51 2igk s LEU 533 Cb -0.40 -3.31 -0.14 0.00 0.50 0.00 0.00 46.19 42.84 2igk s LEU 533 CO 0.48 -0.44 1.19 -2.65 -1.32 0.00 0.00 176.35 173.61 2igk n PRO 534 N 5.36 1.51 0.00 0.98 -0.02 -1.26 -0.58 135.00 140.98 2igk n PRO 534 Ca 0.06 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 2igk n PRO 534 Cb 0.48 -2.04 0.00 0.00 -0.02 0.00 0.00 33.50 31.93 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 1.72 1.86 2.55 -1.23 0.00 -1.26 -4.81 105.19 104.02 2igk n GLY 535 Ca 0.12 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.96 2igk n GLY 535 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2igk n SER 536 N 0.00 2.43 -4.85 1.61 7.64 0.25 -5.07 113.62 115.63 2igk n SER 536 Ca 0.00 -3.13 -0.31 0.00 1.01 0.00 0.00 58.87 56.44 2igk n SER 536 Cb 0.00 -0.54 0.03 0.00 -1.01 0.00 0.00 64.21 62.69 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 -3.10 3.20 0.12 -3.43 1.43 -1.25 -1.46 118.68 114.19 2igk s LEU 537 Ca 0.38 1.51 -0.33 0.00 -1.03 0.00 0.00 54.13 54.66 2igk s LEU 537 Cb 0.40 -4.48 -0.13 0.00 0.03 0.00 0.00 46.19 42.01 2igk s LEU 537 CO -0.06 -1.11 1.70 -0.81 0.23 0.00 0.00 176.35 176.29 2igk n PRO 538 N -2.87 2.36 -3.55 1.29 -0.04 -1.26 -4.61 135.00 126.32 2igk n PRO 538 Ca 0.07 0.85 -0.17 0.00 -0.04 0.00 0.00 63.50 64.21 2igk n PRO 538 Cb 0.54 -2.67 -0.06 0.00 -0.04 0.00 0.00 33.50 31.26 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 1.82 1.01 0.19 0.54 -2.07 -0.74 -4.99 119.66 115.43 2igk s GLN 539 Ca 0.81 0.16 -0.30 0.00 -1.82 0.00 0.00 55.36 54.21 2igk s GLN 539 Cb -0.62 0.47 -0.08 0.00 -1.09 0.00 0.00 33.01 31.70 2igk s GLN 539 CO 0.39 -0.32 0.99 -0.06 -1.32 0.00 0.00 175.29 174.97 2igk s PHE 540 N -1.33 3.82 0.53 9.60 0.08 -1.26 -1.30 117.98 128.12 2igk s PHE 540 Ca -0.11 1.80 -0.15 0.00 0.12 0.00 0.00 56.93 58.60 2igk s PHE 540 Cb -0.01 -3.09 -0.07 0.00 -0.57 0.00 0.00 43.02 39.29 2igk s PHE 540 CO 0.08 0.09 0.98 -1.64 -0.10 0.00 0.00 175.22 174.63 2igk s MET 541 N -0.71 3.86 0.11 0.44 -1.94 -0.08 -4.95 119.30 116.04 2igk s MET 541 Ca 0.45 0.87 -0.35 0.00 -1.71 0.00 0.00 55.69 54.94 2igk s MET 541 Cb -0.26 -2.15 -0.17 0.00 2.01 0.00 0.00 34.83 34.26 2igk s MET 541 CO 0.33 -0.31 1.25 -1.91 -0.01 0.00 0.00 175.02 174.36 2igk n GLU 542 N -1.81 1.07 -1.68 2.03 2.13 -1.26 -4.76 120.64 116.37 2igk n GLU 542 Ca 0.06 0.38 -0.47 0.00 0.66 0.00 0.00 57.16 57.79 2igk n GLU 542 Cb 0.54 -1.96 -0.04 0.00 0.27 0.00 0.00 31.44 30.25 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 2.16 2.30 0.00 5.31 -0.02 -1.26 -1.54 135.00 141.94 2igk n PRO 543 Ca 0.17 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.49 2igk n PRO 543 Cb 0.21 -2.70 0.00 0.00 -0.02 0.00 0.00 33.50 30.99 