#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 5.38 0.71 7.28 1.04 -1.26 -5.08 113.70 121.77 2qta s SER 57 Ca 0.00 -0.63 -0.16 0.00 0.48 0.00 0.00 55.95 55.64 2qta s SER 57 Cb 0.00 -0.27 0.02 0.00 0.10 0.00 0.00 66.02 65.87 2qta s SER 57 CO 0.00 -0.97 1.22 0.59 0.98 0.00 0.00 173.24 175.06 2qta n ASN 58 N -1.96 1.51 -2.85 7.02 3.02 -1.26 -4.84 115.26 115.90 2qta n ASN 58 Ca 0.10 0.73 -0.23 0.00 -0.03 0.00 0.00 54.58 55.14 2qta n ASN 58 Cb 0.60 -1.52 -0.06 0.00 -0.61 0.00 0.00 39.78 38.19 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 -2.47 1.25 -4.20 3.10 9.36 -1.26 -4.80 117.16 118.14 2qta n TYR 59 Ca 0.15 -2.08 -0.15 0.00 3.32 0.00 0.00 57.90 59.14 2qta n TYR 59 Cb 0.49 -1.84 -0.08 0.00 -0.63 0.00 0.00 39.34 37.28 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 2.30 0.00 0.36 2.97 -4.36 -1.26 -4.82 121.20 116.39 2qta s ILE 60 Ca 0.54 -1.90 -0.28 0.00 -0.26 0.00 0.00 60.65 58.76 2qta s ILE 60 Cb 0.18 -2.49 -0.12 0.00 1.25 0.00 0.00 42.46 41.28 2qta s ILE 60 CO -0.03 0.00 1.37 0.59 0.24 0.00 0.00 174.94 177.11 2qta n ASN 61 N -0.88 3.17 -0.02 4.36 3.02 -1.26 -4.69 115.26 118.96 2qta n ASN 61 Ca 0.04 1.21 -0.06 0.00 -0.03 0.00 0.00 54.58 55.73 2qta n ASN 61 Cb 0.64 -1.54 0.13 0.00 -0.61 0.00 0.00 39.78 38.39 2qta n ASN 61 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 2qta h THR 62 N 2.66 1.29 -3.51 3.41 2.02 -1.58 -3.41 112.91 113.79 2qta h THR 62 Ca -0.48 -1.44 -0.72 0.00 0.77 0.00 0.00 66.41 64.54 2qta h THR 62 Cb 1.27 1.43 -0.22 0.00 -1.74 0.00 0.00 68.15 68.89 2qta h THR 62 CO 0.63 0.46 -0.44 -0.63 0.37 0.00 0.00 175.52 175.91 2qta s ILE 63 N -4.38 5.14 0.59 3.11 1.01 -1.26 -5.01 121.20 120.39 2qta s ILE 63 Ca -0.08 -0.71 -0.17 0.00 0.00 0.00 0.00 60.65 59.70 2qta s ILE 63 Cb 0.13 -3.87 -0.03 0.00 0.01 0.00 0.00 42.46 38.70 2qta s ILE 63 CO 0.82 -0.30 1.11 -2.16 0.00 0.00 0.00 174.94 174.40 2qta s PRO 64 N 1.66 3.16 0.38 2.79 0.04 -1.26 -4.86 135.00 136.90 2qta s PRO 64 Ca 0.04 1.45 0.17 0.00 0.04 0.00 0.00 61.00 62.70 2qta s PRO 64 Cb -0.19 -1.99 1.08 0.00 0.04 0.00 0.00 34.50 33.44 2qta s PRO 64 CO 0.09 -0.98 1.73 -0.39 0.04 0.00 0.00 177.00 177.50 2qta h VAL 65 N 0.65 0.46 -0.02 -0.36 -1.51 -1.97 -0.36 116.25 113.13 2qta h VAL 65 Ca -0.48 -0.14 0.01 0.00 -1.23 0.00 0.00 66.70 64.86 2qta h VAL 65 Cb 1.25 0.03 -0.00 0.00 -2.13 0.00 0.00 31.29 30.43 2qta h VAL 65 CO 0.56 0.07 0.03 -0.33 -1.23 0.00 0.00 177.57 176.67 2qta h GLU 66 N 0.40 0.00 -0.17 5.19 3.07 -2.03 -2.05 114.58 118.99 2qta h GLU 66 Ca 0.65 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.51 2qta h GLU 66 Cb 1.57 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.48 2qta h GLU 66 CO -0.38 0.00 0.00 0.39 -1.40 0.00 0.00 179.01 177.62 2qta n GLU 67 N -3.81 1.59 -2.53 2.33 1.02 -0.17 -4.97 120.64 114.10 2qta n GLU 67 Ca -0.02 -1.60 -0.42 0.00 -0.02 0.00 0.00 57.16 55.10 2qta n GLU 67 Cb 0.11 -1.27 -0.03 0.00 -0.02 0.00 0.00 31.44 30.23 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 -1.04 4.52 0.71 3.49 0.74 -0.77 -4.97 119.66 122.33 2qta s GLN 68 Ca 0.19 1.66 -0.11 0.00 0.05 0.00 0.00 55.36 57.15 2qta s GLN 68 Cb 0.12 -3.36 0.01 0.00 1.10 0.00 0.00 33.01 30.89 2qta s GLN 68 CO 0.17 -0.10 1.07 -1.25 -0.55 0.00 0.00 175.29 174.63 2qta s PRO 69 N 0.63 2.85 0.28 1.67 0.04 -1.26 -4.99 135.00 134.22 2qta s PRO 69 Ca 0.54 0.69 -0.29 0.00 0.04 0.00 0.00 61.00 61.98 2qta s PRO 69 Cb -0.27 -2.00 -0.10 0.00 0.04 0.00 0.00 34.50 32.17 2qta s PRO 69 CO 0.30 -1.09 1.31 -2.00 0.04 0.00 0.00 177.00 175.56 2qta s GLU 70 N -5.19 4.38 0.06 4.56 2.12 -1.26 -4.92 118.70 118.45 2qta s GLU 70 Ca 0.58 2.16 -0.31 0.00 0.36 0.00 0.00 54.97 57.76 2qta s GLU 70 Cb -0.13 -3.12 -0.07 0.00 0.26 0.00 0.00 34.13 31.08 2qta s GLU 70 CO 0.54 -0.20 1.38 -0.47 -0.54 0.00 0.00 175.26 175.96 2qta s TYR 71 N -0.68 3.10 -0.80 5.30 5.04 -1.26 -4.92 117.35 123.13 2qta s TYR 71 Ca 0.52 0.93 0.27 0.00 -2.44 0.00 0.00 57.07 56.35 2qta s TYR 71 Cb -0.39 -3.65 0.91 0.00 0.35 0.00 0.00 41.96 39.18 2qta s TYR 71 CO 0.47 -2.30 1.80 -0.35 -1.34 0.00 0.00 175.55 173.84 2qta n PRO 72 N 4.52 0.20 -2.92 4.97 -0.04 -1.26 -4.93 135.00 135.53 2qta n PRO 72 Ca 0.12 0.16 -0.20 0.00 -0.04 0.00 0.00 63.50 63.53 2qta n PRO 72 Cb 0.43 -1.72 0.07 0.00 -0.04 0.00 0.00 33.50 32.24 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 -3.43 1.75 -0.76 0.55 0.00 -1.26 -5.04 107.32 99.13 2qta s GLY 73 Ca 0.11 -2.00 -0.17 0.00 0.00 0.00 0.00 44.72 42.66 2qta s GLY 73 CO 0.58 -1.54 0.85 0.21 0.00 0.00 0.00 173.10 173.21 2qta s ASN 74 N -4.66 6.48 0.22 1.64 3.84 -1.26 -4.94 114.94 116.26 2qta s ASN 74 Ca 0.62 -1.97 -0.08 0.00 0.21 0.00 0.00 52.86 51.64 2qta s ASN 74 Cb -0.06 -2.31 0.32 0.00 -0.55 0.00 0.00 41.25 38.66 2qta s ASN 74 CO 0.40 -0.95 1.74 -0.07 -2.79 0.00 0.00 177.10 175.43 2qta h LEU 75 N 9.49 0.21 -0.65 3.21 3.38 -1.96 0.94 115.31 129.93 2qta h LEU 75 Ca -0.04 0.09 -0.13 0.00 0.09 0.00 0.00 57.88 57.89 2qta h LEU 75 Cb 1.05 0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.87 2qta h LEU 75 CO 1.00 0.11 -0.33 -0.33 0.09 0.00 0.00 178.44 178.99 2qta h GLU 76 N 0.40 0.69 -0.22 1.13 5.08 -1.99 -0.12 114.58 119.55 2qta h GLU 76 Ca 0.33 -0.32 -0.20 0.00 -1.00 0.00 0.00 59.36 58.17 2qta h GLU 76 Cb 0.45 -0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.69 2qta h GLU 76 CO -0.34 0.93 -0.66 1.25 -1.00 0.00 0.00 179.01 179.18 2qta h LEU 77 N 0.59 0.96 -0.92 1.33 5.85 -1.91 -2.55 115.31 118.66 2qta h LEU 77 Ca 0.06 -0.57 -0.04 0.00 0.84 0.00 0.00 57.88 58.18 2qta h LEU 77 Cb 0.84 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.56 2qta h LEU 77 CO 0.07 1.37 0.29 -0.33 -0.34 0.00 0.00 178.44 179.50 2qta h GLU 78 N 0.61 1.07 -0.56 1.25 5.08 -0.59 -1.66 114.58 119.78 2qta h GLU 78 Ca -0.02 -0.18 -0.06 0.00 -1.00 0.00 0.00 59.36 58.10 2qta h GLU 78 Cb 1.28 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 30.33 2qta h GLU 78 CO 0.14 0.87 0.12 -0.09 -1.00 0.00 0.00 179.01 179.05 2qta h ARG 79 N 1.05 0.91 0.02 2.33 2.43 -0.96 0.18 114.38 120.35 2qta h ARG 79 Ca 0.24 -0.23 0.01 0.00 -0.81 0.00 0.00 59.98 59.20 2qta h ARG 79 Cb 0.20 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.62 2qta h ARG 79 CO -0.02 0.86 -0.09 0.00 -1.51 0.00 0.00 179.97 179.21 2qta h ARG 80 N 0.81 -0.16 -0.64 0.20 3.08 -1.04 0.26 114.38 116.90 2qta h ARG 80 Ca 0.18 0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.23 2qta h ARG 80 Cb 0.37 0.04 -0.03 0.00 0.08 0.00 0.00 29.97 30.42 2qta h ARG 80 CO 0.00 -0.11 0.36 0.82 -1.07 0.00 0.00 179.97 179.97 2qta h ILE 81 N -0.17 1.20 -0.79 2.04 2.04 -1.09 -2.21 117.51 118.54 2qta h ILE 81 Ca 0.03 -0.50 -0.03 0.00 1.00 0.00 0.00 64.86 65.36 2qta h ILE 81 Cb 0.20 0.36 -0.04 0.00 -0.74 0.00 0.00 36.82 36.61 2qta h ILE 81 CO -0.07 0.22 0.39 -0.09 0.00 0.00 0.00 178.15 178.59 2qta h ARG 82 N 0.87 1.12 -0.13 2.37 2.43 -0.21 -1.97 114.38 118.86 2qta h ARG 82 Ca 0.23 -0.15 -0.06 0.00 -0.81 0.00 0.00 59.98 59.19 2qta h ARG 82 Cb 0.03 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 29.36 2qta h ARG 82 CO -0.04 0.85 -0.18 0.77 -1.51 0.00 0.00 179.97 179.87 2qta h SER 83 N 1.12 0.21 0.33 -3.80 0.02 0.04 -0.79 113.55 110.67 2qta h SER 83 Ca 0.27 -0.05 -0.15 0.00 -0.84 0.00 0.00 61.79 61.03 2qta h SER 83 Cb 0.09 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.57 2qta h SER 83 CO -0.04 0.40 -0.61 0.00 -1.14 0.00 0.00 176.83 175.45 2qta h ALA 84 N 1.62 0.82 -0.19 3.77 0.00 -0.80 -1.90 119.26 122.58 2qta h ALA 84 Ca 0.04 -0.55 -0.09 0.00 0.00 0.00 0.00 54.91 54.31 2qta h ALA 84 Cb 0.44 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 2qta h ALA 84 CO 0.03 0.73 -0.23 0.82 0.00 0.00 0.00 179.25 180.59 2qta h ILE 85 N 0.20 1.34 -0.50 0.00 2.04 -0.77 -1.34 117.51 118.48 2qta h ILE 85 Ca -0.01 -1.42 0.06 0.00 1.00 0.00 0.00 64.86 64.49 2qta h ILE 85 Cb 1.12 1.82 -0.05 0.00 -0.74 0.00 0.00 36.82 38.97 2qta h ILE 85 CO 0.10 0.43 0.21 0.03 0.00 0.00 0.00 178.15 178.92 2qta h ARG 86 N 0.15 0.40 0.75 2.37 3.08 -1.08 -0.41 114.38 119.64 2qta h ARG 86 Ca 0.02 -0.02 -0.03 0.00 0.07 0.00 0.00 59.98 60.02 2qta h ARG 86 Cb 0.79 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.76 2qta h ARG 86 CO 0.06 0.26 -0.41 2.35 -1.07 0.00 0.00 179.97 181.16 2qta h TRP 87 N 0.41 -1.07 -0.50 3.04 2.91 -1.29 -1.45 115.95 117.99 2qta h TRP 87 Ca 0.23 -0.02 0.06 0.00 1.13 0.00 0.00 58.89 60.30 2qta h TRP 87 Cb 0.21 0.37 -0.03 0.00 -0.51 0.00 0.00 29.16 29.19 2qta h TRP 87 CO -0.14 -0.63 0.34 -0.91 -1.03 0.00 0.00 178.44 176.07 2qta h ASN 88 N -1.07 0.37 -0.27 2.65 2.35 -1.01 0.24 115.58 118.84 2qta h ASN 88 Ca -0.10 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.63 2qta h ASN 88 Cb 0.84 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 39.12 2qta h ASN 88 CO 0.13 0.24 0.07 0.00 -1.65 0.00 0.00 177.43 176.22 2qta h ALA 89 N 1.73 0.35 -0.30 -0.83 0.00 -0.83 0.20 119.26 119.59 2qta h ALA 89 Ca 0.22 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 2qta h ALA 89 Cb 0.34 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2qta h ALA 89 CO -0.06 0.00 0.05 0.82 0.00 0.00 0.00 179.25 180.06 2qta h ILE 90 N 0.27 1.23 -0.88 0.00 2.04 -0.19 -2.54 117.51 117.43 2qta h ILE 90 Ca 0.09 -0.80 0.06 0.00 1.00 0.00 0.00 64.86 65.20 2qta h ILE 90 Cb 0.27 1.18 -0.06 0.00 -0.74 0.00 0.00 36.82 37.47 2qta h ILE 90 CO -0.00 0.26 0.56 0.24 0.00 0.00 0.00 178.15 179.21 2qta h MET 91 N 0.32 1.00 0.11 2.37 2.86 -0.40 0.20 114.93 121.39 2qta h MET 91 Ca 0.09 -0.06 