#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qta s SER 57 N 0.00 5.16 0.76 4.38 1.04 -1.26 -5.08 113.70 118.70 2qta s SER 57 Ca 0.00 -0.79 -0.15 0.00 0.48 0.00 0.00 55.95 55.49 2qta s SER 57 Cb 0.00 -0.03 0.03 0.00 0.10 0.00 0.00 66.02 66.12 2qta s SER 57 CO 0.00 -1.08 1.02 0.59 0.98 0.00 0.00 173.24 174.76 2qta n ASN 58 N -1.99 0.57 -2.96 7.02 3.02 -1.26 -4.83 115.26 114.83 2qta n ASN 58 Ca 0.10 0.63 -0.32 0.00 -0.03 0.00 0.00 54.58 54.95 2qta n ASN 58 Cb 0.61 -1.43 -0.07 0.00 -0.61 0.00 0.00 39.78 38.28 2qta n ASN 58 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2qta n TYR 59 N -2.81 1.78 -4.24 3.10 9.36 -1.26 -4.82 117.16 118.27 2qta n TYR 59 Ca 0.13 -2.66 -0.17 0.00 3.32 0.00 0.00 57.90 58.52 2qta n TYR 59 Cb 0.50 -2.23 -0.08 0.00 -0.63 0.00 0.00 39.34 36.89 2qta n TYR 59 CO 0.00 0.00 0.00 0.96 0.22 0.00 0.00 176.86 178.04 2qta s ILE 60 N 1.73 0.00 0.36 2.97 -4.36 -1.26 -4.81 121.20 115.83 2qta s ILE 60 Ca 0.69 -1.97 -0.28 0.00 -0.26 0.00 0.00 60.65 58.83 2qta s ILE 60 Cb 0.22 -2.51 -0.11 0.00 1.25 0.00 0.00 42.46 41.31 2qta s ILE 60 CO -0.05 0.00 1.50 0.20 0.24 0.00 0.00 174.94 176.83 2qta s ASN 61 N -3.30 6.37 0.28 4.36 0.01 -1.26 -4.69 114.94 116.70 2qta s ASN 61 Ca 0.39 3.01 0.03 0.00 -0.71 0.00 0.00 52.86 55.58 2qta s ASN 61 Cb 0.03 -2.66 0.40 0.00 0.41 0.00 0.00 41.25 39.43 2qta s ASN 61 CO 0.23 -0.86 1.70 0.74 -1.51 0.00 0.00 177.10 177.40 2qta h THR 62 N 3.06 1.28 -3.35 1.60 2.02 -1.74 -3.39 112.91 112.39 2qta h THR 62 Ca -0.50 -1.34 -0.73 0.00 0.77 0.00 0.00 66.41 64.61 2qta h THR 62 Cb 1.23 1.43 -0.24 0.00 -1.74 0.00 0.00 68.15 68.83 2qta h THR 62 CO 0.67 0.42 -0.37 -0.63 0.37 0.00 0.00 175.52 175.98 2qta s ILE 63 N -4.41 4.95 0.66 3.11 1.01 -1.26 -5.01 121.20 120.25 2qta s ILE 63 Ca -0.07 -1.15 -0.16 0.00 0.00 0.00 0.00 60.65 59.27 2qta s ILE 63 Cb 0.14 -3.98 0.00 0.00 0.01 0.00 0.00 42.46 38.63 2qta s ILE 63 CO 0.79 -0.56 1.15 -2.16 0.00 0.00 0.00 174.94 174.16 2qta s PRO 64 N 1.58 2.67 0.52 2.79 0.04 -1.26 -4.83 135.00 136.51 2qta s PRO 64 Ca 0.04 1.56 0.24 0.00 0.04 0.00 0.00 61.00 62.87 2qta s PRO 64 Cb -0.24 -1.92 1.35 0.00 0.04 0.00 0.00 34.50 33.73 2qta s PRO 64 CO 0.05 -1.38 1.99 -0.24 0.04 0.00 0.00 177.00 177.46 2qta h VAL 65 N 0.12 0.75 0.00 -0.36 3.04 -1.95 -0.31 116.25 117.54 2qta h VAL 65 Ca -0.48 -0.02 0.00 0.00 -1.01 0.00 0.00 66.70 65.19 2qta h VAL 65 Cb 1.27 0.69 0.00 0.00 -2.01 0.00 0.00 31.29 31.23 2qta h VAL 65 CO 0.53 0.01 0.00 -0.33 -1.01 0.00 0.00 177.57 176.77 2qta h GLU 66 N 0.06 0.00 -0.31 4.17 3.07 -2.03 -1.76 114.58 117.77 2qta h GLU 66 Ca 0.26 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.12 2qta h GLU 66 Cb 0.96 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.87 2qta h GLU 66 CO -0.02 0.00 0.00 0.39 -1.40 0.00 0.00 179.01 177.98 2qta n GLU 67 N -3.08 2.88 -2.95 2.33 1.02 -0.14 -4.98 120.64 115.72 2qta n GLU 67 Ca -0.01 -2.02 -0.42 0.00 -0.02 0.00 0.00 57.16 54.69 2qta n GLU 67 Cb 0.18 -1.26 -0.05 0.00 -0.02 0.00 0.00 31.44 30.29 2qta n GLU 67 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 2qta s GLN 68 N -1.06 3.97 0.68 3.49 0.74 -0.66 -4.93 119.66 121.89 2qta s GLN 68 Ca 0.22 0.59 -0.16 0.00 0.05 0.00 0.00 55.36 56.05 2qta s GLN 68 Cb 0.12 -3.72 0.01 0.00 1.10 0.00 0.00 33.01 30.51 2qta s GLN 68 CO 0.14 -0.66 1.17 -1.25 -0.55 0.00 0.00 175.29 174.14 2qta s PRO 69 N 2.93 2.55 0.32 1.67 0.04 -1.26 -4.94 135.00 136.30 2qta s PRO 69 Ca 0.32 1.64 -0.29 0.00 0.04 0.00 0.00 61.00 62.71 2qta s PRO 69 Cb -0.14 -1.90 -0.11 0.00 0.04 0.00 0.00 34.50 32.39 2qta s PRO 69 CO 0.12 -1.50 1.52 -1.21 0.04 0.00 0.00 177.00 175.97 2qta s GLU 70 N -3.84 4.15 0.03 4.56 0.41 -1.26 -4.89 118.70 117.86 2qta s GLU 70 Ca 0.72 2.51 -0.30 0.00 -0.41 0.00 0.00 54.97 57.49 2qta s GLU 70 Cb -0.26 -3.02 -0.05 0.00 -1.78 0.00 0.00 34.13 29.02 2qta s GLU 70 CO 0.41 -0.54 1.20 -0.47 -0.49 0.00 0.00 175.26 175.38 2qta s TYR 71 N -0.46 3.36 -1.82 1.61 5.04 -1.26 -4.94 117.35 118.88 2qta s TYR 71 Ca 0.58 1.27 0.29 0.00 -2.44 0.00 0.00 57.07 56.77 2qta s TYR 71 Cb -0.46 -3.42 1.26 0.00 0.35 0.00 0.00 41.96 39.68 2qta s TYR 71 CO 0.53 -1.30 1.87 -0.35 -1.34 0.00 0.00 175.55 174.96 2qta n PRO 72 N 4.29 0.87 -3.32 4.97 -0.04 -1.26 -4.94 135.00 135.57 2qta n PRO 72 Ca 0.09 -0.32 -0.21 0.00 -0.04 0.00 0.00 63.50 63.03 2qta n PRO 72 Cb 0.46 -1.49 0.02 0.00 -0.04 0.00 0.00 33.50 32.45 2qta n PRO 72 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2qta s GLY 73 N -2.35 1.99 -0.72 0.55 0.00 -1.26 -5.05 107.32 100.48 2qta s GLY 73 Ca 0.32 -1.82 -0.19 0.00 0.00 0.00 0.00 44.72 43.03 2qta s GLY 73 CO 0.45 -1.71 0.88 0.21 0.00 0.00 0.00 173.10 172.92 2qta s ASN 74 N -4.43 6.35 0.18 1.64 3.84 -1.26 -4.94 114.94 116.32 2qta s ASN 74 Ca 0.52 -1.60 -0.15 0.00 0.21 0.00 0.00 52.86 51.84 2qta s ASN 74 Cb -0.05 -2.35 0.15 0.00 -0.55 0.00 0.00 41.25 38.46 2qta s ASN 74 CO 0.32 -1.14 1.68 -0.07 -2.79 0.00 0.00 177.10 175.10 2qta h LEU 75 N 10.23 -0.28 -0.77 3.21 3.38 -1.96 0.10 115.31 129.21 2qta h LEU 75 Ca -0.14 0.12 -0.08 0.00 0.09 0.00 0.00 57.88 57.87 2qta h LEU 75 Cb 1.06 0.23 -0.02 0.00 0.09 0.00 0.00 40.66 42.02 2qta h LEU 75 CO 1.09 -0.10 0.04 -0.08 0.09 0.00 0.00 178.44 179.49 2qta h GLU 76 N 0.07 0.97 -0.25 1.13 4.22 -1.99 -0.34 114.58 118.40 2qta h GLU 76 Ca 0.23 -0.27 -0.12 0.00 0.08 0.00 0.00 59.36 59.28 2qta h GLU 76 Cb 0.35 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.49 2qta h GLU 76 CO -0.42 0.93 -0.33 1.25 -2.18 0.00 0.00 179.01 178.27 2qta h LEU 77 N 0.91 0.71 -1.13 1.64 5.85 -1.91 -2.38 115.31 119.00 2qta h LEU 77 Ca 0.17 -0.50 0.01 0.00 0.84 0.00 0.00 57.88 58.40 2qta h LEU 77 Cb 0.47 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.25 2qta h LEU 77 CO 0.02 1.07 0.59 -0.33 -0.34 0.00 0.00 178.44 179.45 2qta h GLU 78 N 0.37 1.16 -0.30 1.25 5.08 -0.80 -1.17 114.58 120.17 2qta h GLU 78 Ca 0.03 -0.07 -0.07 0.00 -1.00 0.00 0.00 59.36 58.25 2qta h GLU 78 Cb 0.91 -0.26 -0.02 0.00 0.50 0.00 0.00 28.75 29.88 2qta h GLU 78 CO 0.08 0.76 -0.12 -0.09 -1.00 0.00 0.00 179.01 178.64 2qta h ARG 79 N 1.19 0.50 -0.52 2.33 1.12 -0.90 -0.80 114.38 117.30 2qta h ARG 79 Ca 0.33 -0.14 -0.04 0.00 -1.11 0.00 0.00 59.98 59.02 2qta h ARG 79 Cb -0.12 -0.05 -0.02 0.00 -0.01 0.00 0.00 29.97 29.77 2qta h ARG 79 CO -0.08 0.62 0.18 0.00 -3.11 0.00 0.00 179.97 177.58 2qta h ARG 80 N 0.46 0.81 -0.24 0.20 3.08 -0.71 -0.15 114.38 117.83 2qta h ARG 80 Ca 0.09 -0.17 -0.03 0.00 0.07 0.00 0.00 59.98 59.94 2qta h ARG 80 Cb 0.49 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.41 2qta h ARG 80 CO 0.03 0.74 0.03 0.82 -1.07 0.00 0.00 179.97 180.51 2qta h ILE 81 N 0.71 1.24 -0.96 2.04 2.04 -1.10 -2.77 117.51 118.71 2qta h ILE 81 Ca 0.17 -0.81 0.01 0.00 1.00 0.00 0.00 64.86 65.23 2qta h ILE 81 Cb 0.26 1.30 -0.05 0.00 -0.74 0.00 0.00 36.82 37.59 2qta h ILE 81 CO -0.01 0.26 0.63 -0.09 0.00 0.00 0.00 178.15 178.94 2qta h ARG 82 N 0.20 1.26 -0.54 2.37 2.43 -0.99 -1.26 114.38 117.86 2qta h ARG 82 Ca 0.07 -0.08 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 2qta h ARG 82 Cb 0.36 -0.28 -0.03 0.00 -0.42 0.00 0.00 29.97 29.60 2qta h ARG 82 CO 0.01 0.83 0.26 0.77 -1.51 0.00 0.00 179.97 180.33 2qta h SER 83 N 1.30 0.68 -0.37 -3.80 0.02 -0.93 0.13 113.55 110.58 2qta h SER 83 Ca 0.35 -0.06 -0.14 0.00 -0.84 0.00 0.00 61.79 61.10 2qta h SER 83 Cb -0.15 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.21 2qta h SER 83 CO -0.08 0.58 -0.30 0.00 -1.14 0.00 0.00 176.83 175.89 2qta h ALA 84 N 1.53 0.54 -0.31 3.77 0.00 -1.04 -1.27 119.26 122.48 2qta h ALA 84 Ca 0.19 -0.42 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 2qta h ALA 84 Cb 0.07 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2qta h ALA 84 CO -0.03 0.58 0.12 0.82 0.00 0.00 0.00 179.25 180.74 2qta h ILE 85 N 0.66 1.18 -0.40 0.00 2.04 -0.57 0.37 117.51 120.80 2qta h ILE 85 Ca 0.07 -0.55 0.03 0.00 1.00 0.00 0.00 64.86 65.41 2qta h ILE 85 Cb 0.88 0.96 -0.03 0.00 -0.74 0.00 0.00 36.82 37.89 2qta h ILE 85 CO 0.08 0.19 0.20 0.03 0.00 0.00 0.00 178.15 178.65 2qta h ARG 86 N 0.35 0.40 0.24 2.37 3.08 -0.68 -1.74 114.38 118.41 2qta h ARG 86 Ca 0.10 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.12 2qta h ARG 86 Cb 0.18 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 2qta h ARG 86 CO -0.01 0.27 -0.16 2.35 -1.07 0.00 0.00 179.97 181.35 2qta h TRP 87 N 0.42 -0.42 -0.37 3.04 2.91 -0.98 -2.14 115.95 118.40 2qta h TRP 87 Ca 0.17 -0.00 -0.02 0.00 1.13 0.00 0.00 58.89 60.16 2qta h TRP 87 Cb 0.06 0.15 -0.02 0.00 -0.51 0.00 0.00 29.16 28.85 2qta h TRP 87 CO -0.10 -0.25 0.13 -0.91 -1.03 0.00 0.00 178.44 176.29 2qta h ASN 88 N -0.40 0.48 -0.07 2.65 2.35 -0.79 0.68 115.58 120.48 2qta h ASN 88 Ca -0.02 -0.05 -0.00 0.00 -0.55 0.00 0.00 56.30 55.68 2qta h ASN 88 Cb 0.34 -0.12 -0.00 0.00 0.05 0.00 0.00 38.32 38.59 2qta h ASN 88 CO 0.01 0.45 0.03 0.00 -1.65 0.00 0.00 177.43 176.27 2qta h ALA 89 N 1.63 0.09 -0.56 -0.83 0.00 -1.15 0.22 119.26 118.65 2qta h ALA 89 Ca 0.13 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 2qta h ALA 89 Cb 0.13 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2qta h ALA 89 CO -0.01 -0.35 0.22 0.82 0.00 0.00 0.00 179.25 179.93 2qta h ILE 90 N -0.03 1.23 -0.47 0.00 2.04 -0.95 -2.41 117.51 116.93 2qta h ILE 90 Ca 0.02 -0.71 0.04 0.00 1.00 0.00 0.00 64.86 65.21 2qta h ILE 90 Cb 0.13 0.63 -0.04 0.00 -0.74 0.00 0.00 36.82 36.81 2qta h ILE 90 CO -0.00 0.27 0.24 0.24 0.00 0.00 0.00 178.15 178.90 2qta h MET 91 N 0.78 0.45 -0.15 2.37 2.86 -0.71 0.33 114.93 120.85 2qta h MET 91 Ca 0.19 -0.03 0.04 0.00 -2.06 0.00 0.00 59.70 57.84 2qta h MET 91 Cb 0.21 -0.10 -0.05 0.00 0.06 0.00 0.00 31.60 31.72 2qta h MET 91 CO -0.01 0.30 -0.15 1.15 1.06 0.00 0.00 176.91 179.26 2qta h THR 92 N 0.47 0.59 -0.44 2.22 2.02 -0.61 0.69 112.91 117.85 2qta h THR 92 Ca 0.20 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 67.31 2qta h THR 92 Cb 0.11 0.59 -0.02 0.00 -1.74 0.00 0.00 68.15 67.09 2qta h THR 92 CO -0.14 0.00 -0.01 0.58 0.37 0.00 0.00 175.52 176.32 2qta h VAL 93 N -0.17 1.26 -0.73 3.16 2.07 -1.21 -2.39 116.25 118.23 2qta h VAL 93 Ca 0.10 -1.06 -0.06 0.00 0.82 0.00 0.00 66.70 66.50 2qta h VAL 93 Cb 0.32 1.07 -0.03 0.00 -1.52 0.00 0.00 31.29 31.14 2qta h VAL 93 CO -0.26 0.36 0.21 -0.07 0.02 0.00 0.00 177.57 177.83 2qta h LEU 94 N 0.63 1.08 -1.15 2.57 3.38 -0.61 -0.26 115.31 120.95 2qta h LEU 94 Ca 0.12 -0.22 -0.06 0.00 0.09 0.00 0.00 57.88 57.82 2qta h LEU 94 Cb 0.51 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 2qta h LEU 94 CO 0.03 1.02 -0.02 0.03 0.09 0.00 0.00 178.44 179.59 2qta h ARG 95 N 1.09 0.57 -0.25 1.13 3.08 -0.81 0.44 114.38 119.63 2qta h ARG 95 Ca 0.23 -0.13 -0.03 0.00 0.07 0.00 0.00 59.98 60.11 2qta h ARG 95 Cb 0.34 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 2qta h ARG 95 CO -0.00 0.61 0.02 0.00 -1.07 0.00 0.00 179.97 179.52 2qta h ALA 96 N 1.45 0.33 -0.82 0.04 0.00 -0.88 -2.81 119.26 116.57 2qta h ALA 96 Ca 0.11 -0.20 0.10 0.00 0.00 0.00 0.00 54.91 54.92 2qta h ALA 96 Cb 0.37 -0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.00 2qta h ALA 96 CO 0.01 0.04 0.46 1.03 0.00 0.00 0.00 179.25 180.80 2qta h SER 97 N 0.21 0.66 -1.00 0.00 0.87 -0.47 -1.86 113.55 111.96 2qta h SER 97 Ca 0.07 0.05 0.34 0.00 -1.23 0.00 0.00 61.79 61.02 2qta h SER 97 Cb 0.38 -0.07 -0.16 0.00 -0.44 0.00 0.00 62.40 62.11 2qta h SER 97 CO 0.01 0.37 0.56 0.07 -0.53 0.00 0.00 176.83 177.31 2qta h LYS 98 N 0.77 0.24 0.00 2.24 2.10 -0.65 -0.10 116.57 121.17 2qta h LYS 98 Ca 0.40 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 59.03 2qta h LYS 98 Cb 0.38 -0.05 0.00 0.00 -0.90 0.00 0.00 32.23 31.65 2qta h LYS 98 CO -0.25 0.16 0.00 0.87 -2.00 0.00 0.00 179.45 178.23 2qta h LYS 99 N 0.25 0.00 -5.94 0.07 1.57 -1.38 -3.46 116.57 107.68 2qta h LYS 99 Ca 0.76 0.00 -0.39 0.00 -1.87 0.00 0.00 60.65 59.15 2qta h LYS 99 Cb 1.79 0.00 0.09 0.00 0.08 0.00 0.00 32.23 34.19 2qta h LYS 99 CO -0.64 0.00 -0.79 -3.47 -0.57 0.00 0.00 179.45 173.97 2qta n ASP 100 N -3.05 -2.08 -0.27 0.86 2.03 -0.05 -4.90 116.55 109.10 2qta n ASP 100 Ca 0.00 -0.73 0.09 0.00 0.52 0.00 0.00 54.79 54.68 2qta n ASP 100 Cb 0.29 -4.47 0.17 0.00 -0.72 0.00 0.00 41.12 36.38 2qta n ASP 100 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2qta n LEU 101 N -4.30 2.68 -3.95 -2.67 4.77 -1.26 -4.97 117.00 107.28 2qta n LEU 101 Ca -0.25 -3.14 -0.30 0.00 -0.03 0.00 0.00 56.01 52.29 2qta n LEU 101 Cb 0.66 -0.46 0.02 0.00 -2.33 0.00 0.00 43.42 41.30 2qta n LEU 101 CO 0.66 0.76 0.06 -0.62 -1.33 0.00 0.00 177.39 176.92 2qta n GLU 102 N -1.25 -5.03 0.08 3.23 -0.58 -1.26 -4.88 120.64 110.95 2qta n GLU 102 Ca 0.17 0.56 -0.05 0.00 -0.42 0.00 0.00 57.16 57.42 2qta n GLU 102 Cb 0.70 -5.37 0.12 0.00 -0.57 0.00 0.00 31.44 26.32 2qta n GLU 102 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 2qta h LEU 103 N -1.97 0.28 0.00 -4.62 3.38 -1.93 -3.49 115.31 106.95 2qta h LEU 103 Ca -0.59 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.23 2qta h LEU 103 Cb 1.38 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 42.05 2qta h LEU 103 CO 0.68 0.81 0.00 0.61 0.09 0.00 0.00 178.44 180.63 2qta n GLY 104 N 0.25 -1.98 0.00 0.83 0.00 -1.26 -5.02 105.19 98.01 2qta n GLY 104 Ca -0.02 -1.46 0.00 0.00 0.00 0.00 0.00 46.02 44.54 2qta n GLY 104 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qta n GLY 105 N 0.00 3.89 3.72 -0.02 0.00 -1.26 -4.83 105.19 106.69 2qta n GLY 105 Ca 0.00 -1.47 -0.24 0.00 0.00 0.00 0.00 46.02 44.31 2qta n GLY 105 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2qta s HIS 106 N -1.51 2.90 0.00 1.61 3.76 -1.26 -5.04 115.29 115.74 2qta s HIS 106 Ca 0.00 -0.15 0.00 0.00 -0.15 0.00 0.00 55.06 54.76 2qta s HIS 106 Cb 0.00 -1.32 0.00 0.00 1.11 0.00 0.00 32.58 32.37 2qta s HIS 106 CO 0.00 0.56 0.00 -1.33 -0.85 0.00 0.00 174.74 173.12 2qta n MET 107 N -0.79 0.00 -0.31 1.40 2.81 -1.26 -4.83 117.12 114.14 2qta n MET 107 Ca -0.08 0.00 0.02 0.00 -1.81 0.00 0.00 57.70 55.84 2qta n MET 107 Cb 0.57 -0.68 0.17 0.00 -0.71 0.00 0.00 33.22 32.57 2qta n MET 107 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2qta h ALA 108 N 0.00 1.23 -0.11 3.04 0.00 -1.96 -2.01 119.26 119.45 2qta h ALA 108 Ca 0.00 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 2qta h ALA 108 Cb 0.45 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 2qta h ALA 108 CO 0.00 0.21 -0.08 1.03 0.00 0.00 0.00 179.25 180.41 2qta h SER 109 N 0.91 0.27 -0.63 0.00 0.87 -1.91 -2.18 113.55 110.88 2qta h SER 109 Ca 0.40 -0.45 -0.03 0.00 -1.23 0.00 0.00 61.79 60.48 2qta h SER 109 Cb 0.29 -0.07 -0.03 0.00 -0.44 0.00 0.00 62.40 62.14 2qta h SER 109 CO -0.21 0.66 0.28 0.15 -0.53 0.00 0.00 176.83 177.17 2qta h PHE 110 N -0.12 0.95 -0.79 2.24 3.57 -1.81 -1.40 116.94 119.57 2qta h PHE 110 Ca 0.02 -0.05 0.07 0.00 3.53 0.00 0.00 57.97 61.54 2qta h PHE 110 Cb 0.57 -0.29 -0.05 0.00 2.79 0.00 0.00 35.95 38.97 2qta h PHE 110 CO 0.08 0.72 0.52 1.96 -2.23 0.00 0.00 178.31 179.35 2qta h GLN 111 N 0.94 0.83 0.00 1.11 1.08 -1.28 0.28 115.11 118.06 2qta h GLN 111 Ca 0.22 -0.05 -0.09 0.00 -1.45 0.00 0.00 58.65 57.29 2qta h GLN 111 Cb 0.15 -0.19 -0.01 0.00 -0.05 0.00 0.00 27.48 27.38 2qta h GLN 111 CO -0.02 0.55 -0.43 0.66 -0.95 0.00 0.00 178.83 178.64 2qta h SER 112 N 0.85 0.00 -0.06 1.46 4.64 -0.81 -3.33 113.55 116.31 2qta h SER 112 Ca 0.34 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.66 2qta h SER 112 Cb 0.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 2qta h SER 112 CO -0.12 0.43 0.00 -1.54 -0.87 0.00 0.00 176.83 174.72 2qta n SER 113 N -3.34 2.01 -0.18 4.97 3.41 -0.72 -4.65 113.62 115.11 2qta n SER 113 Ca 0.01 -1.51 -0.00 0.00 -0.26 0.00 0.00 58.87 57.10 2qta n SER 113 Cb 0.62 -0.03 0.09 0.00 -0.26 0.00 0.00 64.21 64.63 2qta n SER 113 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qta h ALA 114 N 2.01 0.59 -0.29 7.33 0.00 -0.59 -1.54 119.26 126.78 2qta h ALA 114 Ca 0.00 0.15 -0.07 0.00 0.00 0.00 0.00 54.91 55.00 2qta h ALA 114 Cb 0.47 0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 2qta h ALA 114 CO 0.00 -0.36 -0.10 1.15 0.00 0.00 0.00 179.25 179.94 2qta h THR 115 N 0.17 1.22 -0.02 0.00 2.02 -1.85 0.96 112.91 115.41 2qta h THR 115 Ca 0.29 -0.96 -0.00 0.00 0.77 0.00 0.00 66.41 66.51 2qta h THR 115 Cb 0.45 1.12 -0.00 0.00 -1.74 0.00 0.00 68.15 67.97 2qta h THR 115 CO -0.44 0.31 0.01 0.40 0.37 0.00 0.00 175.52 176.18 2qta h ILE 116 N 0.45 1.12 -0.71 3.11 2.04 -1.49 -1.80 117.51 120.24 2qta h ILE 116 Ca 0.09 -0.37 -0.05 0.00 1.00 0.00 0.00 64.86 65.52 2qta h ILE 116 Cb 0.46 1.33 -0.03 0.00 -0.74 0.00 0.00 36.82 37.84 2qta h ILE 116 CO 0.03 0.10 0.23 1.88 0.00 0.00 0.00 178.15 180.39 2qta h TYR 117 N -0.12 1.13 -0.41 1.37 0.05 -1.09 -2.84 116.97 115.07 2qta h TYR 117 Ca 0.01 -0.11 0.06 0.00 0.05 0.00 0.00 58.73 58.74 2qta h TYR 117 Cb 0.15 -0.33 -0.05 0.00 1.01 0.00 0.00 36.73 37.51 2qta h TYR 117 CO -0.02 0.90 0.10 0.22 -1.05 0.00 0.00 178.16 178.30 2qta h ASP 118 N 1.04 0.05 -0.85 3.88 3.58 -0.59 0.16 116.42 123.68 2qta h ASP 118 Ca 0.23 0.06 -0.02 0.00 0.42 0.00 0.00 57.03 57.72 2qta h ASP 118 Cb 0.29 0.08 -0.04 0.00 1.72 0.00 0.00 39.33 41.37 2qta h ASP 118 CO -0.01 0.06 0.46 0.58 -2.88 0.00 0.00 179.24 177.46 2qta h VAL 119 N 0.24 1.25 -0.39 2.25 2.07 -1.27 -0.85 116.25 119.54 2qta h VAL 119 Ca 0.20 -0.63 -0.01 0.00 0.82 0.00 0.00 66.70 67.07 2qta h VAL 119 Cb 0.22 0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.08 2qta h VAL 119 CO -0.24 0.28 0.19 0.00 0.02 0.00 0.00 177.57 177.82 2qta h PHE 121 N 0.49 0.24 0.00 0.00 0.04 -0.21 0.79 116.94 118.30 2qta h PHE 121 Ca 0.13 -0.04 -0.23 0.00 2.80 0.00 0.00 57.97 60.63 2qta h PHE 121 Cb 0.11 -0.06 -0.04 0.00 2.20 0.00 0.00 35.95 38.16 2qta h PHE 121 CO -0.01 0.47 -1.20 -0.91 -0.60 0.00 0.00 178.31 176.05 2qta h ASN 122 N 0.20 0.00 0.00 2.17 2.35 -0.93 -3.42 115.58 115.94 2qta h ASN 122 Ca 0.03 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.78 2qta h ASN 122 Cb 0.58 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.95 2qta h ASN 122 CO 0.04 0.98 0.00 1.41 -1.65 0.00 0.00 177.43 178.21 2qta n HIS 123 N -3.25 0.00 0.01 1.19 8.25 0.26 -4.82 115.22 116.86 2qta n HIS 123 Ca -0.05 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.41 2qta n HIS 123 Cb 0.97 0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.08 2qta n HIS 123 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 2qta n PHE 124 N -0.15 -0.13 -1.64 4.41 3.72 -0.18 -5.02 117.46 118.47 2qta n PHE 124 Ca 0.00 0.02 -0.46 0.00 -0.05 0.00 0.00 57.45 56.96 2qta n PHE 124 Cb 0.09 0.29 -0.04 0.00 -0.94 0.00 0.00 39.48 38.88 2qta n PHE 124 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 2qta n PHE 125 N -2.78 2.23 -3.31 1.38 3.72 0.10 -4.96 117.46 113.84 2qta n PHE 125 Ca 0.00 -0.07 -0.38 0.00 -0.05 0.00 0.00 57.45 56.95 2qta n PHE 125 Cb 0.19 -2.69 -0.06 0.00 -0.94 0.00 0.00 39.48 35.98 2qta n PHE 125 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 2qta s ARG 126 N 4.80 4.33 0.59 -1.08 0.52 -1.26 -4.83 118.95 122.03 2qta s ARG 126 Ca 0.95 0.47 -0.04 0.00 -0.52 0.00 0.00 55.73 56.59 2qta s ARG 126 Cb -0.60 -3.43 0.02 0.00 0.52 0.00 0.00 34.95 31.46 2qta s ARG 126 CO 0.47 0.17 0.88 0.00 0.02 0.00 0.00 175.30 176.84 2qta s ALA 127 N 0.56 3.40 0.27 2.13 0.00 -0.17 0.08 121.76 128.02 2qta s ALA 127 Ca 0.26 -0.87 -0.30 0.00 0.00 0.00 0.00 51.96 51.06 2qta s ALA 127 Cb -0.15 -2.48 -0.13 0.00 0.00 0.00 0.00 23.12 20.35 2qta s ALA 127 CO 0.11 -0.85 1.34 -2.13 0.00 0.00 0.00 175.76 174.23 2qta n ARG 128 N -2.56 1.99 -2.78 0.00 0.63 -1.24 -4.10 116.66 108.60 2qta n ARG 128 Ca 0.05 0.71 -0.07 0.00 -0.92 0.00 0.00 57.85 57.62 2qta n ARG 128 Cb 0.58 -2.32 -0.03 0.00 0.45 0.00 0.00 32.46 31.15 2qta n ARG 128 CO 0.00 0.00 0.00 0.27 -2.51 0.00 0.00 177.63 175.39 2qta n ASN 129 N 1.70 -0.22 0.20 6.15 0.23 -0.40 -4.80 115.26 118.12 2qta n ASN 129 Ca 0.10 -1.77 0.06 0.00 -0.53 0.00 0.00 54.58 52.44 2qta n ASN 129 Cb 0.33 0.58 0.40 0.00 -2.08 0.00 0.00 39.78 39.01 2qta n ASN 129 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 2qta h GLU 130 N 0.00 0.00 0.14 -3.83 4.11 -1.96 -3.28 114.58 109.76 2qta h GLU 130 Ca -0.08 0.00 -0.25 0.00 0.07 0.00 0.00 59.36 59.10 2qta h GLU 130 Cb 0.42 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.68 2qta h GLU 130 CO 0.12 0.34 -1.17 1.96 0.07 0.00 0.00 179.01 180.33 2qta h GLN 131 N 0.00 0.30 -3.72 1.06 7.50 -1.98 -3.49 115.11 114.78 2qta h GLN 131 Ca -0.00 -0.51 -0.10 0.00 0.50 0.00 0.00 58.65 58.54 2qta h GLN 131 Cb 0.76 0.19 -0.09 0.00 0.05 0.00 0.00 27.48 28.40 2qta h GLN 131 CO 0.04 1.25 -0.12 0.16 -1.50 0.00 0.00 178.83 178.66 2qta s ASP 132 N -7.07 0.08 0.00 1.46 1.47 -1.24 -4.87 116.67 106.50 2qta s ASP 132 Ca -0.16 -1.05 0.12 0.00 1.18 0.00 0.00 52.55 52.64 2qta s ASP 132 Cb 0.03 0.61 0.70 0.00 -0.34 0.00 0.00 42.92 43.92 2qta s ASP 132 CO 0.81 -1.19 1.13 0.61 0.68 0.00 0.00 175.17 177.21 2qta n GLY 133 N -0.42 -0.45 6.04 2.12 0.00 -1.26 -1.28 105.19 109.95 2qta n GLY 133 Ca -0.01 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.93 2qta n GLY 133 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qta n GLY 134 N -0.09 -2.06 3.76 -0.02 0.00 -1.26 -3.62 105.19 101.90 2qta n GLY 134 Ca 0.09 -1.42 -0.40 0.00 0.00 0.00 0.00 46.02 44.29 2qta n GLY 134 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2qta s ASP 135 N -3.77 7.07 -0.47 1.61 1.01 0.11 -4.57 116.67 117.66 2qta s ASP 135 Ca 0.00 2.33 -0.15 0.00 0.71 0.00 0.00 52.55 55.43 2qta s ASP 135 Cb 0.00 -2.63 0.07 0.00 1.01 0.00 0.00 42.92 41.38 2qta s ASP 135 CO 0.00 -0.29 0.39 -0.76 0.21 0.00 0.00 175.17 174.72 2qta s LEU 136 N -1.72 5.61 -0.31 1.23 1.43 -0.37 -4.86 118.68 119.69 2qta s LEU 136 Ca 0.48 -1.32 -0.10 0.00 -1.03 0.00 0.00 54.13 52.15 2qta s LEU 136 Cb -0.32 -2.18 -0.01 0.00 0.03 0.00 0.00 46.19 43.70 2qta s LEU 136 CO 0.42 -0.64 0.16 -0.69 0.23 0.00 0.00 176.35 175.83 2qta s VAL 137 N 1.64 4.73 -1.15 -1.59 1.01 -1.26 -0.76 120.40 123.02 2qta s VAL 137 Ca 0.04 -0.33 -0.13 0.00 0.00 0.00 0.00 61.98 61.56 2qta s VAL 137 Cb -0.24 -3.39 0.19 0.00 0.00 0.00 0.00 36.38 32.94 2qta s VAL 137 CO 0.07 0.09 1.33 -0.31 0.00 0.00 0.00 175.10 176.27 2qta s TYR 138 N 1.64 3.62 0.27 5.22 1.51 0.79 -4.77 117.35 125.64 2qta s TYR 138 Ca 0.05 -2.17 -0.30 0.00 -1.01 0.00 0.00 57.07 53.64 2qta s TYR 138 Cb -0.17 -4.21 -0.12 0.00 -0.11 0.00 0.00 41.96 37.35 2qta s TYR 138 CO 0.07 -1.31 1.59 1.19 -1.11 0.00 0.00 175.55 175.98 2qta n PHE 139 N 5.14 2.76 -1.71 2.71 3.72 -1.26 -1.80 117.46 127.02 2qta n PHE 139 Ca 0.32 0.24 -0.42 0.00 -0.05 0.00 0.00 57.45 57.55 2qta n PHE 139 Cb 0.43 -2.59 -0.03 0.00 -0.94 0.00 0.00 39.48 36.35 2qta n PHE 139 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 176.76 175.57 2qta s GLN 140 N -0.26 4.13 0.17 -1.08 0.74 -1.23 -4.69 119.66 117.44 2qta s GLN 140 Ca 0.66 2.61 -0.25 0.00 0.05 0.00 0.00 55.36 58.43 2qta s GLN 140 Cb -0.52 -3.41 0.04 0.00 1.10 0.00 0.00 33.01 30.23 2qta s GLN 140 CO 0.46 -0.82 1.57 0.78 -0.55 0.00 0.00 175.29 176.74 2qta h GLY 141 N 7.97 -0.42 0.65 2.59 0.00 -1.88 -2.54 103.07 109.45 2qta h GLY 141 Ca -0.45 0.54 0.00 0.00 0.00 0.00 0.00 47.33 47.42 2qta h GLY 141 CO 0.95 -0.17 0.00 -2.39 0.00 0.00 0.00 176.54 174.93 2qta n HIS 142 N -5.41 0.00 -0.08 5.60 -0.00 -1.26 -2.27 115.22 111.79 2qta n HIS 142 Ca 0.02 0.00 0.09 0.00 -0.00 0.00 0.00 57.72 57.83 2qta n HIS 142 Cb 0.35 0.00 0.28 0.00 -0.00 0.00 0.00 29.99 30.62 2qta n HIS 142 CO 0.00 0.00 0.00 0.44 -0.00 0.00 0.00 176.34 176.78 2qta n ILE 143 N -0.82 1.11 -0.24 0.61 -6.64 -0.96 -4.51 119.36 107.92 2qta n ILE 143 Ca 0.12 -0.89 0.24 0.00 -1.77 0.00 0.00 62.75 60.45 2qta n ILE 143 Cb 0.06 0.27 0.60 0.00 -1.44 0.00 0.00 39.64 39.12 2qta n ILE 143 CO 0.00 0.00 0.00 0.77 -1.77 0.00 0.00 176.55 175.55 2qta h SER 144 N 3.55 0.25 0.04 7.28 4.64 -1.60 0.43 113.55 128.13 2qta h SER 144 Ca 0.00 0.03 -0.01 0.00 -0.47 0.00 0.00 61.79 61.35 2qta h SER 144 Cb 1.00 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 63.08 2qta h SER 144 CO 0.08 0.08 -0.03 -0.65 -0.87 0.00 0.00 176.83 175.44 2qta h PRO 145 N 0.24 0.00 -0.03 4.77 0.11 -1.87 0.28 132.00 135.50 2qta h PRO 145 Ca 0.48 0.00 -0.22 0.00 0.11 0.00 0.00 66.00 66.37 2qta h PRO 145 Cb 1.47 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.58 2qta h PRO 145 CO -0.13 0.03 -0.90 0.78 -0.21 0.00 0.00 178.00 177.57 2qta h GLY 146 N 0.11 0.52 1.10 -0.55 0.00 -1.25 -1.56 103.07 101.44 2qta h GLY 146 Ca -0.00 -0.87 -0.11 0.00 0.00 0.00 0.00 47.33 46.35 2qta h GLY 146 CO 0.00 0.77 -0.09 -2.08 0.00 0.00 0.00 176.54 175.14 2qta h VAL 147 N 0.28 1.27 -0.60 4.60 2.07 -1.20 -2.13 116.25 120.55 2qta h VAL 147 Ca -0.07 -1.26 -0.08 0.00 0.82 0.00 0.00 66.70 66.10 2qta h VAL 147 Cb 1.53 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 32.21 2qta h VAL 147 CO 0.16 0.45 0.05 1.88 0.02 0.00 0.00 177.57 180.12 2qta h TYR 148 N 0.94 1.10 -0.42 1.57 0.05 -0.93 -1.18 116.97 118.09 2qta h TYR 148 Ca 0.15 -0.17 0.00 0.00 0.05 0.00 0.00 58.73 58.76 2qta h TYR 148 Cb 0.67 -0.29 -0.02 0.00 1.01 0.00 0.00 36.73 38.09 2qta h TYR 148 CO 0.05 0.96 0.27 0.00 -1.05 0.00 0.00 178.16 178.39 2qta h ALA 149 N 1.00 0.53 -0.41 3.88 0.00 -1.14 0.92 119.26 124.04 2qta h ALA 149 Ca 0.17 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.98 2qta h ALA 149 Cb 0.50 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 2qta h ALA 149 CO 0.02 -0.00 -0.01 -0.09 0.00 0.00 0.00 179.25 179.17 2qta h ARG 150 N 0.56 0.73 -0.31 0.00 2.43 -1.28 -0.60 114.38 115.92 2qta h ARG 150 Ca 0.15 -0.24 -0.05 0.00 -0.81 0.00 0.00 59.98 59.04 2qta h ARG 150 Cb -0.05 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.42 2qta h ARG 150 CO -0.03 0.81 -0.02 0.00 -1.51 0.00 0.00 179.97 179.22 2qta h ALA 151 N 0.89 1.39 -0.13 2.80 0.00 -0.93 0.14 119.26 123.42 2qta h ALA 151 Ca 0.12 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 2qta h ALA 151 Cb 0.49 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2qta h ALA 151 CO 0.02 0.42 0.03 0.35 0.00 0.00 0.00 179.25 180.07 2qta h PHE 152 N 0.46 0.22 -0.14 0.00 3.57 -0.60 0.50 116.94 120.96 2qta h PHE 152 Ca 0.10 -0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.54 2qta h PHE 152 Cb 0.34 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 39.01 2qta h PHE 152 CO 0.01 0.38 -0.07 1.25 -2.23 0.00 0.00 178.31 177.65 2qta h LEU 153 N 0.00 0.18 0.00 0.59 5.85 -0.19 0.35 115.31 122.10 2qta h LEU 153 Ca 0.04 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.73 2qta h LEU 153 Cb 0.27 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.25 2qta h LEU 153 CO 0.00 0.29 0.00 -0.62 -0.34 0.00 0.00 178.44 177.77 2qta n GLU 154 N -4.35 0.97 -1.09 1.25 1.02 0.42 -4.76 120.64 114.10 2qta n GLU 154 Ca -0.01 0.00 -0.02 0.00 -0.02 0.00 0.00 57.16 57.11 2qta n GLU 154 Cb 0.21 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.12 2qta n GLU 154 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2qta n GLY 155 N 0.94 0.55 0.02 0.62 0.00 0.11 -4.95 105.19 102.49 2qta n GLY 155 Ca 0.23 -0.98 0.11 0.00 0.00 0.00 0.00 46.02 45.39 2qta n GLY 155 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qta n ARG 156 N -2.89 0.25 -4.14 1.61 1.74 0.17 -4.91 116.66 108.49 2qta n ARG 156 Ca -0.02 -0.03 -0.16 0.00 -0.77 0.00 0.00 57.85 56.87 2qta n ARG 156 Cb 0.08 -1.56 -0.11 0.00 -1.02 0.00 0.00 32.46 29.85 2qta n ARG 156 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2qta