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 4.34 0.90 0.27 -1.23 0.00 -1.26 -0.20 105.19 108.01 2igk n GLY 544 Ca 0.22 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.31 2igk n GLY 544 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2igk h LEU 545 N 0.00 0.08 -1.61 0.99 5.85 -1.32 -1.21 115.31 118.08 2igk h LEU 545 Ca 0.00 -0.00 0.16 0.00 0.84 0.00 0.00 57.88 58.88 2igk h LEU 545 Cb 0.00 -0.02 -0.05 0.00 0.37 0.00 0.00 40.66 40.96 2igk h LEU 545 CO 0.00 0.07 0.51 1.62 -0.34 0.00 0.00 178.44 180.30 2igk h VAL 546 N 0.09 0.77 -5.77 1.05 3.04 -1.88 -3.48 116.25 110.08 2igk h VAL 546 Ca 0.02 -0.13 -0.34 0.00 -1.01 0.00 0.00 66.70 65.25 2igk h VAL 546 Cb 0.01 0.36 0.14 0.00 -2.01 0.00 0.00 31.29 29.79 2igk h VAL 546 CO -0.00 0.07 -0.84 0.18 -1.01 0.00 0.00 177.57 175.96 2igk n LEU 547 N -4.47 -4.21 -1.97 3.16 4.77 -0.46 -4.95 117.00 108.87 2igk n LEU 547 Ca 0.15 -0.75 -0.13 0.00 -0.03 0.00 0.00 56.01 55.25 2igk n LEU 547 Cb 0.57 -2.95 0.05 0.00 -2.33 0.00 0.00 43.42 38.77 2igk n LEU 547 CO 0.33 0.30 0.16 1.41 -1.33 0.00 0.00 177.39 178.26 2igk n HIS 548 N -3.86 1.85 -1.68 -1.77 8.25 -1.26 -5.06 115.22 111.69 2igk n HIS 548 Ca -0.19 -2.00 -0.47 0.00 -0.26 0.00 0.00 57.72 54.80 2igk n HIS 548 Cb 0.64 -0.29 -0.04 0.00 1.12 0.00 0.00 29.99 31.42 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 -0.67 3.30 -4.41 2.41 7.94 -1.26 -4.56 117.00 119.74 2igk n LEU 549 Ca 0.30 1.02 -0.20 0.00 -1.11 0.00 0.00 56.01 56.01 2igk n LEU 549 Cb 0.90 -1.39 -0.10 0.00 0.53 0.00 0.00 43.42 43.35 2igk n LEU 549 CO 0.23 -0.15 -0.30 -0.83 -1.11 0.00 0.00 177.39 175.23 2igk s GLY 550 N 2.77 1.89 0.00 -3.96 0.00 -0.23 -4.22 107.32 103.56 2igk s GLY 550 Ca 0.87 -1.95 0.00 0.00 0.00 0.00 0.00 44.72 43.64 2igk s GLY 550 CO 0.46 -1.78 0.00 0.61 0.00 0.00 0.00 173.10 172.39 2igk n GLY 551 N -0.59 0.73 0.26 0.20 0.00 -0.84 -1.16 105.19 103.79 2igk n GLY 551 Ca -0.04 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.14 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 0.08 -1.36 2.61 1.35 -1.75 -3.32 112.91 110.52 2igk h THR 552 Ca 0.00 -0.71 -0.41 0.00 -0.55 0.00 0.00 66.41 64.74 2igk h THR 552 Cb 0.00 1.65 -0.32 0.00 -1.73 0.00 0.00 68.15 67.76 2igk h THR 552 CO 0.00 0.03 -0.95 0.00 -0.25 0.00 0.00 175.52 174.35 2igk n HIS 553 N -3.13 -0.88 -2.07 4.73 1.44 -0.41 -0.52 115.22 114.38 2igk n HIS 553 Ca 0.01 -3.23 -0.32 0.00 -2.01 0.00 0.00 57.72 52.17 2igk n HIS 553 Cb 0.37 0.25 0.00 0.00 0.12 0.00 0.00 29.99 30.73 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 -1.42 3.46 0.25 -1.40 1.70 -1.11 -3.95 118.95 116.48 2igk s ARG 554 Ca 0.34 1.08 -0.17 0.00 -0.47 0.00 0.00 55.73 56.52 2igk s ARG 554 Cb 0.31 -2.06 -0.08 0.00 -0.57 