0.01 0.00 -2.06 0.00 0.00 59.70 57.68 2qta h MET 91 Cb 0.34 -0.23 -0.02 0.00 0.06 0.00 0.00 31.60 31.76 2qta h MET 91 CO 0.01 0.66 -0.16 1.15 1.06 0.00 0.00 176.91 179.63 2qta h THR 92 N 1.03 0.64 -0.45 2.22 2.02 -0.75 -0.38 112.91 117.24 2qta h THR 92 Ca 0.38 0.00 -0.12 0.00 0.77 0.00 0.00 66.41 67.44 2qta h THR 92 Cb 0.13 0.64 -0.01 0.00 -1.74 0.00 0.00 68.15 67.17 2qta h THR 92 CO -0.16 0.00 -0.18 0.58 0.37 0.00 0.00 175.52 176.13 2qta h VAL 93 N -0.32 1.27 -0.48 3.16 2.07 -1.07 -2.70 116.25 118.18 2qta h VAL 93 Ca 0.02 -1.33 -0.09 0.00 0.82 0.00 0.00 66.70 66.12 2qta h VAL 93 Cb 0.33 1.17 -0.02 0.00 -1.52 0.00 0.00 31.29 31.25 2qta h VAL 93 CO -0.07 0.46 -0.04 -0.07 0.02 0.00 0.00 177.57 177.86 2qta h LEU 94 N 0.77 0.81 -0.79 2.57 3.38 -0.86 -0.73 115.31 120.45 2qta h LEU 94 Ca 0.11 -0.22 -0.04 0.00 0.09 0.00 0.00 57.88 57.81 2qta h LEU 94 Cb 0.75 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 41.25 2qta h LEU 94 CO 0.06 0.90 0.33 0.03 0.09 0.00 0.00 178.44 179.85 2qta h ARG 95 N 0.77 1.18 -0.69 1.13 3.08 -1.01 -0.76 114.38 118.07 2qta h ARG 95 Ca 0.14 -0.20 -0.02 0.00 0.07 0.00 0.00 59.98 59.97 2qta h ARG 95 Cb 0.52 -0.20 -0.03 0.00 0.08 0.00 0.00 29.97 30.35 2qta h ARG 95 CO 0.03 0.94 0.35 0.00 -1.07 0.00 0.00 179.97 180.22 2qta h ALA 96 N 1.17 0.88 -0.70 0.04 0.00 -1.12 -2.79 119.26 116.74 2qta h ALA 96 Ca 0.27 -0.13 0.01 0.00 0.00 0.00 0.00 54.91 55.06 2qta h ALA 96 Cb 0.19 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 2qta h ALA 96 CO -0.02 0.42 0.46 0.77 0.00 0.00 0.00 179.25 180.88 2qta h SER 97 N 0.95 0.79 -0.20 0.00 0.02 -0.47 -2.57 113.55 112.06 2qta h SER 97 Ca 0.24 -0.02 0.06 0.00 -0.84 0.00 0.00 61.79 61.23 2qta h SER 97 Cb 0.08 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.42 2qta h SER 97 CO -0.03 0.57 0.19 0.11 -1.14 0.00 0.00 176.83 176.52 2qta h LYS 98 N 0.93 0.00 0.00 3.45 1.57 -0.88 -0.56 116.57 121.09 2qta h LYS 98 Ca 0.26 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 59.02 2qta h LYS 98 Cb -0.09 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.22 2qta h LYS 98 CO -0.06 0.00 -0.07 0.87 -0.57 0.00 0.00 179.45 179.61 2qta h LYS 99 N 0.00 0.00 -5.94 3.15 1.57 -1.42 -3.46 116.57 110.46 2qta h LYS 99 Ca 0.09 0.00 -0.39 0.00 -1.87 0.00 0.00 60.65 58.48 2qta h LYS 99 Cb 0.47 0.00 0.09 0.00 0.08 0.00 0.00 32.23 32.87 2qta h LYS 99 CO -0.00 0.07 -0.80 -3.47 -0.57 0.00 0.00 179.45 174.68 2qta n ASP 100 N -3.41 -1.93 -0.22 0.86 2.03 -0.22 -4.90 116.55 108.76 2qta n ASP 100 Ca -0.02 -0.74 0.09 0.00 0.52 0.00 0.00 54.79 54.65 2qta n ASP 100 Cb 0.22 -4.45 0.16 0.00 -0.72 0.00 0.00 41.12 36.33 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 -4.29 2.48 -3.90 -2.67 4.77 -1.26 -4.96 117.00 107.17 2qta n LEU 101 Ca -0.26 -3.30 -0.30 0.00 -0.03 0.00 0.00 56.01 52.11 2qta n LEU 101 Cb 0.66 -0.46 0.02 0.00 -2.33 0.00 0.00 43.42 41.31 2qta n LEU 101 CO 0.66 0.89 0.10 -0.62 -1.33 0.00 0.00 177.39 177.09 2qta n GLU 102 N -1.34 -5.34 -0.07 3.23 -0.58 -1.26 -4.87 120.64 110.40 2qta n GLU 102 Ca 0.17 0.59 -0.09 0.00 -0.42 0.00 0.00 57.16 57.41 2qta n GLU 102 Cb 0.66 -5.47 0.06 0.00 -0.57 0.00 0.00 31.44 26.12 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 -2.01 0.78 0.00 -4.62 3.38 -1.93 -3.49 115.31 107.41 2qta h LEU 103 Ca -0.57 -0.33 0.00 0.00 0.09 0.00 0.00 57.88 57.07 2qta h LEU 103 Cb 1.37 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.91 2qta h LEU 103 CO 0.67 1.05 0.00 0.61 0.09 0.00 0.00 178.44 180.86 2qta n GLY 104 N -0.04 -2.05 0.00 0.83 0.00 -1.26 -5.02 105.19 97.64 2qta n GLY 104 Ca -0.01 -1.64 0.00 0.00 0.00 0.00 0.00 46.02 44.37 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 -0.05 3.87 3.91 -0.02 0.00 -1.26 -4.83 105.19 106.80 2qta n GLY 105 Ca 0.00 -1.36 -0.24 0.00 0.00 0.00 0.00 46.02 44.42 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 -0.71 3.36 0.00 1.61 3.76 -1.26 -5.04 115.29 117.01 2qta s HIS 106 Ca 0.00 0.02 0.00 0.00 -0.15 0.00 0.00 55.06 54.93 2qta s HIS 106 Cb 0.00 -1.57 0.00 0.00 1.11 0.00 0.00 32.58 32.12 2qta s HIS 106 CO 0.00 0.50 0.00 -1.33 -0.85 0.00 0.00 174.74 173.06 2qta n MET 107 N -0.85 0.54 -0.33 1.40 2.81 -1.26 -4.84 117.12 114.59 2qta n MET 107 Ca -0.08 0.00 -0.01 0.00 -1.81 0.00 0.00 57.70 55.80 2qta n MET 107 Cb 0.55 -0.70 0.15 0.00 -0.71 0.00 0.00 33.22 32.51 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 1.32 -0.23 3.04 0.00 -1.96 -2.68 119.26 118.75 2qta h ALA 108 Ca 0.00 -0.07 -0.18 0.00 0.00 0.00 0.00 54.91 54.66 2qta h ALA 108 Cb 0.40 -0.38 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 2qta h ALA 108 CO 0.00 0.62 -0.56 1.03 0.00 0.00 0.00 179.25 180.34 2qta h SER 109 N 1.26 0.80 -0.07 0.00 0.87 -1.90 -2.79 113.55 111.71 2qta h SER 109 Ca 0.34 -0.43 -0.10 0.00 -1.23 0.00 0.00 61.79 60.37 2qta h SER 109 Cb -0.13 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 61.58 2qta h SER 109 CO -0.07 1.19 -0.25 0.15 -0.53 0.00 0.00 176.83 177.32 2qta h PHE 110 N 0.55 0.57 -0.64 2.24 3.57 -1.82 -2.25 116.94 119.15 2qta h PHE 110 Ca 0.01 -0.12 -0.00 0.00 3.53 0.00 0.00 57.97 61.38 2qta h PHE 110 Cb 1.14 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 39.71 2qta h PHE 110 CO 0.06 0.71 0.38 1.96 -2.23 0.00 0.00 178.31 179.19 2qta h GLN 111 N 0.45 0.86 0.00 1.11 1.08 -1.37 0.67 115.11 117.91 2qta h GLN 111 Ca 0.07 -0.07 -0.13 0.00 -1.45 0.00 0.00 58.65 57.07 2qta h GLN 111 Cb 0.67 -0.18 -0.02 0.00 -0.05 0.00 0.00 27.48 27.90 2qta h GLN 111 CO 0.05 0.61 -0.61 0.66 -0.95 0.00 0.00 178.83 178.59 2qta h SER 112 N 0.88 0.00 -0.01 1.46 4.64 -1.15 -3.29 113.55 116.06 2qta h SER 112 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 2qta h SER 112 Cb -0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.06 2qta h SER 112 CO -0.04 0.61 -0.18 -1.54 -0.87 0.00 0.00 176.83 174.81 2qta n SER 113 N -3.63 1.81 -0.26 4.97 3.41 -0.90 -4.61 113.62 114.41 2qta n SER 113 Ca -0.01 -1.40 0.07 0.00 -0.26 0.00 0.00 58.87 57.27 2qta n SER 113 Cb 0.65 0.28 0.21 0.00 -0.26 0.00 0.00 64.21 65.08 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 2.67 1.09 -0.08 7.33 0.00 0.26 -1.25 119.26 129.28 2qta h ALA 114 Ca 0.00 0.15 -0.11 0.00 0.00 0.00 0.00 54.91 54.96 2qta h ALA 114 Cb 0.54 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 2qta h ALA 114 CO 0.00 -0.30 -0.44 1.15 0.00 0.00 0.00 179.25 179.66 2qta h THR 115 N 0.34 1.32 -0.07 0.00 2.02 -1.84 0.03 112.91 114.71 2qta h THR 115 Ca 0.45 -1.58 -0.01 0.00 0.77 0.00 0.00 66.41 66.05 2qta h THR 115 Cb 0.77 1.75 -0.00 0.00 -1.74 0.00 0.00 68.15 68.92 2qta h THR 115 CO -0.49 0.47 0.02 0.40 0.37 0.00 0.00 175.52 176.29 2qta h ILE 116 N 0.15 1.17 -0.73 3.11 2.04 -1.42 -1.37 117.51 120.47 2qta h ILE 116 Ca 0.01 -0.53 -0.03 0.00 1.00 0.00 0.00 64.86 65.31 2qta h ILE 116 Cb 0.84 1.39 -0.03 0.00 -0.74 0.00 0.00 36.82 38.28 2qta h ILE 116 CO 0.07 0.15 0.34 1.88 0.00 0.00 0.00 178.15 180.59 2qta h TYR 117 N -0.08 1.06 -0.43 1.37 0.05 -1.25 -2.45 116.97 115.24 2qta h TYR 117 Ca 0.02 -0.06 0.04 0.00 0.05 0.00 0.00 58.73 58.79 2qta h TYR 117 Cb 0.22 -0.33 -0.04 0.00 1.01 0.00 0.00 36.73 37.59 2qta h TYR 117 CO -0.00 0.78 0.21 0.22 -1.05 0.00 0.00 178.16 178.32 2qta h ASP 118 N 1.02 0.30 -0.90 3.88 3.58 -0.71 0.29 116.42 123.88 2qta h ASP 118 Ca 0.25 0.03 -0.02 0.00 0.42 0.00 0.00 57.03 57.71 2qta h ASP 118 Cb 0.13 -0.03 -0.04 0.00 1.72 0.00 0.00 39.33 41.11 2qta h ASP 118 CO -0.03 0.21 0.49 0.58 -2.88 0.00 0.00 179.24 177.61 2qta h VAL 119 N 0.42 1.26 -0.57 2.25 2.07 -1.08 -1.20 116.25 119.40 2qta h VAL 119 Ca 0.19 -0.65 -0.06 0.00 0.82 0.00 0.00 66.70 67.00 2qta h VAL 119 Cb 0.11 0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 29.90 2qta h VAL 119 CO -0.14 0.29 0.11 0.00 0.02 0.00 0.00 177.57 177.85 2qta h PHE 121 N 0.83 0.44 0.00 0.00 0.04 -0.12 0.19 116.94 118.31 2qta h PHE 121 Ca 0.18 -0.12 -0.11 0.00 2.80 0.00 0.00 57.97 60.72 2qta h PHE 121 Cb 0.39 -0.10 -0.02 0.00 2.20 0.00 0.00 35.95 38.42 2qta h PHE 121 CO 0.03 0.70 -0.86 -0.91 -0.60 0.00 0.00 178.31 176.67 2qta h ASN 122 N 0.32 0.00 0.00 2.17 2.35 -1.00 -3.42 115.58 115.99 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 0.81 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.18 2qta h ASN 122 CO 0.06 0.43 0.00 1.41 -1.65 0.00 0.00 177.43 177.69 2qta n HIS 123 N -3.02 0.00 0.00 1.19 8.25 0.22 -4.82 115.22 117.04 2qta n HIS 123 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 2qta n HIS 123 Cb 0.74 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.85 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 -0.16 0.00 -1.72 4.41 3.72 -0.36 -5.01 117.46 118.34 2qta n PHE 124 Ca 0.00 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.98 2qta n PHE 124 Cb 0.08 0.25 -0.03 0.00 -0.94 0.00 0.00 39.48 38.84 2qta n PHE 124 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 2qta s PHE 125 N -1.96 1.37 -0.12 1.38 0.08 0.53 -4.97 117.98 114.29 2qta s PHE 125 Ca 0.00 -0.14 -0.19 0.00 0.12 0.00 0.00 56.93 56.72 2qta s PHE 125 Cb 0.00 -4.14 -0.04 0.00 -0.57 0.00 0.00 43.02 38.27 2qta s PHE 125 CO 0.00 -4.96 0.50 1.03 -0.10 0.00 0.00 175.22 171.69 2qta s ARG 126 N 4.81 4.34 0.66 0.44 0.52 -1.26 -4.81 118.95 123.65 2qta s ARG 126 Ca 0.88 0.49 -0.07 0.00 -0.52 0.00 0.00 55.73 56.51 2qta s ARG 126 Cb -0.39 -3.44 0.03 0.00 0.52 0.00 0.00 34.95 31.67 2qta s ARG 126 CO 0.38 0.13 0.99 0.00 0.02 0.00 0.00 175.30 176.82 2qta s ALA 127 N 0.70 3.14 0.36 2.13 0.00 -0.04 0.12 121.76 128.17 2qta s