s LEU 157 N -3.74 2.30 0.42 0.55 1.43 -1.16 -4.93 118.68 113.56 2qta s LEU 157 Ca 0.04 -0.65 0.07 0.00 -1.03 0.00 0.00 54.13 52.56 2qta s LEU 157 Cb 0.15 -0.36 0.01 0.00 0.03 0.00 0.00 46.19 46.01 2qta s LEU 157 CO 0.82 -0.16 0.58 0.42 0.23 0.00 0.00 176.35 178.24 2qta s THR 158 N -1.59 3.09 0.29 5.49 -4.23 -1.26 -4.49 115.64 112.94 2qta s THR 158 Ca -0.02 -0.97 -0.00 0.00 -1.18 0.00 0.00 61.69 59.51 2qta s THR 158 Cb -0.08 -3.04 0.16 0.00 1.34 0.00 0.00 72.50 70.88 2qta s THR 158 CO 0.01 -0.02 1.84 -0.61 -0.54 0.00 0.00 174.62 175.31 2qta h GLN 159 N 0.62 0.79 -0.62 3.99 4.15 -1.99 -2.10 115.11 119.95 2qta h GLN 159 Ca -0.41 -0.15 0.03 0.00 0.77 0.00 0.00 58.65 58.89 2qta h GLN 159 Cb 1.28 -0.12 -0.04 0.00 0.21 0.00 0.00 27.48 28.81 2qta h GLN 159 CO 0.46 0.71 0.38 1.05 -1.93 0.00 0.00 178.83 179.50 2qta h GLU 160 N 0.76 0.73 -0.33 1.69 4.11 -1.94 0.78 114.58 120.38 2qta h GLU 160 Ca 0.17 -0.04 -0.06 0.00 0.07 0.00 0.00 59.36 59.49 2qta h GLU 160 Cb 0.28 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 2qta h GLU 160 CO -0.00 0.48 -0.04 1.96 0.07 0.00 0.00 179.01 181.48 2qta h GLN 161 N 0.75 0.61 -0.84 1.06 4.20 -1.59 -2.30 115.11 116.99 2qta h GLN 161 Ca 0.25 -0.21 0.00 0.00 0.06 0.00 0.00 58.65 58.75 2qta h GLN 161 Cb 0.02 -0.04 -0.04 0.00 0.30 0.00 0.00 27.48 27.71 2qta h GLN 161 CO -0.10 0.76 0.53 -0.07 -0.67 0.00 0.00 178.83 179.28 2qta h LEU 162 N 0.40 0.98 -0.43 1.46 3.38 -1.00 0.72 115.31 120.82 2qta h LEU 162 Ca 0.09 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2qta h LEU 162 Cb 0.51 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.01 2qta h LEU 162 CO 0.02 0.73 0.00 0.47 0.09 0.00 0.00 178.44 179.75 2qta n ASP 163 N -4.39 0.36 -1.28 -0.43 8.00 0.23 -1.62 116.55 117.42 2qta n ASP 163 Ca 0.09 0.60 -0.05 0.00 0.71 0.00 0.00 54.79 56.14 2qta n ASP 163 Cb 0.04 -0.67 0.21 0.00 -0.02 0.00 0.00 41.12 40.68 2qta n ASP 163 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2qta n ASN 164 N -1.91 2.90 -4.69 -2.24 3.02 0.23 -4.93 115.26 107.64 2qta n ASN 164 Ca 0.02 -3.63 -0.43 0.00 -0.03 0.00 0.00 54.58 50.51 2qta n ASN 164 Cb 0.18 -0.65 -0.03 0.00 -0.61 0.00 0.00 39.78 38.67 2qta n ASN 164 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 2qta n PHE 165 N -1.01 2.57 -1.45 3.10 7.35 -0.64 -1.40 117.46 125.98 2qta n PHE 165 Ca 0.35 -0.11 -0.12 0.00 -0.76 0.00 0.00 57.45 56.81 2qta n PHE 165 Cb 1.10 -2.71 -0.05 0.00 0.35 0.00 0.00 39.48 38.17 2qta n PHE 165 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 2qta n ARG 166 N 5.58 -0.88 -3.58 -4.13 1.74 0.33 -4.87 116.66 110.84 2qta n ARG 166 Ca 0.18 0.91 -0.29 0.00 -0.77 0.00 0.00 57.85 57.88 2qta n ARG 166 Cb 0.36 -4.95 -0.13 0.00 -1.02 0.00 0.00 32.46 26.72 2qta n ARG 166 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 2qta s GLN 167 N -3.21 0.72 -0.01 5.56 -0.21 -0.50 -4.98 119.66 117.04 2qta s GLN 167 Ca 0.00 -1.36 0.13 0.00 0.02 0.00 0.00 55.36 54.15 2qta s GLN 167 Cb 0.00 -1.65 -0.16 0.00 1.00 0.00 0.00 33.01 32.20 2qta s GLN 167 CO 0.00 -1.14 0.46 0.39 -2.12 0.00 0.00 175.29 172.88 2qta n GLU 168 N 4.19 2.03 -0.34 2.91 1.02 -1.26 -3.97 120.64 125.23 2qta n GLU 168 Ca 0.07 -0.04 0.06 0.00 -0.02 0.00 0.00 57.16 57.23 2qta n GLU 168 Cb 0.38 -1.17 0.22 0.00 -0.02 0.00 0.00 31.44 30.85 2qta n GLU 168 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2qta h VAL 169 N 0.00 0.91 -0.14 2.62 2.07 -1.97 -1.91 116.25 117.83 2qta h VAL 169 Ca 0.00 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 67.20 2qta h VAL 169 Cb 0.40 -0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.07 2qta h VAL 169 CO 0.00 0.17 0.00 1.41 0.02 0.00 0.00 177.57 179.17 2qta n HIS 170 N -4.66 0.18 0.00 1.57 8.25 -1.26 -4.95 115.22 114.34 2qta n HIS 170 Ca 0.17 -0.09 0.00 0.00 -0.26 0.00 0.00 57.72 57.54 2qta n HIS 170 Cb 0.34 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.45 2qta n HIS 170 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2qta n GLY 171 N 0.90 2.32 2.22 -1.41 0.00 -0.72 -4.92 105.19 103.59 2qta n GLY 171 Ca 0.11 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.89 2qta n GLY 171 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2qta n ASN 172 N 0.00 4.68 -3.12 1.61 4.05 -1.26 -5.04 115.26 116.18 2qta n ASN 172 Ca 0.00 -3.67 -0.12 0.00 0.45 0.00 0.00 54.58 51.24 2qta n ASN 172 Cb 0.00 -0.39 -0.01 0.00 1.23 0.00 0.00 39.78 40.61 2qta n ASN 172 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2qta n GLY 173 N -0.61 3.44 3.12 8.20 0.00 -1.25 -4.11 105.19 113.97 2qta n GLY 173 Ca 0.40 -2.25 -0.25 0.00 0.00 0.00 0.00 46.02 43.92 2qta n GLY 173 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qta s LEU 174 N 0.00 1.92 0.69 0.99 1.43 -0.98 -4.92 118.68 117.81 2qta s LEU 174 Ca 0.06 -0.32 -0.14 0.00 -1.03 0.00 0.00 54.13 52.70 2qta s LEU 174 Cb -0.00 -0.90 0.02 0.00 0.03 0.00 0.00 46.19 45.33 2qta s LEU 174 CO 0.04 0.15 1.12 -0.44 0.23 0.00 0.00 176.35 177.46 2qta s SER 175 N -0.03 4.84 0.16 2.29 0.01 -1.26 -0.51 113.70 119.19 2qta s SER 175 Ca -0.02 2.04 -0.16 0.00 1.31 0.00 0.00 55.95 59.13 2qta s SER 175 Cb -0.10 -2.55 0.06 0.00 0.21 0.00 0.00 66.02 63.64 2qta s SER 175 CO 0.01 -1.81 1.77 0.77 0.41 0.00 0.00 173.24 174.39 2qta h SER 176 N -0.19 0.24 -3.18 2.44 4.64 -1.97 -3.42 113.55 112.12 2qta h SER 176 Ca -0.46 0.03 -0.57 0.00 -0.47 0.00 0.00 61.79 60.31 2qta h SER 176 Cb 1.25 -0.02 -0.13 0.00 -0.31 0.00 0.00 62.40 63.20 2qta h SER 176 CO 0.53 0.18 -0.50 -0.31 -0.87 0.00 0.00 176.83 175.85 2qta s TYR 177 N -6.15 1.78 -0.58 4.77 2.02 -1.26 -4.72 117.35 113.21 2qta s TYR 177 Ca -0.13 -1.32 -0.27 0.00 -0.37 0.00 0.00 57.07 54.98 2qta s TYR 177 Cb 0.12 -1.14 -0.03 0.00 -0.40 0.00 0.00 41.96 40.51 2qta s TYR 177 CO 0.72 -0.33 1.91 -2.14 -1.57 0.00 0.00 175.55 174.13 2qta s PRO 178 N -3.68 2.63 -0.42 -1.71 0.02 -1.26 -4.90 135.00 125.67 2qta s PRO 178 Ca 0.23 0.74 0.02 0.00 0.02 0.00 0.00 61.00 62.01 2qta s PRO 178 Cb 0.02 -4.39 0.13 0.00 0.02 0.00 0.00 34.50 30.27 2qta s PRO 178 CO 0.15 -2.72 0.20 -1.01 -0.33 0.00 0.00 177.00 173.29 2qta s HIS 179 N 9.22 2.30 0.38 6.54 3.76 -1.26 -3.80 115.29 132.43 2qta s HIS 179 Ca 0.71 -2.50 0.12 0.00 -0.15 0.00 0.00 55.06 53.24 2qta s HIS 179 Cb -0.14 -2.12 0.91 0.00 1.11 0.00 0.00 32.58 32.35 2qta s HIS 179 CO 0.22 -0.81 1.86 -1.35 -0.85 0.00 0.00 174.74 173.81 2qta h PRO 180 N 6.99 0.57 -0.23 8.40 0.11 -1.76 0.20 132.00 146.28 2qta h PRO 180 Ca -0.05 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 66.01 2qta h PRO 180 Cb 0.94 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 31.91 2qta h PRO 180 CO 0.52 0.38 0.06 -0.22 -0.21 0.00 0.00 178.00 178.52 2qta h LYS 181 N 0.59 0.32 0.00 1.05 1.63 -1.43 0.10 116.57 118.83 2qta h LYS 181 Ca 0.46 -0.04 -0.29 0.00 -0.85 0.00 0.00 60.65 59.93 2qta h LYS 181 Cb 0.89 -0.06 -0.05 0.00 -0.60 0.00 0.00 32.23 32.41 2qta h LYS 181 CO -0.21 0.30 -1.72 1.28 -3.45 0.00 0.00 179.45 175.65 2qta n LEU 182 N -4.41 0.90 -3.29 5.20 4.77 -0.08 -4.51 117.00 115.57 2qta n LEU 182 Ca 0.00 0.41 -0.25 0.00 -0.03 0.00 0.00 56.01 56.14 2qta n LEU 182 Cb 0.15 0.15 -0.08 0.00 -2.33 0.00 0.00 43.42 41.31 2qta n LEU 182 CO 0.36 0.40 -0.16 0.23 -1.33 0.00 0.00 177.39 176.89 2qta n MET 183 N -3.05 1.35 0.21 3.23 2.81 -0.37 -4.99 117.12 116.31 2qta n MET 183 Ca -0.17 -3.75 0.11 0.00 -1.81 0.00 0.00 57.70 52.07 2qta n MET 183 Cb 1.05 -1.61 0.59 0.00 -0.71 0.00 0.00 33.22 32.54 2qta n MET 183 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 2qta h PRO 184 N 4.14 0.00 -0.13 0.03 0.13 -1.03 -1.57 132.00 133.56 2qta h PRO 184 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 2qta h PRO 184 Cb 0.80 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.93 2qta h PRO 184 CO 0.59 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.75 2qta n GLU 185 N -2.35 1.36 0.00 0.86 1.02 -1.26 -4.15 120.64 116.13 2qta n GLU 185 Ca -0.01 -1.48 -0.00 0.00 -0.02 0.00 0.00 57.16 55.65 2qta n GLU 185 Cb 0.21 -1.23 -0.00 0.00 -0.02 0.00 0.00 31.44 30.40 2qta n GLU 185 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2qta n PHE 186 N 0.59 0.00 -2.46 -0.32 7.35 -0.61 -1.27 117.46 120.73 2qta n PHE 186 Ca 0.08 0.00 -0.32 0.00 -0.76 0.00 0.00 57.45 56.46 2qta n PHE 186 Cb 0.33 -0.01 -0.03 0.00 0.35 0.00 0.00 39.48 40.12 2qta n PHE 186 CO 0.00 0.00 0.00 -1.58 -0.76 0.00 0.00 176.76 174.42 2qta s TRP 187 N -1.17 3.46 0.00 -5.13 0.52 -1.08 -2.49 118.94 113.06 2qta s TRP 187 Ca -0.01 1.38 0.00 0.00 0.02 0.00 0.00 56.10 57.49 2qta s TRP 187 Cb 0.00 -2.72 0.00 0.00 -1.15 0.00 0.00 33.47 29.60 2qta s TRP 187 CO 0.01 -0.33 0.00 1.04 0.02 0.00 0.00 176.95 177.69 2qta n GLN 188 N -1.57 0.46 -3.90 4.98 6.02 -1.26 -4.35 117.38 117.75 2qta n GLN 188 Ca 0.06 0.00 -0.28 0.00 -0.01 0.00 0.00 57.00 56.77 2qta n GLN 188 Cb 0.54 -0.93 -0.17 0.00 1.02 0.00 0.00 30.24 30.70 2qta n GLN 188 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 2qta s PHE 189 N -1.87 1.63 -0.39 1.08 0.08 -1.26 -4.83 117.98 112.42 2qta s PHE 189 Ca 0.00 -0.94 -0.29 0.00 0.12 0.00 0.00 56.93 55.83 2qta s PHE 189 Cb 0.00 -1.29 0.00 0.00 -0.57 0.00 0.00 43.02 41.16 2qta s PHE 189 CO 0.00 -0.57 1.54 -2.14 -0.10 0.00 0.00 175.22 173.95 2qta s PRO 190 N 1.66 3.48 0.00 0.24 0.02 -1.25 -4.78 135.00 134.37 2qta s PRO 190 Ca 0.03 1.08 0.06 0.00 0.02 0.00 0.00 61.00 62.19 2qta s PRO 190 Cb -0.14 -4.09 -0.06 0.00 0.02 0.00 0.00 34.50 30.24 2qta s PRO 190 CO -0.08 -1.68 0.26 0.25 -0.33 0.00 0.00 177.00 175.42 2qta n THR 191 N 7.19 0.00 -0.30 0.99 -2.24 -1.26 -4.64 114.28 114.02 2qta n THR 191 Ca 0.19 -0.37 0.05 0.00 -2.27 0.00 0.00 64.05 61.64 2qta n THR 191 Cb 0.48 1.01 0.25 0.00 -2.10 0.00 0.00 70.33 69.96 2qta n THR 191 CO 0.00 0.00 0.00 -0.37 -0.57 0.00 0.00 175.07 174.13 2qta h VAL 192 N 0.06 1.05 -1.68 2.28 -1.51 -1.88 -3.34 116.25 111.23 2qta h VAL 192 Ca 0.00 -0.35 -0.47 0.00 -1.23 0.00 0.00 66.70 64.65 2qta h VAL 192 Cb 0.14 -0.05 -0.05 0.00 -2.13 0.00 0.00 31.29 29.19 2qta h VAL 192 CO 0.00 0.18 1.17 -0.55 -1.23 0.00 0.00 177.57 177.14 2qta s SER 193 N -5.99 5.57 0.45 4.19 0.15 -1.26 -4.93 113.70 111.87 2qta s SER 193 Ca -0.11 -0.26 -0.23 0.00 0.70 0.00 0.00 55.95 56.04 2qta s SER 193 Cb 0.20 -2.55 -0.08 0.00 -1.71 0.00 0.00 66.02 61.89 2qta s SER 193 CO 0.80 -2.25 1.14 -0.04 1.20 0.00 0.00 173.24 174.09 2qta s MET 194 N 6.53 3.85 0.00 5.44 1.00 -1.25 -2.63 119.30 132.23 2qta s MET 194 Ca 0.59 1.72 0.00 0.00 0.00 0.00 0.00 55.69 58.00 2qta s MET 194 Cb -0.09 -2.44 0.00 0.00 0.00 0.00 0.00 34.83 32.30 2qta s MET 194 CO 0.11 -0.46 0.00 0.41 0.00 0.00 0.00 175.02 175.08 2qta n GLY 195 N 0.42 3.00 0.15 -0.03 0.00 -1.26 -4.87 105.19 102.60 2qta n GLY 195 Ca 0.07 -0.32 -0.14 0.00 0.00 0.00 0.00 46.02 45.63 2qta n GLY 195 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2qta h LEU 196 N 0.00 0.51 -0.42 0.99 3.38 -1.83 -3.24 115.31 114.70 2qta h LEU 196 Ca 0.00 -0.43 0.09 0.00 0.09 0.00 0.00 57.88 57.63 2qta h LEU 196 Cb 0.00 -0.16 -0.09 0.00 0.09 0.00 0.00 40.66 40.51 2qta h LEU 196 CO 0.00 1.25 -0.17 1.23 0.09 0.00 0.00 178.44 180.83 2qta h GLY 197 N 1.31 0.15 0.99 0.83 0.00 -1.81 -0.03 103.07 104.51 2qta h GLY 197 Ca -0.09 0.22 -0.12 0.00 0.00 0.00 0.00 47.33 47.34 2qta h GLY 197 CO 0.17 -0.19 -0.29 -0.56 0.00 0.00 0.00 176.54 175.67 2qta h PRO 198 N -0.09 0.73 0.07 4.80 0.13 -1.89 -0.33 132.00 135.41 2qta h PRO 198 Ca 0.20 -0.38 -0.27 0.00 -0.87 0.00 0.00 66.00 64.68 2qta h PRO 198 Cb 0.40 0.01 0.01 0.00 0.13 0.00 0.00 31.00 31.56 2qta h PRO 198 CO -0.48 1.00 -1.12 0.97 -0.23 0.00 0.00 178.00 178.14 2qta h ILE 199 N 0.48 1.36 -0.91 -3.56 2.10 -1.61 -2.55 117.51 112.83 2qta h ILE 199 Ca 0.05 -2.55 0.02 0.00 1.08 0.00 0.00 64.86 63.47 2qta h ILE 199 Cb 0.87 2.61 -0.05 0.00 -1.09 0.00 0.00 36.82 39.16 2qta h ILE 199 CO 0.07 0.76 0.59 1.23 -1.08 0.00 0.00 178.15 179.73 2qta h GLY 200 N 0.88 1.30 0.95 8.18 0.00 -0.81 -2.38 103.07 111.18 2qta h GLY 200 Ca -0.14 -0.46 -0.01 0.00 0.00 0.00 0.00 47.33 46.73 2qta h GLY 200 CO 0.20 0.42 0.17 0.00 0.00 0.00 0.00 176.54 177.33 2qta h ALA 201 N 1.36 0.45 -0.42 3.60 0.00 -1.03 -0.03 119.26 123.18 2qta h ALA 201 Ca 0.35 -0.09 0.08 0.00 0.00 0.00 0.00 54.91 55.24 2qta h ALA 201 Cb -0.06 -0.14 -0.07 0.00 0.00 0.00 0.00 17.79 17.53 2qta h ALA 201 CO -0.10 -0.00 0.02 0.82 0.00 0.00 0.00 179.25 179.98 2qta h ILE 202 N 0.43 0.70 0.00 0.00 2.04 -1.05 -0.53 117.51 119.10 2qta h ILE 202 Ca 0.12 -0.04 -0.03 0.00 1.00 0.00 0.00 64.86 65.90 2qta h ILE 202 Cb 0.10 0.56 -0.00 0.00 -0.74 0.00 0.00 36.82 36.73 2qta h ILE 202 CO -0.02 0.02 -0.15 1.88 0.00 0.00 0.00 178.15 179.88 2qta h TYR 203 N 0.13 0.00 -0.07 1.37 -1.99 -1.22 -1.42 116.97 113.77 2qta h TYR 203 Ca 0.21 0.00 -0.03 0.00 2.00 0.00 0.00 58.73 60.91 2qta h TYR 203 Cb 0.29 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.02 2qta h TYR 203 CO -0.26 0.15 -0.07 0.37 -0.00 0.00 0.00 178.16 178.35 2qta h GLN 204 N 0.00 0.17 -0.82 4.88 5.75 -0.34 -0.54 115.11 124.22 2qta h GLN 204 Ca -0.00 -0.09 0.08 0.00 -0.15 0.00 0.00 58.65 58.48 2qta h GLN 204 Cb 0.92 0.00 -0.07 0.00 1.07 0.00 0.00 27.48 29.41 2qta h GLN 204 CO 0.02 0.62 0.48 0.00 -2.65 0.00 0.00 178.83 177.30 2qta h ALA 205 N 0.55 1.14 -0.59 3.38 0.00 -0.93 0.87 119.26 123.68 2qta h ALA 205 Ca 0.01 0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.84 2qta h ALA 205 Cb 0.59 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 2qta h ALA 205 CO 0.02 0.15 0.00 -0.22 0.00 0.00 0.00 179.25 179.20 2qta h LYS 206 N 0.84 1.04 -0.30 0.00 3.64 -1.16 -2.44 116.57 118.18 2qta h LYS 206 Ca 0.38 -0.32 -0.09 0.00 -1.27 0.00 0.00 60.65 59.35 2qta h LYS 206 Cb 0.27 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.98 2qta h LYS 206 CO -0.21 1.01 -0.19 0.35 -2.27 0.00 0.00 179.45 178.14 2qta h PHE 207 N 0.95 0.60 -0.65 1.91 3.57 0.15 -1.20 116.94 122.28 2qta h PHE 207 Ca 0.17 -0.11 -0.06 0.00 3.53 0.00 0.00 57.97 61.50 2qta h PHE 207 Cb 0.55 -0.15 -0.03 0.00 2.79 0.00 0.00 35.95 39.10 2qta h PHE 207 CO 0.04 0.70 0.17 -0.07 -2.23 0.00 0.00 178.31 176.92 2qta h LEU 208 N 0.49 0.99 -0.67 0.59 3.38 -0.63 -0.97 115.31 118.49 2qta h LEU 208 Ca 0.08 -0.23 -0.03 0.00 0.09 0.00 0.00 57.88 57.79 2qta h LEU 208 Cb 0.60 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.06 2qta h LEU 208 CO 0.04 0.96 0.28 0.11 0.09 0.00 0.00 178.44 179.92 2qta h LYS 209 N 0.97 0.99 -0.53 1.13 1.79 -1.11 -2.42 116.57 117.38 2qta h LYS 209 Ca 0.21 -0.17 0.04 0.00 -2.18 0.00 0.00 60.65 58.54 2qta h LYS 209 Cb 0.35 -0.16 -0.04 0.00 -1.58 0.00 0.00 32.23 30.79 2qta h LYS 209 CO 0.00 0.81 0.30 -0.92 -1.08 0.00 0.00 179.45 178.56 2qta h TYR 210 N 0.94 0.55 -0.77 -1.35 3.20 -0.84 0.24 116.97 118.94 2qta h TYR 210 Ca 0.22 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.09 2qta h TYR 210 Cb 0.18 -0.17 -0.04 0.00 1.54 0.00 0.00 36.73 38.25 2qta h TYR 210 CO 0.01 0.29 0.38 -0.07 -1.64 0.00 0.00 178.16 177.13 2qta h LEU 211 N 0.58 0.98 0.14 2.82 4.07 -1.00 0.14 115.31 123.03 2qta h LEU 211 Ca 0.23 -0.10 -0.01 0.00 0.08 0.00 0.00 57.88 58.08 2qta h LEU 211 Cb 0.09 -0.25 0.00 0.00 1.08 0.00 0.00 40.66 41.58 2qta h LEU 211 CO -0.13 0.81 -0.07 -0.08 -1.08 0.00 0.00 178.44 177.90 2qta h GLU 212 N 1.08 -0.18 -0.68 1.13 4.81 -0.89 -0.77 114.58 119.09 2qta h GLU 212 Ca 0.27 0.01 0.05 0.00 -0.13 0.00 0.00 59.36 59.56 2qta h GLU 212 Cb 0.08 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.46 2qta h GLU 212 CO -0.04 0.23 0.45 0.45 -0.73 0.00 0.00 179.01 179.37 2qta h HIS 213 N -0.64 0.73 -0.00 0.92 3.86 -0.35 -1.02 115.15 118.65 2qta h HIS 213 Ca -0.02 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2qta h HIS 213 Cb 0.48 -0.24 0.00 0.00 1.06 0.00 0.00 27.41 28.71 2qta h HIS 213 CO 0.06 0.40 -0.00 0.54 0.86 0.00 0.00 177.93 179.80 2qta n ARG 214 N -4.47 0.82 -1.42 2.45 1.74 0.46 -4.54 116.66 111.69 2qta n ARG 214 Ca 0.09 -0.02 -0.09 0.00 -0.77 0.00 0.00 57.85 57.07 2qta n ARG 214 Cb 0.19 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.10 2qta n ARG 214 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2qta n GLY 215 N 1.10 0.86 0.12 -0.13 0.00 -0.39 -4.93 105.19 101.83 2qta n GLY 215 Ca 0.21 -0.62 -0.18 0.00 0.00 0.00 0.00 46.02 45.43 2qta n GLY 215 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2qta h LEU 216 N 0.00 0.36 -7.00 0.99 3.38 -1.36 -3.48 115.31 108.20 2qta h LEU 216 Ca -0.18 -0.67 -0.03 0.00 0.09 0.00 0.00 57.88 57.08 2qta h LEU 216 Cb 0.68 -0.12 -0.21 0.00 0.09 0.00 0.00 40.66 41.10 2qta h LEU 216 CO 0.26 1.59 0.11 -0.75 0.09 0.00 0.00 178.44 179.74 2qta s LYS 217 N -2.58 0.82 -0.65 1.13 2.20 -0.98 -5.03 119.74 114.65 2qta s LYS 217 Ca -0.15 1.04 -0.27 0.00 -0.36 0.00 0.00 55.97 56.23 2qta s LYS 217 Cb 0.07 0.37 0.03 0.00 -1.51 0.00 0.00 37.83 36.79 2qta s LYS 217 CO 0.81 -0.11 1.18 0.34 -0.36 0.00 0.00 175.35 177.21 2qta s ASP 218 N 0.58 6.30 0.00 1.43 2.15 -1.26 -3.04 116.67 122.83 2qta s ASP 218 Ca -0.02 -0.26 0.19 0.00 0.43 0.00 0.00 52.55 52.89 2qta s ASP 218 Cb -0.05 -2.53 0.42 0.00 -0.30 0.00 0.00 42.92 40.46 2qta s ASP 218 CO -0.02 -1.59 1.35 0.35 -0.17 0.00 0.00 175.17 175.09 2qta n THR 219 N 6.43 0.71 0.05 1.71 -2.24 -1.26 -4.68 114.28 115.00 2qta n THR 219 Ca 0.04 -0.85 0.21 0.00 -2.27 0.00 0.00 64.05 61.18 2qta n THR 219 Cb 0.48 0.77 0.74 0.00 -2.10 0.00 0.00 70.33 70.22 2qta n THR 219 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 2qta h SER 220 N 3.62 0.00 0.11 3.42 4.64 -1.90 -0.02 113.55 123.42 2qta h SER 220 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2qta h SER 220 Cb 0.88 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.97 2qta h SER 220 CO 0.00 0.00 -0.07 0.29 -0.87 0.00 0.00 176.83 176.18 2qta n LYS 221 N -3.84 1.20 -3.40 4.77 5.02 -1.26 -4.89 118.16 115.77 2qta n LYS 221 Ca 0.09 -0.58 -0.38 0.00 -2.02 0.00 0.00 58.31 55.41 2qta n LYS 221 Cb 0.66 -1.49 -0.06 0.00 -0.02 0.00 0.00 35.03 34.12 2qta n LYS 221 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2qta s GLN 222 N -2.20 4.06 -0.04 1.97 -0.21 -0.02 -4.85 119.66 118.38 2qta s GLN 222 Ca 0.35 0.53 0.07 0.00 0.02 0.00 0.00 55.36 56.33 2qta s GLN 222 Cb 0.21 -3.25 -0.02 0.00 1.00 0.00 0.00 33.01 30.95 2qta s GLN 222 CO 0.41 0.61 -0.24 0.99 -2.12 0.00 0.00 175.29 174.94 2qta s THR 223 N -0.90 2.20 -0.25 -0.19 2.01 -1.26 -4.84 115.64 112.41 2qta s THR 223 Ca 0.26 -1.04 -0.10 0.00 0.31 0.00 0.00 61.69 61.12 2qta s THR 223 Cb -0.18 -1.78 -0.05 0.00 0.01 0.00 0.00 72.50 70.51 2qta s THR 223 CO 0.15 0.58 0.14 -0.69 -0.69 0.00 0.00 174.62 174.11 2qta s VAL 224 N -0.49 5.09 -0.17 3.82 1.01 0.21 -1.24 120.40 128.63 2qta s VAL 224 Ca 0.06 0.09 -0.02 0.00 0.00 0.00 0.00 61.98 62.11 2qta s VAL 224 Cb -0.11 -3.39 -0.02 0.00 0.00 0.00 0.00 36.38 32.87 2qta s VAL 224 CO 0.01 0.33 -0.08 -0.31 0.00 0.00 0.00 175.10 175.05 2qta s TYR 225 N 1.30 2.92 -0.27 5.22 2.02 0.06 -0.68 117.35 127.92 2qta s TYR 225 Ca 0.07 -0.66 -0.03 0.00 -0.37 0.00 0.00 57.07 56.08 2qta s TYR 225 Cb -0.14 -1.97 0.03 0.00 -0.40 0.00 0.00 41.96 39.48 2qta s TYR 225 CO 0.06 -0.29 -0.01 0.00 -1.57 0.00 0.00 175.55 173.74 2qta s ALA 226 N 0.75 2.81 -0.41 3.71 0.00 -0.41 -0.15 121.76 128.07 2qta s ALA 226 Ca -0.03 -1.54 -0.17 0.00 0.00 0.00 0.00 51.96 50.22 2qta s ALA 226 Cb -0.15 -1.86 0.02 0.00 0.00 0.00 0.00 23.12 21.13 2qta s ALA 226 CO 0.02 -0.96 0.42 -0.06 0.00 0.00 0.00 175.76 175.17 2qta s PHE 227 N 1.34 3.18 0.21 0.00 0.40 -0.74 -0.12 117.98 122.26 2qta s PHE 227 Ca -0.01 -0.33 0.09 0.00 -0.60 0.00 0.00 56.93 56.09 2qta s PHE 227 Cb -0.18 -2.84 -0.04 0.00 0.51 0.00 0.00 43.02 40.48 2qta s PHE 227 CO -0.02 -0.65 -0.06 -0.51 0.70 0.00 0.00 175.22 174.68 2qta s LEU 228 N 2.09 3.07 0.26 -0.37 1.43 0.18 -3.58 118.68 121.76 2qta s LEU 228 Ca 0.12 -0.60 0.04 0.00 -1.03 0.00 0.00 54.13 52.66 2qta s LEU 228 Cb -0.17 -1.69 -0.03 0.00 0.03 0.00 0.00 46.19 44.33 2qta s LEU 228 CO 0.13 0.06 0.40 -0.83 0.23 0.00 0.00 176.35 176.34 2qta s GLY 229 N -3.16 1.24 0.17 -3.19 0.00 -1.26 -0.61 107.32 100.50 2qta s GLY 229 Ca 0.28 -1.18 0.02 0.00 0.00 0.00 0.00 44.72 43.84 2qta s GLY 229 CO 0.17 -1.18 1.38 1.29 0.00 0.00 0.00 173.10 174.77 2qta h ASP 230 N 1.09 0.28 -0.50 1.64 3.04 -1.82 -3.07 116.42 117.08 2qta h ASP 230 Ca -0.51 -0.22 -0.07 0.00 -3.24 0.00 0.00 57.03 52.99 2qta h ASP 230 Cb 1.23 -0.08 -0.02 0.00 -1.04 0.00 0.00 39.33 39.41 2qta h ASP 230 CO 0.61 1.01 0.06 1.23 -2.04 0.00 0.00 179.24 180.11 2qta h GLY 231 N 1.78 0.96 1.91 7.15 0.00 -1.88 -2.43 103.07 110.55 2qta h GLY 231 Ca -0.04 -0.62 0.01 0.00 0.00 0.00 0.00 47.33 46.68 2qta h GLY 231 CO 0.13 0.58 0.04 -2.09 0.00 0.00 0.00 176.54 175.20 2qta h GLU 232 N 0.84 0.00 0.00 4.80 4.81 -1.92 -2.07 114.58 121.04 2qta h GLU 232 Ca 0.17 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.40 2qta h GLU 232 Cb 0.41 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.79 2qta h GLU 232 CO 0.01 0.00 0.00 -1.33 -0.73 0.00 0.00 179.01 176.96 2qta n MET 233 N -3.94 0.04 0.22 1.92 2.81 -0.92 -1.63 117.12 115.62 2qta n MET 233 Ca -0.02 0.41 0.14 0.00 -1.81 0.00 0.00 57.70 56.42 2qta n MET 233 Cb 0.13 -1.60 0.42 0.00 -0.71 0.00 0.00 33.22 31.45 2qta n MET 233 CO 0.00 0.00 0.00 -0.44 1.51 0.00 0.00 175.97 177.04 2qta h ASP 234 N 0.00 0.00 -3.17 7.83 5.19 -1.54 -3.41 116.42 121.32 2qta h ASP 234 Ca 0.00 0.00 -0.53 0.00 -0.62 0.00 0.00 57.03 55.88 2qta h ASP 234 Cb 0.14 0.00 0.06 0.00 0.18 0.00 0.00 39.33 39.71 2qta h ASP 234 CO 0.00 0.00 0.83 -1.61 -3.12 0.00 0.00 179.24 175.34 2qta s GLU 235 N -3.37 4.22 0.45 3.56 0.41 -0.65 -4.85 118.70 118.47 2qta s GLU 235 Ca 0.05 2.38 0.18 0.00 -0.41 0.00 0.00 54.97 57.17 2qta s GLU 235 Cb 0.08 -3.11 1.13 0.00 -1.78 0.00 0.00 34.13 30.45 2qta s GLU 235 CO 0.58 -0.53 1.94 -1.35 -0.49 0.00 0.00 175.26 175.41 2qta h PRO 236 N 5.63 0.31 0.00 0.39 0.11 -1.90 0.13 132.00 136.67 2qta h PRO 236 Ca -0.45 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 65.62 2qta h PRO 236 Cb 1.21 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 2qta h PRO 236 CO 0.83 0.21 -0.11 0.93 -0.21 0.00 0.00 178.00 179.64 2qta h GLU 237 N 0.32 0.00 -0.39 1.05 3.07 -1.89 -0.25 114.58 116.49 2qta h GLU 237 Ca 0.34 0.00 -0.08 0.00 -0.50 0.00 0.00 59.36 59.12 2qta h GLU 237 Cb 0.87 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.77 2qta h GLU 237 CO -0.09 0.11 -0.06 0.77 -1.40 0.00 0.00 179.01 178.34 2qta h SER 238 N 0.00 0.73 0.00 1.42 0.02 -1.09 -3.35 113.55 111.28 2qta h SER 238 Ca -0.00 -0.35 0.00 0.00 -0.84 0.00 0.00 61.79 60.60 2qta h SER 238 Cb 0.52 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 62.87 2qta h SER 238 CO 0.01 0.91 -0.78 0.29 -1.14 0.00 0.00 176.83 176.12 2qta n LYS 239 N -4.38 2.70 0.20 3.45 5.02 -1.22 -4.70 118.16 119.22 2qta n LYS 239 Ca -0.01 -0.03 0.18 0.00 -2.02 0.00 0.00 58.31 56.43 2qta n LYS 239 Cb 0.33 -1.02 0.82 0.00 -0.02 0.00 0.00 35.03 35.14 2qta n LYS 239 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 2qta h GLY 240 N 1.92 0.00 -0.51 0.72 0.00 -1.17 -1.82 103.07 102.20 2qta h GLY 240 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2qta h GLY 240 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.54 2qta n ALA 241 N -2.26 2.16 0.23 3.60 0.00 -1.26 -4.78 120.51 118.20 2qta n ALA 241 Ca 0.03 -1.32 0.06 0.00 0.00 0.00 0.00 53.44 52.20 2qta n ALA 241 Cb 0.41 -0.23 0.53 0.00 0.00 0.00 0.00 19.45 20.16 2qta n ALA 241 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 177.50 176.66 2qta h ILE 242 N 0.76 1.08 0.00 0.00 3.07 -1.62 -1.74 117.51 119.06 2qta h ILE 242 Ca 0.00 -0.59 -0.00 0.00 1.55 0.00 0.00 64.86 65.81 2qta h ILE 242 Cb 0.70 1.32 -0.00 0.00 -0.27 0.00 0.00 36.82 38.57 2qta h ILE 242 CO 0.02 0.17 -0.02 0.71 -1.05 0.00 0.00 178.15 177.98 2qta h THR 243 N 0.00 0.27 -0.04 0.16 1.35 -1.82 -2.04 112.91 110.78 2qta h THR 243 Ca -0.00 -0.10 -0.03 0.00 -0.55 0.00 0.00 66.41 65.72 2qta h THR 243 Cb 0.31 1.08 -0.01 0.00 -1.73 0.00 0.00 68.15 67.80 2qta h THR 243 CO 0.02 0.02 -0.14 0.40 -0.25 0.00 0.00 175.52 175.57 2qta h ILE 244 N 0.00 1.12 0.00 6.82 1.08 -1.67 -0.29 117.51 124.57 2qta h ILE 244 Ca -0.00 -0.57 -0.07 0.00 -0.39 0.00 0.00 64.86 63.83 2qta h ILE 244 Cb 0.08 1.25 -0.01 0.00 -3.07 0.00 0.00 36.82 35.06 2qta h ILE 244 CO 0.00 0.17 -0.35 0.00 -0.69 0.00 0.00 178.15 177.28 2qta h ALA 245 N 1.80 1.20 0.11 1.87 0.00 -1.52 -0.66 119.26 122.07 2qta h ALA 245 Ca 0.01 -0.31 -0.21 0.00 0.00 0.00 0.00 54.91 54.40 2qta h ALA 245 Cb 0.28 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.02 2qta h ALA 245 CO 0.02 0.43 -1.02 1.15 0.00 0.00 0.00 179.25 179.83 2qta h THR 246 N 0.00 1.31 -0.85 0.00 2.02 -1.34 0.12 112.91 114.17 2qta h THR 246 Ca -0.00 -2.45 0.10 0.00 0.77 0.00 0.00 66.41 64.82 2qta h THR 246 Cb 0.71 2.97 -0.07 0.00 -1.74 0.00 0.00 68.15 70.02 2qta h THR 246 CO 0.04 0.69 0.49 0.03 0.37 0.00 0.00 175.52 177.14 2qta h ARG 247 N -0.42 0.80 -0.49 6.66 3.08 -0.98 -2.05 114.38 120.98 2qta h ARG 247 Ca -0.21 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 59.79 2qta h ARG 247 Cb 1.63 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 31.50 2qta h ARG 247 CO 0.09 0.53 0.00 0.39 -1.07 0.00 0.00 179.97 179.91 2qta n GLU 248 N -4.72 2.24 -3.98 0.04 -0.58 -0.27 -4.96 120.64 108.41 2qta n GLU 248 Ca 0.14 -1.92 -0.32 0.00 -0.42 0.00 0.00 57.16 54.64 2qta n GLU 248 Cb 0.28 -1.43 -0.01 0.00 -0.57 0.00 0.00 31.44 29.70 2qta n GLU 248 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2qta n LYS 249 N 1.07 -1.76 -1.86 3.49 5.02 -0.65 -4.79 118.16 118.68 2qta n LYS 249 Ca 0.18 0.29 -0.42 0.00 -2.02 0.00 0.00 58.31 56.35 2qta n LYS 249 Cb 0.47 -3.86 -0.01 0.00 -0.02 0.00 0.00 35.03 31.61 2qta n LYS 249 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2qta n LEU 250 N -4.52 6.15 -0.00 -0.35 4.77 0.31 -4.53 117.00 118.83 2qta n LEU 250 Ca -0.22 -3.97 0.00 0.00 -0.03 0.00 0.00 56.01 51.79 2qta n LEU 250 Cb 0.64 -1.63 0.00 0.00 -2.33 0.00 0.00 43.42 40.10 2qta n LEU 250 CO 0.75 0.72 0.47 -0.90 -1.33 0.00 0.00 177.39 177.10 2qta n ASP 251 N 6.88 0.00 -0.97 -1.43 5.68 -1.24 -2.25 116.55 123.21 2qta n ASP 251 Ca 0.51 -1.90 0.08 0.00 -0.50 0.00 0.00 54.79 52.97 2qta n ASP 251 Cb 0.41 -0.00 0.24 0.00 -1.14 0.00 0.00 41.12 40.63 2qta n ASP 251 CO 0.00 0.00 0.00 -0.46 -1.33 0.00 0.00 177.20 175.41 2qta n ASN 252 N -0.50 3.70 -4.20 -1.12 6.94 -1.26 -4.87 115.26 113.95 2qta n ASN 252 Ca 0.00 -2.41 -0.31 0.00 -0.02 0.00 0.00 54.58 51.84 2qta n ASN 252 Cb 0.00 -0.42 -0.17 0.00 -2.36 0.00 0.00 39.78 36.83 2qta n ASN 252 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 2qta s LEU 253 N -1.75 2.03 -0.11 -4.53 2.96 -0.95 0.64 118.68 116.97 2qta s LEU 253 Ca 0.37 -0.52 0.00 0.00 -0.22 0.00 0.00 54.13 53.76 2qta s LEU 253 Cb 0.24 -1.32 0.02 0.00 0.50 0.00 0.00 46.19 45.63 2qta s LEU 253 CO 0.16 0.15 -0.09 -0.69 -1.32 0.00 0.00 176.35 174.56 2qta s VAL 254 N 0.31 1.13 -0.08 1.68 1.01 0.15 -2.37 120.40 122.23 2qta s VAL 254 Ca -0.16 -0.38 -0.16 0.00 0.00 0.00 0.00 61.98 61.28 2qta s VAL 254 Cb -0.17 -1.11 -0.05 0.00 0.00 0.00 0.00 36.38 35.05 2qta s VAL 254 CO 0.08 0.38 0.42 -0.36 0.00 0.00 0.00 175.10 175.62 2qta s PHE 255 N 1.48 3.59 -0.32 5.22 0.40 -0.07 -1.28 117.98 126.99 2qta s PHE 255 Ca 0.01 0.88 0.03 0.00 -0.60 0.00 0.00 56.93 57.25 2qta s PHE 255 Cb -0.13 -2.42 0.09 0.00 0.51 0.00 0.00 43.02 41.07 2qta s PHE 255 CO -0.06 0.36 0.04 0.08 0.70 0.00 0.00 175.22 176.33 2qta s VAL 256 N -0.04 1.88 -0.28 -0.44 1.01 0.84 -0.21 120.40 123.17 2qta s