0.00 0.00 34.95 32.55 2igk s ARG 554 CO -0.08 -0.69 0.70 1.41 -1.08 0.00 0.00 175.30 175.56 2igk s MET 555 N -4.25 4.10 0.22 3.89 -2.45 0.12 -0.07 119.30 120.85 2igk s MET 555 Ca 0.61 0.71 -0.21 0.00 -1.25 0.00 0.00 55.69 55.56 2igk s MET 555 Cb -0.14 -2.71 0.07 0.00 1.25 0.00 0.00 34.83 33.31 2igk s MET 555 CO 0.38 0.31 1.00 0.20 1.05 0.00 0.00 175.02 177.97 2igk s GLY 556 N -1.93 0.17 0.06 2.11 0.00 -0.68 -4.57 107.32 102.48 2igk s GLY 556 Ca 0.47 -0.42 -0.15 0.00 0.00 0.00 0.00 44.72 44.61 2igk s GLY 556 CO 0.19 2.14 1.15 0.74 0.00 0.00 0.00 173.10 177.33 2igk h PHE 557 N 2.00 1.01 -3.22 1.90 0.04 -1.93 -3.35 116.94 113.39 2igk h PHE 557 Ca -0.28 -0.58 -0.54 0.00 2.80 0.00 0.00 57.97 59.37 2igk h PHE 557 Cb 1.22 -0.10 -0.36 0.00 2.20 0.00 0.00 35.95 38.91 2igk h PHE 557 CO 1.41 1.42 -0.81 0.34 -0.60 0.00 0.00 178.31 180.06 2igk s ASP 558 N -7.31 2.19 0.22 2.17 2.15 -1.26 -4.93 116.67 109.91 2igk s ASP 558 Ca -0.10 -0.33 -0.12 0.00 0.43 0.00 0.00 52.55 52.43 2igk s ASP 558 Cb 0.06 -0.90 0.29 0.00 -0.30 0.00 0.00 42.92 42.07 2igk s ASP 558 CO 0.92 -0.07 1.62 -0.08 -0.17 0.00 0.00 175.17 177.39 2igk h GLU 559 N 7.89 0.02 0.01 4.34 4.81 -1.88 -0.54 114.58 129.24 2igk h GLU 559 Ca -0.31 -0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 58.91 2igk h GLU 559 Cb 1.14 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.52 2igk h GLU 559 CO 0.44 0.01 -0.00 -0.22 -0.73 0.00 0.00 179.01 178.51 2igk h LYS 560 N 0.02 -0.01 -0.29 1.92 3.64 -1.97 -2.15 116.57 117.73 2igk h LYS 560 Ca 0.34 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.64 2igk h LYS 560 Cb 0.53 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.34 2igk h LYS 560 CO -0.68 0.80 -0.17 0.93 -2.27 0.00 0.00 179.45 178.06 2igk h GLU 561 N -0.94 0.52 -0.60 1.90 5.08 -1.97 -2.96 114.58 115.60 2igk h GLU 561 Ca -0.00 -0.17 0.00 0.00 -1.00 0.00 0.00 59.36 58.19 2igk h GLU 561 Cb 0.82 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.02 2igk h GLU 561 CO 0.00 0.67 0.00 -0.25 -1.00 0.00 0.00 179.01 178.44 2igk n ASP 562 N -4.17 4.01 -3.84 1.42 8.00 -0.22 -5.01 116.55 116.74 2igk n ASP 562 Ca 0.00 -2.20 -0.30 0.00 0.71 0.00 0.00 54.79 53.00 2igk n ASP 562 Cb 0.36 -0.47 0.01 0.00 -0.02 0.00 0.00 41.12 40.99 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 1.13 -4.77 -3.75 -2.24 4.13 -1.06 -4.83 115.26 103.86 2igk n ASN 563 Ca 0.22 -1.03 -0.12 0.00 1.68 0.00 0.00 54.58 55.33 2igk n ASN 563 Cb 0.69 -1.83 -0.06 0.00 -1.54 0.00 0.00 39.78 37.04 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 -1.94 1.64 0.08 0.00 -7.23 -0.99 -2.62 120.40 109.35 2igk s VAL 566 Ca 0.00 -2.15 -0.00 0.00 -1.81 0.00 0.00 61.98 58.02 2igk s VAL 566 Cb 0.00 -1.98 