ALA 127 Ca 0.27 -0.70 -0.27 0.00 0.00 0.00 0.00 51.96 51.25 2qta s ALA 127 Cb -0.15 -2.70 -0.12 0.00 0.00 0.00 0.00 23.12 20.15 2qta s ALA 127 CO 0.11 -1.07 1.28 -2.13 0.00 0.00 0.00 175.76 173.95 2qta n ARG 128 N -2.81 2.09 -3.80 0.00 0.63 -1.23 -3.99 116.66 107.55 2qta n ARG 128 Ca 0.06 0.73 -0.15 0.00 -0.92 0.00 0.00 57.85 57.58 2qta n ARG 128 Cb 0.59 -2.34 -0.05 0.00 0.45 0.00 0.00 32.46 31.11 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 0.66 -0.79 0.23 6.15 0.23 -0.20 -4.80 115.26 116.73 2qta n ASN 129 Ca 0.05 -2.78 0.06 0.00 -0.53 0.00 0.00 54.58 51.39 2qta n ASN 129 Cb 0.37 1.68 0.54 0.00 -2.08 0.00 0.00 39.78 40.29 2qta n ASN 129 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 2qta h GLU 130 N 0.00 0.00 0.03 -3.83 4.81 -1.96 -3.16 114.58 110.47 2qta h GLU 130 Ca -0.21 0.00 -0.30 0.00 -0.13 0.00 0.00 59.36 58.72 2qta h GLU 130 Cb 1.02 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.35 2qta h GLU 130 CO 0.30 0.16 -1.73 1.96 -0.73 0.00 0.00 179.01 178.97 2qta h GLN 131 N 0.00 0.06 -3.01 1.92 1.08 -1.99 -3.49 115.11 109.68 2qta h GLN 131 Ca -0.00 -0.11 0.02 0.00 -1.45 0.00 0.00 58.65 57.11 2qta h GLN 131 Cb 0.30 0.04 -0.02 0.00 -0.05 0.00 0.00 27.48 27.75 2qta h GLN 131 CO 0.02 0.68 0.25 0.16 -0.95 0.00 0.00 178.83 178.99 2qta s ASP 132 N -6.34 -0.11 0.00 1.46 1.47 -1.20 -4.91 116.67 107.05 2qta s ASP 132 Ca -0.08 -0.91 0.13 0.00 1.18 0.00 0.00 52.55 52.87 2qta s ASP 132 Cb 0.08 0.80 0.79 0.00 -0.34 0.00 0.00 42.92 44.24 2qta s ASP 132 CO 0.82 -1.54 1.31 0.61 0.68 0.00 0.00 175.17 177.05 2qta n GLY 133 N -0.50 -0.72 7.00 2.12 0.00 -1.26 -1.03 105.19 110.80 2qta n GLY 133 Ca -0.06 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.87 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 0.35 -1.69 3.77 -0.02 0.00 -1.26 -3.51 105.19 102.84 2qta n GLY 134 Ca 0.10 -1.33 -0.38 0.00 0.00 0.00 0.00 46.02 44.41 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 -4.00 7.17 -0.48 1.61 1.01 0.12 -4.51 116.67 117.58 2qta s ASP 135 Ca 0.00 2.04 -0.15 0.00 0.71 0.00 0.00 52.55 55.16 2qta s ASP 135 Cb 0.00 -2.60 0.09 0.00 1.01 0.00 0.00 42.92 41.42 2qta s ASP 135 CO 0.00 -0.20 0.40 -0.76 0.21 0.00 0.00 175.17 174.82 2qta s LEU 136 N -1.96 5.67 -0.31 1.23 1.43 -0.39 -4.85 118.68 119.50 2qta s LEU 136 Ca 0.50 -1.45 -0.10 0.00 -1.03 0.00 0.00 54.13 52.05 2qta s LEU 136 Cb -0.25 -2.16 -0.01 0.00 0.03 0.00 0.00 46.19 43.81 2qta s LEU 136 CO 0.31 -0.67 0.16 -0.69 0.23 0.00 0.00 176.35 175.69 2qta s VAL 137 N 1.60 4.66 -1.10 -1.59 1.01 -1.26 -0.99 120.40 122.73 2qta s VAL 137 Ca 0.04 -0.41 -0.15 0.00 0.00 0.00 0.00 61.98 61.46 2qta s VAL 137 Cb -0.25 -3.38 0.16 0.00 0.00 0.00 0.00 36.38 32.91 2qta s VAL 137 CO 0.05 0.06 1.30 -0.31 0.00 0.00 0.00 175.10 176.20 2qta s TYR 138 N 1.62 3.39 0.37 5.22 1.51 0.53 -4.80 117.35 125.20 2qta s TYR 138 Ca 0.05 -1.89 -0.28 0.00 -1.01 0.00 0.00 57.07 53.94 2qta s TYR 138 Cb -0.17 -4.28 -0.11 0.00 -0.11 0.00 0.00 41.96 37.29 2qta s TYR 138 CO 0.07 -1.41 1.45 -0.06 -1.11 0.00 0.00 175.55 174.49 2qta s PHE 139 N 1.86 2.67 0.04 2.71 0.08 -1.26 -1.68 117.98 122.40 2qta s PHE 139 Ca 0.38 1.21 -0.33 0.00 0.12 0.00 0.00 56.93 58.31 2qta s PHE 139 Cb -0.04 -3.96 -0.12 0.00 -0.57 0.00 0.00 43.02 38.33 2qta s PHE 139 CO -0.04 -2.79 1.77 0.94 -0.10 0.00 0.00 175.22 175.00 2qta n GLN 140 N 0.51 2.31 -0.25 0.44 7.27 -1.23 -4.69 117.38 121.74 2qta n GLN 140 Ca 0.01 0.84 -0.05 0.00 0.07 0.00 0.00 57.00 57.87 2qta n GLN 140 Cb 0.40 -2.67 -0.04 0.00 2.41 0.00 0.00 30.24 30.34 2qta n GLN 140 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2qta n GLY 141 N 4.02 -1.47 1.40 1.69 0.00 -1.26 -2.40 105.19 107.17 2qta n GLY 141 Ca 0.20 0.70 0.08 0.00 0.00 0.00 0.00 46.02 47.00 2qta n GLY 141 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2qta n HIS 142 N -4.78 1.51 -0.58 1.61 1.44 -1.26 -3.03 115.22 110.13 2qta n HIS 142 Ca 0.02 -0.79 0.08 0.00 -2.01 0.00 0.00 57.72 55.03 2qta n HIS 142 Cb 0.18 -0.40 0.28 0.00 0.12 0.00 0.00 29.99 30.16 2qta n HIS 142 CO 0.00 0.00 0.00 0.44 -2.81 0.00 0.00 176.34 173.97 2qta n ILE 143 N 0.12 1.69 -0.22 0.61 -6.64 -1.01 -4.65 119.36 109.27 2qta n ILE 143 Ca 0.25 -1.29 0.19 0.00 -1.77 0.00 0.00 62.75 60.13 2qta n ILE 143 Cb 1.04 0.16 0.53 0.00 -1.44 0.00 0.00 39.64 39.92 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 3.06 0.37 -0.50 7.28 4.64 -1.70 0.48 113.55 127.20 2qta h SER 144 Ca 0.00 0.03 0.06 0.00 -0.47 0.00 0.00 61.79 61.41 2qta h SER 144 Cb 1.25 -0.04 -0.03 0.00 -0.31 0.00 0.00 62.40 63.28 2qta h SER 144 CO 0.16 0.16 0.33 -0.65 -0.87 0.00 0.00 176.83 175.96 2qta h PRO 145 N 0.38 0.44 -0.11 4.77 0.11 -1.87 -0.07 132.00 135.64 2qta h PRO 145 Ca 0.44 -0.03 -0.12 0.00 0.11 0.00 0.00 66.00 66.40 2qta h PRO 145 Cb 1.13 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.13 2qta h PRO 145 CO -0.15 0.29 -0.47 0.78 -0.21 0.00 0.00 178.00 178.24 2qta h GLY 146 N 0.45 0.30 0.93 -0.55 0.00 -1.24 -1.23 103.07 101.72 2qta h GLY 146 Ca 0.21 -0.31 -0.15 0.00 0.00 0.00 0.00 47.33 47.09 2qta h GLY 146 CO -0.06 0.28 -0.48 -2.08 0.00 0.00 0.00 176.54 174.20 2qta h VAL 147 N 0.22 1.34 -0.81 4.60 2.07 -1.11 -2.48 116.25 120.09 2qta h VAL 147 Ca 0.01 -1.75 -0.02 0.00 0.82 0.00 0.00 66.70 65.76 2qta h VAL 147 Cb 0.91 2.04 -0.04 0.00 -1.52 0.00 0.00 31.29 32.68 2qta h VAL 147 CO 0.07 0.54 0.42 1.88 0.02 0.00 0.00 177.57 180.50 2qta h TYR 148 N 0.23 1.12 -0.47 1.57 0.05 -1.01 -0.28 116.97 118.18 2qta h TYR 148 Ca -0.02 -0.03 -0.04 0.00 0.05 0.00 0.00 58.73 58.68 2qta h TYR 148 Cb 1.11 -0.35 -0.02 0.00 1.01 0.00 0.00 36.73 38.47 2qta h TYR 148 CO 0.10 0.79 0.12 0.00 -1.05 0.00 0.00 178.16 178.12 2qta h ALA 149 N 1.33 0.62 -0.48 3.88 0.00 -1.18 -0.70 119.26 122.74 2qta h ALA 149 Ca 0.28 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.93 2qta h ALA 149 Cb 0.05 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 2qta h ALA 149 CO -0.04 0.30 0.04 -0.09 0.00 0.00 0.00 179.25 179.46 2qta h ARG 150 N 0.64 0.82 -0.96 0.00 2.43 -1.15 -1.13 114.38 115.03 2qta h ARG 150 Ca 0.15 -0.24 -0.00 0.00 -0.81 0.00 0.00 59.98 59.08 2qta h ARG 150 Cb 0.31 -0.08 -0.05 0.00 -0.42 0.00 0.00 29.97 29.73 2qta h ARG 150 CO 0.00 0.85 0.60 0.00 -1.51 0.00 0.00 179.97 179.91 2qta h ALA 151 N 0.94 1.24 -0.22 2.80 0.00 -0.90 0.80 119.26 123.92 2qta h ALA 151 Ca 0.14 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2qta h ALA 151 Cb 0.45 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2qta h ALA 151 CO 0.02 0.67 0.09 0.35 0.00 0.00 0.00 179.25 180.38 2qta h PHE 152 N 1.32 0.33 -0.02 0.00 3.57 -0.87 0.11 116.94 121.38 2qta h PHE 152 Ca 0.35 -0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.81 2qta h PHE 152 Cb -0.09 -0.10 -0.00 0.00 2.79 0.00 0.00 35.95 38.55 2qta h PHE 152 CO 0.00 0.35 -0.08 1.25 -2.23 0.00 0.00 178.31 177.61 2qta h LEU 153 N 0.21 0.02 -0.03 0.59 5.85 -0.57 0.36 115.31 121.74 2qta h LEU 153 Ca 0.07 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.79 2qta h LEU 153 Cb 0.16 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.18 2qta h LEU 153 CO -0.01 0.10 -0.01 -0.62 -0.34 0.00 0.00 178.44 177.57 2qta n GLU 154 N -4.43 0.76 -1.02 1.25 1.02 0.22 -4.83 120.64 113.61 2qta n GLU 154 Ca -0.03 -0.03 -0.01 0.00 -0.02 0.00 0.00 57.16 57.08 2qta n GLU 154 Cb 0.16 -1.50 -0.00 0.00 -0.02 0.00 0.00 31.44 30.08 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 1.14 0.47 0.11 0.62 0.00 0.12 -4.93 105.19 102.71 2qta n GLY 155 Ca 0.19 -0.62 0.09 0.00 0.00 0.00 0.00 46.02 45.68 2qta n GLY 155 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2qta h ARG 156 N 0.38 0.00 -5.78 1.61 3.08 -0.98 -3.46 114.38 109.23 2qta h ARG 156 Ca -0.01 0.00 -0.51 0.00 0.07 0.00 0.00 59.98 59.53 2qta h ARG 156 Cb 0.06 0.00 -0.24 0.00 0.08 0.00 0.00 29.97 29.88 2qta h ARG 156 CO 0.02 0.07 -0.81 -0.51 -1.07 0.00 0.00 179.97 177.67 2qta s LEU 157 N -5.48 2.23 0.57 3.04 1.43 -1.19 -4.94 118.68 114.32 2qta s LEU 157 Ca -0.01 -0.57 -0.01 0.00 -1.03 0.00 0.00 54.13 52.51 2qta s LEU 157 Cb 0.09 -0.77 0.03 0.00 0.03 0.00 0.00 46.19 45.57 2qta s LEU 157 CO 0.79 0.06 0.81 0.42 0.23 0.00 0.00 176.35 178.66 2qta s THR 158 N -1.00 2.87 0.27 5.49 -4.23 -1.26 -4.46 115.64 113.32 2qta s THR 158 Ca 0.04 -0.52 -0.02 0.00 -1.18 0.00 0.00 61.69 60.01 2qta s THR 158 Cb -0.09 -3.10 0.13 0.00 1.34 0.00 0.00 72.50 70.78 2qta s THR 158 CO 0.02 -0.08 1.79 -0.61 -0.54 0.00 0.00 174.62 175.20 2qta h GLN 159 N -0.01 0.82 -0.52 3.99 4.15 -2.00 -2.28 115.11 119.25 2qta h GLN 159 Ca -0.43 -0.19 0.02 0.00 0.77 0.00 0.00 58.65 58.82 2qta h GLN 159 Cb 1.29 -0.11 -0.03 0.00 0.21 0.00 0.00 27.48 28.84 2qta h GLN 159 CO 0.55 0.78 0.35 1.49 -1.93 0.00 0.00 178.83 180.07 2qta h GLU 160 N 0.78 0.63 -0.15 1.69 4.81 -1.94 0.13 114.58 120.53 2qta h GLU 160 Ca 0.16 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 59.30 2qta h GLU 160 Cb 0.37 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 29.61 2qta h GLU 160 CO 0.01 0.41 -0.12 1.96 -0.73 0.00 0.00 179.01 180.55 2qta h GLN 161 N 0.65 0.34 -0.96 1.92 4.20 -1.60 -2.29 115.11 117.37 2qta h GLN 161 Ca 0.20 -0.17 -0.00 0.00 0.06 0.00 0.00 58.65 58.74 2qta h GLN 161 Cb 0.02 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 27.76 2qta h GLN 161 CO -0.05 0.71 0.60 -0.07 -0.67 0.00 0.00 178.83 179.34 2qta h LEU 162 N -0.02 1.13 0.00 1.46 3.38 -0.99 -0.31 115.31 119.96 2qta h LEU 162 Ca 0.03 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2qta h LEU 