VAL 256 Ca 0.24 -1.99 -0.12 0.00 0.00 0.00 0.00 61.98 60.11 2qta s VAL 256 Cb -0.15 -2.35 -0.05 0.00 0.00 0.00 0.00 36.38 33.83 2qta s VAL 256 CO 0.10 -0.54 0.24 -0.63 0.00 0.00 0.00 175.10 174.28 2qta s ILE 257 N 1.12 5.27 -0.71 2.22 1.01 -0.24 -0.64 121.20 129.23 2qta s ILE 257 Ca 0.08 0.29 -0.27 0.00 0.00 0.00 0.00 60.65 60.75 2qta s ILE 257 Cb -0.19 -3.58 0.03 0.00 0.01 0.00 0.00 42.46 38.74 2qta s ILE 257 CO -0.12 0.22 1.23 0.21 0.00 0.00 0.00 174.94 176.49 2qta s ASN 258 N 1.72 6.19 -1.17 3.58 2.47 0.22 -1.31 114.94 126.64 2qta s ASN 258 Ca 0.09 -0.45 -0.13 0.00 0.42 0.00 0.00 52.86 52.79 2qta s ASN 258 Cb -0.16 -2.54 0.18 0.00 -1.45 0.00 0.00 41.25 37.28 2qta s ASN 258 CO 0.11 -1.76 1.36 0.00 -3.72 0.00 0.00 177.10 173.09 2qta n ASN 260 N 5.27 2.43 0.00 0.00 0.23 -1.26 -2.07 115.26 119.86 2qta n ASN 260 Ca 0.34 -1.88 0.00 0.00 -0.53 0.00 0.00 54.58 52.51 2qta n ASN 260 Cb 0.43 -0.21 0.00 0.00 -2.08 0.00 0.00 39.78 37.91 2qta n ASN 260 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 2qta n LEU 261 N 0.82 0.50 -4.34 -4.53 4.77 -1.26 -4.49 117.00 108.46 2qta n LEU 261 Ca 0.17 0.00 -0.28 0.00 -0.03 0.00 0.00 56.01 55.87 2qta n LEU 261 Cb 0.43 -0.78 -0.13 0.00 -2.33 0.00 0.00 43.42 40.60 2qta n LEU 261 CO 0.13 -0.25 -0.55 -1.10 -1.33 0.00 0.00 177.39 174.29 2qta s GLN 262 N -0.50 1.43 0.00 3.23 -0.21 -1.26 -1.30 119.66 121.05 2qta s GLN 262 Ca 0.00 -1.21 0.00 0.00 0.02 0.00 0.00 55.36 54.17 2qta s GLN 262 Cb 0.00 -1.76 0.00 0.00 1.00 0.00 0.00 33.01 32.25 2qta s GLN 262 CO 0.00 0.43 0.00 2.89 -2.12 0.00 0.00 175.29 176.49 2qta n ARG 263 N 1.25 3.33 0.00 2.91 1.85 0.11 -4.40 116.66 121.71 2qta n ARG 263 Ca -0.18 0.00 -0.00 0.00 -1.00 0.00 0.00 57.85 56.67 2qta n ARG 263 Cb 0.53 0.00 -0.00 0.00 -1.05 0.00 0.00 32.46 31.94 2qta n ARG 263 CO 0.00 0.00 0.00 1.25 -0.01 0.00 0.00 177.63 178.87 2qta h LEU 264 N 0.00 -0.01 -2.86 2.89 5.85 -2.00 -3.39 115.31 115.80 2qta h LEU 264 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2qta h LEU 264 Cb 0.00 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.03 2qta h LEU 264 CO 0.00 -0.01 0.00 0.47 -0.34 0.00 0.00 178.44 178.56 2qta n ASP 265 N -2.02 4.42 0.00 1.25 9.92 -1.26 -4.99 116.55 123.86 2qta n ASP 265 Ca -0.00 -2.47 0.00 0.00 -0.53 0.00 0.00 54.79 51.79 2qta n ASP 265 Cb 0.00 -0.57 0.00 0.00 -0.64 0.00 0.00 41.12 39.92 2qta n ASP 265 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2qta n GLY 266 N 0.96 -2.43 3.78 0.44 0.00 -1.26 -5.14 105.19 101.54 2qta n GLY 266 Ca 0.23 -1.24 -0.33 0.00 0.00 0.00 0.00 46.02 44.68 2qta n GLY 266 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2qta s PRO 267 N -1.97 2.93 0.07 1.61 0.04 -1.26 0.08 135.00 136.50 2qta s PRO 267 Ca 0.00 1.31 -0.27 0.00 0.04 0.00 0.00 61.00 62.08 2qta s PRO 267 Cb 0.00 -1.97 -0.17 0.00 0.04 0.00 0.00 34.50 32.40 2qta s PRO 267 CO 0.00 -1.14 1.64 0.28 0.04 0.00 0.00 177.00 177.82 2qta h VAL 268 N 0.07 0.70 -2.28 -0.36 2.07 -1.48 -3.39 116.25 111.59 2qta h VAL 268 Ca -0.47 -0.08 -0.50 0.00 0.82 0.00 0.00 66.70 66.48 2qta h VAL 268 Cb 1.24 0.75 -0.35 0.00 -1.52 0.00 0.00 31.29 31.40 2qta h VAL 268 CO 0.55 0.02 -0.81 0.42 0.02 0.00 0.00 177.57 177.77 2qta s THR 269 N -5.96 -0.02 0.33 2.57 -4.23 -1.26 -5.02 115.64 102.06 2qta s THR 269 Ca -0.15 -1.65 0.01 0.00 -1.18 0.00 0.00 61.69 58.72 2qta s THR 269 Cb 0.04 -0.96 0.27 0.00 1.34 0.00 0.00 72.50 73.19 2qta s THR 269 CO 0.63 -0.88 1.99 1.23 -0.54 0.00 0.00 174.62 177.06 2qta h GLY 270 N 6.66 1.01 0.18 3.99 0.00 -1.91 -2.10 103.07 110.90 2qta h GLY 270 Ca 0.10 -0.37 0.00 0.00 0.00 0.00 0.00 47.33 47.06 2qta h GLY 270 CO 0.25 0.35 0.00 0.70 0.00 0.00 0.00 176.54 177.84 2qta n ASN 271 N -4.43 0.72 0.00 0.19 3.02 -1.26 -0.00 115.26 113.50 2qta n ASN 271 Ca 0.08 -1.35 0.00 0.00 -0.03 0.00 0.00 54.58 53.28 2qta n ASN 271 Cb 0.05 -0.02 0.00 0.00 -0.61 0.00 0.00 39.78 39.21 2qta n ASN 271 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2qta n GLY 272 N 1.03 6.31 2.70 7.41 0.00 -0.79 -4.88 105.19 116.97 2qta n GLY 272 Ca 0.19 -1.69 -0.30 0.00 0.00 0.00 0.00 46.02 44.22 2qta n GLY 272 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qta s LYS 273 N 1.22 0.78 0.48 1.61 1.02 -1.26 -0.49 119.74 123.10 2qta s LYS 273 Ca 0.00 -1.24 0.14 0.00 0.02 0.00 0.00 55.97 54.89 2qta s LYS 273 Cb 0.00 -1.96 1.14 0.00 -0.52 0.00 0.00 37.83 36.49 2qta s LYS 273 CO 0.00 -1.04 2.09 0.97 -0.92 0.00 0.00 175.35 176.45 2qta h ILE 274 N 6.14 0.98 -0.52 2.17 6.09 -1.97 -1.21 117.51 129.20 2qta h ILE 274 Ca -0.10 -0.07 -0.09 0.00 -1.37 0.00 0.00 64.86 63.23 2qta h ILE 274 Cb 0.99 0.76 -0.02 0.00 0.47 0.00 0.00 36.82 39.03 2qta h ILE 274 CO 0.46 0.04 -0.03 0.40 -3.07 0.00 0.00 178.15 175.95 2qta h ILE 275 N 0.20 1.27 -0.47 2.19 2.04 -1.98 -1.09 117.51 119.66 2qta h ILE 275 Ca 0.11 -1.14 -0.09 0.00 1.00 0.00 0.00 64.86 64.73 2qta h ILE 275 Cb 0.17 0.96 -0.02 0.00 -0.74 0.00 0.00 36.82 37.19 2qta h ILE 275 CO -0.02 0.40 -0.08 0.78 0.00 0.00 0.00 178.15 179.23 2qta h ASN 276 N 0.80 0.83 -0.31 1.72 2.35 -1.72 0.49 115.58 119.75 2qta h ASN 276 Ca 0.14 -0.24 0.00 0.00 -0.55 0.00 0.00 56.30 55.65 2qta h ASN 276 Cb 0.56 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.70 2qta h ASN 276 CO 0.03 0.94 0.20 -0.08 -1.65 0.00 0.00 177.43 176.87 2qta h GLU 277 N 0.77 0.41 -0.29 0.81 4.81 -0.87 0.14 114.58 120.35 2qta h GLU 277 Ca 0.13 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.30 2qta h GLU 277 Cb 0.58 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.85 2qta h GLU 277 CO 0.04 0.29 0.06 -0.07 -0.73 0.00 0.00 179.01 178.59 2qta h LEU 278 N 0.41 0.45 -0.38 1.64 3.38 -1.01 -2.03 115.31 117.77 2qta h LEU 278 Ca 0.11 -0.24 0.01 0.00 0.09 0.00 0.00 57.88 57.85 2qta h LEU 278 Cb -0.03 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 2qta h LEU 278 CO -0.02 0.58 0.24 -0.08 0.09 0.00 0.00 178.44 179.25 2qta h GLU 279 N 0.30 0.49 -0.21 1.13 4.81 -0.68 -0.53 114.58 119.88 2qta h GLU 279 Ca 0.09 -0.03 0.04 0.00 -0.13 0.00 0.00 59.36 59.33 2qta h GLU 279 Cb 0.31 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.54 2qta h GLU 279 CO 0.00 0.32 -0.03 0.78 -0.73 0.00 0.00 179.01 179.36 2qta h GLY 280 N 0.50 0.18 1.44 1.92 0.00 -0.57 0.78 103.07 107.32 2qta h GLY 280 Ca 0.14 0.05 -0.23 0.00 0.00 0.00 0.00 47.33 47.29 2qta h GLY 280 CO -0.04 -0.06 -0.94 1.19 0.00 0.00 0.00 176.54 176.69 2qta h ILE 281 N 0.03 1.36 -0.45 2.60 2.10 -1.24 -1.07 117.51 120.85 2qta h ILE 281 Ca 0.10 -2.34 -0.14 0.00 1.08 0.00 0.00 64.86 63.56 2qta h ILE 281 Cb 0.14 2.35 -0.01 0.00 -1.09 0.00 0.00 36.82 38.21 2qta h ILE 281 CO -0.20 0.71 -0.28 -0.26 -1.08 0.00 0.00 178.15 177.05 2qta h PHE 282 N 0.30 1.13 -0.65 2.19 -1.00 -0.97 -0.15 116.94 117.79 2qta h PHE 282 Ca -0.09 -0.29 -0.04 0.00 2.81 0.00 0.00 57.97 60.36 2qta h PHE 282 Cb 1.57 -0.25 -0.03 0.00 3.61 0.00 0.00 35.95 40.85 2qta h PHE 282 CO 0.07 1.12 0.27 1.49 -1.61 0.00 0.00 178.31 179.65 2qta h GLU 283 N 0.82 0.97 -0.24 1.51 4.57 -0.89 -1.43 114.58 119.88 2qta h GLU 283 Ca 0.09 -0.17 -0.00 0.00 -1.18 0.00 0.00 59.36 58.10 2qta h GLU 283 Cb 0.86 -0.16 -0.01 0.00 -0.16 0.00 0.00 28.75 29.28 2qta h GLU 283 CO 0.08 0.81 0.13 0.78 -1.18 0.00 0.00 179.01 179.62 2qta h GLY 284 N 0.91 0.35 0.18 1.92 0.00 -0.79 -1.06 103.07 104.59 2qta h GLY 284 Ca 0.22 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.41 2qta h GLY 284 CO -0.02 0.14 0.00 0.00 0.00 0.00 0.00 176.54 176.66 2qta n ALA 285 N -2.50 2.59 -0.45 3.60 0.00 -0.10 -4.91 120.51 118.74 2qta n ALA 285 Ca 0.01 -0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.19 2qta n ALA 285 Cb 0.10 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.29 2qta n ALA 285 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qta n GLY 286 N 0.93 0.75 3.82 0.00 0.00 -0.40 -4.64 105.19 105.65 2qta n GLY 286 Ca 0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 2qta n GLY 286 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2qta s TRP 287 N -2.45 3.14 -0.27 1.61 0.52 -0.64 -4.75 118.94 116.09 2qta s TRP 287 Ca 0.00 1.49 -0.27 0.00 0.02 0.00 0.00 56.10 57.34 2qta s TRP 287 Cb 0.00 -2.94 0.01 0.00 -1.15 0.00 0.00 33.47 29.39 2qta s TRP 287 CO 0.00 -0.90 0.98 1.21 0.02 0.00 0.00 176.95 178.26 2qta s ASN 288 N -2.94 6.94 -0.19 2.95 3.04 -0.09 -4.49 114.94 120.15 2qta s ASN 288 Ca 0.62 1.11 -0.06 0.00 0.04 0.00 0.00 52.86 54.57 2qta s ASN 288 Cb -0.14 -2.50 -0.03 0.00 -1.54 0.00 0.00 41.25 37.03 2qta s ASN 288 CO 0.36 -0.71 0.02 -0.69 -3.04 0.00 0.00 177.10 173.05 2qta s VAL 289 N 3.26 4.23 -0.20 -5.21 1.01 -1.26 -0.69 120.40 121.54 2qta s VAL 289 Ca 0.41 -0.22 0.01 0.00 0.00 0.00 0.00 61.98 62.18 2qta s VAL 289 Cb -0.14 -2.91 0.04 0.00 0.00 0.00 0.00 36.38 33.37 2qta s VAL 289 CO 0.10 0.44 -0.14 -0.63 0.00 0.00 0.00 175.10 174.87 2qta s ILE 290 N 0.76 1.86 -0.21 2.22 1.01 -0.47 -4.98 121.20 121.39 2qta s ILE 290 Ca 0.01 -1.07 -0.15 0.00 0.00 0.00 0.00 60.65 59.44 2qta s ILE 290 Cb -0.14 -1.85 -0.04 0.00 0.01 0.00 0.00 42.46 40.44 2qta s ILE 290 CO 0.02 0.27 0.35 -0.54 0.00 0.00 0.00 174.94 175.04 2qta s LYS 291 N 1.32 4.15 -0.74 2.79 1.02 -1.26 -0.83 119.74 126.18 2qta s LYS 291 Ca -0.00 0.10 -0.04 0.00 0.02 0.00 0.00 55.97 56.04 2qta s LYS 291 Cb -0.16 -3.54 0.19 0.00 -0.52 0.00 0.00 37.83 33.80 2qta s LYS 291 CO -0.09 -0.02 0.59 0.08 -0.92 0.00 0.00 175.35 174.99 2qta s VAL 292 N 1.27 4.22 -0.19 3.17 1.01 0.40 -1.84 120.40 128.43 2qta s VAL 292 Ca 0.17 -3.13 -0.18 0.00 0.00 0.00 0.00 61.98 58.83 2qta s VAL 292 Cb -0.14 -3.68 -0.20 0.00 0.00 0.00 0.00 36.38 32.35 2qta s VAL 292 CO 0.07 -0.96 0.22 0.23 0.00 0.00 0.00 175.10 174.66 2qta n MET 293 N 3.24 0.61 -4.24 2.72 2.81 -1.26 -1.21 117.12 119.79 2qta n MET 293 Ca 0.13 0.50 -0.19 0.00 -1.81 0.00 0.00 57.70 56.32 2qta n MET 293 Cb 0.39 -1.73 -0.12 0.00 -0.71 0.00 0.00 33.22 31.05 2qta n MET 293 CO 0.00 0.00 0.00 -1.58 1.51 0.00 0.00 175.97 175.90 2qta s TRP 294 N -2.41 1.23 1.05 2.03 0.52 -1.26 -0.59 118.94 119.50 2qta s TRP 294 Ca -0.28 -0.42 -0.16 0.00 0.02 0.00 0.00 56.10 55.26 2qta s TRP 294 Cb 0.06 -0.70 0.22 0.00 -1.15 0.00 0.00 33.47 31.90 2qta s TRP 294 CO 0.63 0.05 1.17 0.20 0.02 0.00 0.00 176.95 179.02 2qta s GLY 295 N -1.52 1.63 0.49 0.98 0.00 -0.75 -4.05 107.32 104.11 2qta s GLY 295 Ca -0.01 -0.86 0.17 0.00 0.00 0.00 0.00 44.72 44.02 2qta s GLY 295 CO 0.02 -0.11 2.07 1.76 0.00 0.00 0.00 173.10 176.83 2qta h SER 296 N -1.99 0.13 0.25 1.64 0.02 -1.94 -2.58 113.55 109.08 2qta h SER 296 Ca -0.47 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.48 2qta h SER 296 Cb 1.29 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.80 2qta h SER 296 CO 0.44 0.09 0.00 0.03 -1.14 0.00 0.00 176.83 176.25 2qta h ARG 297 N 0.15 0.00 0.00 3.45 3.08 -1.93 -1.81 114.38 117.33 2qta h ARG 297 Ca 0.14 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.19 2qta h ARG 297 Cb 0.36 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.41 2qta h ARG 297 CO -0.02 0.00 -0.30 -1.49 -1.07 0.00 0.00 179.97 177.09 2qta h TRP 298 N 0.00 0.00 -0.81 3.04 4.06 -1.82 -3.38 115.95 117.04 2qta h TRP 298 Ca 0.00 0.00 0.01 0.00 2.06 0.00 0.00 58.89 60.96 2qta h TRP 298 Cb 0.12 0.00 -0.04 0.00 -1.00 0.00 0.00 29.16 28.24 2qta h TRP 298 CO 0.00 0.00 0.54 -0.44 -3.56 0.00 0.00 178.44 174.98 2qta h ASP 299 N 0.00 0.92 -0.06 -3.49 3.32 -1.49 0.21 116.42 115.84 2qta h ASP 299 Ca 0.00 -0.02 -0.17 0.00 0.02 0.00 0.00 57.03 56.86 2qta h ASP 299 Cb 0.76 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 40.08 2qta h ASP 299 CO 0.00 0.67 -0.57 -0.08 -1.72 0.00 0.00 179.24 177.54 2qta h GLU 300 N 1.09 0.66 -0.55 3.56 4.57 -1.77 -2.82 114.58 119.32 2qta h GLU 300 Ca 0.30 -0.42 -0.02 0.00 -1.18 0.00 0.00 59.36 58.04 2qta h GLU 300 Cb -0.11 0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 28.51 2qta h GLU 300 CO -0.07 1.04 0.27 1.25 -1.18 0.00 0.00 179.01 180.32 2qta h LEU 301 N 0.50 0.71 -0.37 1.64 5.85 -1.67 -2.15 115.31 119.82 2qta h LEU 301 Ca 0.01 -0.12 -0.17 0.00 0.84 0.00 0.00 57.88 58.44 2qta h LEU 301 Cb 1.13 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 41.98 2qta h LEU 301 CO 0.11 0.63 -0.42 -0.07 -0.34 0.00 0.00 178.44 178.36 2qta h LEU 302 N 0.74 1.00 -0.74 2.25 3.38 -0.95 -2.67 115.31 118.33 2qta h LEU 302 Ca 0.19 -0.48 0.00 0.00 0.09 0.00 0.00 57.88 57.68 2qta h LEU 302 Cb 0.10 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.57 2qta h LEU 302 CO -0.03 1.28 0.00 0.08 0.09 0.00 0.00 178.44 179.87 2qta h ARG 303 N 0.75 0.00 0.00 1.13 0.11 -1.47 -2.82 114.38 112.08 2qta h ARG 303 Ca 0.05 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.13 2qta h ARG 303 Cb 1.02 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.10 2qta h ARG 303 CO 0.10 0.00 -0.48 -0.22 0.10 0.00 0.00 179.97 179.47 2qta h LYS 304 N 0.00 0.00 -5.63 0.08 3.64 -1.21 -3.41 116.57 110.04 2qta h LYS 304 Ca 0.00 0.00 -0.69 0.00 -1.27 0.00 0.00 60.65 58.69 2qta h LYS 304 Cb 0.66 0.00 -0.09 0.00 -0.41 0.00 0.00 32.23 32.39 2qta h LYS 304 CO 0.00 0.00 2.10 -3.47 -2.27 0.00 0.00 179.45 175.81 2qta n ASP 305 N -2.43 4.96 0.17 4.20 2.03 -1.02 -4.76 116.55 119.70 2qta n ASP 305 Ca 0.03 -2.93 0.13 0.00 0.52 0.00 0.00 54.79 52.55 2qta n ASP 305 Cb 0.48 -1.72 0.55 0.00 -0.72 0.00 0.00 41.12 39.70 2qta n ASP 305 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 2qta h THR 306 N 5.38 0.00 0.00 5.18 1.35 -1.85 -2.96 112.91 120.01 2qta h THR 306 Ca 0.43 -0.30 -0.13 0.00 -0.55 0.00 0.00 66.41 65.87 2qta h THR 306 Cb 0.86 1.09 -0.02 0.00 -1.73 0.00 0.00 68.15 68.36 2qta h THR 306 CO 1.44 0.00 -0.68 0.77 -0.25 0.00 0.00 175.52 176.80 2qta h SER 307 N 0.00 0.00 -0.01 5.36 4.64 -1.97 -3.47 113.55 118.10 2qta h SER 307 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2qta h SER 307 Cb 0.39 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.48 2qta h SER 307 CO 0.00 0.59 -0.00 0.61 -0.87 0.00 0.00 176.83 177.16 2qta n GLY 308 N 1.26 0.47 0.09 -0.77 0.00 -1.12 -4.91 105.19 100.22 2qta n GLY 308 Ca 0.00 -0.18 -0.04 0.00 0.00 0.00 0.00 46.02 45.81 2qta n GLY 308 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qta h LYS 309 N 0.78 0.00 -0.23 1.61 1.79 -1.92 -2.02 116.57 116.57 2qta h LYS 309 Ca -0.00 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.45 2qta h LYS 309 Cb 0.06 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.70 2qta h LYS 309 CO 0.01 0.83 0.08 1.25 -1.08 0.00 0.00 179.45 180.53 2qta h LEU 310 N 0.00 0.33 -0.60 2.94 5.85 -1.91 0.67 115.31 122.60 2qta h LEU 310 Ca -0.01 -0.19 0.00 0.00 0.84 0.00 0.00 57.88 58.53 2qta h LEU 310 Cb 1.57 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 42.49 2qta h LEU 310 CO 0.11 0.43 0.38 0.40 -0.34 0.00 0.00 178.44 179.42 2qta h ILE 311 N 0.22 1.16 -0.54 4.05 1.08 -1.95 0.21 117.51 121.73 2qta h ILE 311 Ca 0.08 -0.33 -0.03 0.00 -0.39 0.00 0.00 64.86 64.20 2qta h ILE 311 Cb 0.21 0.31 -0.02 0.00 -3.07 0.00 0.00 36.82 34.24 2qta h ILE 311 CO -0.00 0.16 0.24 -0.61 -0.69 0.00 0.00 178.15 177.25 2qta h GLN 312 N 0.81 0.79 -0.50 2.37 4.15 -0.99 0.13 115.11 121.87 2qta h GLN 312 Ca 0.22 -0.13 -0.02 0.00 0.77 0.00 0.00 58.65 59.49 2qta h GLN 312 Cb -0.06 -0.14 -0.02 0.00 0.21 0.00 0.00 27.48 27.47 2qta h GLN 312 CO -0.04 0.67 0.25 1.25 -1.93 0.00 0.00 178.83 179.03 2qta h LEU 313 N 0.73 0.65 -0.55 -2.39 5.85 0.95 -0.80 115.31 119.75 2qta h LEU 313 Ca 0.18 -0.12 -0.04 0.00 0.84 0.00 0.00 57.88 58.75 2qta h LEU 313 Cb 0.16 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 2qta h LEU 313 CO -0.02 0.58 0.21 0.24 -0.34 0.00 0.00 178.44 179.11 2qta h MET 314 N 0.67 0.83 -0.34 1.25 2.86 -0.17 -2.46 114.93 117.57 2qta h MET 314 Ca 0.17 -0.16 -0.04 0.00 -2.06 0.00 0.00 59.70 57.62 2qta h MET 314 Cb 0.10 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 31.61 2qta h MET 314 CO -0.02 0.74 0.06 -0.91 1.06 0.00 0.00 176.91 177.84 2qta h ASN 315 N 0.76 0.54 1.44 1.22 2.35 -0.45 -3.21 115.58 118.23 2qta h ASN 315 Ca 0.18 -0.25 -0.01 0.00 -0.55 0.00 0.00 56.30 55.67 2qta h ASN 315 Cb 0.22 -0.14 -0.00 0.00 0.05 0.00 0.00 38.32 38.45 2qta h ASN 315 CO -0.01 0.65 -0.04 1.05 -1.65 0.00 0.00 177.43 177.43 2qta h GLU 316 N 0.40 0.00 -6.77 0.81 4.11 -1.10 -3.45 114.58 108.58 2qta h GLU 316 Ca 0.11 0.00 -0.52 0.00 0.07 0.00 0.00 59.36 59.02 2qta h GLU 316 Cb 0.34 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.62 2qta h GLU 316 CO 0.01 0.04 0.56 0.99 0.07 0.00 0.00 179.01 180.67 2qta s THR 317 N -3.45 3.28 0.26 -1.06 2.01 -0.93 -5.02 115.64 110.73 2qta s THR 317 Ca 0.04 1.20 0.05 0.00 0.31 0.00 0.00 61.69 63.29 2qta s THR 317 Cb 0.07 -3.76 -0.03 0.00 0.01 0.00 0.00 72.50 68.79 2qta s THR 317 CO 0.61 0.25 0.37 0.54 -0.69 0.00 0.00 174.62 175.70 2qta s VAL 318 N -0.72 4.95 0.23 3.82 0.11 -1.26 -4.95 120.40 122.58 2qta s VAL 318 Ca 0.49 -1.03 -0.13 0.00 -2.93 0.00 0.00 61.98 58.38 2qta s VAL 318 Cb -0.35 -3.73 0.28 0.00 -1.53 0.00 0.00 36.38 31.06 2qta s VAL 318 CO 0.43 -0.30 1.60 0.44 -3.33 0.00 0.00 175.10 173.94 2qta h ASP 319 N 1.14 -0.78 -0.64 3.54 3.32 -0.83 -0.96 116.42 121.22 2qta h ASP 319 Ca -0.50 0.23 0.10 0.00 0.02 0.00 0.00 57.03 56.87 2qta h ASP 319 Cb 1.24 0.49 -0.07 0.00 0.22 0.00 0.00 39.33 41.20 2qta h ASP 319 CO 0.59 -0.26 0.25 1.23 -1.72 0.00 0.00 179.24 179.34 2qta h GLY 320 N -0.02 0.91 1.39 2.75 0.00 -0.66 -1.72 103.07 105.72 2qta h GLY 320 Ca 0.35 -0.14 -0.13 0.00 0.00 0.00 0.00 47.33 47.41 2qta h GLY 320 CO -0.77 -0.02 -0.36 -0.55 0.00 0.00 0.00 176.54 174.85 2qta h ASP 321 N 0.44 0.72 -0.38 0.19 3.32 -1.44 -1.91 116.42 117.35 2qta h ASP 321 Ca 0.33 -0.30 -0.04 0.00 0.02 0.00 0.00 57.03 57.03 2qta h ASP 321 Cb 0.41 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.74 2qta h ASP 321 CO -0.31 1.00 0.10 1.88 -1.72 0.00 0.00 179.24 180.19 2qta h TYR 322 N 0.57 0.70 -0.06 4.55 0.05 -0.98 -1.82 116.97 119.98 2qta h TYR 322 Ca 0.06 -0.06 -0.13 0.00 0.05 0.00 0.00 58.73 58.65 2qta h TYR 322 Cb 0.88 -0.21 -0.01 0.00 1.01 0.00 0.00 36.73 38.39 2qta h TYR 322 CO 0.04 0.61 -0.56 1.96 -1.05 0.00 0.00 178.16 179.16 2qta h GLN 323 N 0.67 0.19 -0.35 4.88 1.08 -1.05 -2.64 115.11 117.88 2qta h GLN 323 Ca 0.15 -0.12 -0.16 0.00 -1.45 0.00 0.00 58.65 57.07 2qta h GLN 323 Cb 0.27 0.01 -0.00 0.00 -0.05 0.00 0.00 27.48 27.70 2qta h GLN 323 CO -0.00 0.70 -0.42 1.79 -0.95 0.00 0.00 178.83 179.94 2qta h THR 324 N 0.14 1.27 -0.79 -0.54 1.35 -0.80 -2.95 112.91 110.60 2qta h THR 324 Ca -0.00 -1.60 0.04 0.00 -0.55 0.00 0.00 66.41 64.30 2qta h THR 324 Cb 1.03 1.48 -0.05 0.00 -1.73 0.00 0.00 68.15 68.88 2qta h THR 324 CO 0.08 0.53 0.50 -0.26 -0.25 0.00 0.00 175.52 176.12 2qta h PHE 325 N 0.70 0.93 -0.42 4.73 0.04 -1.24 -0.84 116.94 120.83 2qta h PHE 325 Ca 0.05 0.03 0.12 0.00 2.80 0.00 0.00 57.97 60.96 2qta h PHE 325 Cb 1.02 -0.30 -0.02 0.00 2.20 0.00 0.00 35.95 38.85 2qta h PHE 325 CO 0.07 0.51 0.41 -0.22 -0.60 0.00 0.00 178.31 178.48 2qta h LYS 326 N 0.95 0.00 0.00 1.51 3.64 -1.29 -1.05 116.57 120.32 2qta h LYS 326 Ca 0.32 0.00 -0.17 0.00 -1.27 0.00 0.00 60.65 59.53 2qta h LYS 326 Cb 0.06 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.85 2qta h LYS 326 CO -0.13 0.00 -1.61 -1.13 -2.27 0.00 0.00 179.45 174.31 2qta n SER 327 N -3.85 0.64 0.00 4.20 3.41 -0.36 -4.91 113.62 112.74 2qta n SER 327 Ca 0.07 0.28 0.00 0.00 -0.26 0.00 0.00 58.87 58.96 2qta n SER 327 Cb 0.60 0.50 0.00 0.00 -0.26 0.00 0.00 64.21 65.05 2qta n SER 327 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2qta n LYS 328 N -2.79 0.00 -3.94 4.33 4.76 -0.40 -5.11 118.16 115.01 2qta n LYS 328 Ca -0.12 0.00 -0.09 0.00 -2.87 0.00 0.00 58.31 55.23 2qta n LYS 328 Cb 0.85 0.00 -0.03 0.00 -1.84 0.00 0.00 35.03 34.01 2qta n LYS 328 CO 0.00 0.00 0.00 0.16 -1.37 0.00 0.00 177.40 176.19 2qta s ASP 329 N -1.37 0.03 0.61 4.39 1.47 -1.26 -5.03 116.67 115.51 2qta s ASP 329 Ca 0.00 -0.97 0.33 0.00 1.18 0.00 0.00 52.55 53.09 2qta s ASP 329 Cb 0.00 0.68 1.95 0.00 -0.34 0.00 0.00 42.92 45.21 2qta s ASP 329 CO 0.00 -1.32 2.26 1.23 0.68 0.00 0.00 175.17 178.02 2qta h GLY 330 N 2.12 0.00 0.34 2.12 0.00 -1.94 -0.37 103.07 105.33 2qta h GLY 330 Ca -0.26 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 46.97 2qta h GLY 330 CO 0.34 0.00 -0.46 0.00 0.00 0.00 0.00 176.54 176.42 2qta h ALA 331 N 1.97 -0.03 -0.13 3.60 0.00 -1.97 -2.83 119.26 119.87 2qta h ALA 331 Ca 0.01 -0.63 0.03 0.00 0.00 0.00 0.00 54.91 54.32 2qta h ALA 331 Cb 0.06 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2qta h ALA 331 CO -0.00 0.22 0.09 -0.92 0.00 0.00 0.00 179.25 178.64 2qta h TYR 332 N -0.69 0.03 0.01 0.00 5.03 -1.79 -1.73 116.97 117.82 2qta h TYR 332 Ca -0.08 0.00 -0.00 0.00 2.58 0.00 0.00 58.73 61.23 2qta h TYR 332 Cb 1.33 -0.01 0.00 0.00 1.55 0.00 0.00 36.73 39.60 2qta h TYR 332 CO 0.23 0.02 -0.01 0.28 -1.32 0.00 0.00 178.16 177.36 2qta h VAL 333 N 0.03 1.47 0.00 1.81 2.07 -1.11 -0.65 116.25 119.87 2qta h VAL 333 Ca 0.06 -1.49 0.00 0.00 0.82 0.00 0.00 66.70 66.09 2qta h VAL 333 Cb 0.20 2.47 0.00 0.00 -1.52 0.00 0.00 31.29 32.44 2qta h VAL 333 CO -0.00 0.38 0.00 0.08 0.02 0.00 0.00 177.57 178.05 2qta h ARG 334 N -0.66 0.00 0.00 1.57 0.11 -1.23 -1.26 114.38 112.91 2qta h ARG 334 Ca -0.00 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.07 2qta h ARG 334 Cb 0.64 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.72 2qta h ARG 334 CO 0.00 0.00 -0.36 1.49 0.10 0.00 0.00 179.97 181.20 2qta h GLU 335 N 0.00 0.00 -0.00 0.08 4.22 -1.23 0.29 114.58 117.94 2qta h GLU 335 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.44 2qta h GLU 335 Cb 0.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.47 2qta h GLU 335 CO 0.00 0.07 -0.27 0.72 -2.18 0.00 0.00 179.01 177.35 2qta n HIS 336 N -4.66 0.00 0.00 0.92 8.25 -0.26 -3.25 115.22 116.22 2qta n HIS 336 Ca -0.06 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.40 2qta n HIS 336 Cb 0.20 -0.29 0.00 0.00 1.12 0.00 0.00 29.99 31.02 2qta n HIS 336 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2qta n PHE 337 N -1.31 0.00 0.08 4.41 7.35 -0.51 -4.63 117.46 122.85 2qta n PHE 337 Ca 0.08 0.00 0.06 0.00 -0.76 0.00 0.00 57.45 56.84 2qta n PHE 337 Cb 0.33 0.00 0.51 0.00 0.35 0.00 0.00 39.48 40.67 2qta n PHE 337 CO 0.00 0.00 0.00 0.74 -0.76 0.00 0.00 176.76 176.74 2qta h PHE 338 N 0.00 0.32 0.00 -5.13 0.04 -1.58 -1.97 116.94 108.62 2qta h PHE 338 Ca 0.00 0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.78 2qta h PHE 338 Cb 0.00 -0.11 0.00 0.00 2.20 0.00 0.00 35.95 38.04 2qta h PHE 338 CO 0.00 0.20 0.00 0.41 -0.60 0.00 0.00 178.31 178.32 2qta n GLY 339 N -1.51 -0.36 0.08 -1.45 0.00 0.10 -0.95 105.19 101.10 2qta n GLY 339 Ca 0.02 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.98 2qta n GLY 339 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2qta h LYS 340 N 0.00 0.00 -4.68 1.61 3.64 -1.51 -3.46 116.57 112.18 2qta h LYS 340 Ca 0.00 0.00 -0.32 0.00 -1.27 0.00 0.00 60.65 59.06 2qta h LYS 340 Cb 0.13 0.00 -0.23 0.00 -0.41 0.00 0.00 32.23 31.71 2qta h LYS 340 CO 0.00 0.92 -0.75 0.71 -2.27 0.00 0.00 179.45 178.06 2qta s TYR 341 N -2.86 0.75 0.25 1.91 2.02 -1.23 -5.05 117.35 113.12 2qta s TYR 341 Ca 0.01 -0.39 -0.05 0.00 -0.37 0.00 0.00 57.07 56.27 2qta s TYR 341 Cb 0.10 -0.45 0.27 0.00 -0.40 0.00 0.00 41.96 41.49 2qta s TYR 341 CO 0.81 -0.04 1.82 -1.35 -1.57 0.00 0.00 175.55 175.22 2qta h PRO 342 N 4.88 1.08 -0.34 -1.71 0.11 -1.88 0.38 132.00 134.52 2qta h PRO 342 Ca -0.35 -0.18 -0.09 0.00 0.11 0.00 0.00 66.00 65.50 2qta h PRO 342 Cb 1.20 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 32.11 2qta h PRO 342 CO 0.43 0.87 -0.15 0.93 -0.21 0.00 0.00 178.00 179.87 2qta h GLU 343 N 1.06 0.61 0.09 1.05 3.07 -1.97 0.15 114.58 118.63 2qta h GLU 343 Ca 0.25 -0.20 -0.26 0.00 -0.50 0.00 0.00 59.36 58.65 2qta h GLU 343 Cb 0.19 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 28.05 2qta h GLU 343 CO -0.02 0.74 -1.15 1.79 -1.40 0.00 0.00 179.01 178.97 2qta h THR 344 N 0.55 1.49 0.00 1.13 1.35 -1.71 -2.77 112.91 112.95 2qta h THR 344 Ca 0.09 -2.92 -0.06 0.00 -0.55 0.00 0.00 66.41 62.97 2qta h THR 344 Cb 0.57 2.80 -0.01 0.00 -1.73 0.00 0.00 68.15 69.79 2qta h THR 344 CO 0.04 0.85 -0.30 0.00 -0.25 0.00 0.00 175.52 175.86 2qta h ALA 345 N 0.66 1.14 0.00 6.62 0.00 0.92 -2.60 119.26 126.00 2qta h ALA 345 Ca -0.11 -0.27 -0.07 0.00 0.00 0.00 0.00 54.91 54.46 2qta h ALA 345 Cb 1.85 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.58 2qta h ALA 345 CO 0.19 0.37 -0.32 0.00 0.00 0.00 0.00 179.25 179.49 2qta h ALA 346 N 1.70 0.80 -0.00 0.00 0.00 -0.63 -1.93 119.26 119.20 2qta h ALA 346 Ca -0.00 -0.29 -0.10 0.00 0.00 0.00 0.00 54.91 54.52 2qta h ALA 346 Cb 0.70 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 2qta h ALA 346 CO 0.04 0.40 -0.47 -0.07 0.00 0.00 0.00 179.25 179.15 2qta h LEU 347 N 0.00 0.01 -3.04 0.00 3.38 -1.17 -2.97 115.31 111.52 2qta h LEU 347 Ca -0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2qta h LEU 347 Cb 1.22 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.96 2qta h LEU 347 CO 0.04 0.48 0.00 1.33 0.09 0.00 0.00 178.44 180.38 2qta n VAL 348 N -3.98 1.52 -0.12 1.22 0.24 -1.20 -4.57 118.33 111.43 2qta n VAL 348 Ca -0.02 -1.43 -0.08 0.00 -2.04 0.00 0.00 64.34 60.77 2qta n VAL 348 Cb 0.49 0.17 -0.00 0.00 -1.47 0.00 0.00 33.84 33.03 2qta n VAL 348 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2qta h ALA 349 N 1.41 0.49 -0.06 2.33 0.00 -1.18 -1.74 119.26 120.51 2qta h ALA 349 Ca 0.00 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 2qta h ALA 349 Cb 0.96 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 2qta h ALA 349 CO 0.07 -0.03 0.00 -0.25 0.00 0.00 0.00 179.25 179.04 2qta n ASP 350 N -4.80 1.58 -4.54 0.00 8.00 -1.26 -4.83 116.55 110.69 2qta n ASP 350 Ca 0.00 -2.10 -0.33 0.00 0.71 0.00 0.00 54.79 53.07 2qta n ASP 350 Cb 0.04 -0.52 -0.12 0.00 -0.02 0.00 0.00 41.12 40.50 2qta n ASP 350 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 2qta s TRP 351 N -1.15 2.81 0.48 1.24 0.52 -0.65 -5.11 118.94 117.09 2qta s TRP 351 Ca 0.06 -0.08 -0.20 0.00 0.02 0.00 0.00 56.10 55.91 2qta s TRP 351 Cb 0.04 -1.64 -0.09 0.00 -1.15 0.00 0.00 33.47 30.64 2qta s TRP 351 CO 0.02 0.29 1.01 0.95 0.02 0.00 0.00 176.95 179.23 2qta s THR 352 N -0.84 4.03 0.51 2.01 -4.23 -1.26 -4.90 115.64 110.97 2qta s THR 352 Ca 0.13 1.21 0.28 0.00 -1.18 0.00 0.00 61.69 62.13 2qta s THR 352 Cb -0.11 -3.51 0.45 0.00 1.34 0.00 0.00 72.50 70.67 2qta s THR 352 CO 0.03 -0.33 1.90 0.44 -0.54 0.00 0.00 174.62 176.12 2qta h ASP 353 N 1.49 0.08 0.24 3.99 5.19 -1.95 0.18 116.42 125.65 2qta h ASP 353 Ca -0.49 0.01 -0.17 0.00 -0.62 0.00 0.00 57.03 55.76 2qta h ASP 353 Cb 1.21 -0.01 -0.01 0.00 0.18 0.00 0.00 39.33 40.70 2qta h ASP 353 CO 0.60 0.03 -0.67 -0.33 -3.12 0.00 0.00 179.24 175.75 2qta h GLU 354 N 0.08 0.39 0.00 3.56 3.07 -1.90 -2.32 114.58 117.47 2qta h GLU 354 Ca 0.41 -0.30 -0.09 0.00 -0.50 0.00 0.00 59.36 58.88 2qta h GLU 354 Cb 1.49 0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 29.44 2qta h GLU 354 CO -0.04 0.93 -0.43 1.96 -1.40 0.00 0.00 179.01 180.03 2qta h GLN 355 N 0.28 0.00 -0.01 2.33 4.20 -1.02 -2.57 115.11 118.32 2qta h GLN 355 Ca -0.02 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.60 2qta h GLN 355 Cb 1.23 0.00 0.01 0.00 0.30 0.00 0.00 27.48 29.01 2qta h GLN 355 CO 0.11 0.43 -0.35 0.82 -0.67 0.00 0.00 178.83 179.17 2qta h ILE 356 N 0.00 1.49 0.00 2.54 2.04 -1.29 -3.11 117.51 119.17 2qta h ILE 356 Ca -0.00 -1.93 0.00 0.00 1.00 0.00 0.00 64.86 63.93 2qta