0.02 0.00 0.56 0.00 0.00 36.38 34.98 2igk s VAL 566 CO 0.00 -0.59 0.10 -0.46 -0.31 0.00 0.00 175.10 173.84 2igk n ASN 567 N -0.26 0.14 0.00 4.85 0.23 -0.53 -1.68 115.26 118.00 2igk n ASN 567 Ca -0.09 -1.12 0.11 0.00 -0.53 0.00 0.00 54.58 52.96 2igk n ASN 567 Cb 0.60 -0.07 0.63 0.00 -2.08 0.00 0.00 39.78 38.86 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 -1.54 0.17 0.43 5.53 -2.24 -1.26 -0.60 114.28 114.78 2igk n THR 568 Ca 0.02 0.04 0.11 0.00 -2.27 0.00 0.00 64.05 61.95 2igk n THR 568 Cb 0.06 -0.67 0.26 0.00 -2.10 0.00 0.00 70.33 67.88 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 -1.17 3.12 -1.66 3.42 8.00 -1.26 -4.73 116.55 122.26 2igk n ASP 569 Ca 0.14 -1.95 -0.17 0.00 0.71 0.00 0.00 54.79 53.52 2igk n ASP 569 Cb 0.14 -0.25 -0.04 0.00 -0.02 0.00 0.00 41.12 40.95 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 1.25 -5.03 -4.79 -2.24 7.64 0.23 -4.26 113.62 106.42 2igk n SER 570 Ca 0.19 0.17 -0.38 0.00 1.01 0.00 0.00 58.87 59.86 2igk n SER 570 Cb 0.54 -4.08 -0.06 0.00 -1.01 0.00 0.00 64.21 59.60 2igk n SER 570 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 2igk s ARG 571 N -4.24 4.14 0.08 1.43 3.52 -1.26 -1.55 118.95 121.07 2igk s ARG 571 Ca 0.00 0.52 -0.31 0.00 -0.13 0.00 0.00 55.73 55.81 2igk s ARG 571 Cb 0.00 -3.30 -0.08 0.00 -1.56 0.00 0.00 34.95 30.01 2igk s ARG 571 CO 0.00 0.50 1.50 0.08 -0.81 0.00 0.00 175.30 176.57 2igk s VAL 572 N -0.51 3.23 0.21 7.11 1.01 -0.32 -1.46 120.40 129.67 2igk s VAL 572 Ca 0.26 0.76 -0.32 0.00 0.00 0.00 0.00 61.98 62.69 2igk s VAL 572 Cb -0.17 -3.49 -0.15 0.00 0.00 0.00 0.00 36.38 32.58 2igk s VAL 572 CO 0.14 0.02 1.27 0.49 0.00 0.00 0.00 175.10 177.02 2igk n PHE 573 N 4.84 1.69 0.00 5.22 3.72 -1.08 -1.52 117.46 130.34 2igk n PHE 573 Ca 0.14 0.57 0.00 0.00 -0.05 0.00 0.00 57.45 58.10 2igk n PHE 573 Cb 0.41 -2.36 0.00 0.00 -0.94 0.00 0.00 39.48 36.59 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 2.04 2.90 3.40 1.37 0.00 -1.26 -5.00 105.19 108.64 2igk n GLY 574 Ca 0.13 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.80 2igk n GLY 574 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2igk s PHE 575 N -1.98 2.99 0.35 1.61 0.40 -0.58 -4.07 117.98 116.71 2igk s PHE 575 Ca 0.00 -0.62 0.12 0.00 -0.60 0.00 0.00 56.93 55.83 2igk s PHE 575 Cb 0.00 -2.06 0.63 0.00 0.51 0.00 0.00 43.02 42.09 2igk s PHE 575 CO 0.00 -0.33 1.77 0.87 0.70 0.00 0.00 175.22 178.24 2igk h LYS 576 N 7.59 0.01 0.00 0.44 1.57 -1.34 -3.37 116.57 121.47 2igk h LYS 576 Ca -0.36 -0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.39 2igk h LYS 576 Cb 1.18 -0.00 -0.05 0.00 0.08 0.00 0.00 32.23 33.44 2igk h LYS 576 CO 0.60 0.44 -0.40 0.27 -0.57 0.00 0.00 179.45 179.79 