162 Cb 0.63 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.09 2qta h LEU 162 CO 0.03 0.85 0.00 0.47 0.09 0.00 0.00 178.44 179.88 2qta n ASP 163 N -4.36 0.00 -0.72 -0.43 8.00 0.40 -1.56 116.55 117.88 2qta n ASP 163 Ca 0.11 0.37 0.04 0.00 0.71 0.00 0.00 54.79 56.01 2qta n ASP 163 Cb 0.04 -0.43 0.20 0.00 -0.02 0.00 0.00 41.12 40.92 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 -1.43 1.91 -4.72 -2.24 3.02 -0.15 -4.93 115.26 106.73 2qta n ASN 164 Ca 0.04 -3.89 -0.42 0.00 -0.03 0.00 0.00 54.58 50.28 2qta n ASN 164 Cb 0.12 -0.54 -0.03 0.00 -0.61 0.00 0.00 39.78 38.72 2qta n ASN 164 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 2qta s PHE 165 N -3.25 2.91 -1.52 3.10 5.36 -0.60 -1.92 117.98 122.04 2qta s PHE 165 Ca 0.39 0.38 0.00 0.00 -0.96 0.00 0.00 56.93 56.74 2qta s PHE 165 Cb 0.38 -4.11 0.00 0.00 -0.34 0.00 0.00 43.02 38.95 2qta s PHE 165 CO -0.06 -4.18 0.00 0.54 -1.46 0.00 0.00 175.22 170.06 2qta n ARG 166 N 4.04 -1.00 -3.53 10.12 1.74 0.57 -4.87 116.66 123.72 2qta n ARG 166 Ca 0.16 1.00 -0.28 0.00 -0.77 0.00 0.00 57.85 57.96 2qta n ARG 166 Cb 0.36 -5.12 -0.11 0.00 -1.02 0.00 0.00 32.46 26.57 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 -3.25 1.11 0.04 5.56 -0.21 -0.81 -4.98 119.66 117.13 2qta s GLN 167 Ca 0.00 -2.10 0.19 0.00 0.02 0.00 0.00 55.36 53.46 2qta s GLN 167 Cb 0.00 -1.83 -0.16 0.00 1.00 0.00 0.00 33.01 32.02 2qta s GLN 167 CO 0.00 -1.30 0.72 0.39 -2.12 0.00 0.00 175.29 172.98 2qta n GLU 168 N 3.09 0.63 -0.18 2.91 1.02 -1.26 -4.27 120.64 122.58 2qta n GLU 168 Ca 0.21 0.12 0.06 0.00 -0.02 0.00 0.00 57.16 57.53 2qta n GLU 168 Cb 0.42 -1.74 0.35 0.00 -0.02 0.00 0.00 31.44 30.44 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 1.04 -0.34 2.62 2.07 -1.96 0.21 116.25 119.89 2qta h VAL 169 Ca -0.16 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 67.10 2qta h VAL 169 Cb 1.49 0.21 0.00 0.00 -1.52 0.00 0.00 31.29 31.46 2qta h VAL 169 CO 0.03 0.14 0.00 1.41 0.02 0.00 0.00 177.57 179.17 2qta n HIS 170 N -4.47 0.45 0.00 1.57 8.25 -1.26 -5.04 115.22 114.72 2qta n HIS 170 Ca 0.10 -0.23 0.00 0.00 -0.26 0.00 0.00 57.72 57.33 2qta n HIS 170 Cb 0.20 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.31 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 1.05 -1.63 2.95 -1.41 0.00 0.73 -4.91 105.19 101.96 2qta n GLY 171 Ca 0.12 -1.51 -0.20 0.00 0.00 0.00 0.00 46.02 44.42 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 -1.50 -4.86 -2.86 1.61 4.05 -1.26 -4.95 115.26 105.49 2qta n ASN 172 Ca 0.00 -0.19 -0.08 0.00 0.45 0.00 0.00 54.58 54.76 2qta n ASN 172 Cb 0.00 -4.00 -0.00 0.00 1.23 0.00 0.00 39.78 37.01 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 -1.21 2.99 3.07 8.20 0.00 -1.26 -4.28 105.19 112.70 2qta n GLY 173 Ca -0.10 -2.21 -0.24 0.00 0.00 0.00 0.00 46.02 43.47 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 1.83 0.63 0.99 1.43 -0.88 -4.92 118.68 117.76 2qta s LEU 174 Ca 0.09 -0.29 -0.17 0.00 -1.03 0.00 0.00 54.13 52.74 2qta s LEU 174 Cb -0.01 -0.80 -0.01 0.00 0.03 0.00 0.00 46.19 45.40 2qta s LEU 174 CO 0.06 0.11 1.15 -0.44 0.23 0.00 0.00 176.35 177.45 2qta s SER 175 N 0.18 5.10 0.27 2.29 0.01 -1.26 -0.32 113.70 119.97 2qta s SER 175 Ca -0.05 2.16 -0.05 0.00 1.31 0.00 0.00 55.95 59.33 2qta s SER 175 Cb -0.11 -2.57 0.32 0.00 0.21 0.00 0.00 66.02 63.87 2qta s SER 175 CO 0.02 -1.64 1.93 0.77 0.41 0.00 0.00 173.24 174.72 2qta h SER 176 N 0.37 1.07 -4.88 2.44 4.64 -1.96 -3.42 113.55 111.80 2qta h SER 176 Ca -0.48 -0.05 -0.45 0.00 -0.47 0.00 0.00 61.79 60.35 2qta h SER 176 Cb 1.27 -0.27 -0.14 0.00 -0.31 0.00 0.00 62.40 62.95 2qta h SER 176 CO 0.54 0.80 -0.53 -0.31 -0.87 0.00 0.00 176.83 176.45 2qta s TYR 177 N -5.96 1.65 -0.49 4.77 2.02 -1.26 -4.72 117.35 113.36 2qta s TYR 177 Ca -0.12 -1.45 -0.27 0.00 -0.37 0.00 0.00 57.07 54.86 2qta s TYR 177 Cb 0.18 -0.85 -0.04 0.00 -0.40 0.00 0.00 41.96 40.85 2qta s TYR 177 CO 0.81 -0.60 2.05 -2.14 -1.57 0.00 0.00 175.55 174.10 2qta s PRO 178 N -3.70 2.63 -0.38 -1.71 0.02 -1.26 -4.90 135.00 125.69 2qta s PRO 178 Ca 0.35 1.14 0.01 0.00 0.02 0.00 0.00 61.00 62.52 2qta s PRO 178 Cb 0.04 -4.41 0.12 0.00 0.02 0.00 0.00 34.50 30.26 2qta s PRO 178 CO 0.20 -2.69 0.17 -1.01 -0.33 0.00 0.00 177.00 173.34 2qta s HIS 179 N 9.60 2.00 0.34 6.54 3.76 -1.26 -3.89 115.29 132.38 2qta s HIS 179 Ca 0.82 -2.20 0.05 0.00 -0.15 0.00 0.00 55.06 53.58 2qta s HIS 179 Cb -0.18 -1.89 0.69 0.00 1.11 0.00 0.00 32.58 32.31 2qta s HIS 179 CO 0.26 -0.83 1.91 -1.35 -0.85 0.00 0.00 174.74 173.87 2qta h PRO 180 N 7.33 0.81 -0.77 8.40 0.11 -1.76 -0.48 132.00 145.63 2qta h PRO 180 Ca -0.06 -0.05 0.10 0.00 0.11 0.00 0.00 66.00 66.10 2qta h PRO 180 Cb 0.97 -0.18 -0.05 0.00 0.11 0.00 0.00 31.00 31.84 2qta h PRO 180 CO 0.48 0.53 0.51 -0.22 -0.21 0.00 0.00 178.00 179.09 2qta h LYS 181 N 0.83 0.67 0.06 1.05 1.63 -1.24 0.28 116.57 119.85 2qta h LYS 181 Ca 0.39 -0.04 -0.29 0.00 -0.85 0.00 0.00 60.65 59.86 2qta h LYS 181 Cb 0.40 -0.15 -0.03 0.00 -0.60 0.00 0.00 32.23 31.86 2qta h LYS 181 CO -0.16 0.45 -1.53 -0.07 -3.45 0.00 0.00 179.45 174.68 2qta h LEU 182 N 0.69 0.19 -6.29 5.20 3.38 -1.44 -3.40 115.31 113.65 2qta h LEU 182 Ca 0.36 -0.30 -0.59 0.00 0.09 0.00 0.00 57.88 57.44 2qta h LEU 182 Cb 0.46 -0.06 -0.40 0.00 0.09 0.00 0.00 40.66 40.75 2qta h LEU 182 CO -0.13 1.25 -0.86 0.23 0.09 0.00 0.00 178.44 179.02 2qta n MET 183 N -3.30 1.28 0.20 1.13 2.81 -0.48 -5.00 117.12 113.77 2qta n MET 183 Ca -0.15 -3.80 0.13 0.00 -1.81 0.00 0.00 57.70 52.07 2qta n MET 183 Cb 1.03 -1.75 0.69 0.00 -0.71 0.00 0.00 33.22 32.48 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 4.58 0.00 -0.16 0.03 0.13 -1.17 -1.45 132.00 133.96 2qta h PRO 184 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 2qta h PRO 184 Cb 0.81 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.94 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 -2.41 1.61 0.00 0.86 1.02 -1.26 -4.28 120.64 116.18 2qta n GLU 185 Ca -0.02 -1.64 -0.00 0.00 -0.02 0.00 0.00 57.16 55.48 2qta n GLU 185 Cb 0.09 -1.30 -0.00 0.00 -0.02 0.00 0.00 31.44 30.21 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 0.81 0.00 -2.35 -0.32 7.35 -0.57 -1.16 117.46 121.22 2qta n PHE 186 Ca 0.11 0.00 -0.32 0.00 -0.76 0.00 0.00 57.45 56.47 2qta n PHE 186 Cb 0.40 -0.02 -0.03 0.00 0.35 0.00 0.00 39.48 40.18 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 -1.22 3.43 0.00 -5.13 0.23 -1.05 -2.32 118.94 112.88 2qta s TRP 187 Ca -0.01 1.46 0.00 0.00 -2.03 0.00 0.00 56.10 55.52 2qta s TRP 187 Cb 0.00 -2.80 0.00 0.00 0.03 0.00 0.00 33.47 30.70 2qta s TRP 187 CO 0.02 -0.44 0.00 1.04 0.96 0.00 0.00 176.95 178.53 2qta n GLN 188 N -1.67 0.34 -3.91 4.98 6.02 -1.26 -4.38 117.38 117.50 2qta n GLN 188 Ca 0.07 0.00 -0.27 0.00 -0.01 0.00 0.00 57.00 56.78 2qta n GLN 188 Cb 0.54 -0.95 -0.17 0.00 1.02 0.00 0.00 30.24 30.68 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 -1.90 1.57 -0.37 1.08 0.08 -1.26 -4.82 117.98 112.36 2qta s PHE 189 Ca 0.00 -0.83 -0.29 0.00 0.12 0.00 0.00 56.93 55.93 2qta s PHE 189 Cb 0.00 -1.27 0.00 0.00 -0.57 0.00 0.00 43.02 41.18 2qta s PHE 189 CO 0.00 -0.54 1.40 -1.25 -0.10 0.00 0.00 175.22 174.73 2qta s PRO 190 N 1.68 3.67 0.00 0.24 0.04 -1.25 -4.79 135.00 134.60 2qta s PRO 190 Ca 0.04 1.07 0.03 0.00 0.04 0.00 0.00 61.00 62.19 2qta s PRO 190 Cb -0.13 -3.99 -0.03 0.00 0.04 0.00 0.00 34.50 30.39 2qta s PRO 190 CO -0.08 -1.44 0.15 0.25 0.04 0.00 0.00 177.00 175.93 2qta n THR 191 N 6.81 0.00 0.30 1.26 -2.24 -1.26 -4.64 114.28 114.51 2qta n THR 191 Ca 0.16 -0.43 0.19 0.00 -2.27 0.00 0.00 64.05 61.71 2qta n THR 191 Cb 0.47 1.00 0.94 0.00 -2.10 0.00 0.00 70.33 70.65 2qta n THR 191 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 2qta h VAL 192 N 0.03 0.11 -0.78 2.28 3.04 -1.88 -3.34 116.25 115.71 2qta h VAL 192 Ca 0.00 -0.28 -0.61 0.00 -1.01 0.00 0.00 66.70 64.81 2qta h VAL 192 Cb 0.08 1.25 -0.07 0.00 -2.01 0.00 0.00 31.29 30.53 2qta h VAL 192 CO 0.00 0.02 1.97 -0.55 -1.01 0.00 0.00 177.57 178.00 2qta s SER 193 N -5.54 6.45 0.35 3.17 0.15 -1.26 -4.94 113.70 112.08 2qta s SER 193 Ca -0.02 -2.28 -0.27 0.00 0.70 0.00 0.00 55.95 54.07 2qta s SER 193 Cb 0.12 -2.58 -0.12 0.00 -1.71 0.00 0.00 66.02 61.72 2qta s SER 193 CO 0.49 -1.58 1.09 0.23 1.20 0.00 0.00 173.24 174.67 2qta n MET 194 N 8.37 1.57 0.00 5.44 2.81 -1.25 -2.28 117.12 131.79 2qta n MET 194 Ca 0.48 0.56 0.00 0.00 -1.81 0.00 0.00 57.70 56.93 2qta n MET 194 Cb 0.46 -2.05 0.00 0.00 -0.71 0.00 0.00 33.22 30.93 2qta n MET 194 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2qta n GLY 195 N 1.08 3.13 0.17 3.03 0.00 -1.26 -4.92 105.19 106.42 2qta n GLY 195 Ca 0.08 -0.96 -0.14 0.00 0.00 0.00 0.00 46.02 45.00 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 0.63 -0.46 0.99 3.38 -1.77 -3.23 115.31 114.84 2qta h LEU 196 Ca 0.00 -0.48 0.03 0.00 0.09 0.00 0.00 57.88 57.52 2qta h LEU 196 Cb 0.00 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.52 2qta h LEU 196 CO 0.00 1.27 0.26 1.23 0.09 0.00 0.00 178.44 181.29 2qta h GLY 197 N 1.04 0.65 0.93 0.83 0.00 -1.81 0.39 103.07 105.09 2qta h GLY 197 Ca -0.08 -0.19 -0.03 0.00 0.00 0.00 0.00 47.33 47.03 2qta h GLY 197 CO 0.16 0.15 0.13 -0.56 0.00 0.00 0.00 176.54 176.42 2qta h PRO 198 N 0.52 0.59 -0.15 4.80 0.13 -1.89 -0.03 132.00 135.96 2qta h PRO 198 Ca 0.19 -0.12 -0.16 0.00 -0.87 0.00 0.00 66.00 65.04 2qta h PRO 198 Cb 0.05 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 31.09 2qta h PRO 198 CO -0.11 0.60 -0.57 0.97 -0.23 0.00 0.00 178.00 178.66 2qta h ILE 199 N 0.47 1.34 -0.81 -3.56 2.10 -1.61 -1.89 117.51 113.55 2qta h ILE 199 Ca 0.12 -1.84 -0.03 0.00 1.08 0.00 0.00 64.86 64.19 2qta h ILE 199 Cb 0.24 1.83 -0.04 0.00 -1.09 0.00 0.00 36.82 37.77 2qta h ILE 199 CO -0.01 0.56 0.39 1.23 -1.08 0.00 0.00 178.15 179.25 2qta h GLY 200 N 1.15 1.24 0.94 8.18 0.00 -0.75 -2.38 103.07 111.45 2qta h GLY 200 Ca 0.00 -0.61 -0.05 0.00 0.00 0.00 0.00 47.33 46.68 2qta h GLY 200 CO 0.10 0.58 0.07 0.00 0.00 0.00 0.00 176.54 177.29 2qta h ALA 201 N 1.28 0.55 -0.23 3.60 0.00 -0.79 -0.21 119.26 123.46 2qta h ALA 201 Ca 0.28 -0.21 0.04 0.00 0.00 0.00 0.00 54.91 55.02 2qta h ALA 201 Cb 0.11 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 2qta h ALA 201 CO -0.04 0.26 -0.03 0.82 0.00 0.00 0.00 179.25 180.27 2qta h ILE 202 N 0.54 0.81 0.00 0.00 2.04 -0.96 -0.06 117.51 119.87 2qta h ILE 202 Ca 0.13 -0.01 -0.04 0.00 1.00 0.00 0.00 64.86 65.94 2qta h ILE 202 Cb 0.36 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 37.21 2qta h ILE 202 CO 0.01 0.01 -0.18 1.88 0.00 0.00 0.00 178.15 179.87 2qta h TYR 203 N 0.04 0.00 -0.12 1.37 -1.99 -1.31 -1.02 116.97 113.93 2qta h TYR 203 Ca 0.11 0.00 -0.08 0.00 2.00 0.00 0.00 58.73 60.76 2qta h TYR 203 Cb 0.15 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.88 2qta h TYR 203 CO -0.21 0.18 -0.23 0.37 -0.00 0.00 0.00 178.16 178.27 2qta h GLN 204 N 0.00 0.37 -0.55 4.88 5.75 -0.43 0.01 115.11 125.13 2qta h GLN 204 Ca -0.00 -0.23 0.03 0.00 -0.15 0.00 0.00 58.65 58.29 2qta h GLN 204 Cb 0.77 0.03 -0.04 0.00 1.07 0.00 0.00 27.48 29.31 2qta h GLN 204 CO 0.02 0.83 0.33 0.00 -2.65 0.00 0.00 178.83 177.36 2qta h ALA 205 N 0.54 0.71 -0.65 3.38 0.00 -0.71 -0.65 119.26 121.88 2qta h ALA 205 Ca 0.01 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 2qta h ALA 205 Cb 0.81 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.41 2qta h ALA 205 CO 0.05 0.05 0.22 -0.22 0.00 0.00 0.00 179.25 179.35 2qta h LYS 206 N 0.66 0.98 -0.52 0.00 3.64 -1.11 -2.04 116.57 118.18 2qta h LYS 206 Ca 0.22 -0.19 -0.08 0.00 -1.27 0.00 0.00 60.65 59.34 2qta h LYS 206 Cb 0.02 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 31.67 2qta h LYS 206 CO -0.10 0.83 0.00 0.35 -2.27 0.00 0.00 179.45 178.27 2qta h PHE 207 N 0.95 0.94 -0.81 1.91 3.57 -0.18 -1.37 116.94 121.95 2qta h PHE 207 Ca 0.22 -0.14 -0.04 0.00 3.53 0.00 0.00 57.97 61.54 2qta h PHE 207 Cb 0.25 -0.25 -0.04 0.00 2.79 0.00 0.00 35.95 38.70 2qta h PHE 207 CO 0.02 0.85 0.35 -0.07 -2.23 0.00 0.00 178.31 177.23 2qta h LEU 208 N 0.81 1.09 -0.92 0.59 3.38 -0.70 -0.73 115.31 118.83 2qta h LEU 208 Ca 0.15 -0.16 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 2qta h LEU 208 Cb 0.48 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.91 2qta h LEU 208 CO 0.02 0.95 0.34 0.11 0.09 0.00 0.00 178.44 179.95 2qta h LYS 209 N 1.16 1.13 -0.22 1.13 1.79 -0.87 -2.40 116.57 118.29 2qta h LYS 209 Ca 0.27 -0.18 -0.00 0.00 -2.18 0.00 0.00 60.65 58.57 2qta h LYS 209 Cb 0.17 -0.20 -0.01 0.00 -1.58 0.00 0.00 32.23 30.62 2qta h LYS 209 CO -0.03 0.89 0.14 -0.92 -1.08 0.00 0.00 179.45 178.45 2qta h TYR 210 N 1.11 0.28 -1.00 -1.35 3.20 -0.57 0.11 116.97 118.76 2qta h TYR 210 Ca 0.26 0.00 0.04 0.00 3.14 0.00 0.00 58.73 62.18 2qta h TYR 210 Cb 0.16 -0.09 -0.06 0.00 1.54 0.00 0.00 36.73 38.27 2qta h TYR 210 CO 0.02 0.21 0.65 -0.07 -1.64 0.00 0.00 178.16 177.32 2qta h LEU 211 N 0.28 1.08 -0.08 2.82 4.07 -0.92 0.10 115.31 122.67 2qta h LEU 211 Ca 0.08 -0.01 -0.04 0.00 0.08 0.00 0.00 57.88 57.99 2qta h LEU 211 Cb 0.00 -0.24 -0.00 0.00 1.08 0.00 0.00 40.66 41.50 2qta h LEU 211 CO -0.02 0.73 -0.10 -0.08 -1.08 0.00 0.00 178.44 177.90 2qta h GLU 212 N 1.25 0.21 -0.12 1.13 4.81 -0.91 -0.84 114.58 120.11 2qta h GLU 212 Ca 0.40 -0.12 -0.01 0.00 -0.13 0.00 0.00 59.36 59.50 2qta h GLU 212 Cb 0.02 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.41 2qta h GLU 212 CO -0.13 0.67 0.02 0.45 -0.73 0.00 0.00 179.01 179.29 2qta h HIS 213 N -0.24 0.16 -0.00 0.92 3.86 -0.43 -0.09 115.15 119.32 2qta h HIS 213 Ca 0.01 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.22 2qta h HIS 213 Cb 0.64 -0.05 0.00 0.00 1.06 0.00 0.00 27.41 29.06 2qta h HIS 213 CO 0.10 0.15 -0.03 0.54 0.86 0.00 0.00 177.93 179.56 2qta n ARG 214 N -4.46 1.07 -1.53 2.45 1.74 0.33 -4.47 116.66 111.79 2qta n ARG 214 Ca -0.01 -0.32 -0.11 0.00 -0.77 0.00 0.00 57.85 56.65 2qta n ARG 214 Cb 0.13 -1.49 -0.04 0.00 -1.02 0.00 0.00 32.46 30.04 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 1.13 0.89 0.10 -0.13 0.00 -0.05 -4.91 105.19 102.22 2qta n GLY 215 Ca 0.20 -0.52 -0.14 0.00 0.00 0.00 0.00 46.02 45.57 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 0.17 -7.00 0.99 3.38 -1.37 -3.48 115.31 108.00 2qta h LEU 216 Ca -0.23 -0.37 0.01 0.00 0.09 0.00 0.00 57.88 57.38 2qta h LEU 216 Cb 0.82 -0.05 -0.23 0.00 0.09 0.00 0.00 40.66 41.29 2qta h LEU 216 CO 0.31 1.33 0.20 -0.75 0.09 0.00 0.00 178.44 179.62 2qta s LYS 217 N -2.59 0.71 -0.64 1.13 2.20 -0.97 -5.02 119.74 114.56 2qta s LYS 217 Ca -0.11 0.93 -0.27 0.00 -0.36 0.00 0.00 55.97 56.16 2qta s LYS 217 Cb 0.07 0.30 0.03 0.00 -1.51 0.00 0.00 37.83 36.72 2qta s LYS 217 CO 0.81 -0.10 1.19 0.34 -0.36 0.00 0.00 175.35 177.22 2qta s ASP 218 N 0.66 6.32 -0.01 1.43 -1.08 -1.26 -2.95 116.67 119.78 2qta s ASP 218 Ca -0.02 -0.20 0.16 0.00 -0.52 0.00 0.00 52.55 51.98 2qta s ASP 218 Cb -0.05 -2.54 0.47 0.00 -1.46 0.00 0.00 42.92 39.34 2qta s ASP 218 CO -0.06 -1.58 1.39 0.35 0.52 0.00 0.00 175.17 175.79 2qta n THR 219 N 6.48 1.06 0.30 1.71 -2.24 -1.26 -4.65 114.28 115.68 2qta n THR 219 Ca 0.05 -1.03 0.19 0.00 -2.27 0.00 0.00 64.05 60.99 2qta n THR 219 Cb 0.49 0.47 0.99 0.00 -2.10 0.00 0.00 70.33 70.18 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 3.04 0.00 -0.39 3.42 4.64 -1.91 -1.65 113.55 120.70 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 0.01 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.26 2qta n LYS 221 N -3.34 2.08 -4.09 4.77 5.02 -1.26 -4.89 118.16 116.45 2qta n LYS 221 Ca -0.01 -1.65 -0.36 0.00 -2.02 0.00 0.00 58.31 54.26 2qta n LYS 221 Cb 0.21 -1.40 -0.07 0.00 -0.02 0.00 0.00 35.03 33.75 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 -1.48 3.23 -0.02 1.97 -0.21 -0.62 -4.80 119.66 117.72 2qta s GLN 222 Ca 0.33 -0.27 0.07 0.00 0.02 0.00 0.00 55.36 55.50 2qta s GLN 222 Cb 0.18 -3.00 -0.02 0.00 1.00 0.00 0.00 33.01 31.17 2qta s GLN 222 CO 0.24 0.74 -0.23 0.99 -2.12 0.00 0.00 175.29 174.91 2qta s THR 223 N -1.00 1.81 -0.25 -0.19 2.01 -1.26 -4.87 115.64 111.89 2qta s THR 223 Ca 0.15 -0.97 -0.10 0.00 0.31 0.00 0.00 61.69 61.08 2qta s THR 223 Cb -0.12 -1.51 -0.05 0.00 0.01 0.00 0.00 72.50 70.84 2qta s THR 223 CO 0.05 0.51 0.15 -0.69 -0.69 0.00 0.00 174.62 173.95 2qta s VAL 224 N -0.45 5.16 -0.17 3.82 1.01 0.95 -1.26 120.40 129.46 2qta s VAL 224 Ca 0.06 0.11 -0.03 0.00 0.00 0.00 0.00 61.98 62.13 2qta s VAL 224 Cb -0.10 -3.42 -0.02 0.00 0.00 0.00 0.00 36.38 32.84 2qta s VAL 224 CO -0.00 0.32 -0.07 -0.31 0.00 0.00 0.00 175.10 175.04 2qta s TYR 225 N 1.34 2.93 -0.27 5.22 2.02 -0.16 -0.88 117.35 127.56 2qta s TYR 225 Ca 0.07 -0.64 -0.03 0.00 -0.37 0.00 0.00 57.07 56.10 2qta s TYR 225 Cb -0.15 -1.98 0.03 0.00 -0.40 0.00 0.00 41.96 39.46 2qta s TYR 225 CO 0.07 -0.28 -0.01 0.00 -1.57 0.00 0.00 175.55 173.76 2qta s ALA 226 N 0.78 2.82 -0.40 3.71 0.00 -0.30 -0.34 121.76 128.02 2qta s ALA 226 Ca -0.03 -1.54 -0.18 0.00 0.00 0.00 0.00 51.96 50.22 2qta s ALA 226 Cb -0.15 -1.87 0.01 0.00 0.00 0.00 0.00 23.12 21.11 2qta s ALA 226 CO 0.02 -0.96 0.48 -0.06 0.00 0.00 0.00 175.76 175.23 2qta s PHE 227 N 1.35 3.16 0.27 0.00 0.40 -0.67 -0.03 117.98 122.46 2qta s PHE 227 Ca -0.01 -0.19 0.11 0.00 -0.60 0.00 0.00 56.93 56.25 2qta s PHE 227 Cb -0.18 -2.95 -0.05 0.00 0.51 0.00 0.00 43.02 40.36 2qta s PHE 227 CO -0.02 -0.67 -0.13 -0.51 0.70 0.00 0.00 175.22 174.59 2qta s LEU 228 N 2.28 2.80 0.27 -0.37 1.43 -0.17 -3.53 118.68 121.39 2qta s LEU 228 Ca 0.15 -0.89 0.01 0.00 -1.03 0.00 0.00 54.13 52.37 2qta s LEU 228 Cb -0.16 -1.32 -0.04 0.00 0.03 0.00 0.00 46.19 44.70 2qta s LEU 228 CO 0.14 0.03 0.45 -0.83 0.23 0.00 0.00 176.35 176.37 2qta s GLY 229 N -3.53 1.48 0.14 -3.19 0.00 -1.26 -0.97 107.32 99.99 2qta s GLY 229 Ca 0.30 -0.95 -0.03 0.00 0.00 0.00 0.00 44.72 44.05 2qta s GLY 229 CO 0.17 -0.91 1.33 1.29 0.00 0.00 0.00 173.10 174.98 2qta h ASP 230 N 1.32 0.48 -0.21 1.64 3.04 -1.81 -3.13 116.42 117.74 2qta h ASP 230 Ca -0.50 -0.37 -0.06 0.00 -3.24 0.00 0.00 57.03 52.86 2qta h ASP 230 Cb 1.21 -0.15 -0.02 0.00 -1.04 0.00 0.00 39.33 39.34 2qta h ASP 230 CO 0.64 1.17 -0.04 1.23 -2.04 0.00 0.00 179.24 180.19 2qta h GLY 231 N 1.35 0.57 2.00 7.15 0.00 -1.88 -2.22 103.07 110.04 2qta h GLY 231 Ca -0.07 -0.36 -0.01 0.00 0.00 0.00 0.00 47.33 46.89 2qta h GLY 231 CO 0.15 0.34 -0.05 -2.09 0.00 0.00 0.00 176.54 174.89 2qta h GLU 232 N 0.50 0.00 0.00 4.80 4.81 -1.93 -2.11 114.58 120.65 2qta h GLU 232 Ca 0.10 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.33 2qta h GLU 232 Cb 0.40 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.78 2qta h GLU 232 CO 0.02 0.05 0.00 -1.33 -0.73 0.00 0.00 179.01 177.02 2qta n MET 233 N -3.27 0.02 0.20 1.92 2.81 -0.84 -1.58 117.12 116.38 2qta n MET 233 Ca -0.01 0.33 0.09 0.00 -1.81 0.00 0.00 57.70 56.30 2qta n MET 233 Cb 0.23 -1.50 0.25 0.00 -0.71 0.00 0.00 33.22 31.49 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 -2.91 7.83 5.19 -1.55 -3.41 116.42 