h ILE 356 Cb 0.86 2.63 0.00 0.00 -0.74 0.00 0.00 36.82 39.57 2qta h ILE 356 CO 0.06 0.54 0.00 -0.25 0.00 0.00 0.00 178.15 178.50 2qta h TRP 357 N -0.33 0.00 0.00 1.37 2.91 -1.32 -1.32 115.95 117.26 2qta h TRP 357 Ca -0.04 0.00 0.00 0.00 1.13 0.00 0.00 58.89 59.98 2qta h TRP 357 Cb 1.07 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.72 2qta h TRP 357 CO 0.16 0.00 0.00 0.00 -1.03 0.00 0.00 178.44 177.57 2qta h ALA 358 N 2.06 1.00 -2.59 2.65 0.00 -1.39 -3.45 119.26 117.54 2qta h ALA 358 Ca 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.38 2qta h ALA 358 Cb 0.13 0.00 0.05 0.00 0.00 0.00 0.00 17.79 17.97 2qta h ALA 358 CO 0.00 0.00 1.04 1.28 0.00 0.00 0.00 179.25 181.57 2qta n LEU 359 N -3.09 3.99 -4.58 0.00 4.77 -0.50 -4.97 117.00 112.61 2qta n LEU 359 Ca 0.03 1.04 -0.27 0.00 -0.03 0.00 0.00 56.01 56.78 2qta n LEU 359 Cb 0.48 -1.56 -0.11 0.00 -2.33 0.00 0.00 43.42 39.90 2qta n LEU 359 CO 0.32 0.17 -0.34 0.21 -1.33 0.00 0.00 177.39 176.43 2qta s ASN 360 N 1.63 3.83 0.29 -1.43 3.84 -1.26 -5.06 114.94 116.77 2qta s ASN 360 Ca 0.77 -1.26 -0.20 0.00 0.21 0.00 0.00 52.86 52.38 2qta s ASN 360 Cb -0.50 -0.38 -0.09 0.00 -0.55 0.00 0.00 41.25 39.73 2qta s ASN 360 CO 0.34 -0.32 0.79 -0.13 -2.79 0.00 0.00 177.10 174.99 2qta s ARG 361 N -3.66 4.25 0.44 0.43 0.52 -1.26 -1.80 118.95 117.87 2qta s ARG 361 Ca 0.34 0.93 0.19 0.00 -0.52 0.00 0.00 55.73 56.67 2qta s ARG 361 Cb 0.06 -2.68 1.13 0.00 0.52 0.00 0.00 34.95 33.98 2qta s ARG 361 CO 0.17 0.27 1.90 0.78 0.02 0.00 0.00 175.30 178.44 2qta h GLY 362 N 2.92 0.64 1.09 -3.53 0.00 -0.91 -1.76 103.07 101.52 2qta h GLY 362 Ca -0.48 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 46.70 2qta h GLY 362 CO 0.65 0.03 0.00 0.61 0.00 0.00 0.00 176.54 177.82 2qta n GLY 363 N -1.55 -0.42 0.44 4.60 0.00 0.16 -1.51 105.19 106.90 2qta n GLY 363 Ca 0.16 -0.07 0.05 0.00 0.00 0.00 0.00 46.02 46.16 2qta n GLY 363 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2qta n HIS 364 N -1.04 0.10 -3.79 1.61 8.25 -0.66 -4.31 115.22 115.37 2qta n HIS 364 Ca 0.08 -0.13 -0.37 0.00 -0.26 0.00 0.00 57.72 57.05 2qta n HIS 364 Cb 0.05 -0.01 -0.13 0.00 1.12 0.00 0.00 29.99 31.02 2qta n HIS 364 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2qta s ASP 365 N -0.86 5.14 0.30 0.41 -1.08 -0.57 -4.98 116.67 115.02 2qta s ASP 365 Ca 0.14 -1.06 0.06 0.00 -0.52 0.00 0.00 52.55 51.17 2qta s ASP 365 Cb 0.09 -1.83 0.77 0.00 -1.46 0.00 0.00 42.92 40.49 2qta s ASP 365 CO 0.13 -0.28 1.75 -0.65 0.52 0.00 0.00 175.17 176.64 2qta h PRO 366 N 8.17 0.64 -0.65 4.34 0.11 -1.91 -1.15 132.00 141.56 2qta h PRO 366 Ca -0.25 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.82 2qta h PRO 366 Cb 1.09 -0.15 -0.03 0.00 0.11 0.00 0.00 31.00 32.02 2qta h PRO 366 CO 0.59 0.43 0.39 0.87 -0.21 0.00 0.00 178.00 180.07 2qta h LYS 367 N 0.66 0.88 -0.14 1.05 1.57 -1.93 0.11 116.57 118.76 2qta h LYS 367 Ca 0.59 -0.08 -0.21 0.00 -1.87 0.00 0.00 60.65 59.08 2qta h LYS 367 Cb 1.00 -0.19 0.01 0.00 0.08 0.00 0.00 32.23 33.13 2qta h LYS 367 CO -0.42 0.63 -0.75 0.87 -0.57 0.00 0.00 179.45 179.20 2qta h LYS 368 N 0.88 0.70 -0.16 3.15 1.79 -1.59 -2.84 116.57 118.49 2qta h LYS 368 Ca 0.23 -0.56 -0.01 0.00 -2.18 0.00 0.00 60.65 58.14 2qta h LYS 368 Cb -0.03 0.11 -0.01 0.00 -1.58 0.00 0.00 32.23 30.73 2qta h LYS 368 CO -0.04 1.18 0.07 0.82 -1.08 0.00 0.00 179.45 180.39 2qta h ILE 369 N 0.48 1.14 -0.77 1.86 2.04 -1.09 -2.87 117.51 118.31 2qta h ILE 369 Ca -0.04 -0.41 0.05 0.00 1.00 0.00 0.00 64.86 65.46 2qta h ILE 369 Cb 1.36 1.11 -0.05 0.00 -0.74 0.00 0.00 36.82 38.50 2qta h ILE 369 CO 0.15 0.13 0.47 0.22 0.00 0.00 0.00 178.15 179.12 2qta h TYR 370 N 0.12 0.87 -1.00 1.37 3.20 -0.80 -1.90 116.97 118.82 2qta h TYR 370 Ca 0.06 0.03 0.01 0.00 3.14 0.00 0.00 58.73 61.96 2qta h TYR 370 Cb 0.14 -0.28 -0.05 0.00 1.54 0.00 0.00 36.73 38.08 2qta h TYR 370 CO -0.02 0.46 0.66 0.00 -1.64 0.00 0.00 178.16 177.62 2qta h ALA 371 N 1.36 1.28 -0.07 1.82 0.00 -1.40 -1.00 119.26 121.25 2qta h ALA 371 Ca 0.33 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 2qta h ALA 371 Cb 0.12 -0.41 -0.00 0.00 0.00 0.00 0.00 17.79 17.50 2qta h ALA 371 CO -0.15 0.67 0.01 0.00 0.00 0.00 0.00 179.25 179.78 2qta h ALA 372 N 1.37 0.09 0.00 0.00 0.00 -1.14 -1.31 119.26 118.26 2qta h ALA 372 Ca 0.37 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 55.06 2qta h ALA 372 Cb -0.15 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2qta h ALA 372 CO -0.08 -0.28 -0.39 0.74 0.00 0.00 0.00 179.25 179.24 2qta h PHE 373 N -0.12 0.00 -0.14 0.00 -1.00 -1.27 0.01 116.94 114.42 2qta h PHE 373 Ca 0.02 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.75 2qta h PHE 373 Cb 0.27 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.82 2qta h PHE 373 CO 0.01 0.39 -0.09 -0.22 -1.61 0.00 0.00 178.31 176.79 2qta h LYS 374 N 0.00 0.31 -0.83 1.51 1.63 -1.09 -0.70 116.57 117.40 2qta h LYS 374 Ca -0.00 -0.15 -0.02 0.00 -0.85 0.00 0.00 60.65 59.63 2qta h LYS 374 Cb 0.71 -0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 32.29 2qta h LYS 374 CO 0.05 0.66 0.45 -0.22 -3.45 0.00 0.00 179.45 176.94 2qta h LYS 375 N -0.04 1.17 -0.28 1.90 3.64 -0.97 -1.38 116.57 120.60 2qta h LYS 375 Ca 0.03 -0.14 0.01 0.00 -1.27 0.00 0.00 60.65 59.28 2qta h LYS 375 Cb 0.59 -0.23 -0.02 0.00 -0.41 0.00 0.00 32.23 32.16 2qta h LYS 375 CO 0.03 0.87 0.16 0.00 -2.27 0.00 0.00 179.45 178.24 2qta h ALA 376 N 1.24 0.35 -0.70 5.00 0.00 -0.90 -1.16 119.26 123.10 2qta h ALA 376 Ca 0.29 -0.00 0.08 0.00 0.00 0.00 0.00 54.91 55.28 2qta h ALA 376 Cb 0.05 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 2qta h ALA 376 CO -0.05 -0.21 0.46 0.37 0.00 0.00 0.00 179.25 179.82 2qta h GLN 377 N 0.34 0.61 0.03 0.00 4.15 -0.50 -2.44 115.11 117.30 2qta h GLN 377 Ca 0.11 -0.04 -0.22 0.00 0.77 0.00 0.00 58.65 59.27 2qta h GLN 377 Cb 0.00 -0.14 -0.02 0.00 0.21 0.00 0.00 27.48 27.53 2qta h GLN 377 CO -0.06 0.41 -1.04 0.93 -1.93 0.00 0.00 178.83 177.14 2qta h GLU 378 N 0.63 0.08 -6.80 1.69 5.08 -0.72 -3.47 114.58 111.07 2qta h GLU 378 Ca 0.31 -0.13 -0.53 0.00 -1.00 0.00 0.00 59.36 58.02 2qta h GLU 378 Cb 0.39 0.05 0.07 0.00 0.50 0.00 0.00 28.75 29.76 2qta h GLU 378 CO -0.10 1.04 0.81 0.99 -1.00 0.00 0.00 179.01 180.74 2qta s THR 379 N -2.76 2.34 0.15 1.13 2.01 -0.49 -5.03 115.64 112.99 2qta s THR 379 Ca -0.01 0.30 0.07 0.00 0.31 0.00 0.00 61.69 62.36 2qta s THR 379 Cb 0.09 -3.19 -0.04 0.00 0.01 0.00 0.00 72.50 69.37 2qta s THR 379 CO 0.83 0.05 -0.15 -0.54 -0.69 0.00 0.00 174.62 174.12 2qta s LYS 380 N -0.71 1.14 0.00 4.92 -0.14 -1.26 -4.84 119.74 118.86 2qta s LYS 380 Ca 0.60 -1.35 0.00 0.00 -1.36 0.00 0.00 55.97 53.86 2qta s LYS 380 Cb -0.45 -1.05 0.00 0.00 -1.68 0.00 0.00 37.83 34.65 2qta s LYS 380 CO 0.48 0.20 0.00 0.41 -0.76 0.00 0.00 175.35 175.68 2qta n GLY 381 N 0.30 2.99 3.79 -3.33 0.00 -1.26 -5.00 105.19 102.67 2qta n GLY 381 Ca -0.13 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.81 2qta n GLY 381 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2qta s LYS 382 N -0.76 1.65 0.54 1.61 -2.85 -1.26 -4.52 119.74 114.14 2qta s LYS 382 Ca 0.00 -0.88 -0.09 0.00 -1.00 0.00 0.00 55.97 54.01 2qta s LYS 382 Cb 0.00 0.58 -0.04 0.00 -2.06 0.00 0.00 37.83 36.31 2qta s LYS 382 CO 0.00 -0.75 0.90 0.00 0.10 0.00 0.00 175.35 175.60 2qta s ALA 383 N -3.82 3.25 -0.02 0.59 0.00 -1.21 -3.69 121.76 116.86 2qta s ALA 383 Ca 0.10 -0.27 0.07 0.00 0.00 0.00 0.00 51.96 51.85 2qta s ALA 383 Cb -0.05 -2.83 -0.02 0.00 0.00 0.00 0.00 23.12 20.21 2qta s ALA 383 CO 0.04 -0.47 -0.22 0.99 0.00 0.00 0.00 175.76 176.09 2qta s THR 384 N -2.90 2.40 -0.10 0.00 2.01 -1.00 -0.92 115.64 115.13 2qta s THR 384 Ca 0.51 -1.02 0.03 0.00 0.31 0.00 0.00 61.69 61.53 2qta s THR 384 Cb -0.11 -1.88 0.00 0.00 0.01 0.00 0.00 72.50 70.53 2qta s THR 384 CO 0.47 0.55 -0.21 0.54 -0.69 0.00 0.00 174.62 175.28 2qta s VAL 385 N -0.68 1.88 -0.25 3.82 0.11 0.13 -0.89 120.40 124.52 2qta s VAL 385 Ca 0.11 -0.90 -0.08 0.00 -2.93 0.00 0.00 61.98 58.17 2qta s VAL 385 Cb -0.10 -1.64 -0.03 0.00 -1.53 0.00 0.00 36.38 33.07 2qta s VAL 385 CO 0.00 0.52 0.10 -0.63 -3.33 0.00 0.00 175.10 171.75 2qta s ILE 386 N 0.51 4.58 -0.46 7.04 1.01 0.71 -1.36 121.20 133.24 2qta s ILE 386 Ca -0.15 -0.08 -0.15 0.00 0.00 0.00 0.00 60.65 60.26 2qta s ILE 386 Cb -0.17 -3.14 0.06 0.00 0.01 0.00 0.00 42.46 39.22 2qta s ILE 386 CO 0.06 0.33 0.37 -0.76 0.00 0.00 0.00 174.94 174.94 2qta s LEU 387 N 1.50 5.50 -0.35 2.97 1.43 -0.01 -1.08 118.68 128.65 2qta s LEU 387 Ca 0.06 -1.25 -0.13 0.00 -1.03 0.00 0.00 54.13 51.78 2qta s LEU 387 Cb -0.15 -2.17 -0.01 0.00 0.03 0.00 0.00 46.19 43.89 2qta s LEU 387 CO 0.05 -0.60 0.23 0.00 0.23 0.00 0.00 176.35 176.26 2qta s ALA 388 N 1.64 3.45 -0.30 4.21 0.00 -0.43 -0.45 121.76 129.88 2qta s ALA 388 Ca 0.04 -1.45 -0.29 0.00 0.00 0.00 0.00 51.96 50.26 2qta s ALA 388 Cb -0.23 -2.65 0.01 0.00 0.00 0.00 0.00 23.12 20.25 2qta s ALA 388 CO 0.07 -1.05 1.09 -1.58 0.00 0.00 0.00 175.76 174.29 2qta s HIS 389 N 1.69 3.13 0.27 0.00 2.46 -0.35 0.59 115.29 123.08 2qta s HIS 389 Ca 0.05 1.21 0.02 0.00 0.47 0.00 0.00 55.06 56.81 2qta s HIS 389 Cb -0.18 -3.64 -0.04 0.00 -0.13 0.00 0.00 32.58 28.59 2qta s HIS 389 CO 0.10 -0.82 0.15 0.95 -2.47 0.00 0.00 174.74 172.65 2qta s THR 390 N 3.64 0.22 -0.27 0.89 -4.23 -0.88 0.37 115.64 115.38 2qta s THR 390 Ca 0.46 -2.00 -0.07 0.00 -1.18 0.00 0.00 61.69 58.90 2qta s THR 390 Cb -0.13 -2.53 -0.01 0.00 1.34 0.00 0.00 72.50 71.17 2qta s THR 390 CO 0.15 0.00 0.07 -0.63 -0.54 0.00 0.00 174.62 173.67 2qta s ILE 391 N -3.79 4.15 0.24 2.99 1.01 -1.26 -4.14 121.20 120.40 2qta s ILE 391 Ca 0.38 -0.37 -0.30 0.00 0.00 0.00 0.00 60.65 60.35 2qta s ILE 391 Cb 0.06 -3.01 -0.09 0.00 0.01 0.00 0.00 42.46 39.43 2qta s ILE 391 CO 0.16 0.25 1.29 -0.75 0.00 0.00 0.00 174.94 175.90 2qta s LYS 392 N 1.57 4.40 -0.90 2.79 2.20 -1.26 -2.31 119.74 126.23 2qta s LYS 392 Ca 0.05 2.08 0.00 0.00 -0.36 0.00 0.00 55.97 57.74 2qta s LYS 392 Cb -0.16 -3.16 0.00 0.00 -1.51 0.00 0.00 37.83 33.00 2qta s LYS 392 CO 0.03 -0.20 0.00 0.41 -0.36 0.00 0.00 175.35 175.23 2qta n GLY 393 N 1.89 0.11 3.58 5.54 0.00 -0.86 -4.92 105.19 110.54 2qta n GLY 393 Ca 0.04 -0.47 -0.54 0.00 0.00 0.00 0.00 46.02 45.05 2qta n GLY 393 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2qta n TYR 394 N -3.83 1.38 -1.13 1.61 9.36 -0.98 -1.63 117.16 121.94 2qta n TYR 394 Ca -0.12 0.71 -0.04 0.00 3.32 0.00 0.00 57.90 61.77 2qta n TYR 394 Cb 0.56 -2.29 -0.02 0.00 -0.63 0.00 0.00 39.34 36.96 2qta n TYR 394 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2qta n GLY 395 N 2.40 0.50 1.10 2.98 0.00 -1.26 -4.82 105.19 106.08 2qta n GLY 395 Ca 0.19 -0.05 0.12 0.00 0.00 0.00 0.00 46.02 46.28 2qta n GLY 395 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2qta n MET 396 N -0.37 2.44 0.00 1.61 2.81 -0.65 -4.76 117.12 118.20 2qta n MET 396 Ca -0.04 -2.17 0.00 0.00 -1.81 0.00 0.00 57.70 53.68 2qta n MET 396 Cb 0.46 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.47 2qta n MET 396 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2qta n GLY 397 N 1.47 0.00 0.00 3.03 0.00 -1.18 -3.47 105.19 105.05 2qta n GLY 397 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 2qta n GLY 397 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2qta n ASP 398 N 0.00 0.00 -0.05 1.61 9.92 -1.26 -3.93 116.55 122.85 2qta n ASP 398 Ca 0.00 0.19 -0.01 0.00 -0.53 0.00 0.00 54.79 54.44 2qta n ASP 398 Cb 0.00 0.00 -0.00 0.00 -0.64 0.00 0.00 41.12 40.48 2qta n ASP 398 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2qta h ALA 399 N -1.37 0.00 0.00 2.24 0.00 -1.99 -3.54 119.26 114.60 2qta h ALA 399 Ca 0.00 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 2qta h ALA 399 Cb 0.00 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 2qta h ALA 399 CO 0.00 0.09 -1.69 0.00 0.00 0.00 0.00 179.25 177.65 2qta n ALA 400 N -2.83 2.50 -0.34 0.00 0.00 -1.24 -5.11 120.51 113.49 2qta n ALA 400 Ca -0.01 -0.38 0.36 0.00 0.00 0.00 0.00 53.44 53.41 2qta n ALA 400 Cb 0.04 -0.48 0.68 0.00 0.00 0.00 0.00 19.45 19.69 2qta n ALA 400 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 2qta h MET 414 N 0.00 0.00 -0.25 0.00 0.00 -2.03 -3.12 114.93 109.53 2qta h MET 414 Ca -0.02 0.00 -0.11 0.00 0.00 0.00 0.00 59.70 59.57 2qta h MET 414 Cb 0.73 0.00 -0.01 0.00 0.00 0.00 0.00 31.60 32.32 2qta h MET 414 CO 0.00 0.00 -0.32 -0.44 0.00 0.00 0.00 176.91 176.16 2qta h ASP 415 N 0.00 0.53 -0.77 1.22 3.32 -2.05 -2.16 116.42 116.50 2qta h ASP 415 Ca 0.59 -0.20 -0.01 0.00 0.02 0.00 0.00 57.03 57.43 2qta h ASP 415 Cb 2.73 -0.15 -0.04 0.00 0.22 0.00 0.00 39.33 42.10 2qta h ASP 415 CO -0.01 0.81 0.45 1.23 -1.72 0.00 0.00 179.24 180.00 2qta h GLY 416 N 1.05 1.14 1.29 2.75 0.00 -1.99 0.79 103.07 108.09 2qta h GLY 416 Ca 0.05 -0.49 -0.12 0.00 0.00 0.00 0.00 47.33 46.78 2qta h GLY 416 CO 0.06 0.47 -0.20 -2.08 0.00 0.00 0.00 176.54 174.79 2qta h VAL 417 N 1.06 1.27 -0.62 4.60 2.07 -1.96 -2.57 116.25 120.09 2qta h VAL 417 Ca 0.27 -1.32 -0.09 0.00 0.82 0.00 0.00 66.70 66.39 2qta h VAL 417 Cb -0.00 1.16 -0.02 0.00 -1.52 0.00 0.00 31.29 30.90 2qta h VAL 417 CO -0.05 0.45 0.05 -0.09 0.02 0.00 0.00 177.57 177.95 2qta h ARG 418 N 0.72 1.07 -0.81 1.57 2.43 -0.91 -1.59 114.38 116.86 2qta h ARG 418 Ca 0.10 -0.32 0.07 0.00 -0.81 0.00 0.00 59.98 59.03 2qta h ARG 418 Cb 0.72 -0.11 -0.06 0.00 -0.42 0.00 0.00 29.97 30.10 2qta h ARG 418 CO 0.06 1.02 0.48 1.25 -1.51 0.00 0.00 179.97 181.26 2qta h HIS 419 N 0.98 0.88 -0.21 2.20 2.76 -0.56 -0.54 115.15 120.66 2qta h HIS 419 Ca 0.18 0.03 -0.06 0.00 -2.20 0.00 0.00 60.37 58.32 2qta h HIS 419 Cb 0.50 -0.28 -0.00 0.00 1.55 0.00 0.00 27.41 29.18 2qta h HIS 419 CO 0.04 0.41 -0.12 0.82 -1.30 0.00 0.00 177.93 177.78 2qta h ILE 420 N 0.85 1.31 -0.56 6.26 2.04 -1.15 0.18 117.51 126.44 2qta h ILE 420 Ca 0.37 -1.20 0.05 0.00 1.00 0.00 0.00 64.86 65.08 2qta h ILE 420 Cb 0.25 1.66 -0.05 0.00 -0.74 0.00 0.00 36.82 37.94 2qta h ILE 420 CO -0.20 0.37 0.28 -0.09 0.00 0.00 0.00 178.15 178.50 2qta h ARG 421 N 0.14 0.51 -0.12 2.37 1.12 -0.95 -1.87 114.38 115.59 2qta h ARG 421 Ca 0.04 -0.03 -0.04 0.00 -1.11 0.00 0.00 59.98 58.85 2qta h ARG 421 Cb 0.62 -0.12 -0.00 0.00 -0.01 0.00 0.00 29.97 30.46 2qta h ARG 421 CO 0.03 0.34 -0.07 -0.44 -3.11 0.00 0.00 179.97 176.72 2qta h ASP 422 N 0.53 0.27 -0.95 -3.80 3.32 -0.98 -0.72 116.42 114.09 2qta h ASP 422 Ca 0.25 -0.43 0.07 0.00 0.02 0.00 0.00 57.03 56.94 2qta h ASP 422 Cb 0.18 -0.08 -0.07 0.00 0.22 0.00 0.00 39.33 39.58 2qta h ASP 422 CO -0.18 0.65 0.60 -0.09 -1.72 0.00 0.00 179.24 178.50 2qta h ARG 423 N -0.10 1.04 -0.56 3.56 9.65 -0.37 -2.66 114.38 124.95 2qta h ARG 423 Ca 0.02 -0.06 0.00 0.00 -1.10 0.00 0.00 59.98 58.84 2qta h ARG 423 Cb 0.55 -0.24 0.00 0.00 -1.39 0.00 0.00 29.97 28.90 2qta h ARG 423 CO 0.02 0.69 0.00 1.19 2.80 0.00 0.00 179.97 184.67 2qta n PHE 424 N -4.56 1.14 -4.01 2.20 3.72 -0.73 -4.96 117.46 110.26 2qta n PHE 424 Ca 0.15 -0.60 -0.29 0.00 -0.05 0.00 0.00 57.45 56.66 2qta n PHE 424 Cb 0.21 -0.17 -0.01 0.00 -0.94 0.00 0.00 39.48 38.57 2qta n PHE 424 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 2qta n ASN 425 N 0.90 -1.75 -4.73 4.37 4.13 -0.82 -4.83 115.26 112.52 2qta n ASN 425 Ca 0.22 -0.97 -0.41 0.00 1.68 0.00 0.00 54.58 55.10 2qta n ASN 425 Cb 0.76 -3.15 -0.03 0.00 -1.54 0.00 0.00 39.78 35.82 2qta n ASN 425 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2qta s VAL 426 N -3.67 3.76 -1.19 2.41 1.01 -0.34 -4.92 120.40 117.45 2qta s VAL 426 Ca 0.29 1.44 -0.15 0.00 0.00 0.00 0.00 61.98 63.55 2qta s VAL 426 Cb -0.15 -3.92 -0.05 0.00 0.00 0.00 0.00 36.38 32.26 2qta s VAL 426 CO 0.89 0.21 2.21 -0.81 0.00 0.00 0.00 175.10 177.60 2qta n PRO 427 N 2.77 2.43 -4.18 2.72 -0.04 -1.26 -4.82 135.00 132.63 2qta n PRO 427 Ca 0.05 -2.17 -0.23 0.00 -0.04 0.00 0.00 63.50 61.12 2qta n PRO 427 Cb 0.45 -3.01 -0.17 0.00 -0.04 0.00 0.00 33.50 30.74 2qta n PRO 427 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2qta s VAL 428 N 3.68 0.75 0.71 0.52 1.01 -1.26 -5.03 120.40 120.78 2qta s VAL 428 Ca 0.53 -0.21 -0.10 0.00 0.00 0.00 0.00 61.98 62.20 2qta s VAL 428 Cb 0.14 -0.76 0.03 0.00 0.00 0.00 0.00 36.38 35.80 2qta s VAL 428 CO -0.01 0.29 1.08 -0.94 0.00 0.00 0.00 175.10 175.51 2qta s SER 429 N 1.12 5.19 0.40 3.32 1.04 -1.26 -4.86 113.70 118.65 2qta s SER 429 Ca -0.07 0.92 0.09 0.00 0.48 0.00 0.00 55.95 57.36 2qta s SER 429 Cb -0.14 -1.66 0.82 0.00 0.10 0.00 0.00 66.02 65.13 2qta s SER 429 CO -0.01 -1.45 1.96 0.44 0.98 0.00 0.00 173.24 175.16 2qta h ASP 430 N -0.66 0.29 1.03 7.02 5.19 -2.00 -0.68 116.42 126.61 2qta h ASP 430 Ca -0.45 -0.04 -0.00 0.00 -0.62 0.00 0.00 57.03 55.91 2qta h ASP 430 Cb 1.28 -0.08 -0.00 0.00 0.18 0.00 0.00 39.33 40.71 2qta h ASP 430 CO 0.63 0.37 -0.02 0.00 -3.12 0.00 0.00 179.24 177.10 2qta h ALA 431 N 1.68 1.01 0.00 3.45 0.00 -2.06 -3.25 119.26 120.09 2qta h ALA 431 Ca 0.07 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 2qta h ALA 431 Cb 0.25 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 2qta h ALA 431 CO 0.01 0.03 -1.54 -0.25 0.00 0.00 0.00 179.25 177.49 2qta n ASP 432 N -3.12 2.31 -0.34 0.00 8.00 -0.87 -4.74 116.55 117.79 2qta n ASP 432 Ca 0.01 0.00 0.16 0.00 0.71 0.00 0.00 54.79 55.67 2qta n ASP 432 Cb 0.32 1.53 0.38 0.00 -0.02 0.00 0.00 41.12 43.33 2qta n ASP 432 CO 0.00 0.00 0.00 -0.29 -0.39 0.00 0.00 177.20 176.52 2qta h ILE 433 N 0.00 0.63 0.00 0.53 2.10 -1.17 0.28 117.51 119.88 2qta h ILE 433 Ca -0.00 -0.22 0.00 0.00 1.08 0.00 0.00 64.86 65.72 2qta h ILE 433 Cb 0.55 -0.05 0.00 0.00 -1.09 0.00 0.00 36.82 36.23 2qta h ILE 433 CO 0.00 0.11 0.00 1.21 -1.08 0.00 0.00 178.15 178.40 2qta n GLU 434 N -4.75 0.05 -0.03 2.19 2.13 -1.26 -1.56 120.64 117.41 2qta n GLU 434 Ca 0.24 0.30 0.12 0.00 0.66 0.00 0.00 57.16 58.48 2qta n GLU 434 Cb 0.68 -1.59 0.51 0.00 0.27 0.00 0.00 31.44 31.30 2qta n GLU 434 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 2qta n LYS 435 N -1.69 1.57 -4.05 5.31 5.02 0.09 -4.93 118.16 119.48 2qta n LYS 435 Ca 0.03 -0.84 -0.30 0.00 -2.02 0.00 0.00 58.31 55.17 2qta n LYS 435 Cb 0.18 -1.43 -0.03 0.00 -0.02 0.00 0.00 35.03 33.73 2qta n LYS 435 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2qta n LEU 436 N 0.04 -1.66 -4.77 -0.35 4.77 -0.60 -4.88 117.00 109.54 2qta n LEU 436 Ca 0.18 -1.13 -0.35 0.00 -0.03 0.00 0.00 56.01 54.68 2qta n LEU 436 Cb 0.30 -1.98 -0.00 0.00 -2.33 0.00 0.00 43.42 39.41 2qta n LEU 436 CO 0.15 0.50 0.79 -2.16 -1.33 0.00 0.00 177.39 175.33 2qta s PRO 437 N -6.85 3.47 0.29 3.23 0.04 -1.26 -4.96 135.00 128.96 2qta s PRO 437 Ca 0.12 1.63 -0.14 0.00 0.04 0.00 0.00 61.00 62.65 2qta s PRO 437 Cb -0.05 -2.10 -0.08 0.00 0.04 0.00 0.00 34.50 32.30 2qta s PRO 437 CO 0.93 -0.76 0.68 0.71 0.04 0.00 0.00 177.00 178.60 2qta s TYR 438 N -1.73 3.39 -0.10 0.56 2.02 -1.26 -4.91 117.35 115.33 2qta s TYR 438 Ca 0.70 1.13 -0.04 0.00 -0.37 0.00 0.00 57.07 58.49 2qta s TYR 438 Cb -0.24 -2.46 -0.04 0.00 -0.40 0.00 0.00 41.96 38.82 2qta s TYR 438 CO 0.28 0.15 0.07 0.42 -1.57 0.00 0.00 175.55 174.90 2qta s ILE 439 N -1.92 4.85 0.14 2.71 1.01 -1.26 -5.10 121.20 121.63 2qta s ILE 439 Ca 0.52 -0.06 0.06 0.00 0.00 0.00 0.00 60.65 61.17 2qta s ILE 439 Cb -0.11 -3.08 -0.04 0.00 0.01 0.00 0.00 42.46 39.24 2qta s ILE 439 CO 0.18 0.60 -0.13 0.42 0.00 0.00 0.00 174.94 176.02 2qta s THR 440 N -0.96 1.30 -0.29 2.92 -4.23 -1.26 -4.87 115.64 108.25 2qta s THR 440 Ca 0.14 -1.89 -0.04 0.00 -1.18 0.00 0.00 61.69 58.72 2qta s THR 440 Cb -0.12 -1.69 0.03 0.00 1.34 0.00 0.00 72.50 72.06 2qta s THR 440 CO 0.04 -0.56 0.02 -0.36 -0.54 0.00 0.00 174.62 173.22 2qta s PHE 441 N -2.66 3.16 0.64 3.99 0.08 -1.26 -5.10 117.98 116.84 2qta s PHE 441 Ca 0.13 -1.40 -0.17 0.00 0.12 0.00 0.00 56.93 55.61 2qta s PHE 441 Cb -0.02 -2.16 -0.01 0.00 -0.57 0.00 0.00 43.02 40.26 2qta s PHE 441 CO 0.03 -0.69 1.20 -1.25 -0.10 0.00 0.00 175.22 174.40 2qta s PRO 442 N 1.38 2.68 0.37 0.24 0.04 -1.26 -4.69 135.00 133.76 2qta s PRO 442 Ca -0.00 1.77 -0.28 0.00 0.04 0.00 0.00 61.00 62.52 2qta s PRO 442 Cb -0.18 -1.90 -0.11 0.00 0.04 0.00 0.00 34.50 32.35 2qta s PRO 442 CO -0.00 -1.42 1.51 -1.91 0.04 0.00 0.00 177.00 175.22 2qta n GLU 443 N -2.04 2.69 0.00 4.56 2.13 -1.26 -1.46 120.64 125.26 2qta n GLU 443 Ca 0.13 0.95 0.00 0.00 0.66 0.00 0.00 57.16 58.90 2qta n GLU 443 Cb 0.50 -2.69 0.00 0.00 0.27 0.00 0.00 31.44 29.52 2qta n GLU 443 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2qta n GLY 444 N 0.70 3.32 3.79 8.31 0.00 -1.26 -5.05 105.19 114.99 2qta n GLY 444 Ca 0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 2qta n GLY 444 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2qta s SER 445 N -0.44 5.34 0.26 1.61 1.04 -0.53 -4.88 113.70 116.09 2qta s SER 445 Ca 0.00 1.86 -0.03 0.00 0.48 0.00 0.00 55.95 58.26 2qta s SER 445 Cb 0.00 -2.53 0.34 0.00 0.10 0.00 0.00 66.02 63.93 2qta s SER 445 CO 0.00 -1.47 1.81 -0.08 0.98 0.00 0.00 173.24 174.48 2qta h GLU 446 N -0.04 0.92 -0.22 4.02 4.81 -1.97 -1.28 114.58 120.81 2qta h GLU 446 Ca -0.46 -0.18 -0.03 0.00 -0.13 0.00 0.00 59.36 58.56 2qta h GLU 446 Cb 1.23 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 30.46 2qta h GLU 446 CO 0.55 0.80 0.04 0.93 -0.73 0.00 0.00 179.01 180.60 2qta h GLU 447 N 0.89 0.36 -0.46 1.92 3.07 -1.92 -1.49 114.58 116.94 2qta h GLU 447 Ca 0.20 -0.10 -0.02 0.00 -0.50 0.00 0.00 59.36 58.94 2qta h GLU 447 Cb 0.28 -0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 28.13 2qta h GLU 447 CO -0.01 0.51 0.22 1.25 -1.40 0.00 0.00 179.01 179.58 2qta h HIS 448 N 0.17 0.67 -0.27 4.33 2.76 -1.76 -0.55 115.15 120.51 2qta h HIS 448 Ca 0.07 -0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.21 2qta h HIS 448 Cb 0.32 -0.21 -0.01 0.00 1.55 0.00 0.00 27.41 29.06 2qta h HIS 448 CO 0.02 0.54 0.17 1.15 -1.30 0.00 0.00 177.93 178.51 2qta h THR 449 N 0.61 1.06 -0.27 6.26 2.02 -1.16 -2.54 112.91 118.89 2qta h THR 449 Ca 0.16 -0.12 -0.10 0.00 0.77 0.00 0.00 66.41 67.12 2qta h THR 449 Cb 0.12 0.67 -0.00 0.00 -1.74 0.00 0.00 68.15 67.20 2qta h THR 449 CO -0.02 0.06 -0.22 0.22 0.37 0.00 0.00 175.52 175.93 2qta h TYR 450 N 0.35 0.74 -0.12 3.16 5.03 -1.10 -0.42 116.97 124.60 2qta h TYR 450 Ca 0.10 -0.21 0.05 0.00 2.58 0.00 0.00 58.73 61.25 2qta h TYR 450 Cb -0.03 -0.16 -0.06 0.00 1.55 0.00 0.00 36.73 38.03 2qta h TYR 450 CO -0.06 0.92 -0.27 1.25 -1.32 0.00 0.00 178.16 178.67 2qta h LEU 451 N 0.35 -0.84 -0.55 2.82 5.85 -1.05 -1.58 115.31 120.29 2qta h LEU 451 Ca 0.05 0.13 -0.16 0.00 0.84 0.00 0.00 57.88 58.74 2qta h LEU 451 Cb 0.77 0.37 -0.01 0.00 0.37 0.00 0.00 40.66 42.16 2qta h LEU 451 CO 0.06 -0.32 -0.62 0.45 -0.34 0.00 0.00 178.44 177.67 2qta h HIS 452 N -0.35 0.47 0.03 1.25 3.86 -1.45 -3.00 115.15 115.96 2qta h HIS 452 Ca 0.10 -0.18 -0.00 0.00 -1.16 0.00 0.00 60.37 59.12 2qta h HIS 452 Cb 0.50 -0.08 0.00 0.00 1.06 0.00 0.00 27.41 28.88 2qta h HIS 452 CO -0.36 0.89 -0.01 0.00 0.86 0.00 0.00 177.93 179.30 2qta h ALA 453 N 1.07 -0.04 -0.73 2.45 0.00 -0.75 0.14 119.26 121.39 2qta h ALA 453 Ca -0.01 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 54.95 2qta h ALA 453 Cb 1.15 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.90 2qta h ALA 453 CO 0.10 -0.51 0.43 1.96 0.00 0.00 0.00 179.25 181.23 2qta h GLN 454 N -0.06 0.76 -0.21 0.00 1.08 -1.34 -1.90 115.11 113.44 2qta h GLN 454 Ca -0.00 -0.05 -0.15 0.00 -1.45 0.00 0.00 58.65 57.00 2qta h GLN 454 Cb 0.05 -0.17 -0.01 0.00 -0.05 0.00 0.00 27.48 27.30 2qta h GLN 454 CO 0.01 0.50 -0.51 0.00 -0.95 0.00 0.00 178.83 177.88 2qta h ARG 455 N 0.78 0.57 -0.18 1.46 2.47 -1.34 -3.04 114.38 115.11 2qta h ARG 455 Ca 0.33 -0.34 -0.04 0.00 -1.26 0.00 0.00 59.98 58.66 2qta h ARG 455 Cb 0.19 0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 28.53 2qta h ARG 455 CO -0.18 0.95 -0.07 1.96 0.56 0.00 0.00 179.97 183.18 2qta h GLN 456 N 0.45 0.27 0.00 0.04 1.08 0.02 -0.22 115.11 116.75 2qta h GLN 456 Ca 0.02 -0.05 0.00 0.00 -1.45 0.00 0.00 58.65 57.16 2qta h GLN 456 Cb 1.04 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 28.43 2qta h GLN 456 CO 0.10 0.36 0.00 0.87 -0.95 0.00 0.00 178.83 179.21 2qta h LYS 457 N 0.26 0.00 -0.30 1.46 1.57 -1.27 -2.39 116.57 115.90 2qta h LYS 457 Ca 0.06 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.75 2qta h LYS 457 Cb 0.30 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.56 2qta h LYS 457 CO 0.01 0.00 -0.02 1.28 -0.57 0.00 0.00 179.45 180.15 2qta n LEU 458 N -2.90 3.96 0.00 2.94 4.77 -0.21 -4.96 117.00 120.60 2qta n LEU 458 Ca 0.01 -3.37 0.00 0.00 -0.03 0.00 0.00 56.01 52.62 2qta n LEU 458 Cb 0.32 -0.58 0.00 0.00 -2.33 0.00 0.00 43.42 40.82 2qta n LEU 458 CO 0.27 0.94 0.00 1.41 -1.33 0.00 0.00 177.39 178.68 2qta n HIS 459 N -0.86 0.00 0.00 -1.77 8.25 -0.50 -1.00 115.22 119.34 2qta n HIS 459 Ca 0.27 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.73 2qta n HIS 459 Cb 0.96 0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.07 2qta n HIS 459 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2qta n GLY 460 N -2.24 0.34 3.63 -1.41 0.00 -0.63 -4.67 105.19 100.21 2qta n GLY 460 Ca 0.00 -1.88 -0.30 0.00 0.00 0.00 0.00 46.02 43.84 2qta n GLY 460 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2qta s TYR 461 N -1.12 2.85 0.06 1.61 1.51 -1.26 -4.63 117.35 116.36 2qta s TYR 461 Ca 0.00 -0.10 -0.12 0.00 -1.01 0.00 0.00 57.07 55.84 2qta s TYR 461 Cb 0.00 -1.47 0.01 0.00 -0.11 0.00 0.00 41.96 40.39 2qta s TYR 461 CO 0.00 0.46 0.25 -0.48 -1.11 0.00 0.00 175.55 174.67 2qta s LEU 462 N -2.31 1.11 0.57 -1.29 2.34 -1.26 -4.41 118.68 113.43 2qta s LEU 462 Ca 0.24 -0.34 -0.15 0.00 0.06 0.00 0.00 54.13 53.93 2qta s LEU 462 Cb -0.11 1.20 -0.05 0.00 -0.56 0.00 0.00 46.19 46.67 2qta s LEU 462 CO 0.16 -0.63 1.03 -2.16 -1.06 0.00 0.00 176.35 173.69 2qta s PRO 463 N -2.87 3.52 0.12 1.48 0.04 -1.26 -4.99 135.00 131.03 2qta s PRO 463 Ca -0.03 1.09 -0.16 0.00 0.04 0.00 0.00 61.00 61.94 2qta s PRO 463 Cb 0.00 -2.07 0.03 0.00 0.04 0.00 0.00 34.50 32.51 2qta s PRO 463 CO -0.05 -0.64 0.40 -1.54 0.04 0.00 0.00 177.00 175.20 2qta s SER 464 N -3.01 -0.23 -0.05 6.66 1.04 -1.04 -4.83 113.70 112.25 2qta s SER 464 Ca 0.61 -0.31 -0.07 0.00 0.48 0.00 0.00 55.95 56.66 2qta s SER 464 Cb -0.14 0.47 0.01 0.00 0.10 0.00 0.00 66.02 66.47 2qta s SER 464 CO 0.37 -0.84 0.18 -0.60 0.98 0.00 0.00 173.24 173.33 2qta s ARG 465 N -3.74 0.32 -0.30 4.02 3.52 -0.39 -4.80 118.95 117.57 2qta s ARG 465 Ca 0.03 0.06 -0.10 0.00 -0.13 0.00 0.00 55.73 55.58 2qta s ARG 465 Cb 0.02 0.14 -0.02 0.00 -1.56 0.00 0.00 34.95 33.53 2qta s ARG 465 CO -0.12 -0.06 0.16 -1.14 -0.81 0.00 0.00 175.30 173.33 2qta s GLN 466 N -0.39 3.53 0.31 5.12 0.74 -1.26 -4.27 119.66 123.44 2qta s GLN 466 Ca -0.05 -0.59 0.26 0.00 0.05 0.00 0.00 55.36 55.03 2qta s GLN 466 Cb -0.03 -3.58 0.80 0.00 1.10 0.00 0.00 33.01 31.30 2qta s GLN 466 CO 0.01 -0.34 1.75 -1.00 -0.55 0.00 0.00 175.29 175.16 2qta h PRO 467 N 8.36 0.00 -5.15 1.67 0.13 -1.93 -3.42 132.00 131.66 2qta h PRO 467 Ca -0.34 0.00 -0.38 0.00 -0.87 0.00 0.00 66.00 64.41 2qta h PRO 467 Cb 1.16 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 32.08 2qta h PRO 467 CO 0.60 0.00 -0.77 -0.80 -0.23 0.00 0.00 178.00 176.80 2qta s ASN 468 N -4.97 1.47 0.32 1.44 0.01 -1.26 -4.90 114.94 107.04 2qta s ASN 468 Ca 0.08 -0.60 -0.14 0.00 -0.71 0.00 0.00 52.86 51.49 2qta s ASN 468 Cb 0.10 -0.03 -0.09 0.00 0.41 0.00 0.00 41.25 41.64 2qta s ASN 468 CO 0.57 -0.10 0.71 0.72 -1.51 