2igk n ASN 577 N -4.03 1.08 -4.07 0.86 6.94 -1.26 -5.02 115.26 109.76 2igk n ASN 577 Ca -0.02 -2.55 -0.30 0.00 -0.02 0.00 0.00 54.58 51.69 2igk n ASN 577 Cb 0.45 -0.32 -0.16 0.00 -2.36 0.00 0.00 39.78 37.39 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 -1.28 1.81 0.07 -4.53 2.96 -1.26 -0.99 118.68 115.47 2igk s LEU 578 Ca 0.19 -0.50 0.08 0.00 -0.22 0.00 0.00 54.13 53.68 2igk s LEU 578 Cb 0.18 -1.22 -0.03 0.00 0.50 0.00 0.00 46.19 45.62 2igk s LEU 578 CO -0.02 -0.00 -0.21 -0.36 -1.32 0.00 0.00 176.35 174.44 2igk s PHE 579 N 1.17 1.86 -0.05 5.38 0.40 -0.35 -1.18 117.98 125.21 2igk s PHE 579 Ca -0.01 -0.39 0.04 0.00 -0.60 0.00 0.00 56.93 55.97 2igk s PHE 579 Cb -0.14 -1.07 -0.02 0.00 0.51 0.00 0.00 43.02 42.30 2igk s PHE 579 CO -0.06 0.16 -0.17 -0.51 0.70 0.00 0.00 175.22 175.34 2igk s LEU 580 N -1.53 2.57 0.10 -0.37 1.43 -0.60 -0.69 118.68 119.60 2igk s LEU 580 Ca 0.08 -0.26 0.07 0.00 -1.03 0.00 0.00 54.13 52.98 2igk s LEU 580 Cb -0.09 -1.51 -0.03 0.00 0.03 0.00 0.00 46.19 44.58 2igk s LEU 580 CO 0.03 0.33 -0.18 -0.83 0.23 0.00 0.00 176.35 175.93 2igk s GLY 581 N -0.66 1.15 0.00 -3.19 0.00 -0.05 -4.81 107.32 99.76 2igk s GLY 581 Ca 0.10 -1.22 0.00 0.00 0.00 0.00 0.00 44.72 43.60 2igk s GLY 581 CO 0.00 -1.24 0.00 0.61 0.00 0.00 0.00 173.10 172.47 2igk n GLY 582 N 0.98 0.88 0.29 0.20 0.00 -1.26 -4.44 105.19 101.83 2igk n GLY 582 Ca -0.19 -2.22 0.13 0.00 0.00 0.00 0.00 46.02 43.75 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 0.07 0.00 2.00 0.00 0.00 -1.89 -1.51 103.07 101.74 2igk h GLY 584 Ca -0.00 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.23 2igk h GLY 584 CO 0.00 0.00 -0.46 3.43 0.00 0.00 0.00 176.54 179.51 2igk h ASN 585 N 0.00 0.00 -2.78 0.19 2.35 -1.43 -1.02 115.58 112.89 2igk h ASN 585 Ca 0.10 0.00 -0.56 0.00 -0.55 0.00 0.00 56.30 55.29 2igk h ASN 585 Cb 0.81 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 39.16 2igk h ASN 585 CO -0.00 0.46 1.03 -0.63 -1.65 0.00 0.00 177.43 176.65 2igk s ILE 586 N -3.28 3.87 -2.52 2.81 1.01 -0.58 0.12 121.20 122.62 2igk s ILE 586 Ca 0.02 1.03 0.25 0.00 0.00 0.00 0.00 60.65 61.95 2igk s ILE 586 Cb 0.09 -3.74 0.25 0.00 0.01 0.00 0.00 42.46 39.08 2igk s ILE 586 CO 0.72 -0.18 1.39 -0.81 0.00 0.00 0.00 174.94 176.06 2igk n PRO 587 N 7.13 1.75 -3.12 2.79 -0.04 -1.26 -1.98 135.00 140.27 2igk n PRO 587 Ca 0.16 -1.31 -0.18 0.00 -0.04 0.00 0.00 63.50 62.13 2igk n PRO 587 Cb 0.44 -1.47 0.01 0.00 -0.04 0.00 0.00 33.50 32.44 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 -2.16 2.81 -0.29 0.52 -4.23 -1.26 -4.81 115.64 106.22 2igk s THR 588 Ca 0.28 -1.06 -0.24 0.00 -1.18 0.00 0.00 61.69 59.49 2igk s THR 588 Cb 0.20 -2.87 0.00 0.00 1.34 0.00 0.00 72.50 