121.57 2qta h ASP 234 Ca 0.00 0.00 -0.52 0.00 -0.62 0.00 0.00 57.03 55.89 2qta h ASP 234 Cb 0.14 0.00 0.05 0.00 0.18 0.00 0.00 39.33 39.71 2qta h ASP 234 CO 0.00 0.21 0.90 -1.61 -3.12 0.00 0.00 179.24 175.62 2qta s GLU 235 N -3.29 4.18 0.49 3.56 0.41 -0.61 -4.86 118.70 118.59 2qta s GLU 235 Ca 0.04 2.45 0.21 0.00 -0.41 0.00 0.00 54.97 57.26 2qta s GLU 235 Cb 0.07 -3.11 1.27 0.00 -1.78 0.00 0.00 34.13 30.58 2qta s GLU 235 CO 0.67 -0.63 1.98 -1.35 -0.49 0.00 0.00 175.26 175.45 2qta h PRO 236 N 6.33 0.15 0.00 0.39 0.11 -1.89 0.09 132.00 137.17 2qta h PRO 236 Ca -0.44 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.64 2qta h PRO 236 Cb 1.21 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 2qta h PRO 236 CO 0.89 0.10 -0.12 0.93 -0.21 0.00 0.00 178.00 179.59 2qta h GLU 237 N 0.15 0.00 -0.49 1.05 3.07 -1.89 -0.65 114.58 115.82 2qta h GLU 237 Ca 0.27 0.00 -0.09 0.00 -0.50 0.00 0.00 59.36 59.04 2qta h GLU 237 Cb 0.88 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.77 2qta h GLU 237 CO -0.04 0.12 -0.04 0.77 -1.40 0.00 0.00 179.01 178.42 2qta h SER 238 N 0.00 0.89 -0.00 1.42 0.02 -1.11 -3.34 113.55 111.43 2qta h SER 238 Ca -0.00 -0.33 0.00 0.00 -0.84 0.00 0.00 61.79 60.62 2qta h SER 238 Cb 0.46 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 62.76 2qta h SER 238 CO 0.02 1.00 -0.26 0.29 -1.14 0.00 0.00 176.83 176.74 2qta n LYS 239 N -4.28 5.06 0.30 3.45 5.02 -1.22 -4.70 118.16 121.79 2qta n LYS 239 Ca 0.01 -0.01 0.18 0.00 -2.02 0.00 0.00 58.31 56.47 2qta n LYS 239 Cb 0.34 -0.77 0.98 0.00 -0.02 0.00 0.00 35.03 35.56 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 1.32 0.00 -0.05 0.72 0.00 -1.23 -2.42 103.07 101.42 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 -0.02 0.00 0.00 0.00 0.00 176.54 176.52 2qta n ALA 241 N -1.96 1.94 0.32 3.60 0.00 -1.26 -4.75 120.51 118.40 2qta n ALA 241 Ca -0.02 -1.31 0.11 0.00 0.00 0.00 0.00 53.44 52.21 2qta n ALA 241 Cb 0.15 -0.11 0.48 0.00 0.00 0.00 0.00 19.45 19.97 2qta n ALA 241 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 2qta n ILE 242 N -0.63 0.96 0.17 0.00 -5.35 -0.91 -1.10 119.36 112.50 2qta n ILE 242 Ca 0.04 0.38 0.05 0.00 -0.27 0.00 0.00 62.75 62.95 2qta n ILE 242 Cb 0.39 -1.32 0.19 0.00 -1.74 0.00 0.00 39.64 37.16 2qta n ILE 242 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 2qta h THR 243 N 0.00 0.79 -0.34 7.28 2.02 -1.84 -3.24 112.91 117.58 2qta h THR 243 Ca 0.00 -1.81 -0.08 0.00 0.77 0.00 0.00 66.41 65.29 2qta h THR 243 Cb 0.24 2.16 -0.02 0.00 -1.74 0.00 0.00 68.15 68.79 2qta h THR 243 CO 0.00 0.40 -0.14 0.40 0.37 0.00 0.00 175.52 176.55 2qta h ILE 244 N 0.00 1.25 0.00 3.11 1.08 -1.48 -2.26 117.51 119.20 2qta h ILE 244 Ca -0.00 -1.12 -0.01 0.00 -0.39 0.00 0.00 64.86 63.33 2qta h ILE 244 Cb 1.13 1.14 -0.00 0.00 -3.07 0.00 0.00 36.82 36.02 2qta h ILE 244 CO 0.05 0.37 -0.05 0.00 -0.69 0.00 0.00 178.15 177.83 2qta h ALA 245 N 1.30 1.86 0.21 1.87 0.00 -1.68 -0.65 119.26 122.17 2qta h ALA 245 Ca 0.10 -0.05 -0.31 0.00 0.00 0.00 0.00 54.91 54.65 2qta h ALA 245 Cb 0.56 -0.01 0.03 0.00 0.00 0.00 0.00 17.79 18.37 2qta h ALA 245 CO 0.04 0.06 -1.41 1.15 0.00 0.00 0.00 179.25 179.09 2qta h THR 246 N 0.00 1.23 -1.01 0.00 2.02 -1.58 -1.09 112.91 112.48 2qta h THR 246 Ca -0.00 -2.60 0.05 0.00 0.77 0.00 0.00 66.41 64.63 2qta h THR 246 Cb 0.09 2.99 -0.06 0.00 -1.74 0.00 0.00 68.15 69.43 2qta h THR 246 CO 0.01 0.79 0.66 0.03 0.37 0.00 0.00 175.52 177.38 2qta h ARG 247 N -0.01 1.21 -0.28 6.66 3.08 -0.88 -2.69 114.38 121.47 2qta h ARG 247 Ca -0.26 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.72 2qta h ARG 247 Cb 2.01 -0.27 0.00 0.00 0.08 0.00 0.00 29.97 31.79 2qta h ARG 247 CO 0.21 0.80 0.00 0.39 -1.07 0.00 0.00 179.97 180.30 2qta n GLU 248 N -4.46 2.14 -3.81 0.04 -0.58 -0.30 -4.98 120.64 108.69 2qta n GLU 248 Ca 0.14 -1.72 -0.26 0.00 -0.42 0.00 0.00 57.16 54.90 2qta n GLU 248 Cb 0.12 -1.45 0.01 0.00 -0.57 0.00 0.00 31.44 29.55 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 0.95 -3.06 -1.78 3.49 5.02 -0.80 -4.83 118.16 117.15 2qta n LYS 249 Ca 0.18 0.47 -0.42 0.00 -2.02 0.00 0.00 58.31 56.52 2qta n LYS 249 Cb 0.48 -4.57 0.00 0.00 -0.02 0.00 0.00 35.03 30.92 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 -4.30 6.77 -0.14 -0.35 4.77 -0.48 -4.40 117.00 118.87 2qta n LEU 250 Ca -0.24 -4.14 0.00 0.00 -0.03 0.00 0.00 56.01 51.60 2qta n LEU 250 Cb 0.66 -1.66 0.00 0.00 -2.33 0.00 0.00 43.42 40.09 2qta n LEU 250 CO 0.71 1.07 0.39 -0.90 -1.33 0.00 0.00 177.39 177.33 2qta n ASP 251 N 6.18 0.25 -0.76 -1.43 5.68 -1.23 -1.82 116.55 123.42 2qta n ASP 251 Ca 0.52 -1.82 0.07 0.00 -0.50 0.00 0.00 54.79 53.06 2qta n ASP 251 Cb 0.39 -0.12 0.21 0.00 -1.14 0.00 0.00 41.12 40.46 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 -0.35 3.42 -4.17 -1.12 6.94 -1.26 -4.90 115.26 113.81 2qta n ASN 252 Ca 0.00 -2.55 -0.30 0.00 -0.02 0.00 0.00 54.58 51.72 2qta n ASN 252 Cb 0.06 -0.39 -0.17 0.00 -2.36 0.00 0.00 39.78 36.92 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 -1.98 1.97 -0.09 -4.53 2.96 -0.75 -0.04 118.68 116.22 2qta s LEU 253 Ca 0.33 -0.47 -0.01 0.00 -0.22 0.00 0.00 54.13 53.76 2qta s LEU 253 Cb 0.24 -1.23 0.03 0.00 0.50 0.00 0.00 46.19 45.73 2qta s LEU 253 CO 0.12 0.14 -0.04 -0.69 -1.32 0.00 0.00 176.35 174.57 2qta s VAL 254 N 0.30 0.69 -0.11 1.68 1.01 -0.06 -2.35 120.40 121.57 2qta s VAL 254 Ca -0.14 -0.09 -0.16 0.00 0.00 0.00 0.00 61.98 61.59 2qta s VAL 254 Cb -0.16 -0.79 -0.05 0.00 0.00 0.00 0.00 36.38 35.38 2qta s VAL 254 CO 0.06 0.30 0.39 -0.36 0.00 0.00 0.00 175.10 175.50 2qta s PHE 255 N 1.84 3.54 -0.32 5.22 0.40 -0.07 -1.15 117.98 127.44 2qta s PHE 255 Ca 0.05 0.80 0.02 0.00 -0.60 0.00 0.00 56.93 57.20 2qta s PHE 255 Cb -0.12 -2.42 0.08 0.00 0.51 0.00 0.00 43.02 41.07 2qta s PHE 255 CO -0.07 0.29 0.01 0.08 0.70 0.00 0.00 175.22 176.23 2qta s VAL 256 N 0.23 2.47 -0.30 -0.44 1.01 0.96 -0.42 120.40 123.91 2qta s VAL 256 Ca 0.22 -1.95 -0.11 0.00 0.00 0.00 0.00 61.98 60.14 2qta s VAL 256 Cb -0.15 -2.63 -0.04 0.00 0.00 0.00 0.00 36.38 33.57 2qta s VAL 256 CO 0.08 -0.36 0.20 -0.63 0.00 0.00 0.00 175.10 174.40 2qta s ILE 257 N 1.04 5.27 -0.65 2.22 1.01 0.15 -0.99 121.20 129.25 2qta s ILE 257 Ca 0.02 0.04 -0.27 0.00 0.00 0.00 0.00 60.65 60.43 2qta s ILE 257 Cb -0.20 -3.57 0.02 0.00 0.01 0.00 0.00 42.46 38.72 2qta s ILE 257 CO -0.06 0.17 1.38 0.21 0.00 0.00 0.00 174.94 176.64 2qta s ASN 258 N 1.74 6.08 -1.21 3.58 2.47 -0.14 -1.66 114.94 125.81 2qta s ASN 258 Ca 0.07 -0.05 -0.10 0.00 0.42 0.00 0.00 52.86 53.20 2qta s ASN 258 Cb -0.16 -2.55 0.20 0.00 -1.45 0.00 0.00 41.25 37.29 2qta s ASN 258 CO 0.11 -1.81 1.57 0.00 -3.72 0.00 0.00 177.10 173.24 2qta n ASN 260 N 3.93 1.77 0.00 0.00 0.23 -1.26 -1.95 115.26 117.98 2qta n ASN 260 Ca 0.35 -1.69 0.00 0.00 -0.53 0.00 0.00 54.58 52.71 2qta n ASN 260 Cb 0.38 -0.09 0.00 0.00 -2.08 0.00 0.00 39.78 38.00 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 0.39 0.46 -4.04 -4.53 4.32 -1.26 -4.51 117.00 107.82 2qta n LEU 261 Ca 0.17 0.00 -0.21 0.00 -0.02 0.00 0.00 56.01 55.95 2qta n LEU 261 Cb 0.36 -1.26 -0.15 0.00 -1.62 0.00 0.00 43.42 40.75 2qta n LEU 261 CO 0.14 -0.41 -0.45 -1.58 -1.22 0.00 0.00 177.39 173.87 2qta s GLN 262 N -0.82 0.97 0.00 3.23 0.74 -1.26 -1.55 119.66 120.97 2qta s GLN 262 Ca 0.00 -0.38 0.00 0.00 0.05 0.00 0.00 55.36 55.03 2qta s GLN 262 Cb 0.00 -0.92 0.00 0.00 1.10 0.00 0.00 33.01 33.19 2qta s GLN 262 CO 0.00 0.20 0.00 2.89 -0.55 0.00 0.00 175.29 177.83 2qta n ARG 263 N 2.98 3.80 0.04 1.67 1.85 -0.09 -4.45 116.66 122.46 2qta n ARG 263 Ca -0.15 0.00 -0.08 0.00 -1.00 0.00 0.00 57.85 56.62 2qta n ARG 263 Cb 0.55 0.00 -0.06 0.00 -1.05 0.00 0.00 32.46 31.91 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 -0.17 -1.32 2.89 5.85 -1.99 -3.38 115.31 117.19 2qta h LEU 264 Ca 0.00 -0.28 0.00 0.00 0.84 0.00 0.00 57.88 58.44 2qta h LEU 264 Cb 0.00 0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.07 2qta h LEU 264 CO 0.00 0.40 0.00 0.47 -0.34 0.00 0.00 178.44 178.97 2qta n ASP 265 N -4.89 1.99 0.00 1.25 9.92 -1.26 -5.01 116.55 118.55 2qta n ASP 265 Ca -0.06 -1.74 0.00 0.00 -0.53 0.00 0.00 54.79 52.46 2qta n ASP 265 Cb 0.22 -0.11 0.00 0.00 -0.64 0.00 0.00 41.12 40.59 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 1.21 -1.45 3.78 0.44 0.00 -1.26 -5.15 105.19 102.75 2qta n GLY 266 Ca 0.17 -1.01 -0.34 0.00 0.00 0.00 0.00 46.02 44.83 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 -1.18 3.35 0.09 1.61 0.04 -1.26 -0.91 135.00 136.74 2qta s PRO 267 Ca 0.00 1.50 -0.24 0.00 0.04 0.00 0.00 61.00 62.30 2qta s PRO 267 Cb 0.00 -2.02 -0.14 0.00 0.04 0.00 0.00 34.50 32.38 2qta s PRO 267 CO 0.00 -0.83 1.73 0.28 0.04 0.00 0.00 177.00 178.22 2qta h VAL 268 N 1.03 0.92 -2.10 -0.36 2.07 -1.59 -3.38 116.25 112.84 2qta h VAL 268 Ca -0.49 0.00 -0.48 0.00 0.82 0.00 0.00 66.70 66.55 2qta h VAL 268 Cb 1.25 0.92 -0.33 0.00 -1.52 0.00 0.00 31.29 31.60 2qta h VAL 268 CO 0.57 0.00 -0.83 0.42 0.02 0.00 0.00 177.57 177.75 2qta s THR 269 N -6.18 -0.03 0.46 2.57 -4.23 -1.26 -5.02 115.64 101.95 2qta s THR 269 Ca -0.13 -1.93 0.17 0.00 -1.18 0.00 0.00 61.69 58.62 2qta s THR 269 Cb 0.06 -0.92 0.35 0.00 1.34 0.00 0.00 72.50 73.33 2qta s THR 269 CO 0.66 -0.88 1.99 1.23 -0.54 0.00 0.00 174.62 177.07 2qta h GLY 270 N 6.02 0.40 -2.69 3.99 0.00 -1.91 -1.07 103.07 107.81 2qta h GLY 270 Ca 0.16 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.38 2qta h GLY 270 CO 0.26 0.06 0.00 0.70 0.00 0.00 0.00 