0.00 0.00 177.10 177.48 2qta s PHE 469 N -1.29 3.39 -0.01 2.20 -0.71 -1.26 -4.89 117.98 115.41 2qta s PHE 469 Ca -0.04 1.15 -0.03 0.00 -1.04 0.00 0.00 56.93 56.98 2qta s PHE 469 Cb -0.10 -2.49 -0.27 0.00 -1.21 0.00 0.00 43.02 38.95 2qta s PHE 469 CO 0.02 0.10 0.82 1.79 -1.34 0.00 0.00 175.22 176.61 2qta h THR 470 N 1.90 1.11 -4.23 -4.49 1.35 -1.87 -3.48 112.91 103.20 2qta h THR 470 Ca -0.48 -2.76 -0.52 0.00 -0.55 0.00 0.00 66.41 62.10 2qta h THR 470 Cb 1.17 2.73 0.14 0.00 -1.73 0.00 0.00 68.15 70.46 2qta h THR 470 CO 0.66 0.81 0.34 -1.83 -0.25 0.00 0.00 175.52 175.25 2qta s GLU 471 N -2.61 2.25 -0.23 4.72 -1.05 -1.26 -5.02 118.70 115.50 2qta s GLU 471 Ca -0.10 1.46 -0.07 0.00 -0.15 0.00 0.00 54.97 56.11 2qta s GLU 471 Cb 0.07 -1.88 -0.03 0.00 -0.44 0.00 0.00 34.13 31.85 2qta s GLU 471 CO 0.85 -1.69 0.07 0.21 0.95 0.00 0.00 175.26 175.65 2qta s LYS 472 N -4.31 3.72 0.18 -4.83 2.20 -1.26 -5.09 119.74 110.36 2qta s LYS 472 Ca 0.68 -0.45 -0.08 0.00 -0.36 0.00 0.00 55.97 55.75 2qta s LYS 472 Cb -0.22 -3.30 -0.07 0.00 -1.51 0.00 0.00 37.83 32.73 2qta s LYS 472 CO 0.48 -0.08 0.48 -0.51 -0.36 0.00 0.00 175.35 175.36 2qta s LEU 473 N 1.34 4.22 -0.86 5.43 1.43 -1.26 -5.03 118.68 123.95 2qta s LEU 473 Ca 0.05 0.81 -0.06 0.00 -1.03 0.00 0.00 54.13 53.90 2qta s LEU 473 Cb -0.15 -3.48 0.22 0.00 0.03 0.00 0.00 46.19 42.81 2qta s LEU 473 CO 0.04 -0.00 0.76 -1.61 0.23 0.00 0.00 176.35 175.76 2qta s GLU 474 N -2.65 3.35 0.60 1.70 0.41 -1.26 -4.98 118.70 115.87 2qta s GLU 474 Ca 0.44 -2.95 -0.18 0.00 -0.41 0.00 0.00 54.97 51.86 2qta s GLU 474 Cb -0.12 -4.10 -0.03 0.00 -1.78 0.00 0.00 34.13 28.10 2qta s GLU 474 CO 0.22 -1.24 1.19 -0.51 -0.49 0.00 0.00 175.26 174.43 2qta s LEU 475 N -0.77 3.63 0.72 1.80 1.43 -1.26 -4.59 118.68 119.64 2qta s LEU 475 Ca 0.24 2.34 -0.14 0.00 -1.03 0.00 0.00 54.13 55.54 2qta s LEU 475 Cb -0.11 -4.59 0.03 0.00 0.03 0.00 0.00 46.19 41.55 2qta s LEU 475 CO -0.09 -1.61 1.15 -2.16 0.23 0.00 0.00 176.35 173.87 2qta s PRO 476 N -3.42 2.33 0.58 1.29 0.04 -1.26 -5.02 135.00 129.55 2qta s PRO 476 Ca 0.76 1.51 0.01 0.00 0.04 0.00 0.00 61.00 63.32 2qta s PRO 476 Cb -0.29 -1.88 0.05 0.00 0.04 0.00 0.00 34.50 32.42 2qta s PRO 476 CO 0.34 -1.63 0.82 -1.54 0.04 0.00 0.00 177.00 175.02 2qta s SER 477 N -2.49 5.13 0.30 6.66 1.04 -1.26 -4.96 113.70 118.13 2qta s SER 477 Ca 0.69 -0.03 0.04 0.00 0.48 0.00 0.00 55.95 57.12 2qta s SER 477 Cb -0.23 -0.77 0.49 0.00 0.10 0.00 0.00 66.02 65.61 2qta s SER 477 CO 0.46 -1.26 1.78 0.25 0.98 0.00 0.00 173.24 175.44 2qta h LEU 478 N -0.05 0.46 -1.52 2.42 5.85 -1.96 -1.52 115.31 118.99 2qta h LEU 478 Ca -0.41 -0.13 0.10 0.00 0.84 0.00 0.00 57.88 58.28 2qta h LEU 478 Cb 1.29 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 42.16 2qta h LEU 478 CO 0.51 0.65 0.46 -0.61 -0.34 0.00 0.00 178.44 179.12 2qta h GLN 479 N 0.42 0.52 0.00 1.25 4.15 -2.00 0.32 115.11 119.77 2qta h GLN 479 Ca 0.07 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.46 2qta h GLN 479 Cb 0.56 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 28.13 2qta h GLN 479 CO 0.04 0.34 0.00 -0.44 -1.93 0.00 0.00 178.83 176.84 2qta h ASP 480 N 0.53 0.00 -0.63 -0.69 3.32 -1.64 0.10 116.42 117.42 2qta h ASP 480 Ca 0.33 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.38 2qta h ASP 480 Cb 0.55 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.10 2qta h ASP 480 CO -0.11 0.00 0.00 0.49 -1.72 0.00 0.00 179.24 177.90 2qta n PHE 481 N -2.74 1.64 -0.33 4.55 3.72 0.11 -4.76 117.46 119.67 2qta n PHE 481 Ca -0.01 -0.65 0.18 0.00 -0.05 0.00 0.00 57.45 56.92 2qta n PHE 481 Cb 0.12 -0.32 0.36 0.00 -0.94 0.00 0.00 39.48 38.70 2qta n PHE 481 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 2qta h GLY 482 N 4.04 1.52 1.53 1.37 0.00 -0.76 -0.51 103.07 110.27 2qta h GLY 482 Ca 0.00 0.04 -0.01 0.00 0.00 0.00 0.00 47.33 47.36 2qta h GLY 482 CO 0.30 -0.55 0.26 0.00 0.00 0.00 0.00 176.54 176.55 2qta h ALA 483 N 1.94 1.60 0.00 3.60 0.00 -1.85 -1.10 119.26 123.44 2qta h ALA 483 Ca 0.65 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.49 2qta h ALA 483 Cb 1.44 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2qta h ALA 483 CO -0.82 0.34 0.00 -0.07 0.00 0.00 0.00 179.25 178.70 2qta h LEU 484 N 0.63 0.00 0.00 0.00 3.38 -1.48 -2.77 115.31 115.07 2qta h LEU 484 Ca 0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.13 2qta h LEU 484 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2qta h LEU 484 CO -0.03 0.00 -0.32 0.18 0.09 0.00 0.00 178.44 178.37 2qta n LEU 485 N -2.96 0.56 -4.95 1.67 4.77 -0.43 -3.06 117.00 112.61 2qta n LEU 485 Ca 0.01 0.33 -0.23 0.00 -0.03 0.00 0.00 56.01 56.10 2qta n LEU 485 Cb 0.32 -0.29 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 2qta n LEU 485 CO 0.27 -0.05 0.23 -1.61 -1.33 0.00 0.00 177.39 174.90 2qta s GLU 486 N -3.09 3.19 0.41 3.23 2.02 -1.05 -1.33 118.70 122.08 2qta s GLU 486 Ca 0.10 -0.50 -0.27 0.00 0.02 0.00 0.00 54.97 54.32 2qta s GLU 486 Cb 0.15 -2.61 -0.09 0.00 0.10 0.00 0.00 34.13 31.67 2qta s GLU 486 CO 0.65 -0.12 1.44 -2.00 0.02 0.00 0.00 175.26 175.24 2qta s GLU 487 N -4.45 3.90 -0.10 1.61 2.12 -1.26 -4.46 118.70 116.06 2qta s GLU 487 Ca 0.46 2.46 -0.15 0.00 0.36 0.00 0.00 54.97 58.10 2qta s GLU 487 Cb -0.10 -2.80 -0.05 0.00 0.26 0.00 0.00 34.13 31.44 2qta s GLU 487 CO 0.37 -0.66 0.36 -0.65 -0.54 0.00 0.00 175.26 174.14 2qta s GLN 488 N -2.27 4.13 -0.04 4.30 -1.52 0.33 -4.89 119.66 119.70 2qta s GLN 488 Ca 0.57 0.26 -0.25 0.00 -1.95 0.00 0.00 55.36 54.00 2qta s GLN 488 Cb -0.44 -3.35 -0.19 0.00 -0.22 0.00 0.00 33.01 28.80 2qta s GLN 488 CO 0.58 0.38 1.11 1.03 -0.25 0.00 0.00 175.29 178.15 2qta h SER 489 N 6.01 -0.10 -3.95 5.90 0.87 -1.93 -3.41 113.55 116.93 2qta h SER 489 Ca -0.45 -0.45 -0.49 0.00 -1.23 0.00 0.00 61.79 59.18 2qta h SER 489 Cb 1.19 0.03 0.02 0.00 -0.44 0.00 0.00 62.40 63.19 2qta h SER 489 CO 0.70 0.43 0.25 -0.54 -0.53 0.00 0.00 176.83 177.15 2qta s LYS 490 N -3.90 3.82 0.02 2.24 1.02 -1.26 -5.03 119.74 116.65 2qta s LYS 490 Ca -0.15 0.68 -0.29 0.00 0.02 0.00 0.00 55.97 56.23 2qta s LYS 490 Cb 0.01 -2.26 -0.04 0.00 -0.52 0.00 0.00 37.83 35.03 2qta s LYS 490 CO 0.60 -0.19 0.95 -1.21 -0.92 0.00 0.00 175.35 174.59 2qta s GLU 491 N -4.09 4.58 0.37 1.68 2.02 -1.26 -4.68 118.70 117.31 2qta s GLU 491 Ca 0.55 1.39 0.07 0.00 0.02 0.00 0.00 54.97 56.99 2qta s GLU 491 Cb -0.10 -3.44 -0.03 0.00 0.10 0.00 0.00 34.13 30.66 2qta s GLU 491 CO 0.34 0.02 0.25 0.96 0.02 0.00 0.00 175.26 176.84 2qta s ILE 492 N 0.77 0.14 0.41 -1.63 -4.36 -0.98 -4.64 121.20 110.90 2qta s ILE 492 Ca 0.50 -2.00 0.07 0.00 -0.26 0.00 0.00 60.65 58.96 2qta s ILE 492 Cb -0.21 -2.43 -0.06 0.00 1.25 0.00 0.00 42.46 41.00 2qta s ILE 492 CO 0.28 0.00 0.13 -0.94 0.24 0.00 0.00 174.94 174.65 2qta s SER 493 N -3.46 4.27 0.43 4.36 1.04 -1.26 -1.57 113.70 117.50 2qta s SER 493 Ca 0.35 -1.16 0.29 0.00 0.48 0.00 0.00 55.95 55.92 2qta s SER 493 Cb 0.02 -0.46 1.09 0.00 0.10 0.00 0.00 66.02 66.77 2qta s SER 493 CO 0.25 -0.51 1.85 0.71 0.98 0.00 0.00 173.24 176.52 2qta h THR 494 N 1.53 0.00 0.08 2.02 1.35 -1.81 -1.27 112.91 114.82 2qta h THR 494 Ca -0.43 -0.49 -0.28 0.00 -0.55 0.00 0.00 66.41 64.66 2qta h THR 494 Cb 1.25 1.42 0.03 0.00 -1.73 0.00 0.00 68.15 69.11 2qta h THR 494 CO 0.73 0.00 -1.15 0.74 -0.25 0.00 0.00 175.52 175.59 2qta h THR 495 N 0.00 1.29 -0.62 6.82 2.02 -1.87 -1.52 112.91 119.03 2qta h THR 495 Ca 0.00 -2.38 -0.02 0.00 0.77 0.00 0.00 66.41 64.78 2qta h THR 495 Cb 0.55 2.62 -0.03 0.00 -1.74 0.00 0.00 68.15 69.55 2qta h THR 495 CO 0.00 0.73 0.29 0.40 0.37 0.00 0.00 175.52 177.31 2qta h ILE 496 N 0.28 1.20 -0.62 3.11 2.04 -1.69 -1.24 117.51 120.60 2qta h ILE 496 Ca -0.17 -0.58 -0.04 0.00 1.00 0.00 0.00 64.86 65.07 2qta h ILE 496 Cb 1.83 0.42 -0.03 0.00 -0.74 0.00 0.00 36.82 38.30 2qta h ILE 496 CO 0.22 0.24 0.21 0.00 0.00 0.00 0.00 178.15 178.83 2qta h ALA 497 N 1.45 0.80 -0.22 1.87 0.00 -1.17 -0.95 119.26 121.05 2qta h ALA 497 Ca 0.22 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2qta h ALA 497 Cb 0.10 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 2qta h ALA 497 CO -0.03 0.45 0.14 0.35 0.00 0.00 0.00 179.25 180.17 2qta h PHE 498 N 0.87 0.27 -0.91 0.00 3.57 -0.59 0.16 116.94 120.32 2qta h PHE 498 Ca 0.20 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.69 2qta h PHE 498 Cb 0.26 -0.09 -0.04 0.00 2.79 0.00 0.00 35.95 38.86 2qta h PHE 498 CO 0.02 0.18 0.50 0.28 -2.23 0.00 0.00 178.31 177.06 2qta h VAL 499 N 0.29 1.26 -0.30 1.41 2.07 -0.98 -0.56 116.25 119.44 2qta h VAL 499 Ca 0.08 -0.63 -0.09 0.00 0.82 0.00 0.00 66.70 66.88 2qta h VAL 499 Cb -0.03 0.03 -0.02 0.00 -1.52 0.00 0.00 31.29 29.76 2qta h VAL 499 CO -0.02 0.29 -0.18 0.03 0.02 0.00 0.00 177.57 177.71 2qta h ARG 500 N 1.27 0.55 -0.50 1.57 3.08 -0.78 -1.40 114.38 118.17 2qta h ARG 500 Ca 0.32 -0.19 -0.11 0.00 0.07 0.00 0.00 59.98 60.07 2qta h ARG 500 Cb 0.02 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.01 2qta h ARG 500 CO -0.05 0.71 -0.11 0.00 -1.07 0.00 0.00 179.97 179.45 2qta h ALA 501 N 1.30 0.86 -0.61 0.04 0.00 0.06 -1.93 119.26 118.99 2qta h ALA 501 Ca 0.08 -0.34 -0.04 0.00 0.00 0.00 0.00 54.91 54.61 2qta h ALA 501 Cb 0.60 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 2qta h ALA 501 CO 0.04 0.64 0.22 1.25 0.00 0.00 0.00 179.25 181.41 2qta h LEU 502 N 0.82 0.86 -1.50 0.00 5.85 -0.75 -2.32 115.31 118.28 2qta h LEU 502 Ca 0.13 -0.19 -0.00 0.00 0.84 0.00 0.00 57.88 58.66 2qta h LEU 502 Cb 0.64 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.43 2qta h LEU 502 CO 0.04 0.81 0.27 0.78 -0.34 0.00 0.00 178.44 180.00 2qta h ASN 503 N 0.85 0.53 -0.17 1.25 2.35 -0.86 -0.07 115.58 119.46 2qta h ASN 503 Ca 0.20 -0.03 -0.05 0.00 -0.55 0.00 0.00 56.30 55.87 2qta h ASN 503 Cb 0.24 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.46 2qta h ASN 503 CO -0.01 0.42 -0.04 0.58 -1.65 0.00 0.00 177.43 176.72 2qta h VAL 504 N 0.62 1.20 -0.01 2.81 2.07 -0.84 -2.77 116.25 119.33 2qta h VAL 504 Ca 0.16 -0.82 -0.21 0.00 0.82 0.00 0.00 66.70 66.65 2qta h VAL 504 Cb -0.02 1.02 -0.00 0.00 -1.52 0.00 0.00 31.29 30.78 2qta h VAL 504 CO -0.03 0.27 -0.89 0.24 0.02 0.00 0.00 177.57 177.19 2qta h MET 505 N 0.45 0.36 0.00 1.57 2.86 -0.70 -3.04 114.93 116.42 2qta h MET 505 Ca 0.09 -0.37 0.00 0.00 -2.06 0.00 0.00 59.70 57.37 2qta h MET 505 Cb 0.36 0.10 0.00 0.00 0.06 0.00 0.00 31.60 32.12 2qta h MET 505 CO 0.02 1.04 0.00 1.28 1.06 0.00 0.00 176.91 180.31 2qta n LEU 506 N -3.74 0.00 0.01 1.22 4.77 -0.19 -1.24 117.00 117.84 2qta n LEU 506 Ca -0.06 0.26 0.11 0.00 -0.03 0.00 0.00 56.01 56.29 2qta n LEU 506 Cb 0.80 -0.26 -0.07 0.00 -2.33 0.00 0.00 43.42 41.57 2qta n LEU 506 CO 0.50 -0.12 -0.24 1.17 -1.33 0.00 0.00 177.39 177.38 2qta n LYS 507 N -1.26 0.35 -2.54 3.23 4.81 -1.10 -4.76 118.16 116.89 2qta n LYS 507 Ca 0.08 -0.06 -0.43 0.00 -0.87 0.00 0.00 58.31 57.04 2qta n LYS 507 Cb 0.13 -1.56 -0.02 0.00 0.02 0.00 0.00 35.03 33.59 2qta n LYS 507 CO 0.00 0.00 0.00 1.21 1.17 0.00 0.00 177.40 179.78 2qta s ASN 508 N -3.96 7.03 0.29 3.14 3.84 -0.37 -4.92 114.94 120.00 2qta s ASN 508 Ca 0.01 1.57 -0.01 0.00 0.21 0.00 0.00 52.86 54.63 2qta s ASN 508 Cb 0.14 -2.54 0.46 0.00 -0.55 0.00 0.00 41.25 38.77 2qta s ASN 508 CO 0.85 -0.70 1.93 0.50 -2.79 0.00 0.00 177.10 176.89 2qta h LYS 509 N 7.79 1.07 -0.47 0.43 3.64 -1.90 0.14 116.57 127.27 2qta h LYS 509 Ca -0.24 -0.06 -0.13 0.00 -1.27 0.00 0.00 60.65 58.95 2qta h LYS 509 Cb 1.09 -0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 32.66 2qta h LYS 509 CO 0.96 0.71 -0.20 1.03 -2.27 0.00 0.00 179.45 179.68 2qta h SER 510 N 1.11 0.99 -0.00 4.20 0.87 -1.91 -3.37 113.55 115.43 2qta h SER 510 Ca 0.37 -0.39 0.00 0.00 -1.23 0.00 0.00 61.79 60.54 2qta h SER 510 Cb 0.07 -0.27 0.00 0.00 -0.44 0.00 0.00 62.40 61.76 2qta h SER 510 CO -0.12 1.16 -0.25 2.30 -0.53 0.00 0.00 176.83 179.40 2qta n ILE 511 N -4.15 0.00 -0.32 2.23 -5.35 -1.15 -4.75 119.36 105.87 2qta n ILE 511 Ca -0.00 -0.38 0.17 0.00 -0.27 0.00 0.00 62.75 62.27 2qta n ILE 511 Cb 0.45 1.03 0.36 0.00 -1.74 0.00 0.00 39.64 39.74 2qta n ILE 511 CO 0.00 0.00 0.00 0.07 -1.76 0.00 0.00 176.55 174.86 2qta h LYS 512 N 0.24 0.40 -0.01 6.28 2.10 -0.81 0.44 116.57 125.21 2qta h LYS 512 Ca 0.00 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.63 2qta h LYS 512 Cb 0.17 -0.09 0.00 0.00 -0.90 0.00 0.00 32.23 31.41 2qta h LYS 512 CO 0.00 0.27 -0.19 -0.25 -2.00 0.00 0.00 179.45 177.27 2qta n ASP 513 N -5.02 0.77 0.05 7.07 8.00 -1.26 -3.51 116.55 122.65 2qta n ASP 513 Ca 0.25 -0.73 0.12 0.00 0.71 0.00 0.00 54.79 55.14 2qta n ASP 513 Cb 0.76 0.04 0.15 0.00 -0.02 0.00 0.00 41.12 42.04 2qta n ASP 513 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2qta n ARG 514 N -0.80 0.28 -2.22 -1.24 5.12 0.15 -4.91 116.66 113.04 2qta n ARG 514 Ca 0.13 0.07 -0.39 0.00 -1.93 0.00 0.00 57.85 55.72 2qta n ARG 514 Cb 0.32 -1.66 -0.02 0.00 -1.16 0.00 0.00 32.46 29.94 2qta n ARG 514 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2qta s LEU 515 N -4.11 4.29 -0.44 0.55 1.43 -0.97 -0.87 118.68 118.57 2qta s LEU 515 Ca 0.06 2.48 0.02 0.00 -1.03 0.00 0.00 54.13 55.66 2qta s LEU 515 Cb 0.14 -3.87 0.14 0.00 0.03 0.00 0.00 46.19 42.63 2qta s LEU 515 CO 0.73 -0.63 0.26 -0.69 0.23 0.00 0.00 176.35 176.26 2qta s VAL 516 N -1.29 1.14 0.14 -1.59 1.01 -0.20 -4.85 120.40 114.76 2qta s VAL 516 Ca 0.54 -2.50 -0.30 0.00 0.00 0.00 0.00 61.98 59.72 2qta s VAL 516 Cb -0.34 -1.80 -0.07 0.00 0.00 0.00 0.00 36.38 34.17 2qta s VAL 516 CO 0.44 -0.95 1.16 -2.84 0.00 0.00 0.00 175.10 172.91 2qta s PRO 517 N 0.36 4.51 -0.04 2.72 0.02 -1.26 -1.06 135.00 140.25 2qta s PRO 517 Ca 0.20 1.78 0.03 0.00 0.02 0.00 0.00 61.00 63.03 2qta s PRO 517 Cb -0.20 -3.29 0.00 0.00 0.02 0.00 0.00 34.50 31.03 2qta s PRO 517 CO -0.03 -0.09 -0.13 0.42 -0.33 0.00 0.00 177.00 176.84 2qta s ILE 518 N 0.28 1.13 0.09 2.83 1.01 0.30 -1.28 121.20 125.56 2qta s ILE 518 Ca 0.54 -0.54 0.03 0.00 0.00 0.00 0.00 60.65 60.68 2qta s ILE 518 Cb -0.30 -0.99 -0.03 0.00 0.01 0.00 0.00 42.46 41.15 2qta s ILE 518 CO 0.33 0.34 -0.10 0.27 0.00 0.00 0.00 174.94 175.78 2qta s ILE 519 N 0.16 0.87 -0.76 2.92 -4.36 -0.54 -2.02 121.20 117.46 2qta s ILE 519 Ca -0.04 -1.57 -0.01 0.00 -0.26 0.00 0.00 60.65 58.77 2qta s ILE 519 Cb -0.11 -1.26 0.19 0.00 1.25 0.00 0.00 42.46 42.53 2qta s ILE 519 CO 0.02 -0.54 0.61 0.00 0.24 0.00 0.00 174.94 175.26 2qta s ALA 520 N -2.32 3.93 0.00 2.27 0.00 -1.26 -1.32 121.76 123.06 2qta s ALA 520 Ca 0.03 -3.62 0.00 0.00 0.00 0.00 0.00 51.96 48.37 2qta s ALA 520 Cb -0.04 -2.68 0.00 0.00 0.00 0.00 0.00 23.12 20.41 2qta s ALA 520 CO -0.00 -2.13 0.00 -3.47 0.00 0.00 0.00 175.76 170.16 2qta n ASP 521 N 2.73 0.00 -4.66 0.00 2.03 -0.97 -4.51 116.55 111.17 2qta n ASP 521 Ca 0.16 0.00 -0.42 0.00 0.52 0.00 0.00 54.79 55.05 2qta n ASP 521 Cb 0.37 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.74 2qta n ASP 521 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 2qta s GLU 522 N 0.00 4.10 0.01 -0.67 0.41 -1.26 -4.83 118.70 116.46 2qta s GLU 522 Ca 0.00 2.32 0.00 0.00 -0.41 0.00 0.00 54.97 56.88 2qta s GLU 522 Cb 0.00 -4.08 0.00 0.00 -1.78 0.00 0.00 34.13 28.27 2qta s GLU 522 CO 0.00 -0.97 0.00 0.00 -0.49 0.00 0.00 175.26 173.80 2qta n ALA 523 N 7.58 3.00 -0.26 5.21 0.00 -1.26 -4.73 120.51 130.05 2qta n ALA 523 Ca 0.19 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.76 2qta n ALA 523 Cb 0.42 0.47 0.40 0.00 0.00 0.00 0.00 19.45 20.74 2qta n ALA 523 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qta h ARG 524 N 0.00 0.62 0.00 0.00 3.08 -1.94 0.26 114.38 116.41 2qta h ARG 524 Ca 0.00 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 60.00 2qta h ARG 524 Cb 0.89 -0.14 -0.00 0.00 0.08 0.00 0.00 29.97 30.79 2qta h ARG 524 CO 0.00 0.41 -0.08 1.15 -1.07 0.00 0.00 179.97 180.39 2qta h THR 525 N 0.64 1.03 -0.49 2.04 2.02 -1.97 -1.88 112.91 114.31 2qta h THR 525 Ca 0.45 -0.26 0.00 0.00 0.77 0.00 0.00 66.41 67.36 2qta h THR 525 Cb 0.77 1.14 0.00 0.00 -1.74 0.00 0.00 68.15 68.32 2qta h THR 525 CO -0.20 0.07 0.00 0.49 0.37 0.00 0.00 175.52 176.25 2qta n PHE 526 N -4.42 0.64 -2.89 3.16 3.72 0.73 -4.96 117.46 113.45 2qta n PHE 526 Ca -0.03 -0.44 -0.22 0.00 -0.05 0.00 0.00 57.45 56.71 2qta n PHE 526 Cb 0.15 -0.01 0.03 0.00 -0.94 0.00 0.00 39.48 38.71 2qta n PHE 526 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2qta n GLY 527 N 1.10 -0.52 0.02 1.37 0.00 -0.13 -4.84 105.19 102.19 2qta n GLY 527 Ca 0.17 0.10 0.12 0.00 0.00 0.00 0.00 46.02 46.42 2qta n GLY 527 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2qta n MET 528 N -3.83 0.10 0.20 1.61 2.81 -0.55 -4.37 117.12 113.09 2qta n MET 528 Ca -0.14 0.02 0.16 0.00 -1.81 0.00 0.00 57.70 55.93 2qta n MET 528 Cb 0.64 -1.55 0.80 0.00 -0.71 0.00 0.00 33.22 32.39 2qta n MET 528 CO 0.00 0.00 0.00 1.05 1.51 0.00 0.00 175.97 178.53 2qta h GLU 529 N 0.00 0.00 -0.07 0.03 9.09 -1.90 -1.83 114.58 119.90 2qta h GLU 529 Ca 0.00 0.00 -0.07 0.00 0.05 0.00 0.00 59.36 59.34 2qta h GLU 529 Cb 0.58 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.67 2qta h GLU 529 CO 0.00 0.00 -0.30 0.78 0.05 0.00 0.00 179.01 179.54 2qta h GLY 530 N 0.00 0.14 2.00 1.06 0.00 -1.97 -2.74 103.07 101.56 2qta h GLY 530 Ca 0.08 -0.11 -0.04 0.00 0.00 0.00 0.00 47.33 47.26 2qta h GLY 530 CO -0.00 0.10 -0.19 1.41 0.00 0.00 0.00 176.54 177.86 2qta h LEU 531 N 0.12 0.00 -0.87 3.11 3.38 -1.64 -3.19 115.31 116.21 2qta h LEU 531 Ca 0.02 0.00 0.11 0.00 0.09 0.00 0.00 57.88 58.10 2qta h LEU 531 Cb 0.60 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.27 2qta h LEU 531 CO 0.04 0.19 0.50 -0.26 0.09 0.00 0.00 178.44 179.00 2qta h PHE 532 N 0.00 0.90 -0.54 1.13 0.04 -1.60 -0.34 116.94 116.54 2qta h PHE 532 Ca -0.00 0.03 -0.09 0.00 2.80 0.00 0.00 57.97 60.71 2qta h PHE 532 Cb 0.39 -0.27 -0.02 0.00 2.20 0.00 0.00 35.95 38.25 2qta h PHE 532 CO 0.00 0.33 -0.02 0.00 -0.60 0.00 0.00 178.31 178.02 2qta h ARG 533 N 0.80 0.96 0.36 1.51 3.08 -1.73 0.16 114.38 119.52 2qta h ARG 533 Ca 0.44 -0.32 -0.02 0.00 0.07 0.00 0.00 59.98 60.16 2qta h ARG 533 Cb 0.47 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.44 2qta h ARG 533 CO -0.28 0.98 -0.17 1.96 -1.07 0.00 0.00 179.97 181.38 2qta h GLN 534 N 0.83 -0.47 -0.00 0.04 4.20 -1.43 -3.40 115.11 114.88 2qta h GLN 534 Ca 0.15 0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.89 2qta h GLN 534 Cb 0.56 0.11 0.00 0.00 0.30 0.00 0.00 27.48 28.45 2qta h GLN 534 CO 0.03 -0.18 -0.51 0.44 -0.67 0.00 0.00 178.83 177.94 2qta n ILE 535 N -5.11 0.00 -0.68 2.54 -5.35 -0.23 -5.08 119.36 105.44 2qta n ILE 535 Ca -0.08 -0.24 0.09 0.00 -0.27 0.00 0.00 62.75 62.24 2qta n ILE 535 Cb 0.26 1.02 -0.03 0.00 -1.74 0.00 0.00 39.64 39.14 2qta n ILE 535 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2qta n GLY 536 N 1.24 -2.21 3.59 3.28 0.00 0.04 -1.40 105.19 109.72 2qta n GLY 536 Ca 0.03 -1.32 -0.35 0.00 0.00 0.00 0.00 46.02 44.38 2qta n GLY 536 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qta s ILE 537 N -2.50 4.59 -0.10 -0.61 1.09 -1.26 -1.24 121.20 121.17 2qta s ILE 537 Ca 0.00 -0.10 -0.29 0.00 -1.10 0.00 0.00 60.65 59.16 2qta s ILE 537 Cb 0.00 -3.08 -0.06 0.00 -1.06 0.00 0.00 42.46 38.26 2qta s ILE 537 CO 0.00 0.44 1.95 -0.47 -0.10 0.00 0.00 174.94 176.76 2qta s TYR 538 N 0.57 1.46 -0.46 3.97 5.04 0.10 -2.47 117.35 125.57 2qta s TYR 538 Ca 0.02 0.09 0.05 0.00 -2.44 0.00 0.00 57.07 54.79 2qta s TYR 538 Cb -0.13 -4.07 0.18 0.00 0.35 0.00 0.00 41.96 38.28 2qta s TYR 538 CO 0.01 -4.47 0.53 0.45 -1.34 0.00 0.00 175.55 170.73 2qta s SER 539 N 5.45 0.02 -0.14 4.32 0.15 0.90 -4.73 113.70 119.68 2qta s SER 539 Ca 0.87 -2.38 -0.01 0.00 0.70 0.00 0.00 55.95 55.13 2qta s SER 539 Cb -0.35 0.72 -0.03 0.00 -1.71 0.00 0.00 66.02 64.64 2qta s SER 539 CO 0.36 -0.12 1.19 -2.65 1.20 0.00 0.00 173.24 173.23 2qta n PRO 540 N 2.94 0.49 0.00 5.44 -0.02 -1.26 -3.25 135.00 139.35 2qta n PRO 540 Ca 0.24 -0.48 0.00 0.00 -2.02 0.00 0.00 63.50 61.23 2qta n PRO 540 Cb 0.52 -1.86 0.00 0.00 -0.02 0.00 0.00 33.50 32.13 2qta n PRO 540 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 2qta n GLU 558 N 3.83 0.00 -2.18 -0.52 2.13 -1.26 -4.73 120.64 117.92 2qta n GLU 558 Ca 0.11 0.00 -0.03 0.00 0.66 0.00 0.00 57.16 57.90 2qta n GLU 558 Cb 0.10 0.00 -0.01 0.00 0.27 0.00 0.00 31.44 31.80 2qta n GLU 558 CO 0.00 0.00 0.00 -0.40 -0.41 0.00 0.00 177.13 176.32 2qta n ASP 559 N 0.00 -0.17 0.15 4.31 5.68 -1.03 -4.97 116.55 120.51 2qta n ASP 559 Ca 0.00 -1.34 0.11 0.00 -0.50 0.00 0.00 54.79 53.06 2qta n ASP 559 Cb 0.00 0.35 0.55 0.00 -1.14 0.00 0.00 41.12 40.88 2qta n ASP 559 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 2qta n GLU 560 N -0.10 0.15 0.00 0.11 0.28 -1.20 -0.07 120.64 119.81 2qta n GLU 560 Ca 0.01 0.58 0.11 0.00 -0.16 0.00 0.00 57.16 57.70 2qta n GLU 560 Cb 0.10 -1.93 0.04 0.00 1.43 0.00 0.00 31.44 31.09 2qta n GLU 560 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 2qta n LYS 561 N -2.24 0.97 -1.72 3.44 4.76 -1.26 -4.08 118.16 118.03 2qta n LYS 561 Ca -0.00 -0.77 -0.41 0.00 -2.87 0.00 0.00 58.31 54.25 2qta n LYS 561 Cb 0.09 -1.48 0.00 0.00 -1.84 0.00 0.00 35.03 31.80 2qta n LYS 561 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2qta n GLY 562 N 1.42 0.76 0.10 0.72 0.00 -0.35 -4.91 105.19 102.92 2qta n GLY 562 Ca 0.09 0.26 -0.11 0.00 0.00 0.00 0.00 46.02 46.26 2qta n GLY 562 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2qta n GLN 563 N 0.29 0.66 -2.75 1.61 7.27 -0.50 -3.37 117.38 120.60 2qta n GLN 563 Ca 0.05 0.23 -0.41 0.00 0.07 0.00 0.00 57.00 56.94 2qta n GLN 563 Cb 0.38 -1.72 -0.05 0.00 2.41 0.00 0.00 30.24 31.26 2qta n GLN 563 CO 0.00 0.00 0.00 0.42 0.07 0.00 0.00 177.06 177.55 2qta s ILE 564 N -2.57 4.33 -0.31 1.69 1.01 -0.37 -4.48 121.20 120.50 2qta s ILE 564 Ca -0.10 2.07 -0.15 0.00 0.00 0.00 0.00 60.65 62.46 2qta s ILE 564 Cb 0.07 -4.32 -0.02 0.00 0.01 0.00 0.00 42.46 38.20 2qta s ILE 564 CO 0.81 0.40 0.38 -0.76 0.00 0.00 0.00 174.94 175.76 2qta s LEU 565 N -0.50 4.23 -0.44 2.97 1.43 -0.40 -0.72 118.68 125.25 2qta s LEU 565 Ca 0.44 0.04 -0.12 0.00 -1.03 0.00 0.00 54.13 53.46 2qta s LEU 565 Cb -0.24 -2.40 0.07 0.00 0.03 0.00 0.00 46.19 43.65 2qta s LEU 565 CO 0.31 -0.28 0.31 -1.58 0.23 0.00 0.00 176.35 175.34 2qta s GLN 566 N 2.08 2.77 0.00 1.70 2.00 -1.26 -1.47 119.66 125.48 2qta s GLN 566 Ca 0.14 -1.40 0.21 0.00 -2.00 0.00 0.00 55.36 52.32 2qta s GLN 566 Cb -0.16 -3.93 0.53 0.00 0.80 0.00 0.00 33.01 30.25 2qta s GLN 566 CO 0.11 -0.97 1.45 0.39 -0.50 0.00 0.00 175.29 175.77 2qta n GLU 567 N 5.04 2.40 0.00 1.67 -0.58 -0.43 -4.93 120.64 123.81 2qta n GLU 567 Ca -0.11 -2.15 0.00 0.00 -0.42 0.00 0.00 57.16 54.48 2qta n GLU 567 Cb 0.43 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.81 2qta n GLU 567 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2qta n GLY 568 N 1.47 -1.03 3.58 0.62 0.00 -1.26 -4.15 105.19 104.41 2qta n GLY 568 Ca 0.20 -1.16 -0.41 0.00 0.00 0.00 0.00 46.02 44.64 2qta n GLY 568 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qta s ILE 569 N 0.00 4.05 -0.48 -0.61 1.01 -1.26 -2.30 121.20 121.61 2qta s ILE 569 Ca 0.00 -1.76 0.04 0.00 0.00 0.00 0.00 60.65 58.93 2qta s ILE 569 Cb 0.00 -5.13 0.19 0.00 0.01 0.00 0.00 42.46 37.53 2qta s ILE 569 CO 0.00 -1.93 0.79 0.21 0.00 0.00 0.00 174.94 174.02 2qta s ASN 570 N 4.49 -1.24 0.25 3.58 3.84 -1.26 -5.02 114.94 119.58 2qta s ASN 570 Ca 0.55 -1.43 -0.03 0.00 0.21 0.00 0.00 52.86 52.16 2qta s ASN 570 Cb 0.03 1.62 0.29 0.00 -0.55 0.00 0.00 41.25 42.65 2qta s ASN 570 CO 0.07 -0.05 1.75 -0.33 -2.79 0.00 0.00 177.10 175.76 2qta h GLU 571 N 4.97 0.87 -0.48 0.43 3.07 -1.92 -0.83 114.58 120.69 2qta h GLU 571 Ca 0.05 -0.23 -0.02 0.00 -0.50 0.00 0.00 59.36 58.66 2qta h GLU 571 Cb 1.13 -0.10 -0.02 0.00 -0.84 0.00 0.00 28.75 28.91 2qta h GLU 571 CO -0.01 0.84 0.22 1.25 -1.40 0.00 0.00 179.01 179.92 2qta h LEU 572 N 0.81 0.64 -0.19 1.33 6.46 -1.93 0.11 115.31 122.55 2qta h LEU 572 Ca 0.16 -0.14 -0.01 0.00 -0.12 0.00 0.00 57.88 57.78 2qta h LEU 572 Cb 0.43 -0.16 -0.01 0.00 -0.73 0.00 0.00 40.66 40.19 2qta h LEU 572 CO 0.02 0.60 0.09 1.23 -0.62 0.00 0.00 178.44 179.76 2qta h GLY 573 N 0.64 0.29 0.71 3.75 0.00 -1.86 -0.03 103.07 106.57 2qta h GLY 573 Ca 0.17 -0.14 0.05 0.00 0.00 0.00 0.00 47.33 47.41 2qta h GLY 573 CO -0.02 0.13 0.32 0.00 0.00 0.00 0.00 176.54 176.98 2qta h ALA 574 N 0.96 0.78 -0.63 3.60 0.00 -0.99 -0.08 119.26 122.91 2qta h ALA 574 Ca 0.06 0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.01 2qta h ALA 574 Cb 0.11 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 2qta h ALA 574 CO -0.01 -0.00 0.42 0.78 0.00 0.00 0.00 179.25 180.44 2qta h GLY 575 N 0.61 0.88 1.69 0.00 0.00 -0.29 0.19 103.07 106.16 2qta h GLY 575 Ca 0.26 -0.32 -0.15 0.00 0.00 0.00 0.00 47.33 47.12 2qta h GLY 575 CO -0.17 0.30 -0.61 0.00 0.00 0.00 0.00 176.54 176.07 2qta h SER 577 N 0.24 0.51 -0.86 0.00 0.02 -0.33 -0.84 113.55 112.29 2qta h SER 577 Ca -0.01 -0.40 0.06 0.00 -0.84 0.00 0.00 61.79 60.60 2qta h SER 577 Cb 1.12 -0.14 -0.06 0.00 0.14 0.00 0.00 62.40 63.46 2qta h SER 577 CO 0.10 0.80 0.54 -0.25 -1.14 0.00 0.00 176.83 176.88 2qta h TRP 578 N 0.22 0.99 -0.57 3.45 7.01 -0.46 -0.79 115.95 125.81 2qta h TRP 578 Ca 0.05 0.03 -0.09 0.00 2.11 0.00 0.00 58.89 60.99 2qta h TRP 578 Cb 0.61 -0.32 -0.02 0.00 -2.10 0.00 0.00 29.16 27.32 2qta h TRP 578 CO 0.06 0.52 -0.02 1.25 -2.79 0.00 0.00 178.44 177.46 2qta h LEU 579 N 0.99 0.97 -0.64 0.65 5.85 -0.70 0.24 115.31 122.67 2qta h LEU 579 Ca 0.37 -0.27 -0.07 0.00 0.84 0.00 0.00 57.88 58.75 2qta h LEU 579 Cb 0.14 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 40.89 2qta h LEU 579 CO -0.16 1.04 0.14 0.00 -0.34 0.00 0.00 178.44 179.11 2qta h ALA 580 N 1.06 0.85 -0.17 1.25 0.00 -0.58 -2.34 119.26 119.32 2qta h ALA 580 Ca 0.16 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 2qta h ALA 580 Cb 0.55 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2qta h ALA 580 CO 0.03 0.58 -0.03 0.00 0.00 0.00 0.00 179.25 179.82 2qta h ALA 581 N 1.05 0.24 0.00 0.00 0.00 -0.88 -2.39 119.26 117.28 2qta h ALA 581 Ca 0.20 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2qta h ALA 581 Cb 0.38 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2qta h ALA 581 CO 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 179.25 179.25 2qta n ALA 582 N -2.35 1.27 -0.08 0.00 0.00 0.82 -2.43 120.51 117.74 2qta n ALA 582 Ca -0.05 0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.47 2qta n ALA 582 Cb 0.26 -1.23 0.00 0.00 0.00 0.00 0.00 19.45 18.48 2qta n ALA 582 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2qta n THR 583 N -1.91 0.65 0.25 0.00 -2.24 -0.89 -1.52 114.28 108.62 2qta n THR 583 Ca 0.01 -0.78 0.08 0.00 -2.27 0.00 0.00 64.05 61.09 2qta n THR 583 Cb 0.09 0.70 0.64 0.00 -2.10 0.00 0.00 70.33 69.66 2qta n THR 583 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 2qta h SER 584 N 0.00 0.00 -0.35 3.42 0.87 -1.08 -0.94 113.55 115.47 2qta h SER 584 Ca 0.00 0.00 0.05 0.00 -1.23 0.00 0.00 61.79 60.61 2qta h SER 584 Cb 0.39 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.33 2qta h SER 584 CO 0.00 0.08 0.24 0.10 -0.53 0.00 0.00 176.83 176.71 2qta h TYR 585 N 0.00 0.27 0.00 2.24 -0.00 -1.76 -0.56 116.97 117.16 2qta h TYR 585 Ca -0.00 0.01 -0.17 0.00 0.00 0.00 0.00 58.73 58.56 2qta h TYR 585 Cb 0.15 -0.09 -0.03 0.00 0.00 0.00 0.00 36.73 36.76 2qta h TYR 585 CO 0.00 0.15 -1.24 0.45 -0.00 0.00 0.00 178.16 