71.16 2igk s THR 588 CO 0.39 0.00 0.82 0.00 -0.54 0.00 0.00 174.62 175.29 2igk s ALA 589 N -2.42 3.56 0.03 3.99 0.00 -1.26 -4.83 121.76 120.83 2igk s ALA 589 Ca 0.54 -0.31 0.04 0.00 0.00 0.00 0.00 51.96 52.23 2igk s ALA 589 Cb -0.08 -3.33 -0.02 0.00 0.00 0.00 0.00 23.12 19.69 2igk s ALA 589 CO 0.33 -1.15 -0.12 1.52 0.00 0.00 0.00 175.76 176.34 2igk s TYR 590 N 2.98 1.04 -0.15 0.00 1.13 -1.26 -4.53 117.35 116.56 2igk s TYR 590 Ca 0.34 -0.33 0.13 0.00 -1.41 0.00 0.00 57.07 55.80 2igk s TYR 590 Cb -0.14 -0.62 -0.19 0.00 -1.10 0.00 0.00 41.96 39.91 2igk s TYR 590 CO 0.11 0.01 0.04 0.41 -2.51 0.00 0.00 175.55 173.61 2igk n GLY 591 N 2.02 -0.73 3.76 5.49 0.00 -1.26 -4.09 105.19 110.38 2igk n GLY 591 Ca -0.18 -0.25 -0.32 0.00 0.00 0.00 0.00 46.02 45.27 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 -2.37 2.29 0.05 4.61 0.00 -1.26 -4.41 121.76 120.67 2igk s ALA 592 Ca -0.09 0.38 -0.31 0.00 0.00 0.00 0.00 51.96 51.95 2igk s ALA 592 Cb 0.05 -3.30 -0.08 0.00 0.00 0.00 0.00 23.12 19.79 2igk s ALA 592 CO 0.62 -1.66 1.64 -0.80 0.00 0.00 0.00 175.76 175.56 2igk s ASN 593 N -3.08 6.63 0.18 0.00 -0.87 -1.26 -4.91 114.94 111.63 2igk s ASN 593 Ca 0.63 2.43 0.26 0.00 -1.57 0.00 0.00 52.86 54.62 2igk s ASN 593 Cb -0.19 -2.56 0.87 0.00 -0.02 0.00 0.00 41.25 39.36 2igk s ASN 593 CO 0.51 -0.88 1.79 -0.81 -2.57 0.00 0.00 177.10 175.15 2igk n PRO 594 N 5.75 0.22 -0.17 -0.60 -0.04 -1.26 -4.41 135.00 134.50 2igk n PRO 594 Ca 0.16 0.19 -0.05 0.00 -0.04 0.00 0.00 63.50 63.76 2igk n PRO 594 Cb 0.41 -1.77 0.05 0.00 -0.04 0.00 0.00 33.50 32.15 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 0.99 -0.86 0.52 2.02 -1.90 -1.26 112.91 112.41 2igk h THR 595 Ca 0.00 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 67.00 2igk h THR 595 Cb 0.69 0.40 -0.04 0.00 -1.74 0.00 0.00 68.15 67.47 2igk h THR 595 CO 0.00 0.10 0.54 0.25 0.37 0.00 0.00 175.52 176.77 2igk h LEU 596 N 0.54 1.01 -0.41 2.58 5.85 -1.87 0.67 115.31 123.68 2igk h LEU 596 Ca 0.22 -0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.86 2igk h LEU 596 Cb 0.10 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.86 2igk h LEU 596 CO -0.14 0.76 0.12 0.74 -0.34 0.00 0.00 178.44 179.58 2igk h THR 597 N 1.18 1.22 -0.84 1.05 2.02 -1.61 -1.48 112.91 114.45 2igk h THR 597 Ca 0.31 -0.75 -0.01 0.00 0.77 0.00 0.00 66.41 66.73 2igk h THR 597 Cb -0.08 0.93 -0.04 0.00 -1.74 0.00 0.00 68.15 67.22 2igk h THR 597 CO -0.06 0.26 0.50 0.00 0.37 0.00 0.00 175.52 176.59 2igk h ALA 598 N 0.97 1.07 -0.46 6.16 0.00 -0.56 -1.93 119.26 124.51 2igk h ALA 598 Ca 0.13 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2igk h ALA 598 Cb 0.28 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2igk