176.54 177.57 2qta n ASN 271 N -4.45 4.07 -0.13 0.19 3.02 -1.26 -0.08 115.26 116.62 2qta n ASN 271 Ca 0.10 -2.28 0.00 0.00 -0.03 0.00 0.00 54.58 52.36 2qta n ASN 271 Cb 0.44 -0.52 0.00 0.00 -0.61 0.00 0.00 39.78 39.09 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 1.20 5.96 2.62 7.41 0.00 -0.41 -4.90 105.19 117.08 2qta n GLY 272 Ca 0.23 -1.66 -0.29 0.00 0.00 0.00 0.00 46.02 44.29 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 0.71 0.67 0.49 1.61 1.02 -1.26 -0.52 119.74 122.46 2qta s LYS 273 Ca 0.00 -1.19 0.17 0.00 0.02 0.00 0.00 55.97 54.97 2qta s LYS 273 Cb 0.00 -1.71 1.20 0.00 -0.52 0.00 0.00 37.83 36.80 2qta s LYS 273 CO 0.00 -1.08 2.07 0.97 -0.92 0.00 0.00 175.35 176.39 2qta h ILE 274 N 5.88 0.93 -0.46 2.17 6.09 -1.98 -1.49 117.51 128.66 2qta h ILE 274 Ca -0.08 -0.05 -0.11 0.00 -1.37 0.00 0.00 64.86 63.25 2qta h ILE 274 Cb 0.99 0.76 -0.02 0.00 0.47 0.00 0.00 36.82 39.02 2qta h ILE 274 CO 0.42 0.03 -0.15 0.40 -3.07 0.00 0.00 178.15 175.78 2qta h ILE 275 N 0.15 1.27 -0.21 2.19 2.04 -1.98 -0.90 117.51 120.06 2qta h ILE 275 Ca 0.13 -1.26 -0.16 0.00 1.00 0.00 0.00 64.86 64.57 2qta h ILE 275 Cb 0.34 1.07 -0.01 0.00 -0.74 0.00 0.00 36.82 37.48 2qta h ILE 275 CO -0.02 0.43 -0.52 0.78 0.00 0.00 0.00 178.15 178.83 2qta h ASN 276 N 0.78 0.66 -0.15 1.72 4.21 -1.76 0.76 115.58 121.80 2qta h ASN 276 Ca 0.12 -0.34 -0.00 0.00 1.21 0.00 0.00 56.30 57.28 2qta h ASN 276 Cb 0.67 -0.19 -0.01 0.00 -1.12 0.00 0.00 38.32 37.68 2qta h ASN 276 CO 0.05 1.06 0.09 -0.08 -1.29 0.00 0.00 177.43 177.25 2qta h GLU 277 N 0.47 0.21 -0.37 0.81 4.81 -1.05 0.98 114.58 120.44 2qta h GLU 277 Ca 0.02 -0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.19 2qta h GLU 277 Cb 1.06 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 30.38 2qta h GLU 277 CO 0.10 0.22 0.11 -0.07 -0.73 0.00 0.00 179.01 178.64 2qta h LEU 278 N 0.15 0.55 -0.72 1.64 3.38 -1.03 -2.06 115.31 117.22 2qta h LEU 278 Ca 0.05 -0.21 0.02 0.00 0.09 0.00 0.00 57.88 57.83 2qta h LEU 278 Cb 0.06 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.63 2qta h LEU 278 CO -0.01 0.62 0.46 -0.08 0.09 0.00 0.00 178.44 179.52 2qta h GLU 279 N 0.46 0.89 -0.19 1.13 4.81 -0.69 -1.64 114.58 119.36 2qta h GLU 279 Ca 0.12 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.29 2qta h GLU 279 Cb 0.27 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 2qta h GLU 279 CO -0.00 0.59 0.11 0.78 -0.73 0.00 0.00 179.01 179.76 2qta h GLY 280 N 0.92 0.27 1.53 1.92 0.00 -0.50 -0.30 103.07 106.91 2qta h GLY 280 Ca 0.28 -0.11 -0.22 0.00 0.00 0.00 0.00 47.33 47.27 2qta h GLY 280 CO -0.09 0.11 -0.92 1.19 0.00 0.00 0.00 176.54 176.83 2qta h ILE 281 N 0.22 1.39 -0.36 2.60 2.10 -1.28 -1.59 117.51 120.59 2qta h ILE 281 Ca 0.07 -2.40 -0.16 0.00 1.08 0.00 0.00 64.86 63.45 2qta h ILE 281 Cb 0.03 2.38 -0.01 0.00 -1.09 0.00 0.00 36.82 38.13 2qta h ILE 281 CO -0.01 0.72 -0.41 -0.26 -1.08 0.00 0.00 178.15 177.11 2qta h PHE 282 N 0.25 1.09 -0.54 2.19 -1.00 -1.28 -0.11 116.94 117.55 2qta h PHE 282 Ca -0.08 -0.33 -0.03 0.00 2.81 0.00 0.00 57.97 60.34 2qta h PHE 282 Cb 1.55 -0.23 -0.02 0.00 3.61 0.00 0.00 35.95 40.86 2qta h PHE 282 CO 0.06 1.16 0.23 1.49 -1.61 0.00 0.00 178.31 179.63 2qta h GLU 283 N 0.73 0.80 0.00 1.51 4.57 -1.08 -0.52 114.58 120.60 2qta h GLU 283 Ca 0.05 -0.14 -0.04 0.00 -1.18 0.00 0.00 59.36 58.06 2qta h GLU 283 Cb 1.00 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 29.45 2qta h GLU 283 CO 0.10 0.69 -0.17 0.78 -1.18 0.00 0.00 179.01 179.23 2qta h GLY 284 N 0.73 0.00 0.49 1.92 0.00 -1.02 -0.84 103.07 104.34 2qta h GLY 284 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.51 2qta h GLY 284 CO -0.02 0.00 -0.02 0.00 0.00 0.00 0.00 176.54 176.51 2qta n ALA 285 N -2.31 2.66 -0.45 3.60 0.00 -0.07 -4.91 120.51 119.02 2qta n ALA 285 Ca -0.02 -0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.13 2qta n ALA 285 Cb 0.29 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.36 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 1.10 0.77 3.89 0.00 0.00 -0.32 -4.61 105.19 106.03 2qta n GLY 286 Ca 0.21 -0.01 -0.29 0.00 0.00 0.00 0.00 46.02 45.93 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 -2.00 3.48 -0.25 1.61 0.52 -0.26 -4.78 118.94 117.25 2qta s TRP 287 Ca 0.00 0.97 -0.18 0.00 0.02 0.00 0.00 56.10 56.90 2qta s TRP 287 Cb 0.00 -2.66 -0.03 0.00 -1.15 0.00 0.00 33.47 29.63 2qta s TRP 287 CO 0.00 -0.68 0.54 1.21 0.02 0.00 0.00 176.95 178.04 2qta s ASN 288 N -4.22 6.48 -0.17 2.95 2.47 -0.60 -4.43 114.94 117.42 2qta s ASN 288 Ca 0.53 0.58 -0.04 0.00 0.42 0.00 0.00 52.86 54.35 2qta s ASN 288 Cb -0.11 -2.29 -0.02 0.00 -1.45 0.00 0.00 41.25 37.37 2qta s ASN 288 CO 0.49 -0.30 -0.03 -0.69 -3.72 0.00 0.00 177.10 172.85 2qta s VAL 289 N 2.30 3.83 -0.21 -5.21 1.01 -1.26 -0.69 120.40 120.16 2qta s VAL 289 Ca 0.23 -0.37 0.01 0.00 0.00 0.00 0.00 61.98 61.85 2qta s VAL 289 Cb -0.16 -2.70 0.03 0.00 0.00 0.00 0.00 36.38 33.56 2qta s VAL 289 CO 0.09 0.47 -0.15 -0.63 0.00 0.00 0.00 175.10 174.87 2qta s ILE 290 N 0.67 2.18 -0.15 2.22 1.01 -0.27 -4.98 121.20 121.88 2qta s ILE 290 Ca -0.02 -1.19 -0.15 0.00 0.00 0.00 0.00 60.65 59.29 2qta s ILE 290 Cb -0.14 -2.07 -0.04 0.00 0.01 0.00 0.00 42.46 40.22 2qta s ILE 290 CO 0.02 0.31 0.36 -0.54 0.00 0.00 0.00 174.94 175.09 2qta s LYS 291 N 1.23 4.28 -0.64 2.79 1.02 -1.26 -0.91 119.74 126.24 2qta s LYS 291 Ca -0.00 0.22 0.03 0.00 0.02 0.00 0.00 55.97 56.24 2qta s LYS 291 Cb -0.16 -3.44 0.16 0.00 -0.52 0.00 0.00 37.83 33.87 2qta s LYS 291 CO -0.09 0.19 0.42 0.08 -0.92 0.00 0.00 175.35 175.03 2qta s VAL 292 N 0.60 3.03 -0.18 3.17 1.01 -0.00 -1.33 120.40 126.69 2qta s VAL 292 Ca 0.20 -3.70 -0.18 0.00 0.00 0.00 0.00 61.98 58.29 2qta s VAL 292 Cb -0.14 -3.01 -0.15 0.00 0.00 0.00 0.00 36.38 33.08 2qta s VAL 292 CO 0.06 -0.92 0.18 0.24 0.00 0.00 0.00 175.10 174.66 2qta h MET 293 N 6.09 0.00 -5.91 2.72 0.00 -1.84 -0.09 114.93 115.91 2qta h MET 293 Ca 0.04 0.00 -0.56 0.00 0.00 0.00 0.00 59.70 59.18 2qta h MET 293 Cb 0.84 0.00 -0.27 0.00 0.00 0.00 0.00 31.60 32.17 2qta h MET 293 CO 0.72 0.71 -0.84 -1.58 0.00 0.00 0.00 176.91 175.92 2qta s TRP 294 N -2.27 1.70 1.11 -0.22 0.52 -1.26 -0.30 118.94 118.22 2qta s TRP 294 Ca -0.23 -0.36 -0.15 0.00 0.02 0.00 0.00 56.10 55.39 2qta s TRP 294 Cb 0.04 -1.04 0.24 0.00 -1.15 0.00 0.00 33.47 31.56 2qta s TRP 294 CO 0.48 0.05 1.08 0.20 0.02 0.00 0.00 176.95 178.78 2qta s GLY 295 N -0.96 1.56 0.60 0.98 0.00 -0.42 -4.16 107.32 104.91 2qta s GLY 295 Ca 0.07 -0.55 0.31 0.00 0.00 0.00 0.00 44.72 44.55 2qta s GLY 295 CO 0.01 0.18 2.27 1.76 0.00 0.00 0.00 173.10 177.32 2qta h SER 296 N -2.28 0.00 0.38 1.64 0.02 -1.94 -2.68 113.55 108.69 2qta h SER 296 Ca -0.52 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.42 2qta h SER 296 Cb 1.32 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.86 2qta h SER 296 CO 0.49 0.00 -0.04 0.03 -1.14 0.00 0.00 176.83 176.17 2qta h ARG 297 N 0.00 0.00 0.00 3.45 3.08 -1.92 -2.00 114.38 116.99 2qta h ARG 297 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2qta h ARG 297 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.06 2qta h ARG 297 CO 0.00 0.04 -0.11 -1.49 -1.07 0.00 0.00 179.97 177.35 2qta h TRP 298 N 0.00 0.00 -0.63 3.04 4.06 -1.83 -3.36 115.95 117.23 2qta h TRP 298 Ca -0.00 0.00 0.07 0.00 2.06 0.00 0.00 58.89 61.02 2qta h TRP 298 Cb 0.25 0.00 -0.06 0.00 -1.00 0.00 0.00 29.16 28.35 2qta h TRP 298 CO 0.00 0.00 0.31 -0.44 -3.56 0.00 0.00 178.44 174.75 2qta h ASP 299 N 0.00 0.42 -0.31 -3.49 3.32 -1.51 -1.26 116.42 113.59 2qta h ASP 299 Ca 0.00 0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.10 2qta h ASP 299 Cb 0.88 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 40.39 2qta h ASP 299 CO 0.00 0.26 0.20 -0.08 -1.72 0.00 0.00 179.24 177.90 2qta h GLU 300 N 0.57 0.40 -0.08 3.56 4.81 -1.77 -1.49 114.58 120.57 2qta h GLU 300 Ca 0.30 -0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.51 2qta h GLU 300 Cb 0.26 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.54 2qta h GLU 300 CO -0.22 0.26 0.02 -0.07 -0.73 0.00 0.00 179.01 178.27 2qta h LEU 301 N 0.41 0.03 -1.18 1.64 4.07 -1.64 -1.29 115.31 117.35 2qta h LEU 301 Ca 0.11 0.01 -0.07 0.00 0.08 0.00 0.00 57.88 58.01 2qta h LEU 301 Cb -0.04 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.69 2qta h LEU 301 CO -0.03 0.03 -0.16 -0.07 -1.08 0.00 0.00 178.44 177.13 2qta h LEU 302 N 0.06 0.37 -0.31 1.67 3.38 -1.14 -2.60 115.31 116.75 2qta h LEU 302 Ca 0.03 -0.10 -0.18 0.00 0.09 0.00 0.00 57.88 57.72 2qta h LEU 302 Cb 0.02 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.67 2qta h LEU 302 CO -0.03 0.55 -0.52 -0.09 0.09 0.00 0.00 178.44 178.44 2qta h ARG 303 N 0.36 0.89 -0.00 1.13 2.43 -0.94 -3.20 114.38 115.05 2qta h ARG 303 Ca 0.07 -0.55 0.00 0.00 -0.81 0.00 0.00 59.98 58.68 2qta h ARG 303 Cb 0.49 0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.10 2qta h ARG 303 CO 0.03 1.19 -0.21 0.36 -1.51 0.00 0.00 179.97 179.83 2qta n LYS 304 N -4.01 0.27 -2.72 0.20 2.85 -0.52 -4.63 118.16 109.59 2qta n LYS 304 Ca -0.04 -0.10 -0.43 0.00 -1.05 0.00 0.00 58.31 56.69 2qta n LYS 304 Cb 0.62 -1.50 -0.02 0.00 -0.65 0.00 0.00 35.03 33.48 2qta n LYS 304 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 177.40 177.69 2qta s ASP 305 N -2.80 6.73 0.15 -5.58 2.15 -0.98 -4.79 116.67 111.55 2qta s ASP 305 Ca 0.18 -2.15 0.21 0.00 0.43 0.00 0.00 52.55 51.22 2qta s ASP 305 Cb 0.19 -2.50 0.86 0.00 -0.30 0.00 0.00 42.92 41.17 2qta