177.52 2qta n SER 586 N -4.48 1.88 -0.35 0.10 2.88 -0.76 -3.17 113.62 109.72 2qta n SER 586 Ca 0.04 0.46 0.01 0.00 -1.33 0.00 0.00 58.87 58.05 2qta n SER 586 Cb 0.22 -0.87 0.16 0.00 -0.75 0.00 0.00 64.21 62.96 2qta n SER 586 CO 0.00 0.00 0.00 0.74 -1.23 0.00 0.00 175.04 174.55 2qta h THR 587 N -1.00 1.08 0.00 2.46 2.02 -1.17 -3.20 112.91 113.10 2qta h THR 587 Ca -0.26 -0.38 0.00 0.00 0.77 0.00 0.00 66.41 66.54 2qta h THR 587 Cb 1.08 -0.13 0.00 0.00 -1.74 0.00 0.00 68.15 67.36 2qta h THR 587 CO -0.16 0.20 0.00 0.59 0.37 0.00 0.00 175.52 176.53 2qta n ASN 588 N -4.54 1.73 -4.01 4.18 3.02 -0.26 -4.10 115.26 111.29 2qta n ASN 588 Ca 0.14 -1.78 -0.32 0.00 -0.03 0.00 0.00 54.58 52.59 2qta n ASN 588 Cb 0.17 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.34 2qta n ASN 588 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 2qta n ASN 589 N -0.39 -4.20 -3.51 6.41 5.15 -1.09 -4.75 115.26 112.87 2qta n ASN 589 Ca 0.00 -0.85 -0.29 0.00 -0.60 0.00 0.00 54.58 52.84 2qta n ASN 589 Cb 0.22 -3.38 -0.13 0.00 -0.53 0.00 0.00 39.78 35.95 2qta n ASN 589 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 2qta s LEU 590 N -7.23 1.13 -0.06 1.20 2.96 -0.96 -4.76 118.68 110.96 2qta s LEU 590 Ca 0.69 -2.06 -0.31 0.00 -0.22 0.00 0.00 54.13 52.23 2qta s LEU 590 Cb -0.36 -0.47 -0.09 0.00 0.50 0.00 0.00 46.19 45.76 2qta s LEU 590 CO 0.85 -0.33 1.99 -0.81 -1.32 0.00 0.00 176.35 176.73 2qta n PRO 591 N 4.23 2.43 -4.36 0.98 -0.04 -1.26 -3.08 135.00 133.90 2qta n PRO 591 Ca 0.08 0.86 -0.29 0.00 -0.04 0.00 0.00 63.50 64.11 2qta n PRO 591 Cb 0.38 -2.90 -0.12 0.00 -0.04 0.00 0.00 33.50 30.81 2qta n PRO 591 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 2qta s MET 592 N 4.71 1.68 -0.41 0.54 -1.94 -1.26 -4.86 119.30 117.77 2qta s MET 592 Ca 0.93 -1.22 0.03 0.00 -1.71 0.00 0.00 55.69 53.72 2qta s MET 592 Cb -0.52 -2.05 0.11 0.00 2.01 0.00 0.00 34.83 34.38 2qta s MET 592 CO 0.45 0.47 0.15 0.42 -0.01 0.00 0.00 175.02 176.50 2qta s ILE 593 N -1.10 2.08 0.08 2.53 1.01 -0.05 -4.40 121.20 121.35 2qta s ILE 593 Ca 0.16 -2.57 -0.24 0.00 0.00 0.00 0.00 60.65 58.01 2qta s ILE 593 Cb -0.10 -2.50 -0.06 0.00 0.01 0.00 0.00 42.46 39.81 2qta s ILE 593 CO 0.08 -0.71 0.73 -2.16 0.00 0.00 0.00 174.94 172.88 2qta s PRO 594 N 0.54 4.47 -0.27 2.79 0.04 -1.26 -1.03 135.00 140.27 2qta s PRO 594 Ca 0.14 1.02 0.02 0.00 0.04 0.00 0.00 61.00 62.22 2qta s PRO 594 Cb -0.22 -3.31 0.06 0.00 0.04 0.00 0.00 34.50 31.07 2qta s PRO 594 CO -0.07 0.43 -0.09 -0.06 0.04 0.00 0.00 177.00 177.26 2qta s PHE 595 N -0.57 3.29 -0.32 0.56 0.40 -0.22 -1.57 117.98 119.56 2qta s PHE 595 Ca 0.36 -2.30 -0.11 0.00 -0.60 0.00 0.00 56.93 54.28 2qta s PHE 595 Cb -0.21 -2.00 -0.01 0.00 0.51 0.00 0.00 43.02 41.31 2qta s PHE 595 CO 0.23 -0.87 0.18 -0.47 0.70 0.00 0.00 175.22 174.99 2qta s TYR 596 N 1.11 3.20 -0.09 0.36 5.04 -1.01 -0.53 117.35 125.42 2qta s TYR 596 Ca -0.08 -0.39 0.01 0.00 -2.44 0.00 0.00 57.07 54.18 2qta s TYR 596 Cb -0.20 -2.40 -0.02 0.00 0.35 0.00 0.00 41.96 39.69 2qta s TYR 596 CO -0.05 -0.40 -0.13 -1.50 -1.34 0.00 0.00 175.55 172.13 2qta s ILE 597 N 1.66 3.08 0.38 3.14 2.07 -0.86 -1.41 121.20 129.27 2qta s ILE 597 Ca 0.05 -0.68 -0.13 0.00 -1.41 0.00 0.00 60.65 58.48 2qta s ILE 597 Cb -0.17 -2.25 0.05 0.00 0.13 0.00 0.00 42.46 40.21 2qta s ILE 597 CO 0.08 0.55 0.74 -0.72 -1.91 0.00 0.00 174.94 173.68 2qta s TYR 598 N -0.15 0.30 -0.06 3.50 -0.85 -1.13 -4.27 117.35 114.69 2qta s TYR 598 Ca -0.01 -0.91 -0.30 0.00 -0.52 0.00 0.00 57.07 55.34 2qta s TYR 598 Cb -0.13 0.68 -0.04 0.00 0.38 0.00 0.00 41.96 42.84 2qta s TYR 598 CO 0.03 -1.51 1.45 0.71 -1.52 0.00 0.00 175.55 174.71 2qta s TYR 599 N -2.38 2.56 0.41 -3.49 1.51 -1.26 -0.71 117.35 113.99 2qta s TYR 599 Ca 0.18 0.66 0.18 0.00 -1.01 0.00 0.00 57.07 57.08 2qta s TYR 599 Cb -0.04 -3.71 1.09 0.00 -0.11 0.00 0.00 41.96 39.19 2qta s TYR 599 CO 0.13 -2.73 1.82 0.66 -1.11 0.00 0.00 175.55 174.32 2qta h SER 600 N 8.49 0.42 -0.28 2.29 4.64 -1.28 0.17 113.55 128.01 2qta h SER 600 Ca -0.35 0.06 0.04 0.00 -0.47 0.00 0.00 61.79 61.06 2qta h SER 600 Cb 1.16 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 63.22 2qta h SER 600 CO 0.94 0.13 0.19 -0.03 -0.87 0.00 0.00 176.83 177.19 2qta h MET 601 N 0.40 0.20 -0.89 4.77 1.85 -1.84 -1.99 114.93 117.44 2qta h MET 601 Ca 0.53 -0.01 -0.22 0.00 -0.61 0.00 0.00 59.70 59.38 2qta h MET 601 Cb 1.33 -0.05 -0.13 0.00 0.43 0.00 0.00 31.60 33.19 2qta h MET 601 CO -0.22 0.14 0.28 1.19 -0.40 0.00 0.00 176.91 177.89 2qta n PHE 602 N -4.49 1.89 0.00 1.39 3.72 0.60 -4.25 117.46 116.32 2qta n PHE 602 Ca 0.02 -1.08 0.00 0.00 -0.05 0.00 0.00 57.45 56.34 2qta n PHE 602 Cb 0.20 -0.61 0.00 0.00 -0.94 0.00 0.00 39.48 38.13 2qta n PHE 602 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2qta n GLY 603 N -0.23 0.52 0.41 1.37 0.00 -0.75 -4.44 105.19 102.07 2qta n GLY 603 Ca 0.33 0.00 0.22 0.00 0.00 0.00 0.00 46.02 46.57 2qta n GLY 603 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2qta h PHE 604 N 0.00 0.61 -0.75 1.61 -1.00 -1.85 0.32 116.94 115.88 2qta h PHE 604 Ca 0.00 0.02 -0.04 0.00 2.81 0.00 0.00 57.97 60.76 2qta h PHE 604 Cb 0.00 -0.18 -0.03 0.00 3.61 0.00 0.00 35.95 39.35 2qta h PHE 604 CO 0.00 0.09 0.33 0.37 -1.61 0.00 0.00 178.31 177.48 2qta h GLN 605 N 0.39 1.11 0.05 1.51 4.15 -1.87 0.27 115.11 120.72 2qta h GLN 605 Ca 0.56 -0.18 -0.33 0.00 0.77 0.00 0.00 58.65 59.47 2qta h GLN 605 Cb 1.44 -0.19 -0.04 0.00 0.21 0.00 0.00 27.48 28.90 2qta h GLN 605 CO -0.26 0.89 -1.89 -2.13 -1.93 0.00 0.00 178.83 173.51 2qta n ARG 606 N -4.35 0.69 -0.83 1.69 3.00 -0.05 -4.47 116.66 112.33 2qta n ARG 606 Ca 0.06 0.26 0.05 0.00 -0.00 0.00 0.00 57.85 58.23 2qta n ARG 606 Cb 0.16 -1.73 0.16 0.00 0.00 0.00 0.00 32.46 31.05 2qta n ARG 606 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.63 178.07 2qta n ILE 607 N -3.21 1.68 -0.08 5.15 -5.35 0.92 -4.85 119.36 113.62 2qta n ILE 607 Ca -0.25 -2.71 0.14 0.00 -0.27 0.00 0.00 62.75 59.66 2qta n ILE 607 Cb 1.05 0.06 0.53 0.00 -1.74 0.00 0.00 39.64 39.54 2qta n ILE 607 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 2qta h GLY 608 N 1.01 0.51 2.00 3.28 0.00 -1.06 -0.30 103.07 108.51 2qta h GLY 608 Ca -0.05 -0.14 -0.13 0.00 0.00 0.00 0.00 47.33 47.01 2qta h GLY 608 CO 0.03 0.08 -0.60 -1.80 0.00 0.00 0.00 176.54 174.24 2qta h ASP 609 N 0.34 0.00 0.13 0.19 3.58 -1.89 -1.39 116.42 117.39 2qta h ASP 609 Ca 0.29 -0.00 -0.20 0.00 0.42 0.00 0.00 57.03 57.53 2qta h ASP 609 Cb 0.66 -0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.71 2qta h ASP 609 CO -0.07 0.60 -0.77 0.25 -2.88 0.00 0.00 179.24 176.37 2qta h LEU 610 N 0.00 0.64 -0.93 2.28 5.85 -1.50 -1.50 115.31 120.16 2qta h LEU 610 Ca -0.01 -0.43 -0.05 0.00 0.84 0.00 0.00 57.88 58.23 2qta h LEU 610 Cb 1.07 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.87 2qta h LEU 610 CO 0.08 1.20 0.22 0.00 -0.34 0.00 0.00 178.44 179.60 2qta h TRP 612 N 0.97 0.54 -0.51 0.00 2.91 -1.18 -2.66 115.95 116.01 2qta h TRP 612 Ca 0.22 -0.10 -0.00 0.00 1.13 0.00 0.00 58.89 60.14 2qta h TRP 612 Cb 0.25 -0.14 -0.03 0.00 -0.51 0.00 0.00 29.16 28.74 2qta h TRP 612 CO 0.02 0.66 0.31 0.00 -1.03 0.00 0.00 178.44 178.41 2qta h ALA 613 N 0.80 1.59 -0.31 2.65 0.00 -0.64 -1.73 119.26 121.62 2qta h ALA 613 Ca 0.07 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 2qta h ALA 613 Cb 0.47 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 2qta h ALA 613 CO 0.02 0.36 -0.08 0.00 0.00 0.00 0.00 179.25 179.55 2qta h ALA 614 N 1.65 1.27 -0.46 0.00 0.00 -0.09 0.89 119.26 122.51 2qta h ALA 614 Ca 0.19 -0.25 -0.10 0.00 0.00 0.00 0.00 54.91 54.75 2qta h ALA 614 Cb -0.04 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2qta h ALA 614 CO -0.04 0.48 -0.08 0.78 0.00 0.00 0.00 179.25 180.39 2qta h GLY 615 N 0.90 0.95 1.02 0.00 0.00 -1.00 -0.52 103.07 104.42 2qta h GLY 615 Ca 0.09 -0.76 -0.01 0.00 0.00 0.00 0.00 47.33 46.65 2qta h GLY 615 CO 0.02 0.70 0.54 -1.80 0.00 0.00 0.00 176.54 176.00 2qta h ASP 616 N 0.72 1.12 0.00 0.19 3.58 -0.69 -2.10 116.42 119.24 2qta h ASP 616 Ca 0.12 -0.08 0.00 0.00 0.42 0.00 0.00 57.03 57.49 2qta h ASP 616 Cb 0.62 -0.28 0.00 0.00 1.72 0.00 0.00 39.33 41.39 2qta h ASP 616 CO 0.04 0.87 0.00 1.67 -2.88 0.00 0.00 179.24 178.94 2qta n GLN 617 N -4.36 0.97 -3.55 0.28 7.27 0.24 -1.11 117.38 117.12 2qta n GLN 617 Ca 0.10 0.00 -0.23 0.00 0.07 0.00 0.00 57.00 56.94 2qta n GLN 617 Cb 0.07 -1.32 0.08 0.00 2.41 0.00 0.00 30.24 31.48 2qta n GLN 617 CO 0.00 0.00 0.00 1.04 0.07 0.00 0.00 177.06 178.17 2qta n GLN 618 N -0.82 -7.64 -1.92 3.69 1.13 -0.72 -4.93 117.38 106.17 2qta n GLN 618 Ca 0.15 0.80 -0.41 0.00 -1.94 0.00 0.00 57.00 55.60 2qta n GLN 618 Cb 0.07 -5.75 -0.01 0.00 0.11 0.00 0.00 30.24 24.66 2qta n GLN 618 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2qta s ALA 619 N -3.31 3.56 -0.28 -1.58 0.00 -0.28 -4.84 121.76 115.04 2qta s ALA 619 Ca 0.55 1.46 0.01 0.00 0.00 0.00 0.00 51.96 53.98 2qta s ALA 619 Cb -0.24 -3.57 0.08 0.00 0.00 0.00 0.00 23.12 19.39 2qta s ALA 619 CO 0.70 -0.90 0.01 1.03 0.00 0.00 0.00 175.76 176.60 2qta s ARG 620 N -1.79 1.33 0.02 0.00 0.52 -0.57 -3.65 118.95 114.82 2qta s ARG 620 Ca 0.53 -1.19 -0.04 0.00 -0.52 0.00 0.00 55.73 54.50 2qta s ARG 620 Cb -0.44 -2.57 0.01 0.00 0.52 0.00 0.00 34.95 32.48 2qta s ARG 620 CO 0.58 -0.77 0.18 0.41 0.02 0.00 0.00 175.30 175.71 2qta n GLY 621 N 4.63 1.05 3.18 -3.53 0.00 -1.26 -4.46 105.19 104.80 2qta n GLY 621 Ca -0.06 -0.94 -0.31 0.00 0.00 0.00 0.00 46.02 44.71 2qta n GLY 621 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2qta s PHE 622 N -4.82 2.46 -0.40 1.61 0.40 -0.61 -0.76 117.98 115.87 2qta s PHE 622 Ca 0.04 -1.07 -0.15 0.00 -0.60 0.00 0.00 56.93 55.15 2qta s PHE 622 Cb -0.00 -1.67 0.01 0.00 0.51 0.00 0.00 43.02 41.87 2qta s PHE 622 CO 0.01 -0.45 0.32 -0.51 0.70 0.00 0.00 175.22 175.28 2qta s LEU 623 N 0.50 4.96 -0.43 -0.37 1.43 0.32 -2.40 118.68 122.69 2qta s LEU 623 Ca -0.15 -0.77 -0.17 0.00 -1.03 0.00 0.00 54.13 52.01 2qta s LEU 623 Cb -0.17 -2.20 0.03 0.00 0.03 0.00 0.00 46.19 43.88 2qta s LEU 623 CO 0.06 -0.44 0.43 -0.63 0.23 0.00 0.00 176.35 176.00 2qta s ILE 624 N 1.77 5.11 -0.79 -0.59 -1.09 -0.50 -0.69 121.20 124.42 2qta s ILE 624 Ca 0.07 -0.50 -0.22 0.00 -2.23 0.00 0.00 60.65 57.76 2qta s ILE 624 Cb -0.18 -4.06 0.08 0.00 -1.58 0.00 0.00 42.46 36.71 2qta s ILE 624 CO 0.11 -0.47 1.12 -0.83 -1.23 0.00 0.00 174.94 173.64 2qta s GLY 625 N 1.98 1.44 0.95 6.18 0.00 -0.02 -2.83 107.32 115.02 2qta s GLY 625 Ca 0.10 -2.09 -0.15 0.00 0.00 0.00 0.00 44.72 42.59 2qta s GLY 625 CO 0.12 2.21 1.20 -0.32 0.00 0.00 0.00 173.10 176.32 2qta s GLY 626 N 3.85 1.65 -1.64 0.20 0.00 0.11 -0.63 107.32 110.86 2qta s GLY 626 Ca 0.30 -0.84 -0.08 0.00 0.00 0.00 0.00 44.72 44.10 2qta s GLY 626 CO 0.03 -0.18 0.24 -1.30 0.00 0.00 0.00 173.10 171.89 2qta n THR 627 N -3.82 -0.90 -2.56 0.90 -2.24 -1.15 -0.96 114.28 103.55 2qta n THR 627 Ca 0.11 -0.34 -0.22 0.00 -2.27 0.00 0.00 64.05 61.33 2qta n THR 627 Cb 0.60 -1.03 0.05 0.00 -2.10 0.00 0.00 70.33 67.84 2qta n THR 627 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2qta s SER 628 N -4.02 5.12 0.00 3.42 1.04 -0.74 -4.55 113.70 113.98 2qta s SER 628 Ca 0.27 0.03 0.00 0.00 0.48 0.00 0.00 55.95 56.73 2qta s SER 628 Cb -0.16 -0.83 0.00 0.00 0.10 0.00 0.00 66.02 65.13 2qta s SER 628 CO 1.00 -1.28 0.00 0.61 0.98 0.00 0.00 173.24 174.55 2qta n GLY 629 N -2.48 -0.13 0.09 7.32 0.00 -0.61 -4.42 105.19 104.97 2qta n GLY 629 Ca 0.09 -1.28 -0.10 0.00 0.00 0.00 0.00 46.02 44.73 2qta n GLY 629 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2qta h ARG 630 N 0.00 -0.02 -0.00 1.61 9.65 -0.53 -3.06 114.38 122.03 2qta h ARG 630 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 2qta h ARG 630 Cb 0.00 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.58 2qta h ARG 630 CO 0.00 -0.01 -0.26 0.25 2.80 0.00 0.00 179.97 182.75 2qta n THR 631 N -5.17 0.00 0.02 0.20 -2.24 -1.26 -4.33 114.28 101.50 2qta n THR 631 Ca -0.04 -0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.61 2qta n THR 631 Cb 0.10 -0.11 -0.14 0.00 -2.10 0.00 0.00 70.33 68.08 2qta n THR 631 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 2qta h THR 632 N 0.02 1.05 -1.95 4.28 2.02 -1.77 -3.31 112.91 113.25 2qta h THR 632 Ca 0.00 -2.79 -0.78 0.00 0.77 0.00 0.00 66.41 63.61 2qta h THR 632 Cb 0.50 2.62 -0.21 0.00 -1.74 0.00 0.00 68.15 69.31 2qta h THR 632 CO 0.00 0.73 1.55 -0.11 0.37 0.00 0.00 175.52 178.06 2qta n LEU 633 N -3.30 7.09 -0.30 2.58 7.94 -1.24 -4.85 117.00 124.93 2qta n LEU 633 Ca -0.16 -5.03 0.00 0.00 -1.11 0.00 0.00 56.01 49.71 2qta n LEU 633 Cb 1.03 -1.32 0.14 0.00 0.53 0.00 0.00 43.42 43.80 2qta n LEU 633 CO 0.47 1.78 1.18 -0.55 -1.11 0.00 0.00 177.39 179.17 2qta h ASN 634 N 5.03 0.81 1.65 1.96 -1.07 -1.83 -3.14 115.58 118.98 2qta h ASN 634 Ca 0.45 0.02 0.00 0.00 0.07 0.00 0.00 56.30 56.83 2qta h ASN 634 Cb 0.48 -0.15 0.00 0.00 -2.07 0.00 0.00 38.32 36.58 2qta h ASN 634 CO 1.41 0.52 -0.29 1.23 0.07 0.00 0.00 177.43 180.37 2qta h GLY 635 N 0.94 0.00 1.93 9.14 0.00 -1.87 -1.86 103.07 111.35 2qta h GLY 635 Ca 0.37 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.60 2qta h GLY 635 CO -0.17 0.00 -0.41 0.83 0.00 0.00 0.00 176.54 176.78 2qta h GLU 636 N 0.00 0.08 0.00 4.80 4.39 -1.86 -3.41 114.58 118.58 2qta h GLU 636 Ca 0.00 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.66 2qta h GLU 636 Cb 0.97 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.62 2qta h GLU 636 CO 0.00 0.48 0.00 0.41 -1.16 0.00 0.00 179.01 178.74 2qta n GLY 637 N -0.28 -1.25 0.23 -3.84 0.00 -1.26 -4.58 105.19 94.21 2qta n GLY 637 Ca -0.02 -1.38 0.01 0.00 0.00 0.00 0.00 46.02 44.63 2qta n GLY 637 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2qta h LEU 638 N 0.00 -0.21 -1.52 0.99 6.46 -1.84 0.01 115.31 119.21 2qta h LEU 638 Ca 0.00 0.14 0.00 0.00 -0.12 0.00 0.00 57.88 57.90 2qta h LEU 638 Cb 0.00 0.24 0.00 0.00 -0.73 0.00 0.00 40.66 40.17 2qta h LEU 638 CO 0.00 -0.09 0.00 0.00 -0.62 0.00 0.00 178.44 177.73 2qta n GLN 639 N -5.24 1.97 -0.01 1.25 6.02 -1.26 -4.15 117.38 115.96 2qta n GLN 639 Ca 0.09 -1.49 -0.01 0.00 -0.01 0.00 0.00 57.00 55.58 2qta n GLN 639 Cb 0.34 -1.38 -0.01 0.00 1.02 0.00 0.00 30.24 30.22 2qta n GLN 639 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 2qta n HIS 640 N 0.70 0.00 -2.33 1.08 8.25 -0.83 -4.93 115.22 117.17 2qta n HIS 640 Ca 0.16 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.20 2qta n HIS 640 Cb 0.38 -0.06 -0.03 0.00 1.12 0.00 0.00 29.99 31.40 2qta n HIS 640 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 2qta s GLU 641 N -2.03 3.23 -0.54 -0.41 2.02 -0.07 -4.55 118.70 116.35 2qta s GLU 641 Ca -0.01 0.53 -0.21 0.00 0.02 0.00 0.00 54.97 55.30 2qta s GLU 641 Cb 0.00 -4.16 0.06 0.00 0.10 0.00 0.00 34.13 30.13 2qta s GLU 641 CO 0.05 -2.03 0.75 0.34 0.02 0.00 0.00 175.26 174.40 2qta s ASP 642 N 4.95 6.25 -0.20 -0.19 2.15 -1.26 -4.71 116.67 123.67 2qta s ASP 642 Ca 0.56 -0.77 0.14 0.00 0.43 0.00 0.00 52.55 52.91 2qta s ASP 642 Cb -0.12 -2.35 0.43 0.00 -0.30 0.00 0.00 42.92 40.59 2qta s ASP 642 CO 0.25 -1.05 1.31 0.61 -0.17 0.00 0.00 175.17 176.12 2qta n GLY 643 N 5.17 4.73 0.00 2.66 0.00 -1.26 -1.57 105.19 114.92 2qta n GLY 643 Ca -0.04 -1.17 0.00 0.00 0.00 0.00 0.00 46.02 44.81 2qta n GLY 643 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2qta n HIS 644 N -1.06 0.00 -0.07 1.61 1.44 -1.26 -0.87 115.22 115.00 2qta n HIS 644 Ca 0.22 0.00 0.09 0.00 -2.01 0.00 0.00 57.72 56.02 2qta n HIS 644 Cb 0.82 0.04 0.46 0.00 0.12 0.00 0.00 29.99 31.43 2qta n HIS 644 CO 0.00 0.00 0.00 0.66 -2.81 0.00 0.00 176.34 174.19 2qta h SER 645 N 0.00 0.44 0.45 4.39 4.64 -1.91 0.61 113.55 122.17 2qta h SER 645 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 2qta h SER 645 Cb 0.59 -0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 62.59 2qta h SER 645 CO 0.00 0.29 -0.09 0.45 -0.87 0.00 0.00 176.83 176.60 2qta h HIS 646 N 0.50 0.00 0.03 4.77 3.86 -1.96 0.47 115.15 122.81 2qta h HIS 646 Ca 0.24 0.00 -0.24 0.00 -1.16 0.00 0.00 60.37 59.21 2qta h HIS 646 Cb 0.30 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.78 2qta h HIS 646 CO -0.00 0.09 -1.00 0.82 0.86 0.00 0.00 177.93 178.70 2qta h ILE 647 N 0.00 1.41 -0.13 2.45 1.08 -1.24 -1.50 117.51 119.57 2qta h ILE 647 Ca -0.00 -2.53 -0.18 0.00 -0.39 0.00 0.00 64.86 61.75 2qta h ILE 647 Cb 0.34 2.51 0.01 0.00 -3.07 0.00 0.00 36.82 36.61 2qta h ILE 647 CO 0.01 0.75 -0.63 1.56 -0.69 0.00 0.00 178.15 179.16 2qta h GLN 648 N 0.21 0.66 -0.02 2.37 4.20 -0.93 -3.28 115.11 118.32 2qta h GLN 648 Ca -0.09 -0.53 -0.09 0.00 0.06 0.00 0.00 58.65 57.99 2qta h GLN 648 Cb 1.66 0.11 -0.01 0.00 0.30 0.00 0.00 27.48 29.53 2qta h GLN 648 CO 0.17 1.15 -0.40 0.66 -0.67 0.00 0.00 178.83 179.75 2qta h SER 649 N 0.33 0.04 0.48 1.46 4.64 -0.08 -2.64 113.55 117.78 2qta h SER 649 Ca -0.04 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 2qta h SER 649 Cb 1.27 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 2qta h SER 649 CO 0.13 0.44 0.00 0.00 -0.87 0.00 0.00 176.83 176.53 2qta n LEU 650 N -4.06 0.19 0.06 5.97 -0.00 -0.57 -1.87 117.00 116.72 2qta n LEU 650 Ca -0.02 0.55 0.13 0.00 -0.00 0.00 0.00 56.01 56.67 2qta n LEU 650 Cb 0.44 -0.53 0.48 0.00 -0.00 0.00 0.00 43.42 43.80 2qta n LEU 650 CO 0.40 -0.39 0.89 0.35 -0.00 0.00 0.00 177.39 178.64 2qta n THR 651 N -1.71 0.48 -3.26 1.47 -2.24 -0.99 -4.64 114.28 103.38 2qta n THR 651 Ca 0.03 -0.06 -0.42 0.00 -2.27 0.00 0.00 64.05 61.33 2qta n THR 651 Cb 0.16 -0.69 -0.08 0.00 -2.10 0.00 0.00 70.33 67.62 2qta n THR 651 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2qta s ILE 652 N -3.09 5.02 0.28 2.28 1.01 -0.78 -4.96 121.20 120.96 2qta s ILE 652 Ca 0.10 0.06 0.02 0.00 0.00 0.00 0.00 60.65 60.84 2qta s ILE 652 Cb 0.14 -4.01 0.27 0.00 0.01 0.00 0.00 42.46 38.87 2qta s ILE 652 CO 0.51 -0.32 1.74 -0.65 0.00 0.00 0.00 174.94 176.22 2qta h PRO 653 N 8.61 0.57 -0.54 2.79 0.11 -1.87 -2.29 132.00 139.37 2qta h PRO 653 Ca -0.27 -0.03 -0.12 0.00 0.11 0.00 0.00 66.00 65.69 2qta h PRO 653 Cb 1.12 -0.13 -0.07 0.00 0.11 0.00 0.00 31.00 32.03 2qta h PRO 653 CO 0.79 0.37 0.11 0.27 -0.21 0.00 0.00 178.00 179.34 2qta n ASN 654 N -4.90 4.48 -4.63 -2.05 6.94 -1.26 -4.87 115.26 108.96 2qta n ASN 654 Ca 0.20 -3.18 -0.35 0.00 -0.02 0.00 0.00 54.58 51.23 2qta n ASN 654 Cb 0.54 -0.67 -0.10 0.00 -2.36 0.00 0.00 39.78 37.20 2qta n ASN 654 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2qta s ILE 656 N 0.63 5.00 -0.10 0.00 -1.09 0.18 -4.89 121.20 120.93 2qta s ILE 656 Ca 0.05 -0.09 -0.01 0.00 -2.23 0.00 0.00 60.65 58.37 2qta s ILE 656 Cb -0.13 -3.45 -0.03 0.00 -1.58 0.00 0.00 42.46 37.27 2qta s ILE 656 CO 0.01 0.17 -0.06 -0.44 -1.23 0.00 0.00 174.94 173.39 2qta s SER 657 N 1.70 4.63 0.04 3.58 0.01 -1.26 -1.38 113.70 121.02 2qta s SER 657 Ca 0.06 -0.09 0.04 0.00 1.31 0.00 0.00 55.95 57.27 2qta s SER 657 Cb -0.16 -1.43 -0.02 0.00 0.21 0.00 0.00 66.02 64.61 2qta s SER 657 CO 0.09 0.28 -0.13 -0.31 0.41 0.00 0.00 173.24 173.58 2qta s TYR 658 N -0.28 1.10 -0.53 2.43 2.02 -0.45 -4.54 117.35 117.10 2qta s TYR 658 Ca 0.04 -0.36 0.07 0.00 -0.37 0.00 0.00 57.07 56.45 2qta s TYR 658 Cb -0.13 -0.65 0.25 0.00 -0.40 0.00 0.00 41.96 41.03 2qta s TYR 658 CO 0.02 0.02 0.63 -3.47 -1.57 0.00 0.00 175.55 171.18 2qta n ASP 659 N 1.87 2.06 -4.77 2.29 2.03 0.06 -1.86 116.55 118.23 2qta n ASP 659 Ca -0.19 -3.08 -0.36 0.00 0.52 0.00 0.00 54.79 51.68 2qta n ASP 659 Cb 0.55 -0.66 0.01 0.00 -0.72 0.00 0.00 41.12 40.30 2qta n ASP 659 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2qta s PRO 660 N -1.81 3.44 -0.06 -0.67 0.04 -1.26 -0.98 135.00 133.70 2qta s PRO 660 Ca 0.37 1.79 0.11 0.00 0.04 0.00 0.00 61.00 63.31 2qta s PRO 660 Cb 0.15 -2.19 -0.23 0.00 0.04 0.00 0.00 34.50 32.26 2qta s PRO 660 CO -0.06 -0.82 0.60 0.00 0.04 0.00 0.00 177.00 176.76 2qta n ALA 661 N -0.97 1.45 -2.47 8.56 0.00 -1.26 -3.79 120.51 122.04 2qta n ALA 661 Ca 0.10 -0.79 -0.22 0.00 0.00 0.00 0.00 53.44 52.53 2qta n ALA 661 Cb 0.49 -0.80 -0.11 0.00 0.00 0.00 0.00 19.45 19.03 2qta n ALA 661 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2qta s TYR 662 N -2.59 1.81 0.16 0.00 2.02 -1.26 -4.78 117.35 112.71 2qta s TYR 662 Ca -0.06 -0.46 -0.16 0.00 -0.37 0.00 0.00 57.07 56.01 2qta s TYR 662 Cb 0.08 -0.92 0.08 0.00 -0.40 0.00 0.00 41.96 40.80 2qta s TYR 662 CO 0.82 0.31 1.71 0.00 -1.57 0.00 0.00 175.55 176.82 2qta h ALA 663 N 3.39 0.35 0.00 3.71 0.00 -1.88 -2.80 119.26 122.02 2qta h ALA 663 Ca -0.43 0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.50 2qta h ALA 663 Cb 1.20 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.12 2qta h ALA 663 CO 0.49 -0.37 -0.32 0.10 0.00 0.00 0.00 179.25 179.15 2qta h TYR 664 N 0.14 0.00 -0.43 0.00 -0.00 -1.83 -2.68 116.97 112.17 2qta h TYR 664 Ca 0.17 0.00 -0.14 0.00 0.00 0.00 0.00 58.73 58.76 2qta h TYR 664 Cb 0.23 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 36.95 2qta h TYR 664 CO -0.22 0.32 -0.30 0.93 -0.00 0.00 0.00 178.16 178.89 2qta h GLU 665 N 0.00 0.95 -0.17 0.10 5.08 -1.82 -1.98 114.58 116.73 2qta h GLU 665 Ca -0.00 -0.45 0.02 0.00 -1.00 0.00 0.00 59.36 57.93 2qta h GLU 665 Cb 0.62 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.84 2qta h GLU 665 CO 0.04 1.11 0.03 0.28 -1.00 0.00 0.00 179.01 179.47 2qta h VAL 666 N 0.79 0.92 -0.25 3.13 2.07 -1.37 0.13 116.25 121.68 2qta h VAL 666 Ca 0.09 -0.03 0.01 0.00 0.82 0.00 0.00 66.70 67.59 2qta h VAL 666 Cb 0.88 0.81 -0.02 0.00 -1.52 0.00 0.00 31.29 31.44 2qta h VAL 666 CO 0.08 0.02 0.13 0.00 0.02 0.00 0.00 177.57 177.81 2qta h ALA 667 N 1.12 0.30 -0.59 1.67 0.00 -1.38 0.28 119.26 120.66 2qta h ALA 667 Ca 0.08 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 2qta h ALA 667 Cb 0.07 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 2qta h ALA 667 CO -0.10 -0.27 0.23 0.28 0.00 0.00 0.00 179.25 179.39 2qta h VAL 668 N 0.27 1.23 -0.49 0.00 2.07 -1.09 -0.68 116.25 117.56 2qta h VAL 668 Ca 0.10 -0.72 -0.04 0.00 0.82 0.00 0.00 66.70 66.87 2qta h VAL 668 Cb 0.02 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 30.37 2qta h VAL 668 CO -0.07 0.28 0.16 0.40 0.02 0.00 0.00 177.57 178.36 2qta h ILE 669 N 0.82 1.22 -0.32 4.57 2.04 -0.41 -1.48 117.51 123.96 2qta h ILE 669 Ca 0.20 -0.73 -0.15 0.00 1.00 0.00 0.00 64.86 65.18 2qta h ILE 669 Cb 0.21 0.79 -0.01 0.00 -0.74 0.00 0.00 36.82 37.07 2qta h ILE 669 CO -0.02 0.27 -0.39 0.24 0.00 0.00 0.00 178.15 178.26 2qta h MET 670 N 0.65 0.76 -0.22 2.37 2.86 -0.77 -1.01 114.93 119.58 2qta h MET 670 Ca 0.16 -0.39 -0.01 0.00 -2.06 0.00 0.00 59.70 57.40 2qta h MET 670 Cb 0.25 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.91 2qta h MET 670 CO -0.01 1.01 0.09 1.25 1.06 0.00 0.00 176.91 180.31 2qta h HIS 671 N 0.62 0.33 -0.42 -0.22 -0.00 -1.03 -1.02 115.15 113.41 2qta h HIS 671 Ca 0.05 -0.02 -0.02 0.00 -0.00 0.00 0.00 60.37 60.38 2qta h HIS 671 Cb 0.93 -0.10 -0.02 0.00 -0.00 0.00 0.00 27.41 28.23 2qta h HIS 671 CO 0.05 0.36 0.20 0.22 -0.00 0.00 0.00 177.93 178.76 2qta h ASP 672 N 0.20 0.55 -0.77 3.26 3.58 -1.20 -0.69 116.42 121.36 2qta h ASP 672 Ca 0.07 -0.13 0.00 0.00 0.42 0.00 0.00 57.03 57.40 2qta h ASP 672 Cb 0.17 -0.14 -0.04 0.00 1.72 0.00 0.00 39.33 41.04 2qta h ASP 672 CO -0.01 0.53 0.49 1.23 -2.88 0.00 0.00 179.24 178.61 2qta h GLY 673 N 0.54 1.09 0.80 -0.78 0.00 -1.06 0.84 103.07 104.49 2qta h GLY 673 Ca 0.14 -0.42 0.03 0.00 0.00 0.00 0.00 47.33 47.08 2qta h GLY 673 CO -0.02 0.41 0.09 -2.00 0.00 0.00 0.00 176.54 175.02 2qta h LEU 674 N 1.04 0.10 -0.16 3.11 5.85 -0.81 -0.78 115.31 123.66 2qta h LEU 674 Ca 0.28 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 59.01 2qta h LEU 674 Cb -0.10 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 40.94 2qta h LEU 674 CO -0.06 0.09 0.06 -0.08 -0.34 0.00 0.00 178.44 178.11 2qta h GLU 675 N 0.21 0.25 -0.10 1.25 4.57 -0.56 -0.32 114.58 119.87 2qta h GLU 675 Ca 0.11 -0.05 0.01 0.00 -1.18 0.00 0.00 59.36 58.25 2qta h GLU 675 Cb 0.08 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 28.62 2qta h GLU 675 CO -0.11 0.35 0.04 0.00 -1.18 0.00 0.00 179.01 178.11 2qta h ARG 676 N 0.10 0.09 0.11 1.92 3.08 -0.60 0.24 114.38 119.32 2qta h ARG 676 Ca 0.05 -0.01 -0.27 0.00 0.07 0.00 0.00 59.98 59.83 2qta h ARG 676 Cb 0.20 -0.02 0.01 0.00 0.08 0.00 0.00 29.97 30.24 2qta h ARG 676 CO -0.00 0.06 -1.19 0.52 -1.07 0.00 0.00 179.97 178.29 2qta h MET 677 N 0.09 0.34 0.00 0.04 2.86 -1.15 0.92 114.93 118.03 2qta h MET 677 Ca 0.04 -0.51 0.00 0.00 -2.06 0.00 0.00 59.70 57.17 2qta h MET 677 Cb 0.02 0.18 0.00 0.00 0.06 0.00 0.00 31.60 31.86 2qta h MET 677 CO -0.04 1.22 0.00 0.66 1.06 0.00 0.00 176.91 179.80 2qta n TYR 678 N -3.62 0.00 -1.88 -0.22 4.01 -0.14 -4.23 117.16 111.09 2qta n TYR 678 Ca -0.09 -0.24 0.00 0.00 -0.16 0.00 0.00 57.90 57.41 2qta n TYR 678 Cb 0.98 -0.02 0.00 0.00 -0.31 0.00 0.00 39.34 39.99 2qta n TYR 678 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2qta n GLY 679 N -0.24 0.48 0.30 2.72 0.00 0.85 -4.63 105.19 104.68 2qta n GLY 679 Ca 0.00 -1.90 0.10 0.00 0.00 0.00 0.00 46.02 44.22 2qta n GLY 679 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2qta h GLU 680 N 0.00 0.09 -0.74 1.61 5.08 -1.90 -2.54 114.58 116.18 2qta h GLU 680 Ca 0.00 -0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.40 2qta h GLU 680 Cb 0.00 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.19 2qta h GLU 680 CO 0.00 0.06 0.49 -0.22 -1.00 0.00 0.00 179.01 178.34 2qta h LYS 681 N 0.09 0.84 -6.68 2.33 3.64 -1.79 -3.46 116.57 111.54 2qta h LYS 681 Ca 0.08 -0.05 -0.54 0.00 -1.27 0.00 0.00 60.65 58.88 2qta h LYS 681 Cb 0.22 -0.19 -0.08 0.00 -0.41 0.00 0.00 32.23 31.78 2qta h LYS 681 CO -0.01 0.56 -0.93 1.04 -2.27 0.00 0.00 179.45 177.83 2qta n GLN 682 N -4.46 -2.04 -2.39 1.90 6.02 -0.96 -4.88 117.38 110.58 2qta n GLN 682 Ca 0.10 0.28 -0.41 0.00 -0.01 0.00 0.00 57.00 56.96 2qta n GLN 682 Cb 0.15 -3.98 -0.03 0.00 1.02 0.00 0.00 30.24 27.39 2qta n GLN 682 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 2qta s GLU 683 N -6.82 4.50 -1.14 -1.09 2.12 0.29 -4.95 118.70 111.61 2qta s GLU 683 Ca 0.11 1.86 -0.15 0.00 0.36 0.00 0.00 54.97 57.15 2qta s GLU 683 Cb -0.05 -3.25 0.16 0.00 0.26 0.00 0.00 34.13 31.25 2qta s GLU 683 CO 0.93 -0.09 1.36 -0.80 -0.54 0.00 0.00 175.26 176.12 2qta s ASN 684 N 0.17 6.98 0.10 -1.70 0.01 -1.26 -4.40 114.94 114.83 2qta s ASN 684 Ca 0.53 -2.79 -0.06 0.00 -0.71 0.00 0.00 52.86 49.83 2qta s ASN 684 Cb -0.32 -2.40 -0.02 0.00 0.41 0.00 0.00 41.25 38.92 2qta s ASN 684 CO 0.36 -0.81 0.14 0.68 -1.51 0.00 0.00 177.10 175.96 2qta s VAL 685 N 1.79 0.14 0.21 1.60 -7.23 -1.26 -4.89 120.40 110.77 2qta s VAL 685 Ca 0.40 -1.44 0.06 0.00 -1.81 0.00 0.00 61.98 59.19 2qta s VAL 685 Cb -0.03 -1.54 -0.05 0.00 0.56 0.00 0.00 36.38 35.31 2qta s VAL 685 CO -0.02 -0.65 -0.10 -0.72 -0.31 0.00 0.00 175.10 173.29 2qta s TYR 686 N -3.91 1.67 0.07 2.82 -0.85 -0.38 -4.19 117.35 112.57 2qta s TYR 686 Ca 0.10 -0.67 0.04 0.00 -0.52 0.00 0.00 57.07 56.02 2qta s TYR 686 Cb 0.06 -0.85 -0.04 0.00 0.38 0.00 0.00 41.96 41.51 2qta s TYR 686 CO -0.08 0.25 -0.01 0.71 -1.52 0.00 0.00 175.55 174.90 2qta s TYR 687 N -3.09 2.98 -0.13 -3.49 1.51 0.07 -0.65 117.35 114.55 2qta s TYR 687 Ca 0.24 -0.02 -0.01 0.00 -1.01 0.00 0.00 57.07 56.27 2qta s TYR 687 Cb 0.01 -1.56 0.03 0.00 -0.11 0.00 0.00 41.96 40.34 2qta s TYR 687 CO 0.07 0.46 -0.05 -0.47 -1.11 0.00 0.00 175.55 174.46 2qta s