h ALA 598 CO -0.00 0.53 0.31 1.98 0.00 0.00 0.00 179.25 182.07 2igk h MET 599 N 1.15 0.61 -0.88 0.00 -1.53 -0.73 -1.33 114.93 112.22 2igk h MET 599 Ca 0.30 -0.04 0.05 0.00 -3.44 0.00 0.00 59.70 56.58 2igk h MET 599 Cb -0.04 -0.14 -0.06 0.00 -0.55 0.00 0.00 31.60 30.81 2igk h MET 599 CO -0.06 0.40 0.56 0.77 0.14 0.00 0.00 176.91 178.72 2igk h SER 600 N 0.62 0.89 -0.32 1.39 0.02 -0.96 0.58 113.55 115.77 2igk h SER 600 Ca 0.17 0.01 -0.06 0.00 -0.84 0.00 0.00 61.79 61.06 2igk h SER 600 Cb -0.07 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.26 2igk h SER 600 CO -0.04 0.59 -0.01 -0.07 -1.14 0.00 0.00 176.83 176.16 2igk h LEU 601 N 1.04 0.65 -0.50 5.07 3.38 -1.05 -2.49 115.31 121.40 2igk h LEU 601 Ca 0.37 -0.15 -0.17 0.00 0.09 0.00 0.00 57.88 58.03 2igk h LEU 601 Cb 0.11 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 2igk h LEU 601 CO -0.15 0.72 -0.61 0.00 0.09 0.00 0.00 178.44 178.49 2igk h ALA 602 N 1.35 0.69 -0.31 1.53 0.00 -0.07 -0.81 119.26 121.64 2igk h ALA 602 Ca 0.13 -0.55 0.02 0.00 0.00 0.00 0.00 54.91 54.52 2igk h ALA 602 Cb 0.41 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 2igk h ALA 602 CO 0.02 0.71 0.14 0.82 0.00 0.00 0.00 179.25 180.94 2igk h ILE 603 N 0.34 0.97 -0.73 0.00 2.04 -0.76 -0.86 117.51 118.51 2igk h ILE 603 Ca -0.01 -0.10 -0.02 0.00 1.00 0.00 0.00 64.86 65.73 2igk h ILE 603 Cb 1.16 0.64 -0.03 0.00 -0.74 0.00 0.00 36.82 37.85 2igk h ILE 603 CO 0.11 0.05 0.36 0.50 0.00 0.00 0.00 178.15 179.17 2igk h LYS 604 N 0.30 1.03 -0.82 2.37 3.64 -1.25 -2.19 116.57 119.65 2igk h LYS 604 Ca 0.13 -0.14 -0.04 0.00 -1.27 0.00 0.00 60.65 59.33 2igk h LYS 604 Cb 0.06 -0.19 -0.04 0.00 -0.41 0.00 0.00 32.23 31.65 2igk h LYS 604 CO -0.10 0.79 0.34 1.03 -2.27 0.00 0.00 179.45 179.24 2igk h SER 605 N 1.03 1.11 -0.06 4.20 0.87 -0.69 -2.43 113.55 117.58 2igk h SER 605 Ca 0.25 -0.17 -0.08 0.00 -1.23 0.00 0.00 61.79 60.56 2igk h SER 605 Cb 0.09 -0.29 -0.01 0.00 -0.44 0.00 0.00 62.40 61.75 2igk h SER 605 CO -0.03 0.97 -0.21 0.00 -0.53 0.00 0.00 176.83 177.03 2igk h GLU 607 N 0.40 0.96 -0.22 0.00 5.08 -0.93 -0.56 114.58 119.32 2igk h GLU 607 Ca 0.07 -0.15 -0.05 0.00 -1.00 0.00 0.00 59.36 58.23 2igk h GLU 607 Cb 0.59 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.67 2igk h GLU 607 CO 0.04 0.78 -0.05 -0.92 -1.00 0.00 0.00 179.01 177.85 2igk h TYR 608 N 0.94 0.47 -0.88 4.33 5.03 -1.09 -2.68 116.97 123.10 2igk h TYR 608 Ca 0.22 -0.10 0.00 0.00 2.58 0.00 0.00 58.73 61.44 2igk h TYR 608 Cb 0.17 -0.12 -0.04 0.00 1.55 0.00 0.00 36.73 38.29 2igk h TYR 608 CO 0.01 0.66 0.57 0.82 -1.32 0.00 0.00 178.16 178.90 2igk h ILE 609 N 0.15 1.23 0.00 1.81 2.04 -0.94 -2.21 117.51 119.60 2igk h ILE 609 Ca 0.06 -0.44 -0.05 0.00 1.00 0.00 0.00 64.86 65.42 2igk h ILE 609 Cb 0.51 -0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.54 2igk h ILE 609 CO 0.02 0.23 -0.24 0.11 0.00 0.00 0.00 178.15 178.27 2igk h LYS 610 N 1.19 0.00 0.00 2.37 1.57 -1.03 -1.50 116.57 119.17 2igk h LYS 610 Ca 0.32 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.10 2igk h LYS 610 Cb -0.11 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.20 2igk h LYS 610 CO -0.07 0.24 -0.33 1.04 -0.57 0.00 0.00 179.45 179.76 2igk n GLN 611 N -3.87 0.03 0.00 3.15 6.02 -0.87 -4.41 117.38 117.43 2igk n GLN 611 Ca -0.02 0.01 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 2igk n GLN 611 Cb 0.33 -1.52 0.00 0.00 1.02 0.00 0.00 30.24 30.06 2igk n GLN 611 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2igk n ASN 612 N -1.57 0.43 -3.84 1.08 3.02 -0.79 -5.02 115.26 108.57 2igk n ASN 612 Ca 0.06 -0.79 -0.13 0.00 -0.03 0.00 0.00 54.58 53.69 2igk n ASN 612 Cb 0.35 0.18 -0.14 0.00 -0.61 0.00 0.00 39.78 39.56 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 -0.18 -0.04 -0.20 3.10 0.08 -0.63 -5.06 117.98 115.04 2igk s PHE 613 Ca 0.00 0.13 -0.08 0.00 0.12 0.00 0.00 56.93 57.11 2igk s PHE 613 Cb 0.00 -0.02 -0.04 0.00 -0.57 0.00 0.00 43.02 42.39 2igk s PHE 613 CO 0.00 -0.04 0.07 0.99 -0.10 0.00 0.00 175.22 176.14 2igk s THR 614 N 0.22 4.74 0.37 0.64 2.01 -1.26 -4.69 115.64 117.67 2igk s THR 614 Ca -0.02 -0.05 -0.28 0.00 0.31 0.00 0.00 61.69 61.66 2igk s THR 614 Cb -0.03 -3.15 -0.10 0.00 0.01 0.00 0.00 72.50 69.23 2igk s THR 614 CO -0.01 0.43 1.41 -2.84 -0.69 0.00 0.00 174.62 172.92 2igk s PRO 615 N 0.63 4.15 0.73 4.92 0.02 -1.26 -4.97 135.00 139.22 2igk s PRO 615 Ca 0.04 2.41 -0.15 0.00 0.02 0.00 0.00 61.00 63.32 2igk s PRO 615 Cb -0.13 -2.97 0.04 0.00 0.02 0.00 0.00 34.50 31.46 2igk s PRO 615 CO 0.01 -0.43 1.19 -1.54 -0.33 0.00 0.00 177.00 175.90 2igk s SER 616 N -0.33 4.27 0.15 2.53 1.04 -1.26 -4.94 113.70 115.16 2igk s SER 616 Ca 0.52 2.28 -0.31 0.00 0.48 0.00 0.00 55.95 58.93 2igk s SER 616 Cb -0.43 -2.58 -0.08 0.00 0.10 0.00 0.00 66.02 63.03 2igk s SER 616 CO 0.58 -2.21 1.33 -2.84 0.98 0.00 0.00 173.24 171.09 2igk s PRO 617 N -4.00 4.36 -0.84 4.02 0.02 -1.26 -4.89 135.00 132.42 2igk s PRO 617 Ca 0.73 2.03 -0.26 0.00 0.02 0.00 0.00 61.00 63.52 2igk s PRO 617 Cb -0.27 -3.23 0.04 0.00 0.02 0.00 0.00 34.50 31.05 2igk s PRO 617 CO 0.45 -0.34 1.33 0.12 -0.33 0.00 0.00 177.00 178.24 2igk s PHE 618 N 0.66 2.38 -0.91 6.54 5.36 -1.26 -5.14 117.98 125.61 2igk s PHE 618 Ca 0.60 -0.34 0.07 0.00 -0.96 0.00 0.00 56.93 56.31 2igk s PHE 618 Cb -0.36 -4.65 0.06 0.00 -0.34 0.00 0.00 43.02 37.73 2igk s PHE 618 CO 0.34 -2.02 0.73 -2.37 -1.46 0.00 0.00 175.22 170.43