TYR 688 N -1.24 1.37 -0.13 2.71 5.04 -0.48 0.12 117.35 124.73 2qta s TYR 688 Ca 0.24 -0.75 0.01 0.00 -2.44 0.00 0.00 57.07 54.12 2qta s TYR 688 Cb -0.12 -1.17 0.02 0.00 0.35 0.00 0.00 41.96 41.05 2qta s TYR 688 CO 0.16 -0.52 -0.16 0.42 -1.34 0.00 0.00 175.55 174.11 2qta s ILE 689 N 1.74 1.62 0.02 3.14 1.01 0.13 -1.34 121.20 127.52 2qta s ILE 689 Ca 0.03 -0.69 -0.23 0.00 0.00 0.00 0.00 60.65 59.76 2qta s ILE 689 Cb -0.14 -1.49 -0.05 0.00 0.01 0.00 0.00 42.46 40.79 2qta s ILE 689 CO -0.07 0.47 0.70 0.42 0.00 0.00 0.00 174.94 176.45 2qta s THR 690 N 1.23 4.82 0.33 2.92 -4.23 -0.78 -0.84 115.64 119.09 2qta s THR 690 Ca -0.00 1.47 0.07 0.00 -1.18 0.00 0.00 61.69 62.05 2qta s THR 690 Cb -0.14 -4.04 -0.06 0.00 1.34 0.00 0.00 72.50 69.60 2qta s THR 690 CO -0.07 0.38 -0.04 0.42 -0.54 0.00 0.00 174.62 174.77 2qta s THR 691 N -0.04 1.82 0.25 3.99 -4.23 0.20 -4.31 115.64 113.31 2qta s THR 691 Ca 0.36 -2.11 0.12 0.00 -1.18 0.00 0.00 61.69 58.87 2qta s THR 691 Cb -0.19 -2.65 -0.05 0.00 1.34 0.00 0.00 72.50 70.95 2qta s THR 691 CO 0.20 -0.18 -0.19 -0.76 -0.54 0.00 0.00 174.62 173.15 2qta s LEU 692 N -3.54 2.60 -0.04 4.79 1.43 -1.26 -1.79 118.68 120.87 2qta s LEU 692 Ca 0.32 -0.95 0.17 0.00 -1.03 0.00 0.00 54.13 52.64 2qta s LEU 692 Cb 0.05 -1.17 0.53 0.00 0.03 0.00 0.00 46.19 45.63 2qta s LEU 692 CO 0.15 0.06 1.45 -0.46 0.23 0.00 0.00 176.35 177.77 2qta n ASN 693 N -0.39 3.75 -4.54 2.29 6.94 -1.26 -2.96 115.26 119.10 2qta n ASN 693 Ca -0.07 -2.17 -0.34 0.00 -0.02 0.00 0.00 54.58 51.97 2qta n ASN 693 Cb 0.59 -0.42 -0.11 0.00 -2.36 0.00 0.00 39.78 37.48 2qta n ASN 693 CO 0.00 0.00 0.00 -0.70 -1.03 0.00 0.00 177.26 175.53 2qta s GLU 694 N -1.32 3.78 0.07 -3.83 2.12 -1.26 -5.01 118.70 113.25 2qta s GLU 694 Ca 0.39 -0.45 -0.19 0.00 0.36 0.00 0.00 54.97 55.08 2qta s GLU 694 Cb 0.23 -3.06 -0.07 0.00 0.26 0.00 0.00 34.13 31.49 2qta s GLU 694 CO 0.23 0.20 0.57 -0.80 -0.54 0.00 0.00 175.26 174.93 2qta s ASN 695 N 0.50 7.06 0.27 -1.70 0.01 -1.26 -4.13 114.94 115.69 2qta s ASN 695 Ca -0.00 1.26 -0.21 0.00 -0.71 0.00 0.00 52.86 53.19 2qta s ASN 695 Cb -0.14 -2.36 0.04 0.00 0.41 0.00 0.00 41.25 39.20 2qta s ASN 695 CO 0.02 0.26 0.80 -0.72 -1.51 0.00 0.00 177.10 175.95 2qta s TYR 696 N -1.05 -0.12 0.20 2.20 -0.85 -0.61 -4.84 117.35 112.27 2qta s TYR 696 Ca 0.29 -0.34 -0.32 0.00 -0.52 0.00 0.00 57.07 56.18 2qta s TYR 696 Cb -0.19 0.72 -0.11 0.00 0.38 0.00 0.00 41.96 42.75 2qta s TYR 696 CO 0.19 -1.19 1.63 -1.58 -1.52 0.00 0.00 175.55 173.08 2qta s HIS 697 N -3.46 2.97 -0.35 -3.49 5.65 -1.26 -2.33 115.29 113.02 2qta s HIS 697 Ca 0.12 0.54 -0.04 0.00 0.25 0.00 0.00 55.06 55.93 2qta s HIS 697 Cb -0.05 -4.02 0.06 0.00 -1.18 0.00 0.00 32.58 27.39 2qta s HIS 697 CO 0.07 -3.78 0.10 -1.64 -0.65 0.00 0.00 174.74 168.83 2qta s MET 698 N 0.95 2.44 0.84 2.88 1.00 -1.26 -4.97 119.30 121.17 2qta s MET 698 Ca 0.71 -1.35 -0.12 0.00 0.00 0.00 0.00 55.69 54.92 2qta s MET 698 Cb -0.47 -3.41 0.10 0.00 0.00 0.00 0.00 34.83 31.05 2qta s MET 698 CO 0.33 -0.75 1.17 -1.25 0.00 0.00 0.00 175.02 174.52 2qta s PRO 699 N 1.30 1.73 0.47 2.03 0.04 -1.26 -0.51 135.00 138.80 2qta s PRO 699 Ca -0.01 0.15 -0.20 0.00 0.04 0.00 0.00 61.00 60.97 2qta s PRO 699 Cb -0.21 -1.92 -0.09 0.00 0.04 0.00 0.00 34.50 32.32 2qta s PRO 699 CO 0.00 -1.76 1.01 0.00 0.04 0.00 0.00 177.00 176.29 2qta s ALA 700 N -3.51 2.92 0.26 8.56 0.00 -1.26 -4.32 121.76 124.41 2qta s ALA 700 Ca 0.63 0.55 -0.30 0.00 0.00 0.00 0.00 51.96 52.84 2qta s ALA 700 Cb -0.12 -3.22 -0.10 0.00 0.00 0.00 0.00 23.12 19.68 2qta s ALA 700 CO 0.50 -0.18 1.37 1.41 0.00 0.00 0.00 175.76 178.86 2qta s MET 701 N -3.21 4.32 0.35 0.00 1.75 -0.45 -4.88 119.30 117.19 2qta s MET 701 Ca 0.66 2.22 -0.28 0.00 -1.25 0.00 0.00 55.69 57.04 2qta s MET 701 Cb -0.14 -3.12 -0.09 0.00 2.84 0.00 0.00 34.83 34.32 2qta s MET 701 CO 0.18 -0.31 1.23 -2.14 -0.65 0.00 0.00 175.02 173.32 2qta s PRO 702 N -0.74 4.27 0.20 4.11 0.02 -1.26 -4.92 135.00 136.69 2qta s PRO 702 Ca 0.56 2.02 -0.33 0.00 0.02 0.00 0.00 61.00 63.27 2qta s PRO 702 Cb -0.40 -2.94 -0.13 0.00 0.02 0.00 0.00 34.50 31.05 2qta s PRO 702 CO 0.45 -0.19 1.55 -1.91 -0.33 0.00 0.00 177.00 176.57 2qta n GLU 703 N 0.58 2.23 -0.66 5.54 2.13 -1.26 -2.08 120.64 127.12 2qta n GLU 703 Ca 0.01 0.80 0.00 0.00 0.66 0.00 0.00 57.16 58.64 2qta n GLU 703 Cb 0.44 -2.55 0.00 0.00 0.27 0.00 0.00 31.44 29.60 2qta n GLU 703 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2qta n GLY 704 N 3.01 1.56 0.00 8.31 0.00 -1.26 -4.91 105.19 111.91 2qta n GLY 704 Ca 0.15 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.25 2qta n GLY 704 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qta n ALA 705 N 0.57 1.86 -0.14 4.61 0.00 -0.88 -4.18 120.51 122.36 2qta n ALA 705 Ca 0.00 -0.07 -0.03 0.00 0.00 0.00 0.00 53.44 53.34 2qta n ALA 705 Cb 0.00 -1.27 0.04 0.00 0.00 0.00 0.00 19.45 18.23 2qta n ALA 705 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2qta h GLU 706 N 0.00 0.10 -0.53 0.00 3.07 -1.91 -0.61 114.58 114.70 2qta h GLU 706 Ca 0.00 -0.01 -0.07 0.00 -0.50 0.00 0.00 59.36 58.78 2qta h GLU 706 Cb 0.19 -0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 28.06 2qta h GLU 706 CO 0.00 0.07 0.04 1.49 -1.40 0.00 0.00 179.01 179.21 2qta h GLU 707 N 0.10 0.91 -0.74 2.33 4.57 -2.00 -1.92 114.58 117.83 2qta h GLU 707 Ca 0.23 -0.27 -0.02 0.00 -1.18 0.00 0.00 59.36 58.12 2qta h GLU 707 Cb 0.34 -0.09 -0.04 0.00 -0.16 0.00 0.00 28.75 28.80 2qta h GLU 707 CO -0.39 0.91 0.40 0.78 -1.18 0.00 0.00 179.01 179.52 2qta h GLY 708 N 0.78 1.11 0.96 1.92 0.00 -1.68 0.85 103.07 107.02 2qta h GLY 708 Ca 0.16 -0.50 -0.01 0.00 0.00 0.00 0.00 47.33 46.98 2qta h GLY 708 CO 0.02 0.48 0.19 -2.22 0.00 0.00 0.00 176.54 175.01 2qta h ILE 709 N 1.04 1.14 -0.49 2.60 2.04 -0.79 0.68 117.51 123.73 2qta h ILE 709 Ca 0.26 -0.35 -0.07 0.00 1.00 0.00 0.00 64.86 65.71 2qta h ILE 709 Cb 0.04 0.74 -0.02 0.00 -0.74 0.00 0.00 36.82 36.85 2qta h ILE 709 CO -0.04 0.14 0.05 0.03 0.00 0.00 0.00 178.15 178.33 2qta h ARG 710 N 0.43 0.84 0.00 2.37 3.08 -0.78 -3.04 114.38 117.28 2qta h ARG 710 Ca 0.12 -0.24 -0.08 0.00 0.07 0.00 0.00 59.98 59.85 2qta h ARG 710 Cb 0.05 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.00 2qta h ARG 710 CO -0.02 0.85 -0.39 0.87 -1.07 0.00 0.00 179.97 180.21 2qta h LYS 711 N 0.71 0.00 0.00 0.04 1.57 -0.65 -3.48 116.57 114.76 2qta h LYS 711 Ca 0.15 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 2qta h LYS 711 Cb 0.44 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.75 2qta h LYS 711 CO 0.02 0.39 0.00 0.41 -0.57 0.00 0.00 179.45 179.70 2qta n GLY 712 N 0.07 1.26 3.55 3.86 0.00 0.12 -4.23 105.19 109.83 2qta n GLY 712 Ca -0.01 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.85 2qta n GLY 712 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2qta s ILE 713 N -1.03 0.00 -0.05 -0.61 2.07 -0.53 -0.65 121.20 120.40 2qta s ILE 713 Ca 0.00 -0.01 -0.22 0.00 -1.41 0.00 0.00 60.65 59.00 2qta s ILE 713 Cb 0.00 -0.98 0.05 0.00 0.13 0.00 0.00 42.46 41.65 2qta s ILE 713 CO 0.00 -0.01 0.50 -0.72 -1.91 0.00 0.00 174.94 172.80 2qta s TYR 714 N -0.55 -0.44 -0.12 3.50 1.13 -0.99 -4.46 117.35 115.43 2qta s TYR 714 Ca -0.07 0.77 -0.29 0.00 -1.41 0.00 0.00 57.07 56.07 2qta s TYR 714 Cb -0.02 0.25 -0.01 0.00 -1.10 0.00 0.00 41.96 41.07 2qta s TYR 714 CO 0.06 -0.48 1.12 0.21 -2.51 0.00 0.00 175.55 173.95 2qta s LYS 715 N -1.10 4.34 -0.14 -3.49 2.20 -1.26 -2.52 119.74 117.76 2qta s LYS 715 Ca -0.11 1.52 -0.15 0.00 -0.36 0.00 0.00 55.97 56.88 2qta s LYS 715 Cb -0.03 -3.60 -0.24 0.00 -1.51 0.00 0.00 37.83 32.45 2qta s LYS 715 CO 0.06 -0.48 0.37 1.25 -0.36 0.00 0.00 175.35 176.19 2qta h LEU 716 N 8.64 0.26 -7.18 5.43 5.85 -0.39 -3.48 115.31 124.44 2qta h LEU 716 Ca -0.29 -0.78 -0.05 0.00 0.84 0.00 0.00 57.88 57.61 2qta h LEU 716 Cb 1.13 -0.09 -0.14 0.00 0.37 0.00 0.00 40.66 41.93 2qta h LEU 716 CO 0.91 1.66 0.07 -1.83 -0.34 0.00 0.00 178.44 178.90 2qta s GLU 717 N -2.47 1.11 -0.10 1.25 -1.05 -1.08 -5.01 118.70 111.36 2qta s GLU 717 Ca -0.24 -0.39 0.02 0.00 -0.15 0.00 0.00 54.97 54.22 2qta s GLU 717 Cb 0.06 0.51 0.01 0.00 -0.44 0.00 0.00 34.13 34.26 2qta s GLU 717 CO 0.71 -0.43 -0.17 0.99 0.95 0.00 0.00 175.26 177.30 2qta s THR 718 N -3.07 1.61 -0.09 1.83 2.01 -1.26 -0.47 115.64 116.21 2qta s THR 718 Ca -0.02 -0.73 -0.01 0.00 0.31 0.00 0.00 61.69 61.24 2qta s THR 718 Cb -0.00 -1.44 -0.03 0.00 0.01 0.00 0.00 72.50 71.04 2qta s THR 718 CO -0.07 0.46 -0.05 -0.63 -0.69 0.00 0.00 174.62 173.65 2qta s ILE 719 N 0.74 3.88 0.44 1.82 1.01 0.49 -4.98 121.20 124.59 2qta s ILE 719 Ca -0.11 -0.40 -0.20 0.00 0.00 0.00 0.00 60.65 59.94 2qta s ILE 719 Cb -0.16 -2.62 -0.10 0.00 0.01 0.00 0.00 42.46 39.59 2qta s ILE 719 CO 0.02 0.58 0.94 -1.61 0.00 0.00 0.00 174.94 174.87 2qta s GLU 720 N -0.59 4.16 -0.29 2.79 0.41 -1.26 -2.09 118.70 121.83 2qta s GLU 720 Ca 0.09 1.06 -0.16 0.00 -0.41 0.00 0.00 54.97 55.55 2qta s GLU 720 Cb -0.12 -2.19 0.16 0.00 -1.78 0.00 0.00 34.13 30.20 2qta s GLU 720 CO 0.02 -0.06 1.03 0.20 -0.49 0.00 0.00 175.26 175.96 2qta s GLY 721 N -2.35 0.10 0.26 -1.39 0.00 -1.26 -4.23 107.32 98.45 2qta s GLY 721 Ca 0.61 3.27 0.23 0.00 0.00 0.00 0.00 44.72 48.82 2qta s GLY 721 CO 0.17 2.68 1.20 1.48 0.00 0.00 0.00 173.10 178.63 2qta h SER 722 N 6.02 0.00 1.08 1.64 4.64 -1.81 -3.35 113.55 121.77 2qta h SER 722 Ca -0.27 -0.01 -0.04 0.00 -0.47 0.00 0.00 61.79 61.00 2qta h SER 722 Cb 1.18 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.26 2qta h SER 722 CO 0.19 0.01 -0.94 0.11 -0.87 0.00 0.00 176.83 175.33 2qta h LYS 723 N 0.00 0.00 -1.39 4.77 1.57 -0.82 -3.49 116.57 117.20 2qta h LYS 723 Ca 0.00 0.00 0.34 0.00 -1.87 0.00 0.00 60.65 59.12 2qta h LYS 723 Cb 0.99 0.00 -0.12 0.00 0.08 0.00 0.00 32.23 33.17 2qta h LYS 723 CO 0.00 0.08 0.85 0.20 -0.57 0.00 0.00 179.45 180.01 2qta s GLY 724 N -4.44 -0.43 -0.02 3.86 0.00 -1.21 -4.95 107.32 100.14 2qta s GLY 724 Ca 0.00 0.72 -0.01 0.00 0.00 0.00 0.00 44.72 45.43 2qta s GLY 724 CO 0.78 0.21 0.05 1.25 0.00 0.00 0.00 173.10 175.39 2qta s LYS 725 N -2.36 0.05 0.24 2.90 2.20 -1.26 -0.33 119.74 121.19 2qta s LYS 725 Ca 0.14 0.08 0.01 0.00 -0.36 0.00 0.00 55.97 55.85 2qta s LYS 725 Cb 0.05 -0.00 -0.04 0.00 -1.51 0.00 0.00 37.83 36.33 2qta s LYS 725 CO -0.04 -0.02 0.16 0.14 -0.36 0.00 0.00 175.35 175.22 2qta s VAL 726 N 0.14 0.10 -0.02 4.02 -7.23 -0.71 -4.33 120.40 112.37 2qta s VAL 726 Ca -0.01 -2.00 0.07 0.00 -1.81 0.00 0.00 61.98 58.23 2qta s VAL 726 Cb -0.02 -2.52 -0.02 0.00 0.56 0.00 0.00 36.38 34.39 2qta s VAL 726 CO -0.00 0.00 -0.22 -1.10 -0.31 0.00 0.00 175.10 173.47 2qta s GLN 727 N -3.97 2.22 -0.08 4.82 -0.21 0.29 -1.92 119.66 120.81 2qta s GLN 727 Ca 0.39 -0.87 0.03 0.00 0.02 0.00 0.00 55.36 54.93 2qta s GLN 727 Cb 0.06 -2.15 0.01 0.00 1.00 0.00 0.00 33.01 31.93 2qta s GLN 727 CO 0.16 0.58 -0.16 -0.51 -2.12 0.00 0.00 175.29 173.23 2qta s LEU 728 N -0.72 1.79 -0.03 2.90 1.43 0.89 -1.46 118.68 123.49 2qta s LEU 728 Ca 0.11 -0.39 0.08 0.00 -1.03 0.00 0.00 54.13 52.90 2qta s LEU 728 Cb -0.10 -1.02 -0.02 0.00 0.03 0.00 0.00 46.19 45.08 2qta s LEU 728 CO -0.00 0.07 -0.26 -0.76 0.23 0.00 0.00 176.35 175.64 2qta s LEU 729 N 0.57 2.05 0.13 1.79 1.02 -0.02 -0.37 118.68 123.85 2qta s LEU 729 Ca -0.16 -0.47 -0.13 0.00 0.02 0.00 0.00 54.13 53.39 2qta s LEU 729 Cb -0.16 -1.33 0.02 0.00 0.02 0.00 0.00 46.19 44.73 2qta s LEU 729 CO 0.05 0.30 0.33 -0.83 0.02 0.00 0.00 176.35 176.22 2qta s GLY 730 N -0.50 -0.04 0.22 -3.19 0.00 -0.92 -1.59 107.32 101.30 2qta s GLY 730 Ca 0.07 -0.36 -0.05 0.00 0.00 0.00 0.00 44.72 44.37 2qta s GLY 730 CO 0.00 -0.53 0.26 -1.35 0.00 0.00 0.00 173.10 171.48 2qta s SER 731 N -2.85 0.07 0.26 1.64 1.04 -1.24 -0.86 113.70 111.75 2qta s SER 731 Ca 0.06 -1.22 0.00 0.00 0.48 0.00 0.00 55.95 55.27 2qta s SER 731 Cb 0.03 0.46 0.00 0.00 0.10 0.00 0.00 66.02 66.61 2qta s SER 731 CO -0.09 -0.96 0.00 0.61 0.98 0.00 0.00 173.24 173.78 2qta n GLY 732 N -0.32 2.01 0.14 7.32 0.00 -0.15 -2.11 105.19 112.08 2qta n GLY 732 Ca 0.01 -0.19 0.13 0.00 0.00 0.00 0.00 46.02 45.97 2qta n GLY 732 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2qta h SER 733 N 1.15 0.00 0.40 1.61 4.64 -1.89 -3.09 113.55 116.36 2qta h SER 733 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2qta h SER 733 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2qta h SER 733 CO 0.00 0.00 -0.36 -0.38 -0.87 0.00 0.00 176.83 175.22 2qta n ILE 734 N -2.37 0.00 -0.05 0.95 2.08 -0.90 -3.95 119.36 115.12 2qta n ILE 734 Ca 0.03 -0.06 -0.12 0.00 0.56 0.00 0.00 62.75 63.16 2qta n ILE 734 Cb 0.33 0.26 -0.07 0.00 -0.75 0.00 0.00 39.64 39.42 2qta n ILE 734 CO 0.00 0.00 0.00 0.25 0.56 0.00 0.00 176.55 177.36 2qta h LEU 735 N 0.54 0.31 0.00 1.39 5.85 -1.49 -1.28 115.31 120.63 2qta h LEU 735 Ca 0.00 -0.41 0.00 0.00 0.84 0.00 0.00 57.88 58.31 2qta h LEU 735 Cb 0.49 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.44 2qta h LEU 735 CO 0.00 0.65 0.00 0.54 -0.34 0.00 0.00 178.44 179.29 2qta n ARG 736 N -4.66 0.00 0.00 1.25 1.74 -1.25 -0.92 116.66 112.82 2qta n ARG 736 Ca -0.06 0.00 -0.14 0.00 -0.77 0.00 0.00 57.85 56.88 2qta n ARG 736 Cb 0.29 0.00 -0.14 0.00 -1.02 0.00 0.00 32.46 31.59 2qta n ARG 736 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2qta h HIS 737 N 0.00 0.24 -0.95 -1.55 3.86 -1.49 -0.92 115.15 114.35 2qta h HIS 737 Ca 0.00 -0.18 0.17 0.00 -1.16 0.00 0.00 60.37 59.21 2qta h HIS 737 Cb 0.00 -0.01 -0.10 0.00 1.06 0.00 0.00 27.41 28.36 2qta h HIS 737 CO 0.00 1.33 0.54 0.28 0.86 0.00 0.00 177.93 180.95 2qta h VAL 738 N 0.04 0.71 -0.22 2.45 2.07 -1.18 -0.22 116.25 119.88 2qta h VAL 738 Ca -0.32 -0.24 -0.18 0.00 0.82 0.00 0.00 66.70 66.78 2qta h VAL 738 Cb 2.02 -0.06 -0.00 0.00 -1.52 0.00 0.00 31.29 31.72 2qta h VAL 738 CO 0.10 0.13 -0.59 0.03 0.02 0.00 0.00 177.57 177.26 2qta h ARG 739 N 0.71 0.72 -0.39 1.57 3.08 -0.28 -0.53 114.38 119.26 2qta h ARG 739 Ca 0.54 -0.47 0.05 0.00 0.07 0.00 0.00 59.98 60.16 2qta h ARG 739 Cb 0.81 0.06 -0.04 0.00 0.08 0.00 0.00 29.97 30.88 2qta h ARG 739 CO -0.38 1.10 0.13 1.49 -1.07 0.00 0.00 179.97 181.24 2qta h GLU 740 N 0.54 0.27 -0.77 0.04 4.81 -1.01 -2.86 114.58 115.60 2qta h GLU 740 Ca 0.00 -0.02 0.03 0.00 -0.13 0.00 0.00 59.36 59.25 2qta h GLU 740 Cb 1.17 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 30.44 2qta h GLU 740 CO 0.12 0.18 0.51 0.00 -0.73 0.00 0.00 179.01 179.09 2qta h ALA 741 N 1.26 1.53 -0.75 2.92 0.00 -0.34 -0.45 119.26 123.42 2qta h ALA 741 Ca 0.18 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 2qta h ALA 741 Cb 0.17 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 2qta h ALA 741 CO -0.19 0.40 0.29 0.00 0.00 0.00 0.00 179.25 179.74 2qta h ALA 742 N 1.55 1.09 -0.25 0.00 0.00 -0.91 0.94 119.26 121.69 2qta h ALA 742 Ca 0.31 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 2qta h ALA 742 Cb 0.03 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 2qta h ALA 742 CO -0.09 0.64 0.05 0.93 0.00 0.00 0.00 179.25 180.79 2qta h GLU 743 N 1.09 0.40 -0.56 0.00 4.39 -0.91 -2.18 114.58 116.81 2qta h GLU 743 Ca 0.25 -0.10 -0.00 0.00 0.34 0.00 0.00 59.36 59.84 2qta h GLU 743 Cb 0.23 -0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 28.80 2qta h GLU 743 CO -0.02 0.51 0.34 0.82 -1.16 0.00 0.00 179.01 179.50 2qta h ILE 744 N 0.22 1.17 -0.70 3.13 2.04 -0.99 0.22 117.51 122.60 2qta h ILE 744 Ca 0.08 -0.38 0.04 0.00 1.00 0.00 0.00 64.86 65.60 2qta h ILE 744 Cb 0.30 0.40 -0.05 0.00 -0.74 0.00 0.00 36.82 36.74 2qta h ILE 744 CO 0.00 0.17 0.43 -0.07 0.00 0.00 0.00 178.15 178.68 2qta h LEU 745 N 0.76 0.69 0.15 1.44 3.38 -0.69 0.18 115.31 121.21 2qta h LEU 745 Ca 0.20 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.17 2qta h LEU 745 Cb -0.02 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.60 2qta h LEU 745 CO -0.04 0.47 -0.07 0.00 0.09 0.00 0.00 178.44 178.89 2qta h ALA 746 N 1.31 -0.20 -0.25 1.53 0.00 -0.95 -0.85 119.26 119.85 2qta h ALA 746 Ca 0.29 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 2qta h ALA 746 Cb 0.06 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2qta h ALA 746 CO -0.12 -0.30 0.07 -0.22 0.00 0.00 0.00 179.25 178.67 2qta h LYS 747 N -0.84 0.39 0.00 0.00 3.64 -0.52 -0.02 116.57 119.22 2qta h LYS 747 Ca -0.02 -0.09 -0.17 0.00 -1.27 0.00 0.00 60.65 59.10 2qta h LYS 747 Cb 0.53 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.27 2qta h LYS 747 CO 0.03 0.48 -1.10 -0.44 -2.27 0.00 0.00 179.45 176.15 2qta h ASP 748 N 0.23 0.00 0.00 4.20 5.19 -0.79 -3.40 116.42 121.84 2qta h ASP 748 Ca 0.08 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.49 2qta h ASP 748 Cb 0.26 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.77 2qta h ASP 748 CO -0.00 0.66 0.00 -1.22 -3.12 0.00 0.00 179.24 175.56 2qta n TYR 749 N -3.08 0.00 -1.86 4.55 4.02 -0.43 -5.01 117.16 115.35 2qta n TYR 749 Ca -0.05 0.00 -0.15 0.00 -0.01 0.00 0.00 57.90 57.68 2qta n TYR 749 Cb 0.85 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 40.13 2qta n TYR 749 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2qta n GLY 750 N 0.08 0.66 3.51 2.72 0.00 -0.02 -4.69 105.19 107.45 2qta n GLY 750 Ca 0.00 -0.27 -0.41 0.00 0.00 0.00 0.00 46.02 45.34 2qta n GLY 750 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qta s VAL 751 N -2.66 5.23 0.95 1.61 1.01 -0.59 -0.15 120.40 125.80 2qta s VAL 751 Ca 0.00 -0.27 -0.12 0.00 0.00 0.00 0.00 61.98 61.59 2qta s VAL 751 Cb 0.00 -3.82 0.16 0.00 0.00 0.00 0.00 36.38 32.72 2qta s VAL 751 CO 0.00 -0.14 1.09 -0.83 0.00 0.00 0.00 175.10 175.22 2qta s GLY 752 N 1.72 1.59 -0.05 4.51 0.00 0.55 -2.74 107.32 112.90 2qta s GLY 752 Ca 0.08 -0.24 -0.24 0.00 0.00 0.00 0.00 44.72 44.32 2qta s GLY 752 CO 0.11 0.32 0.53 -1.35 0.00 0.00 0.00 173.10 172.71 2qta s SER 753 N -3.46 -0.48 -0.14 1.64 1.04 -0.89 -1.74 113.70 109.67 2qta s SER 753 Ca 0.64 0.53 -0.18 0.00 0.48 0.00 0.00 55.95 57.42 2qta s SER 753 Cb -0.18 0.52 -0.04 0.00 0.10 0.00 0.00 66.02 66.42 2qta s SER 753 CO 0.57 -0.51 0.49 -1.81 0.98 0.00 0.00 173.24 172.97 2qta s ASP 754 N -1.08 6.67 -0.22 7.02 1.01 -0.81 -0.38 116.67 128.87 2qta s ASP 754 Ca -0.11 0.79 -0.05 0.00 0.71 0.00 0.00 52.55 53.90 2qta s ASP 754 Cb -0.02 -2.29 -0.02 0.00 1.01 0.00 0.00 42.92 41.60 2qta s ASP 754 CO 0.07 -0.04 -0.00 -0.69 0.21 0.00 0.00 175.17 174.71 2qta s VAL 755 N 0.86 3.78 -0.11 -1.27 1.01 0.38 -0.08 120.40 124.97 2qta s VAL 755 Ca 0.26 -0.36 -0.01 0.00 0.00 0.00 0.00 61.98 61.87 2qta s VAL 755 Cb -0.15 -2.73 -0.02 0.00 0.00 0.00 0.00 36.38 33.48 2qta s VAL 755 CO 0.10 0.41 -0.08 -0.31 0.00 0.00 0.00 175.10 175.22 2qta s TYR 756 N 1.31 2.91 -0.09 5.22 1.51 0.50 0.42 117.35 129.13 2qta s TYR 756 Ca 0.04 -0.29 -0.29 0.00 -1.01 0.00 0.00 57.07 55.52 2qta s TYR 756 Cb -0.15 -1.82 -0.02 0.00 -0.11 0.00 0.00 41.96 39.87 2qta s TYR 756 CO 0.00 0.04 0.97 0.45 -1.11 0.00 0.00 175.55 175.91 2qta s SER 757 N -0.09 7.23 -0.43 2.29 0.15 -1.05 -2.16 113.70 119.64 2qta s SER 757 Ca 0.00 1.51 -0.07 0.00 0.70 0.00 0.00 55.95 58.09 2qta s SER 757 Cb -0.13 -2.54 0.10 0.00 -1.71 0.00 0.00 66.02 61.74 2qta s SER 757 CO 0.03 -0.39 0.26 -0.69 1.20 0.00 0.00 173.24 173.66 2qta s VAL 758 N 1.76 3.86 -0.65 4.45 1.01 -0.04 -2.34 120.40 128.45 2qta s VAL 758 Ca 0.48 -1.75 0.26 0.00 0.00 0.00 0.00 61.98 60.96 2qta s VAL 758 Cb -0.19 -3.51 0.29 0.00 0.00 0.00 0.00 36.38 32.97 2qta s VAL 758 CO 0.19 -0.65 1.76 0.71 0.00 0.00 0.00 175.10 177.11 2qta h THR 759 N 6.21 0.00 -0.94 3.92 1.35 -1.15 -3.40 112.91 118.90 2qta h THR 759 Ca -0.19 -0.49 -0.01 0.00 -0.55 0.00 0.00 66.41 65.17 2qta h THR 759 Cb 1.07 1.45 -0.20 0.00 -1.73 0.00 0.00 68.15 68.74 2qta h THR 759 CO 0.77 0.00 -0.40 -0.55 -0.25 0.00 0.00 175.52 175.09 2qta s SER 760 N -4.67 -1.48 0.36 5.36 0.15 -0.93 -0.76 113.70 111.75 2qta s SER 760 Ca 0.09 -0.42 0.04 0.00 0.70 0.00 0.00 55.95 56.36 2qta s SER 760 Cb 0.11 1.89 0.69 0.00 -1.71 0.00 0.00 66.02 67.01 2qta s SER 760 CO 0.57 -0.20 2.00 -0.26 1.20 0.00 0.00 173.24 176.55 2qta h PHE 761 N 7.24 0.67 -0.16 3.44 0.04 -1.82 -2.43 116.94 123.92 2qta h PHE 761 Ca 0.02 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.76 2qta h PHE 761 Cb 1.19 -0.22 -0.01 0.00 2.20 0.00 0.00 35.95 39.11 2qta h PHE 761 CO 0.16 0.46 -0.01 1.15 -0.60 0.00 0.00 178.31 179.47 2qta h THR 762 N 0.70 1.27 -0.31 -1.55 2.02 -1.84 0.14 112.91 113.34 2qta h THR 762 Ca 0.18 -0.90 -0.02 0.00 0.77 0.00 0.00 66.41 66.45 2qta h THR 762 Cb -0.01 1.54 -0.02 0.00 -1.74 0.00 0.00 68.15 67.92 2qta h THR 762 CO -0.03 0.27 0.10 -0.33 0.37 0.00 0.00 175.52 175.90 2qta h GLU 763 N 0.03 0.44 -0.34 6.66 4.39 -1.75 -0.53 114.58 123.48 2qta h GLU 763 Ca 0.04 -0.06 -0.15 0.00 0.34 0.00 0.00 59.36 59.54 2qta h GLU 763 Cb 0.41 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.97 2qta h GLU 763 CO 0.01 0.38 -0.39 -0.07 -1.16 0.00 0.00 179.01 177.79 2qta h LEU 764 N 0.44 0.87 -0.43 1.33 3.38 -1.17 -0.62 115.31 119.10 2qta h LEU 764 Ca 0.11 -0.40 -0.08 0.00 0.09 0.00 0.00 57.88 57.61 2qta h LEU 764 Cb 0.13 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 2qta h LEU 764 CO -0.01 1.16 -0.03 0.00 0.09 0.00 0.00 178.44 179.65 2qta h ALA 765 N 0.88 0.59 -0.32 1.53 0.00 -0.29 -0.68 119.26 120.98 2qta h ALA 765 Ca 0.06 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 2qta h ALA 765 Cb 0.96 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 2qta h ALA 765 CO 0.09 0.40 0.15 0.00 0.00 0.00 0.00 179.25 179.89 2qta h ARG 766 N 0.62 0.46 -0.77 0.00 3.08 -1.02 0.77 114.38 117.52 2qta h ARG 766 Ca 0.12 -0.07 0.05 0.00 0.07 0.00 0.00 59.98 60.15 2qta h ARG 766 Cb 0.53 -0.08 -0.05 0.00 0.08 0.00 0.00 29.97 30.44 2qta h ARG 766 CO 0.03 0.44 0.47 0.22 -1.07 0.00 0.00 179.97 180.06 2qta h ASP 767 N 0.37 0.74 -0.12 7.04 3.58 -1.00 0.50 116.42 127.55 2qta h ASP 767 Ca 0.11 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.57 2qta h ASP 767 Cb 0.14 -0.14 -0.01 0.00 1.72 0.00 0.00 39.33 41.04 2qta h ASP 767 CO -0.01 0.49 0.07 1.23 -2.88 0.00 0.00 179.24 178.14 2qta h GLY 768 N 0.88 0.17 1.01 -0.78 0.00 -0.46 -1.17 103.07 102.71 2qta h GLY 768 Ca 0.33 -0.07 0.01 0.00 0.00 0.00 0.00 47.33 47.60 2qta h GLY 768 CO -0.15 0.06 0.65 1.46 0.00 0.00 0.00 176.54 178.56 2qta h GLN 769 N 0.14 1.31 -0.68 4.80 4.20 -0.44 0.59 115.11 125.03 2qta h GLN 769 Ca 0.04 -0.09 0.02 0.00 0.06 0.00 0.00 58.65 58.69 2qta h GLN 769 Cb 0.00 -0.29 -0.04 0.00 0.30 0.00 0.00 27.48 27.45 2qta h GLN 769 CO -0.01 0.88 0.44 -0.44 -0.67 0.00 0.00 178.83 179.03 2qta h ASP 770 N 1.35 0.74 -0.12 1.46 3.32 -0.40 0.65 116.42 123.42 2qta h ASP 770 Ca 0.36 -0.01 -0.04 0.00 0.02 0.00 0.00 57.03 57.37 2qta h ASP 770 Cb -0.14 -0.17 -0.00 0.00 0.22 0.00 0.00 39.33 39.23 2qta h ASP 770 CO -0.08 0.52 -0.07 0.00 -1.72 0.00 0.00 179.24 177.90 2qta h GLU 772 N -0.09 1.16 -0.07 0.00 4.39 -0.64 0.32 114.58 119.65 2qta h GLU 772 Ca 0.03 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 59.65 2qta h GLU 772 Cb 0.54 -0.26 -0.00 0.00 -0.10 0.00 0.00 28.75 28.92 2qta h GLU 772 CO 0.02 0.77 0.00 -0.09 -1.16 0.00 0.00 179.01 178.55 2qta h ARG 773 N 1.20 0.12 -0.55 2.33 2.43 -0.84 -1.56 114.38 117.50 2qta h ARG 773 Ca 0.33 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.47 2qta h ARG 773 Cb -0.12 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.40 2qta h ARG 773 CO -0.08 0.38 0.36 2.35 -1.51 0.00 0.00 179.97 181.47 2qta h TRP 774 N -0.15 0.70 -0.33 2.20 7.01 -0.77 -1.84 115.95 122.78 2qta h TRP 774 Ca 0.02 0.01 0.04 0.00 2.11 0.00 0.00 58.89 61.07 2qta h TRP 774 Cb 0.32 -0.24 -0.04 0.00 -2.10 0.00 0.00 29.16 27.11 2qta h TRP 774 CO 0.03 0.46 0.10 -0.91 -2.79 0.00 0.00 178.44 175.32 2qta h ASN 775 N 0.75 0.09 -0.40 2.65 2.35 -0.90 -1.25 115.58 118.87 2qta h ASN 775 Ca 0.20 0.04 -0.00 0.00 -0.55 0.00 0.00 56.30 55.99 2qta h ASN 775 Cb -0.07 0.03 -0.02 0.00 0.05 0.00 0.00 38.32 38.32 2qta h ASN 775 CO -0.04 0.09 0.25 -0.03 -1.65 0.00 0.00 177.43 176.05 2qta h MET 776 N 0.23 0.55 -0.00 0.81 1.85 -0.88 -2.52 114.93 114.96 2qta h MET 776 Ca 0.15 -0.04 0.00 0.00 -0.61 0.00 0.00 59.70 59.20 2qta h MET 776 Cb 0.13 -0.12 0.00 0.00 0.43 0.00 0.00 31.60 32.04 2qta h MET 776 CO -0.16 0.38 -0.33 1.28 -0.40 0.00 0.00 176.91 177.69 2qta n LEU 777 N -4.45 0.40 -3.19 3.39 4.77 -0.73 -4.22 117.00 112.98 2qta n LEU 777 Ca 0.03 0.11 -0.24 0.00 -0.03 0.00 0.00 56.01 55.89 2qta n LEU 777 Cb 0.08 -0.30 -0.06 0.00 -2.33 0.00 0.00 43.42 40.81 2qta n LEU 777 CO 0.36 0.09 -0.10 1.41 -1.33 0.00 0.00 177.39 177.82 2qta n HIS 778 N -1.40 1.59 0.31 -1.77 8.25 -0.53 -4.96 115.22 116.71 2qta n HIS 778 Ca 0.07 -3.85 0.19 0.00 -0.26 0.00 0.00 57.72 53.87 2qta n HIS 778 Cb 0.33 -0.44 1.04 0.00 1.12 0.00 0.00 29.99 32.04 2qta n HIS 778 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2qta h PRO 779 N 3.55 0.00 -0.00 -0.41 0.13 -1.72 -1.46 132.00 132.09 2qta h PRO 779 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 2qta h PRO 779 Cb 0.78 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.91 2qta h PRO 779 CO 0.63 0.00 -0.43 1.28 -0.23 0.00 0.00 178.00 179.25 2qta n LEU 780 N -3.22 0.90 -4.96 1.56 4.32 -1.26 -4.92 117.00 109.41 2qta n LEU 780 Ca -0.02 -0.22 -0.22 0.00 -0.02 0.00 0.00 56.01 55.53 2qta n LEU 780 Cb 0.19 -0.15 -0.01 0.00 -1.62 0.00 0.00 43.42 41.82 2qta n LEU 780 CO 0.20 0.19 0.04 -1.61 -1.22 0.00 0.00 177.39 174.98 2qta s GLU 781 N -2.73 3.40 0.14 3.23 0.41 -0.55 -5.05 118.70 117.54 2qta s GLU 781 Ca 0.17 -0.67 -0.31 0.00 -0.41 0.00 0.00 54.97 53.75 2qta s GLU 781 Cb 0.18 -2.81 -0.09 0.00 -1.78 0.00 0.00 34.13 29.62 2qta s GLU 781 CO 0.62 0.29 1.55 0.99 -0.49 0.00 0.00 175.26 178.23 2qta s THR 782 N -2.11 2.81 0.35 3.63 2.01 -1.26 -4.93 115.64 116.14 2qta s THR 782 Ca 0.37 0.54 -0.28 0.00 0.31 0.00 0.00 61.69 62.62 2qta s THR 782 Cb -0.09 -3.34 -0.12 0.00 0.01 0.00 0.00 72.50 68.96 2qta s THR 782 CO 0.31 0.03 1.44 -2.65 -0.69 0.00 0.00 174.62 173.07 2qta n PRO 783 N 4.25 2.49 -2.91 4.92 -0.02 -1.26 -4.98 135.00 137.49 2qta n PRO 783 Ca 0.14 0.88 -0.32 0.00 -2.02 0.00 0.00 63.50 62.18 2qta n PRO 783 Cb 0.39 -2.57 -0.05 0.00 -0.02 0.00 0.00 33.50 31.26 2qta n PRO 783 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2qta s ARG 784 N -1.70 3.95 -0.24 -0.52 0.52 -1.26 -5.06 118.95 114.64 2qta s ARG 784 Ca 0.56 0.69 -0.05 0.00 -0.52 0.00 0.00 55.73 56.41 2qta s ARG 784 Cb -0.52 -2.35 -0.02 0.00 0.52 0.00 0.00 34.95 32.59 2qta s ARG 784 CO 0.60 0.01 0.01 0.08 0.02 0.00 0.00 175.30 176.03 2qta s VAL 785 N -2.22 3.79 0.50 3.52 1.01 -1.26 -4.85 120.40 120.89 2qta s VAL 785 Ca 0.55 -0.37 -0.22 0.00 0.00 0.00 0.00 61.98 61.94 2qta s VAL 785 Cb -0.10 -2.76 -0.08 0.00 0.00 0.00 0.00 36.38 33.44 2qta s VAL 785 CO 0.23 0.37 1.00 -2.65 0.00 0.00 0.00 175.10 174.05 2qta n PRO 786 N 4.85 1.19 -0.33 2.72 -0.02 -1.26 -4.76 135.00 137.38 2qta n PRO 786 Ca -0.17 0.44 0.03 0.00 -2.02 0.00 0.00 63.50 61.78 2qta n PRO 786 Cb 0.51 -2.12 0.17 0.00 -0.02 0.00 0.00 33.50 32.05 2qta n PRO 786 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 2qta h TYR 787 N 1.10 1.06 -0.01 6.00 3.20 -1.90 -0.62 116.97 125.80 2qta h TYR 787 Ca -0.47 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.41 2qta h TYR 787 Cb 1.35 -0.34 -0.00 0.00 1.54 0.00 0.00 36.73 39.27 2qta h TYR 787 CO 0.41 0.50 -0.09 0.97 -1.64 0.00 0.00 178.16 178.31 2qta h ILE 788 N 1.01 1.07 0.00 1.81 2.10 -1.89 -0.04 117.51 121.57 2qta h ILE 788 Ca 0.42 -0.32 -0.02 0.00 1.08 0.00 0.00 64.86 66.01 2qta h ILE 788 Cb 0.26 1.16 -0.00 0.00 -1.09 0.00 0.00 36.82 37.15 2qta h ILE 788 CO -0.20 0.09 -0.11 0.00 -1.08 0.00 0.00 178.15 176.85 2qta h ALA 789 N 1.90 0.94 0.00 0.18 0.00 -1.28 -2.02 119.26 118.98 2qta h ALA 789 Ca 0.00 -0.10 -0.10 0.00 0.00 0.00 0.00 54.91 54.71 2qta h ALA 789 Cb 0.16 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2qta h ALA 789 CO 0.01 0.14 -0.53 1.96 0.00 0.00 0.00 179.25 180.83 2qta h GLN 790 N 0.00 0.00 0.07 0.00 4.20 -0.40 -3.31 115.11 115.67 2qta h GLN 790 Ca -0.00 0.00 -0.30 0.00 0.06 0.00 0.00 58.65 58.40 2qta h GLN 790 Cb 0.99 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.74 2qta h GLN 790 CO 0.01 0.44 -1.63 0.28 -0.67 0.00 0.00 178.83 177.27 2qta h VAL 791 N 0.00 1.01 -2.15 -0.54 2.07 -1.11 -3.48 116.25 112.04 2qta h VAL 791 Ca -0.01 -2.73 -0.45 0.00 0.82 0.00 0.00 66.70 64.32 2qta h VAL 791 Cb 1.37 2.61 0.01 0.00 -1.52 0.00 0.00 31.29 33.76 2qta h VAL 791 CO 0.06 0.74 -0.30 -0.04 0.02 0.00 0.00 177.57 178.05 2qta s MET 792 N -2.61 3.21 0.00 1.57 -1.94 -0.77 -4.91 119.30 113.85 2qta s MET 792 Ca -0.09 -0.80 0.00 0.00 -1.71 0.00 0.00 55.69 53.09 2qta s MET 792 Cb 0.07 -2.78 0.00 0.00 2.01 0.00 0.00 34.83 34.14 2qta s MET 792 CO 0.83 0.09 0.00 0.27 -0.01 0.00 0.00 175.02 176.20 2qta n ASN 793 N -1.68 1.03 -0.75 3.03 0.23 -1.26 -4.87 115.26 110.99 2qta n ASN 793 Ca -0.02 -0.45 0.11 0.00 -0.53 0.00 0.00 54.58 53.69 2qta n ASN 793 Cb 0.58 0.00 0.32 0.00 -2.08 0.00 0.00 39.78 38.60 2qta n ASN 793 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 2qta n ASP 794 N -0.89 2.28 -4.77 0.53 5.75 -1.26 -3.89 116.55 114.31 2qta n ASP 794 Ca 0.00 -1.80 -0.40 0.00 -0.01 0.00 0.00 54.79 52.59 2qta n ASP 794 Cb 0.00 -0.12 -0.02 0.00 -1.03 0.00 0.00 41.12 39.94 2qta n ASP 794 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2qta s ALA 795 N -1.75 3.38 0.13 2.12 0.00 -1.26 -4.23 121.76 120.15 2qta s ALA 795 Ca 0.34 1.12 -0.34 0.00 0.00 0.00 0.00 51.96 53.08 2qta s ALA 795 Cb 0.20 -3.43 -0.17 0.00 0.00 0.00 0.00 23.12 19.72 2qta s ALA 795 CO 0.29 -0.54 1.05 -0.35 0.00 0.00 0.00 175.76 176.21 2qta n PRO 796 N 0.66 0.69 -4.47 0.00 -0.04 -1.26 -4.24 135.00 126.34 2qta n PRO 796 Ca 0.01 0.25 -0.28 0.00 -0.04 0.00 0.00 63.50 63.44 2qta n PRO 796 Cb 0.44 -1.68 -0.13 0.00 -0.04 0.00 0.00 33.50 32.09 2qta n PRO 796 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2qta s ALA 797 N -0.22 2.18 -0.03 0.55 0.00 -0.35 -0.55 121.76 123.34 2qta s ALA 797 Ca 0.77 -1.36 0.02 0.00 0.00 0.00 0.00 51.96 51.40 2qta s ALA 797 Cb -0.98 -0.36 0.01 0.00 0.00 0.00 0.00 23.12 21.79 2qta s ALA 797 CO 0.54 0.49 -0.09 0.08 0.00 0.00 0.00 175.76 176.78 2qta s VAL 798 N -1.02 0.76 0.06 0.00 1.01 -0.53 -0.76 120.40 119.91 2qta s VAL 798 Ca 0.11 -0.34 0.08 0.00 0.00 0.00 0.00 61.98 61.84 2qta s VAL 798 Cb -0.10 -0.69 -0.03 0.00 0.00 0.00 0.00 36.38 35.56 2qta s VAL 798 CO 0.05 0.24 -0.23 0.00 0.00 0.00 0.00 175.10 175.16 2qta s ALA 799 N 0.27 1.94 -0.04 5.51 0.00 0.20 -0.84 121.76 128.81 2qta s ALA 799 Ca -0.04 -1.17 -0.02 0.00 0.00 0.00 0.00 51.96 50.72 2qta s ALA 799 Cb -0.09 -0.36 0.02 0.00 0.00 0.00 0.00 23.12 22.69 2qta s ALA 799 CO 0.01 0.43 0.08 0.45 0.00 0.00 0.00 175.76 176.73 2qta s SER 800 N -1.38 -0.05 0.25 0.00 0.15 -0.62 -0.25 113.70 111.80 2qta s SER 800 Ca 0.09 0.16 -0.00 0.00 0.70 0.00 0.00 55.95 56.90 2qta s SER 800 Cb -0.09 0.11 -0.03 0.00 -1.71 0.00 0.00 66.02 64.30 2qta s SER 800 CO 0.03 -0.08 0.24 0.42 1.20 0.00 0.00 173.24 175.05 2qta s THR 801 N 0.55 0.00 -1.91 6.45 -4.23 -1.22 -3.69 115.64 111.59 2qta s THR 801 Ca -0.04 -1.90 0.07 0.00 -1.18 0.00 0.00 61.69 58.63 2qta s THR 801 Cb -0.06 -2.48 0.20 0.00 1.34 0.00 0.00 72.50 71.49 2qta s THR 801 CO -0.02 0.00 1.14 -0.67 -0.54 0.00 0.00 174.62 174.53 2qta n ASP 802 N -0.74 1.25 -4.66 3.99 2.03 -1.26 -4.20 116.55 112.96 2qta n ASP 802 Ca 0.03 -2.02 -0.25 0.00 0.52 0.00 0.00 54.79 53.07 2qta n ASP 802 Cb 0.64 -0.17 -0.09 0.00 -0.72 0.00 0.00 41.12 40.78 2qta n ASP 802 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 2qta s TYR 803 N -1.70 2.56 0.78 -0.67 1.51 -1.26 -1.83 117.35 116.73 2qta s TYR 803 Ca 0.15 -0.54 -0.15 0.00 -1.01 0.00 0.00 57.07 55.52 2qta s TYR 803 Cb 0.08 -1.70 0.04 0.00 -0.11 0.00 0.00 41.96 40.26 2qta s TYR 803 CO 0.10 0.38 1.00 0.00 -1.11 0.00 0.00 175.55 175.91 2qta n MET 804 N -1.05 0.30 -0.20 -0.62 0.00 -0.05 -0.89 117.12 114.61 2qta n MET 804 Ca -0.03 0.17 0.22 0.00 0.00 0.00 0.00 57.70 58.05 2qta n MET 804 Cb 0.64 -2.26 0.58 0.00 0.00 0.00 0.00 33.22 32.18 2qta n MET 804 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 175.97 176.84 2qta h LYS 805 N -0.63 0.26 -0.02 3.17 1.57 -1.83 -0.63 116.57 118.45 2qta h LYS 805 Ca -0.46 -0.02 0.01 0.00 -1.87 0.00 0.00 60.65 58.31 2qta h LYS 805 Cb 1.32 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 33.57 2qta h LYS 805 CO 0.45 0.17 0.02 1.25 -0.57 0.00 0.00 179.45 180.77 2qta h LEU 806 N 0.26 0.00 -0.95 2.94 5.85 -1.95 0.10 115.31 121.56 2qta h LEU 806 Ca 0.44 0.00 0.05 0.00 0.84 0.00 0.00 57.88 59.21 2qta h LEU 806 Cb 1.29 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 42.25 2qta h LEU 806 CO -0.12 0.00 0.61 0.15 -0.34 0.00 0.00 178.44 178.75 2qta h PHE 807 N 0.00 1.14 0.00 1.25 3.57 -1.42 -1.31 116.94 120.17 2qta h PHE 807 Ca 0.01 0.03 -0.14 0.00 3.53 0.00 0.00 57.97 61.40 2qta h PHE 807 Cb 0.05 -0.38 -0.02 0.00 2.79 0.00 0.00 35.95 38.39 2qta h PHE 807 CO 0.00 0.61 -1.74 0.00 -2.23 0.00 0.00 178.31 174.95 2qta n ALA 808 N -2.36 2.19 0.26 2.41 0.00 -0.74 -4.13 120.51 118.14 2qta n ALA 808 Ca 0.14 -0.66 0.14 0.00 0.00 0.00 0.00 53.44 53.06 2qta n ALA 808 Cb 0.15 -0.75 0.61 0.00 0.00 0.00 0.00 19.45 19.45 2qta n ALA 808 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2qta h GLU 809 N 0.00 0.00 0.00 0.00 4.81 -0.43 -3.15 114.58 115.82 2qta h GLU 809 Ca -0.17 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.06 2qta h GLU 809 Cb 1.46 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.84 2qta h GLU 809 CO 0.02 0.09 0.00 -0.56 -0.73 0.00 0.00 179.01 177.83 2qta h GLN 810 N 0.00 0.00 -0.33 1.92 3.07 -1.40 -1.50 115.11 116.87 2qta h GLN 810 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 2qta h GLN 810 Cb 0.59 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.15 2qta h GLN 810 CO 0.01 0.00 0.00 1.33 0.09 0.00 0.00 178.83 180.26 2qta n VAL 811 N -2.76 0.44 -0.25 1.86 0.24 -1.19 -4.63 118.33 112.04 2qta n VAL 811 Ca -0.02 -0.72 0.01 0.00 -2.04 0.00 0.00 64.34 61.56 2qta n VAL 811 Cb 0.06 1.05 0.08 0.00 -1.47 0.00 0.00 33.84 33.56 2qta n VAL 811 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 2qta h ARG 812 N 4.39 -0.01 -0.26 7.34 9.65 -1.46 0.17 114.38 134.19 2qta h ARG 812 Ca 0.00 0.00 0.08 0.00 -1.10 0.00 0.00 59.98 58.96 2qta h ARG 812 Cb 0.97 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.54 2qta h ARG 812 CO 0.00 -0.01 0.22 1.15 2.80 0.00 0.00 179.97 184.13 2qta h THR 813 N -0.01 0.69 0.00 0.20 2.02 -1.82 -2.55 112.91 111.43 2qta h THR 813 Ca 0.34 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.52 2qta h THR 813 Cb 0.54 0.84 0.00 0.00 -1.74 0.00 0.00 68.15 67.78 2qta h THR 813 CO -0.75 0.00 -1.34 -1.22 0.37 0.00 0.00 175.52 172.58 2qta n TYR 814 N -4.18 0.12 -2.20 3.16 4.01 -0.01 -4.90 117.16 113.16 2qta n TYR 814 Ca 0.03 0.03 -0.43 0.00 -0.16 0.00 0.00 57.90 57.38 2qta n TYR 814 Cb 0.37 -0.34 -0.02 0.00 -0.31 0.00 0.00 39.34 39.04 2qta n TYR 814 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 2qta s VAL 815 N -3.25 3.90 -2.00 -0.72 1.01 -0.84 -4.07 120.40 114.43 2qta s VAL 815 Ca 0.01 1.09 0.00 0.00 0.00 0.00 0.00 61.98 63.08 2qta s VAL 815 Cb 0.15 -3.71 0.01 0.00 0.00 0.00 0.00 36.38 32.83 2qta s VAL 815 CO 0.86 -0.10 0.55 -0.81 0.00 0.00 0.00 175.10 175.60 2qta n PRO 816 N 6.90 0.54 -4.12 2.72 -0.04 -1.26 -4.78 135.00 134.96 2qta n PRO 816 Ca 0.16 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.30 2qta n PRO 816 Cb 0.44 -1.01 -0.07 0.00 -0.04 0.00 0.00 33.50 32.82 2qta n PRO 816 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2qta s ALA 817 N -2.00 3.50 0.19 0.55 0.00 -1.25 -4.23 121.76 118.53 2qta s ALA 817 Ca 0.00 -0.95 -0.06 0.00 0.00 0.00 0.00 51.96 50.95 2qta s ALA 817 Cb 0.00 -1.46 0.12 0.00 0.00 0.00 0.00 23.12 21.78 2qta s ALA 817 CO 0.00 0.71 1.56 -0.44 0.00 0.00 0.00 175.76 177.59 2qta h ASP 818 N 3.79 0.79 -3.31 0.00 3.32 -1.87 -3.42 116.42 115.73 2qta h ASP 818 Ca -0.48 -0.34 -0.63 0.00 0.02 0.00 0.00 57.03 55.60 2qta h ASP 818 Cb 1.17 -0.22 -0.21 0.00 0.22 0.00 0.00 39.33 40.30 2qta h ASP 818 CO 0.63 1.07 -0.65 -0.62 -1.72 0.00 0.00 179.24 177.94 2qta s ASP 819 N -6.82 4.95 -0.14 6.45 2.15 -1.26 -5.05 116.67 116.94 2qta s ASP 819 Ca -0.09 -0.09 -0.04 0.00 0.43 0.00 0.00 52.55 52.76 2qta s ASP 819 Cb 0.12 -1.82 0.06 0.00 -0.30 0.00 0.00 42.92 40.99 2qta s ASP 819 CO 0.85 0.16 0.16 -0.47 -0.17 0.00 0.00 175.17 175.70 2qta s TYR 820 N 0.39 -0.10 -0.11 -5.34 5.04 -1.25 -1.21 117.35 114.76 2qta s TYR 820 Ca -0.03 0.23 -0.01 0.00 -2.44 0.00 0.00 57.07 54.83 2qta s TYR 820 Cb -0.14 -0.41 -0.02 0.00 0.35 0.00 0.00 41.96 41.73 2qta s TYR 820 CO 0.02 -0.43 -0.08 0.50 -1.34 0.00 0.00 175.55 174.22 2qta s ARG 821 N 2.26 3.24 -0.10 4.97 6.06 0.06 -5.00 118.95 130.43 2qta s ARG 821 Ca 0.04 -0.59 0.03 0.00 -2.50 0.00 0.00 55.73 52.70 2qta s ARG 821 Cb -0.14 -2.69 -0.01 0.00 0.06 0.00 0.00 34.95 32.17 2qta s ARG 821 CO -0.08 0.38 -0.20 0.08 -2.50 0.00 0.00 175.30 172.98 2qta s VAL 822 N -0.05 2.46 0.10 7.11 1.01 -1.26 -0.63 120.40 129.14 2qta s VAL 822 Ca -0.01 -0.88 0.04 0.00 0.00 0.00 0.00 61.98 61.13 2qta s VAL 822 Cb -0.14 -1.97 -0.04 0.00 0.00 0.00 0.00 36.38 34.23 2qta s VAL 822 CO 0.03 0.55 0.07 -0.76 0.00 0.00 0.00 175.10 174.99 2qta s LEU 823 N 0.25 3.70 0.19 3.92 1.43 0.65 -4.96 118.68 123.86 2qta s LEU 823 Ca -0.13 -0.08 -0.23 0.00 -1.03 0.00 0.00 54.13 52.65 2qta s LEU 823 Cb -0.17 -2.38 0.06 0.00 0.03 0.00 0.00 46.19 43.73 2qta s LEU 823 CO 0.07 0.15 0.95 -0.83 0.23 0.00 0.00 176.35 176.92 2qta s GLY 824 N -2.50 -0.10 -0.47 -3.19 0.00 -1.26 -3.40 107.32 96.39 2qta s GLY 824 Ca 0.29 -0.07 -0.00 0.00 0.00 0.00 0.00 44.72 44.94 2qta s GLY 824 CO 0.21 0.49 1.94 -1.30 0.00 0.00 0.00 173.10 174.43 2qta n THR 825 N -0.52 3.11 -1.64 0.90 -2.24 -0.07 -4.68 114.28 109.14 2qta n THR 825 Ca -0.05 -2.13 -0.42 0.00 -2.27 0.00 0.00 64.05 59.18 2qta n THR 825 Cb 0.60 -1.04 0.00 0.00 -2.10 0.00 0.00 70.33 67.79 2qta n THR 825 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2qta n ASP 826 N -0.51 1.76 0.00 3.42 9.92 -1.26 -4.58 116.55 125.30 2qta n ASP 826 Ca 0.49 1.11 0.00 0.00 -0.53 0.00 0.00 54.79 55.86 2qta n ASP 826 Cb 0.86 -1.39 0.00 0.00 -0.64 0.00 0.00 41.12 39.96 2qta n ASP 826 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2qta n GLY 827 N 1.05 2.86 3.76 0.44 0.00 -1.26 -3.44 105.19 108.60 2qta n GLY 827 Ca 0.08 -1.94 -0.40 0.00 0.00 0.00 0.00 46.02 43.75 2qta n GLY 827 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2qta s PHE 828 N -2.97 3.36 1.04 1.61 0.08 -1.26 -4.96 117.98 114.88 2qta s PHE 828 Ca 0.00 1.58 -0.15 0.00 0.12 0.00 0.00 56.93 58.49 2qta s PHE 828 Cb 0.00 -3.45 0.21 0.00 -0.57 0.00 0.00 43.02 39.21 2qta s PHE 828 CO 0.00 -1.09 1.12 0.20 -0.10 0.00 0.00 175.22 175.35 2qta s GLY 829 N -0.72 1.58 0.10 4.36 0.00 -1.26 -4.97 107.32 106.42 2qta s GLY 829 Ca 0.46 -0.63 -0.26 0.00 0.00 0.00 0.00 44.72 44.30 2qta s GLY 829 CO 0.46 0.07 0.83 1.09 0.00 0.00 0.00 173.10 175.54 2qta s ARG 830 N -5.22 1.12 -0.08 2.90 1.70 -1.26 -3.29 118.95 114.83 2qta s ARG 830 Ca 0.67 -0.50 -0.23 0.00 -0.47 0.00 0.00 55.73 55.19 2qta s ARG 830 Cb -0.14 0.45 -0.03 0.00 -0.57 0.00 0.00 34.95 34.66 2qta s ARG 830 CO 0.56 -0.50 0.71 -1.12 -1.08 0.00 0.00 175.30 173.87 2qta s SER 831 N -2.71 6.98 0.04 -2.89 0.01 -1.26 -4.16 113.70 109.70 2qta s SER 831 Ca 0.07 1.18 -0.14 0.00 1.31 0.00 0.00 55.95 58.36 2qta s SER 831 Cb -0.02 -2.41 0.05 0.00 0.21 0.00 0.00 66.02 63.85 2qta s SER 831 CO -0.05 -0.14 0.66 -0.67 0.41 0.00 0.00 173.24 173.44 2qta n ASP 832 N 3.92 -0.79 -4.81 2.44 -0.08 -0.70 -4.98 116.55 111.55 2qta n ASP 832 Ca -0.01 -1.29 -0.31 0.00 -1.51 0.00 0.00 54.79 51.67 2qta n ASP 832 Cb 0.51 1.26 0.06 0.00 2.34 0.00 0.00 41.12 45.29 2qta n ASP 832 CO 0.00 0.00 0.00 -0.94 0.12 0.00 0.00 177.20 176.38 2qta s SER 833 N -2.49 5.17 0.22 1.67 1.04 -1.26 -3.68 113.70 114.37 2qta s SER 833 Ca 0.15 1.63 -0.09 0.00 0.48 0.00 0.00 55.95 58.13 2qta s SER 833 Cb -0.01 -2.47 0.21 0.00 0.10 0.00 0.00 66.02 63.85 2qta s SER 833 CO 0.01 -1.58 1.88 0.03 0.98 0.00 0.00 173.24 174.57 2qta h ARG 834 N -0.81 1.03 -0.31 4.02 3.08 -1.92 -1.70 114.38 117.77 2qta h ARG 834 Ca -0.44 -0.06 0.02 0.00 0.07 0.00 0.00 59.98 59.57 2qta h ARG 834 Cb 1.22 -0.23 -0.03 0.00 0.08 0.00 0.00 29.97 31.01 2qta h ARG 834 CO 0.56 0.68 0.15 1.49 -1.07 0.00 0.00 179.97 181.79 2qta h GLU 835 N 1.06 0.31 -0.78 0.04 4.81 -1.92 0.03 114.58 118.14 2qta h GLU 835 Ca 0.31 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.47 2qta h GLU 835 Cb -0.07 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.21 2qta h GLU 835 CO -0.09 0.21 0.30 -0.91 -0.73 0.00 0.00 179.01 177.79 2qta h ASN 836 N 0.32 1.09 0.08 1.04 2.35 -1.87 -1.95 115.58 116.65 2qta h ASN 836 Ca 0.13 -0.18 -0.13 0.00 -0.55 0.00 0.00 56.30 55.57 2qta h ASN 836 Cb 0.05 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.13 2qta h ASN 836 CO -0.09 0.97 -0.43 -0.07 -1.65 0.00 0.00 177.43 176.16 2qta h LEU 837 N 1.14 0.46 -1.02 1.61 3.38 -0.94 0.24 115.31 120.19 2qta h LEU 837 Ca 0.26 -0.21 -0.09 0.00 0.09 0.00 0.00 57.88 57.93 2qta h LEU 837 Cb 0.23 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 2qta h LEU 837 CO -0.02 0.84 -0.42 0.03 0.09 0.00 0.00 178.44 178.96 2qta h ARG 838 N 0.36 0.00 0.16 1.13 3.08 -0.74 0.84 114.38 119.21 2qta h ARG 838 Ca 0.03 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 59.85 2qta h ARG 838 Cb 0.90 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.98 2qta h ARG 838 CO 0.08 0.42 -1.00 1.25 -1.07 0.00 0.00 179.97 179.65 2qta h HIS 839 N 0.00 0.63 -0.46 3.04 2.76 -1.12 -2.27 115.15 117.72 2qta h HIS 839 Ca -0.00 -0.46 0.03 0.00 -2.20 0.00 0.00 60.37 57.74 2qta h HIS 839 Cb 0.87 -0.03 -0.04 0.00 1.55 0.00 0.00 27.41 29.77 2qta h HIS 839 CO 0.00 1.38 0.25 1.25 -1.30 0.00 0.00 177.93 179.51 2qta h HIS 840 N -0.26 0.47 -0.00 5.26 -0.00 -0.23 -1.94 115.15 118.45 2qta h HIS 840 Ca -0.18 0.02 0.00 0.00 -0.00 0.00 0.00 60.37 60.21 2qta h HIS 840 Cb 1.76 -0.14 0.00 0.00 -0.00 0.00 0.00 27.41 29.03 2qta h HIS 840 CO 0.18 0.25 0.00 1.19 -0.00 0.00 0.00 177.93 179.55 2qta n PHE 841 N -4.87 0.00 -3.64 5.26 3.72 0.26 -4.73 117.46 113.47 2qta n PHE 841 Ca 0.03 -0.00 -0.22 0.00 -0.05 0.00 0.00 57.45 57.21 2qta n PHE 841 Cb 0.09 0.00 0.06 0.00 -0.94 0.00 0.00 39.48 38.69 2qta n PHE 841 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 2qta n GLU 842 N -0.91 -5.91 0.00 -1.08 1.02 -0.73 -4.56 120.64 108.46 2qta n GLU 842 Ca 0.20 0.71 0.00 0.00 -0.02 0.00 0.00 57.16 58.06 2qta n GLU 842 Cb 0.09 -5.52 0.00 0.00 -0.02 0.00 0.00 31.44 25.99 2qta n GLU 842 CO 0.00 0.00 0.00 1.33 1.18 0.00 0.00 177.13 179.64 2qta n VAL 843 N -4.38 0.00 -1.66 2.62 0.24 -0.89 -4.54 118.33 109.73 2qta n VAL 843 Ca -0.21 -0.36 -0.30 0.00 -2.04 0.00 0.00 64.34 61.43 2qta n VAL 843 Cb 0.64 1.21 0.21 0.00 -1.47 0.00 0.00 33.84 34.43 2qta n VAL 843 CO 0.00 0.00 0.00 1.51 -2.14 0.00 0.00 176.83 176.20 2qta s ASP 844 N -0.18 2.27 0.22 -1.34 1.47 -1.01 -4.70 116.67 113.41 2qta s ASP 844 Ca 0.00 0.34 -0.08 0.00 1.18 0.00 0.00 52.55 53.99 2qta s ASP 844 Cb 0.00 -0.40 0.35 0.00 -0.34 0.00 0.00 42.92 42.52 2qta s ASP 844 CO 0.00 -3.26 1.73 0.00 0.68 0.00 0.00 175.17 174.32 2qta h ALA 845 N -2.00 0.88 -0.90 2.11 0.00 -1.93 -1.16 119.26 116.25 2qta h ALA 845 Ca -0.44 0.10 0.02 0.00 0.00 0.00 0.00 54.91 54.59 2qta h ALA 845 Cb 1.25 0.08 -0.05 0.00 0.00 0.00 0.00 17.79 19.07 2qta h ALA 845 CO 0.34 -0.21 0.60 0.66 0.00 0.00 0.00 179.25 180.64 2qta h SER 846 N 0.41 1.02 0.15 0.00 4.64 -1.92 -0.01 113.55 117.84 2qta h SER 846 Ca 0.35 -0.02 -0.17 0.00 -0.47 0.00 0.00 61.79 61.48 2qta h SER 846 Cb 0.48 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 62.31 2qta h SER 846 CO -0.36 0.73 -0.61 1.88 -0.87 0.00 0.00 176.83 177.60 2qta h TYR 847 N 1.20 0.59 -0.39 4.77 -1.99 -1.65 -1.69 116.97 117.81 2qta h TYR 847 Ca 0.34 -0.23 -0.01 0.00 2.00 0.00 0.00 58.73 60.83 2qta h TYR 847 Cb -0.10 -0.10 -0.02 0.00 2.00 0.00 0.00 36.73 38.51 2qta h TYR 847 CO -0.00 0.95 0.19 0.28 -0.00 0.00 0.00 178.16 179.59 2qta h VAL 848 N 0.34 1.17 -0.06 -2.88 2.07 -0.31 0.41 116.25 116.99 2qta h VAL 848 Ca -0.01 -0.48 0.01 0.00 0.82 0.00 0.00 66.70 67.05 2qta h VAL 848 Cb 1.16 0.76 -0.01 0.00 -1.52 0.00 0.00 31.29 31.68 2qta h VAL 848 CO 0.11 0.18 -0.02 0.58 0.02 0.00 0.00 177.57 178.44 2qta h VAL 849 N 0.50 0.93 -0.56 2.57 2.07 -0.95 0.64 116.25 121.45 2qta h VAL 849 Ca 0.14 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.65 2qta h VAL 849 Cb 0.11 0.93 -0.03 0.00 -1.52 0.00 0.00 31.29 30.78 2qta h VAL 849 CO -0.02 0.00 0.33 0.58 0.02 0.00 0.00 177.57 178.49 2qta h VAL 850 N -0.01 1.16 -0.48 2.57 2.07 -1.11 -0.00 116.25 120.45 2qta h VAL 850 Ca 0.03 -0.36 -0.12 0.00 0.82 0.00 0.00 66.70 67.07 2qta h VAL 850 Cb 0.05 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 30.19 2qta h VAL 850 CO -0.07 0.17 -0.17 0.00 0.02 0.00 0.00 177.57 177.52 2qta h ALA 851 N 1.60 0.67 -0.26 1.67 0.00 -0.28 -1.28 119.26 121.37 2qta h ALA 851 Ca 0.20 -0.37 -0.05 0.00 0.00 0.00 0.00 54.91 54.69 2qta h ALA 851 Cb -0.02 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2qta h ALA 851 CO -0.04 0.62 -0.03 0.00 0.00 0.00 0.00 179.25 179.81 2qta h ALA 852 N 0.88 0.35 -0.29 0.00 0.00 -0.14 -2.63 119.26 117.42 2qta h ALA 852 Ca 0.12 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 2qta h ALA 852 Cb 0.74 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 2qta h ALA 852 CO 0.06 0.12 0.04 -0.07 0.00 0.00 0.00 179.25 179.40 2qta h LEU 853 N 0.24 0.39 -1.25 0.00 3.38 -0.98 -2.16 115.31 114.94 2qta h LEU 853 Ca 0.07 -0.05 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 2qta h LEU 853 Cb 0.47 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 2qta h LEU 853 CO 0.02 0.42 0.06 1.23 0.09 0.00 0.00 178.44 180.26 2qta h GLY 854 N 0.69 0.61 1.18 0.83 0.00 -0.89 -0.35 103.07 105.15 2qta h GLY 854 Ca 0.10 -0.34 -0.25 0.00 0.00 0.00 0.00 47.33 46.84 2qta h GLY 854 CO 0.00 0.32 -0.94 0.83 0.00 0.00 0.00 176.54 176.75 2qta h GLU 855 N 0.55 0.72 0.00 4.80 5.08 -1.10 -2.39 114.58 122.25 2qta h GLU 855 Ca 0.12 -0.72 -0.02 0.00 -1.00 0.00 0.00 59.36 57.75 2qta h GLU 855 Cb 0.27 0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.71 2qta h GLU 855 CO 0.00 1.30 -0.07 -0.07 -1.00 0.00 0.00 179.01 179.17 2qta h LEU 856 N 0.42 0.00 0.10 1.33 3.38 -1.04 -2.15 115.31 117.35 2qta h LEU 856 Ca -0.10 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.58 2qta h LEU 856 Cb 1.59 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.33 2qta h LEU 856 CO 0.19 0.07 -1.37 0.00 0.09 0.00 0.00 178.44 177.43 2qta h ALA 857 N 1.93 0.25 0.00 1.53 0.00 -0.95 -2.03 119.26 119.99 2qta h ALA 857 Ca -0.00 -1.03 0.00 0.00 0.00 0.00 0.00 54.91 53.88 2qta h ALA 857 Cb 0.30 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.23 2qta h ALA 857 CO 0.01 1.13 0.00 1.63 0.00 0.00 0.00 179.25 182.01 2qta n LYS 858 N -3.44 0.10 0.00 0.00 5.02 -0.84 -1.48 118.16 117.53 2qta n LYS 858 Ca -0.11 0.33 0.11 0.00 -2.02 0.00 0.00 58.31 56.61 2qta n LYS 858 Cb 1.02 -1.69 -0.03 0.00 -0.02 0.00 0.00 35.03 34.32 2qta n LYS 858 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2qta n ARG 859 N -1.89 0.90 0.00 1.97 1.74 -1.03 -4.97 116.66 113.39 2qta n ARG 859 Ca 0.03 -0.75 0.00 0.00 -0.77 0.00 0.00 57.85 56.36 2qta n ARG 859 Cb 0.21 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.17 2qta n ARG 859 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2qta n GLY 860 N 1.44 2.68 0.25 -0.13 0.00 -0.55 -4.90 105.19 103.98 2qta n GLY 860 Ca 0.08 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.24 2qta n GLY 860 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2qta h GLU 861 N 2.20 0.00 -3.75 1.61 5.08 -1.61 -3.42 114.58 114.69 2qta h GLU 861 Ca 0.00 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.28 2qta h GLU 861 Cb 0.00 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 29.11 2qta h GLU 861 CO 0.00 0.00 -0.33 0.96 -1.00 0.00 0.00 179.01 178.64 2qta s ILE 862 N -3.78 0.13 0.11 3.13 -4.36 -1.15 -4.98 121.20 110.30 2qta s ILE 862 Ca -0.03 -1.09 -0.30 0.00 -0.26 0.00 0.00 60.65 58.97 2qta s ILE 862 Cb 0.08 -1.31 -0.06 0.00 1.25 0.00 0.00 42.46 42.42 2qta s ILE 862 CO 0.24 -0.60 0.99 -0.62 0.24 0.00 0.00 174.94 175.19 2qta s ASP 863 N -2.84 7.44 0.54 4.36 -1.08 -1.26 -4.45 116.67 119.37 2qta s ASP 863 Ca 0.04 1.83 0.37 0.00 -0.52 0.00 0.00 52.55 54.28 2qta s ASP 863 Cb 0.04 -2.59 1.55 0.00 -1.46 0.00 0.00 42.92 40.46 2qta s ASP 863 CO -0.11 -0.12 1.79 0.11 0.52 0.00 0.00 175.17 177.35 2qta h LYS 864 N 5.67 0.02 -0.20 4.34 1.57 -1.96 0.36 116.57 126.37 2qta h LYS 864 Ca -0.43 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.35 2qta h LYS 864 Cb 1.21 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.51 2qta h LYS 864 CO 0.73 0.01 0.13 -0.22 -0.57 0.00 0.00 179.45 179.53 2qta h LYS 865 N 0.02 0.26 -0.20 3.15 3.64 -1.99 -1.01 116.57 120.45 2qta h LYS 865 Ca 0.59 -0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 59.86 2qta h LYS 865 Cb 2.33 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 34.08 2qta h LYS 865 CO -0.02 0.18 -0.29 -0.39 -2.27 0.00 0.00 179.45 176.66 2qta h VAL 866 N 0.27 1.27 -0.23 2.00 -1.51 -0.64 0.12 116.25 117.52 2qta h VAL 866 Ca 0.07 -1.29 -0.18 0.00 -1.23 0.00 0.00 66.70 64.07 2qta h VAL 866 Cb -0.03 1.44 0.00 0.00 -2.13 0.00 0.00 31.29 30.57 2qta h VAL 866 CO -0.02 0.40 -0.57 -0.37 -1.23 0.00 0.00 177.57 175.78 2qta h VAL 867 N 0.33 1.29 -0.83 7.19 -1.51 -1.29 -0.67 116.25 120.76 2qta h VAL 867 Ca 0.05 -1.77 0.01 0.00 -1.23 0.00 0.00 66.70 63.76 2qta h VAL 867 Cb 0.68 1.78 -0.04 0.00 -2.13 0.00 0.00 31.29 31.58 2qta h VAL 867 CO 0.05 0.57 0.55 0.00 -1.23 0.00 0.00 177.57 177.51 2qta h ALA 868 N 0.62 1.05 -0.18 5.19 0.00 -0.83 -1.19 119.26 123.93 2qta h ALA 868 Ca -0.01 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.74 2qta h ALA 868 Cb 1.19 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 2qta h ALA 868 CO 0.12 0.45 -0.36 -0.44 0.00 0.00 0.00 179.25 179.03 2qta h ASP 869 N 1.12 0.38 -0.53 0.00 3.32 -0.65 -2.67 116.42 117.39 2qta h ASP 869 Ca 0.30 -0.15 -0.09 0.00 0.02 0.00 0.00 57.03 57.11 2qta h ASP 869 Cb -0.13 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 39.30 2qta h ASP 869 CO -0.07 0.72 -0.02 0.00 -1.72 0.00 0.00 179.24 178.15 2qta h ALA 870 N 1.31 0.72 -0.50 3.45 0.00 -0.33 0.15 119.26 124.05 2qta h ALA 870 Ca 0.04 -0.31 0.05 0.00 0.00 0.00 0.00 54.91 54.69 2qta h ALA 870 Cb 0.78 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 2qta h ALA 870 CO 0.06 0.56 0.25 0.82 0.00 0.00 0.00 179.25 180.93 2qta h ILE 871 N 0.82 0.95 -0.18 0.00 2.04 -0.98 -0.73 117.51 119.43 2qta h ILE 871 Ca 0.15 -0.16 -0.07 0.00 1.00 0.00 0.00 64.86 65.78 2qta h ILE 871 Cb 0.56 0.42 -0.00 0.00 -0.74 0.00 0.00 36.82 37.06 2qta h ILE 871 CO 0.03 0.09 -0.15 0.00 0.00 0.00 0.00 178.15 178.12 2qta h ALA 872 N 1.28 0.25 -0.79 1.87 0.00 -1.34 -1.79 119.26 118.74 2qta h ALA 872 Ca 0.22 -0.33 0.17 0.00 0.00 0.00 0.00 54.91 54.98 2qta h ALA 872 Cb 0.14 -0.06 -0.11 0.00 0.00 0.00 0.00 17.79 17.77 2qta h ALA 872 CO -0.16 0.14 0.27 -0.22 0.00 0.00 0.00 179.25 179.28 2qta h LYS 873 N 0.07 0.35 -0.27 0.00 3.64 -0.59 -0.71 116.57 119.06 2qta h LYS 873 Ca 0.03 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 2qta h LYS 873 Cb 0.68 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.42 2qta h LYS 873 CO 0.04 0.23 0.00 1.19 -2.27 0.00 0.00 179.45 178.64 2qta n PHE 874 N -5.08 0.35 -3.67 1.91 3.72 -0.31 -4.93 117.46 109.44 2qta n PHE 874 Ca 0.16 -0.18 -0.25 0.00 -0.05 0.00 0.00 57.45 57.13 2qta n PHE 874 Cb 0.50 0.00 0.03 0.00 -0.94 0.00 0.00 39.48 39.07 2qta n PHE 874 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 2qta n ASN 875 N 0.31 -3.38 -4.57 4.37 3.02 -0.27 -4.94 115.26 109.80 2qta n ASN 875 Ca 0.11 -0.91 -0.36 0.00 -0.03 0.00 0.00 54.58 53.39 2qta n ASN 875 Cb 0.25 -3.78 -0.11 0.00 -0.61 0.00 0.00 39.78 35.54 2qta n ASN 875 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2qta s ILE 876 N -3.60 4.69 -0.71 2.41 1.01 -0.69 -5.04 121.20 119.28 2qta s ILE 876 Ca 0.25 -0.06 -0.24 0.00 0.00 0.00 0.00 60.65 60.60 2qta s ILE 876 Cb -0.08 -3.15 0.06 0.00 0.01 0.00 0.00 42.46 39.30 2qta s ILE 876 CO 0.83 0.40 1.09 -0.62 0.00 0.00 0.00 174.94 176.64 2qta s ASP 877 N 0.94 6.19 0.54 3.58 -1.08 -1.26 -4.71 116.67 120.87 2qta s ASP 877 Ca 0.04 -0.86 0.36 0.00 -0.52 0.00 0.00 52.55 51.57 2qta s ASP 877 Cb -0.14 -2.47 1.84 0.00 -1.46 0.00 0.00 42.92 40.69 2qta s ASP 877 CO 0.03 -1.56 2.10 0.00 0.52 0.00 0.00 175.17 176.25 2qta h ALA 878 N 9.70 1.00 -0.37 3.66 0.00 -1.96 -3.01 119.26 128.29 2qta h ALA 878 Ca -0.25 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.66 2qta h ALA 878 Cb 1.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.85 2qta h ALA 878 CO 1.22 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 180.22 2qta n ASP 879 N -2.86 3.03 -4.75 0.00 8.00 -1.26 -5.00 116.55 113.71 2qta n ASP 879 Ca -0.01 -1.92 -0.32 0.00 0.71 0.00 0.00 54.79 53.25 2qta n ASP 879 Cb 0.13 -0.24 0.09 0.00 -0.02 0.00 0.00 41.12 41.08 2qta n ASP 879 CO 0.00 0.00 0.00 -1.59 -0.39 0.00 0.00 177.20 175.22 2qta s LYS 880 N -1.06 2.22 0.63 -1.24 -2.85 -1.14 -4.93 119.74 111.37 2qta s LYS 880 Ca 0.28 1.38 -0.19 0.00 -1.00 0.00 0.00 55.97 56.45 2qta s LYS 880 Cb 0.15 -1.88 -0.02 0.00 -2.06 0.00 0.00 37.83 34.03 2qta s LYS 880 CO 0.21 -1.70 1.31 0.54 0.10 0.00 0.00 175.35 175.81 2qta s VAL 881 N -2.55 2.04 0.20 1.79 0.11 -1.26 -4.89 120.40 115.84 2qta s VAL 881 Ca 0.66 0.02 -0.32 0.00 -2.93 0.00 0.00 61.98 59.41 2qta s VAL 881 Cb -0.21 -3.01 -0.12 0.00 -1.53 0.00 0.00 36.38 31.51 2qta s VAL 881 CO 0.50 -0.00 1.71 -3.20 -3.33 0.00 0.00 175.10 170.78 2qta n ASN 882 N -1.72 3.89 -0.13 3.54 2.85 -1.26 -4.82 115.26 117.61 2qta n ASN 882 Ca 0.15 1.06 0.25 0.00 -0.11 0.00 0.00 54.58 55.92 2qta n ASN 882 Cb 0.47 -1.56 0.68 0.00 1.24 0.00 0.00 39.78 40.62 2qta n ASN 882 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 2qta h PRO 883 N 6.70 0.06 0.00 1.20 0.11 -1.85 0.96 132.00 139.19 2qta h PRO 883 Ca -0.43 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.65 2qta h PRO 883 Cb 1.21 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 2qta h PRO 883 CO 0.95 0.04 -0.09 -0.09 -0.21 0.00 0.00 178.00 178.60 2qta h ARG 884 N 0.07 0.00 0.00 1.05 2.43 -1.88 -2.72 114.38 113.32 2qta h ARG 884 Ca 0.38 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.55 2qta h ARG 884 Cb 1.41 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.96 2qta h ARG 884 CO -0.03 0.09 -0.99 1.28 -1.51 0.00 0.00 179.97 178.81 2qta n LEU 885 N -4.35 0.84 0.00 3.80 4.32 0.29 -4.52 117.00 117.37 2qta n LEU 885 Ca -0.03 -0.37 0.04 0.00 -0.02 0.00 0.00 56.01 55.64 2qta n LEU 885 Cb 0.17 -0.04 0.26 0.00 -1.62 0.00 0.00 43.42 42.19 2qta n LEU 885 CO 0.34 0.20 0.49 0.00 -1.22 0.00 0.00 177.39 177.20