s ASP 305 CO 0.57 -1.17 1.65 0.35 -0.17 0.00 0.00 175.17 176.40 2qta n THR 306 N 6.00 0.80 0.20 1.71 -2.24 -1.26 -3.04 114.28 116.44 2qta n THR 306 Ca 0.36 0.17 0.08 0.00 -2.27 0.00 0.00 64.05 62.39 2qta n THR 306 Cb 0.48 -1.01 0.27 0.00 -2.10 0.00 0.00 70.33 67.97 2qta n THR 306 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 2qta h SER 307 N 0.00 0.00 0.00 3.42 4.64 -1.98 -3.47 113.55 116.17 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 0.37 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 2qta h SER 307 CO 0.00 0.26 0.00 0.61 -0.87 0.00 0.00 176.83 176.83 2qta n GLY 308 N 0.69 0.60 0.19 -0.77 0.00 -1.17 -4.91 105.19 99.81 2qta n GLY 308 Ca 0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.94 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 1.53 0.45 -0.65 1.61 1.79 -1.90 -2.12 116.57 117.28 2qta h LYS 309 Ca 0.00 -0.34 -0.01 0.00 -2.18 0.00 0.00 60.65 58.12 2qta h LYS 309 Cb 0.09 0.06 -0.03 0.00 -1.58 0.00 0.00 32.23 30.77 2qta h LYS 309 CO 0.00 0.96 0.38 1.25 -1.08 0.00 0.00 179.45 180.96 2qta h LEU 310 N 0.32 0.80 -0.34 2.94 5.85 -1.90 0.12 115.31 123.09 2qta h LEU 310 Ca -0.02 -0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.61 2qta h LEU 310 Cb 1.23 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 42.04 2qta h LEU 310 CO 0.12 0.64 0.16 0.40 -0.34 0.00 0.00 178.44 179.42 2qta h ILE 311 N 0.89 1.16 -0.48 4.05 2.04 -1.94 0.11 117.51 123.33 2qta h ILE 311 Ca 0.23 -0.47 0.05 0.00 1.00 0.00 0.00 64.86 65.67 2qta h ILE 311 Cb 0.01 0.85 -0.05 0.00 -0.74 0.00 0.00 36.82 36.89 2qta h ILE 311 CO -0.04 0.17 0.21 -0.61 0.00 0.00 0.00 178.15 177.89 2qta h GLN 312 N 0.41 0.41 -0.35 2.37 4.15 -0.70 0.15 115.11 121.55 2qta h GLN 312 Ca 0.12 -0.02 0.01 0.00 0.77 0.00 0.00 58.65 59.52 2qta h GLN 312 Cb 0.13 -0.09 -0.02 0.00 0.21 0.00 0.00 27.48 27.70 2qta h GLN 312 CO -0.01 0.27 0.23 1.25 -1.93 0.00 0.00 178.83 178.63 2qta h LEU 313 N 0.42 0.39 -0.60 -2.39 5.85 -0.48 -0.33 115.31 118.16 2qta h LEU 313 Ca 0.22 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.93 2qta h LEU 313 Cb 0.17 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.08 2qta h LEU 313 CO -0.18 0.28 0.37 0.24 -0.34 0.00 0.00 178.44 178.81 2qta h MET 314 N 0.46 0.81 -0.50 1.25 2.86 0.07 -2.43 114.93 117.46 2qta h MET 314 Ca 0.13 -0.07 0.01 0.00 -2.06 0.00 0.00 59.70 57.71 2qta h MET 314 Cb -0.04 -0.17 -0.03 0.00 0.06 0.00 0.00 31.60 31.42 2qta h MET 314 CO -0.04 0.57 0.33 -0.91 1.06 0.00 0.00 176.91 177.93 2qta h ASN 315 N 0.81 0.57 1.62 1.22 2.35 -0.21 -3.22 115.58 118.72 2qta h ASN 315 Ca 0.22 -0.01 -0.06 0.00 -0.55 0.00 0.00 56.30 55.89 2qta h ASN 315 Cb -0.03 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.19 2qta h ASN 315 CO -0.04 0.41 -0.29 1.05 -1.65 0.00 0.00 177.43 176.91 2qta h GLU 316 N 0.68 0.00 -6.70 0.81 4.11 -0.92 -3.46 114.58 109.10 2qta h GLU 316 Ca 0.18 0.00 -0.52 0.00 0.07 0.00 0.00 59.36 59.09 2qta h GLU 316 Cb -0.07 0.00 0.04 0.00 0.50 0.00 0.00 28.75 29.22 2qta h GLU 316 CO -0.04 0.29 0.67 0.99 0.07 0.00 0.00 179.01 180.99 2qta s THR 317 N -3.12 3.08 0.46 -1.06 2.01 -0.93 -5.01 115.64 111.07 2qta s THR 317 Ca 0.05 0.91 0.01 0.00 0.31 0.00 0.00 61.69 62.97 2qta s THR 317 Cb 0.07 -3.58 0.00 0.00 0.01 0.00 0.00 72.50 69.00 2qta s THR 317 CO 0.71 0.14 0.67 0.68 -0.69 0.00 0.00 174.62 176.13 2qta s VAL 318 N -0.00 3.76 0.22 3.82 -7.23 -1.26 -4.93 120.40 114.76 2qta s VAL 318 Ca 0.56 -0.58 -0.09 0.00 -1.81 0.00 0.00 61.98 60.06 2qta s VAL 318 Cb -0.38 -3.38 0.19 0.00 0.56 0.00 0.00 36.38 33.38 2qta s VAL 318 CO 0.40 -0.25 1.68 0.44 -0.31 0.00 0.00 175.10 177.06 2qta h ASP 319 N 0.39 -0.14 -0.78 4.85 3.32 -0.85 -2.00 116.42 121.22 2qta h ASP 319 Ca -0.45 0.14 0.10 0.00 0.02 0.00 0.00 57.03 56.84 2qta h ASP 319 Cb 1.26 0.22 -0.07 0.00 0.22 0.00 0.00 39.33 40.96 2qta h ASP 319 CO 0.56 -0.07 0.42 1.23 -1.72 0.00 0.00 179.24 179.66 2qta h GLY 320 N 0.19 1.20 1.27 2.75 0.00 -0.73 -1.13 103.07 106.62 2qta h GLY 320 Ca 0.34 -0.27 -0.15 0.00 0.00 0.00 0.00 47.33 47.24 2qta h GLY 320 CO -0.49 0.08 -0.41 -0.55 0.00 0.00 0.00 176.54 175.17 2qta h ASP 321 N 0.70 0.85 -0.88 0.19 3.32 -1.61 -1.83 116.42 117.17 2qta h ASP 321 Ca 0.38 -0.39 -0.00 0.00 0.02 0.00 0.00 57.03 57.04 2qta h ASP 321 Cb 0.39 -0.24 -0.04 0.00 0.22 0.00 0.00 39.33 39.66 2qta h ASP 321 CO -0.27 1.15 0.54 1.88 -1.72 0.00 0.00 179.24 180.83 2qta h TYR 322 N 0.64 1.15 -0.29 4.55 0.05 -1.02 -1.77 116.97 120.29 2qta h TYR 322 Ca 0.05 0.00 -0.11 0.00 0.05 0.00 0.00 58.73 58.73 2qta h TYR 322 Cb 0.98 -0.38 -0.01 0.00 1.01 0.00 0.00 36.73 38.32 2qta h TYR 322 CO 0.05 0.76 -0.27 1.96 -1.05 0.00 0.00 178.16 179.61 2qta h GLN 323 N 1.21 0.58 -0.81 4.88 1.08 -1.00 -2.77 115.11 118.28 2qta h GLN 323 Ca 0.32 -0.24 -0.02 0.00 -1.45 0.00 0.00 58.65 57.26 2qta h GLN 323 Cb -0.07 -0.03 -0.04 0.00 -0.05 0.00 0.00 27.48 27.30 2qta h GLN 323 CO -0.06 0.80 0.41 1.15 -0.95 0.00 0.00 178.83 180.18 2qta h THR 324 N 0.51 1.25 -0.49 -0.54 2.02 -0.52 -2.78 112.91 112.36 2qta h THR 324 Ca 0.07 -0.66 0.02 0.00 0.77 0.00 0.00 66.41 66.61 2qta h THR 324 Cb 0.73 0.20 -0.03 0.00 -1.74 0.00 0.00 68.15 67.31 2qta h THR 324 CO 0.06 0.29 0.29 -0.26 0.37 0.00 0.00 175.52 176.26 2qta h PHE 325 N 1.13 0.54 0.00 3.16 0.04 -1.09 -1.30 116.94 119.42 2qta h PHE 325 Ca 0.28 0.02 0.00 0.00 2.80 0.00 0.00 57.97 61.07 2qta h PHE 325 Cb 0.08 -0.17 0.00 0.00 2.20 0.00 0.00 35.95 38.06 2qta h PHE 325 CO 0.01 0.31 0.00 1.57 -0.60 0.00 0.00 178.31 179.60 2qta h LYS 326 N 0.58 0.00 -0.02 1.51 2.10 -1.30 -1.33 116.57 118.11 2qta h LYS 326 Ca 0.19 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.84 2qta h LYS 326 Cb 0.01 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.34 2qta h LYS 326 CO -0.09 0.00 -0.19 -1.13 -2.00 0.00 0.00 179.45 176.05 2qta n SER 327 N -2.51 1.78 0.00 7.07 3.41 -0.50 -4.91 113.62 117.96 2qta n SER 327 Ca -0.01 -1.42 0.00 0.00 -0.26 0.00 0.00 58.87 57.18 2qta n SER 327 Cb 0.10 0.15 0.00 0.00 -0.26 0.00 0.00 64.21 64.20 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 0.12 0.05 -3.72 4.33 4.76 -0.50 -5.12 118.16 118.09 2qta n LYS 328 Ca 0.14 0.00 -0.12 0.00 -2.87 0.00 0.00 58.31 55.46 2qta n LYS 328 Cb 0.43 0.00 -0.01 0.00 -1.84 0.00 0.00 35.03 33.61 2qta n LYS 328 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 2qta n ASP 329 N 0.00 -1.58 -0.30 4.39 5.68 -1.26 -5.05 116.55 118.43 2qta n ASP 329 Ca 0.00 -2.66 0.03 0.00 -0.50 0.00 0.00 54.79 51.66 2qta n ASP 329 Cb 0.00 2.79 0.17 0.00 -1.14 0.00 0.00 41.12 42.94 2qta n ASP 329 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 2qta h GLY 330 N 1.83 1.31 0.97 6.12 0.00 -1.94 -2.07 103.07 109.30 2qta h GLY 330 Ca -0.27 -0.33 -0.01 0.00 0.00 0.00 0.00 47.33 46.72 2qta h GLY 330 CO 0.36 0.14 0.24 0.00 0.00 0.00 0.00 176.54 177.29 2qta h ALA 331 N 1.46 0.56 -0.56 3.60 0.00 -1.97 -0.74 119.26 121.60 2qta h ALA 331 Ca 0.40 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 55.26 2qta h ALA 331 Cb 0.35 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 2qta h ALA 331 CO -0.24 0.08 0.33 -0.92 0.00 0.00 0.00 179.25 178.50 2qta h TYR 332 N 0.57 0.62 -0.43 0.00 5.03 -1.85 -2.08 116.97 118.83 2qta h TYR 332 Ca 0.15 0.02 -0.05 0.00 2.58 0.00 0.00 58.73 61.44 2qta h TYR 332 Cb 0.05 -0.20 -0.02 0.00 1.55 0.00 0.00 36.73 38.11 2qta h TYR 332 CO -0.02 0.34 0.08 0.28 -1.32 0.00 0.00 178.16 177.52 2qta h VAL 333 N 0.65 1.24 -0.97 1.81 2.07 -1.01 -0.28 116.25 119.76 2qta h VAL 333 Ca 0.23 -0.86 0.08 0.00 0.82 0.00 0.00 66.70 66.97 2qta h VAL 333 Cb 0.05 0.97 -0.07 0.00 -1.52 0.00 0.00 31.29 30.72 2qta h VAL 333 CO -0.11 0.30 0.62 -0.09 0.02 0.00 0.00 177.57 178.30 2qta h ARG 334 N 0.57 1.05 0.02 1.57 2.43 -0.76 -0.28 114.38 118.97 2qta h ARG 334 Ca 0.13 -0.06 -0.04 0.00 -0.81 0.00 0.00 59.98 59.20 2qta h ARG 334 Cb 0.36 -0.24 -0.00 0.00 -0.42 0.00 0.00 29.97 29.67 2qta h ARG 334 CO 0.01 0.69 -0.19 1.49 -1.51 0.00 0.00 179.97 180.46 2qta h GLU 335 N 1.08 0.03 0.00 0.20 4.81 -1.17 0.84 114.58 120.37 2qta h GLU 335 Ca 0.44 -0.05 -0.05 0.00 -0.13 0.00 0.00 59.36 59.57 2qta h GLU 335 Cb 0.26 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.65 2qta h GLU 335 CO -0.20 1.03 -0.67 0.45 -0.73 0.00 0.00 179.01 178.89 2qta h HIS 336 N -0.93 0.00 0.00 0.92 3.86 -1.06 -3.19 115.15 114.75 2qta h HIS 336 Ca -0.04 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.17 2qta h HIS 336 Cb 1.09 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.56 2qta h HIS 336 CO 0.26 0.19 0.00 0.34 0.86 0.00 0.00 177.93 179.57 2qta n PHE 337 N -2.94 0.00 0.23 2.45 7.35 -0.15 -4.52 117.46 119.87 2qta n PHE 337 Ca 0.00 0.00 0.10 0.00 -0.76 0.00 0.00 57.45 56.79 2qta n PHE 337 Cb 0.63 0.00 0.65 0.00 0.35 0.00 0.00 39.48 41.10 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 0.00 0.00 -5.13 0.04 -1.54 -1.79 116.94 108.51 2qta h PHE 338 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 2qta h PHE 338 Cb 0.00 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.15 2qta h PHE 338 CO 0.00 0.00 0.00 0.41 -0.60 0.00 0.00 178.31 178.12 2qta n GLY 339 N -1.55 -0.68 0.25 -1.45 0.00 0.29 -1.45 105.19 100.59 2qta n GLY 339 Ca -0.01 -0.14 0.13 0.00 0.00 0.00 0.00 46.02 46.00 2qta n GLY 339 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qta h LYS 340 N 0.00 0.00 -3.73 1.61 1.79 -1.47 -3.44 116.57 111.33 2qta h LYS 340 Ca 0.00 0.00 -0.19 0.00 -2.18 0.00 0.00 60.65 58.28 2qta h LYS 340 Cb 0.00 0.00 -0.24 0.00 -1.58 0.00 0.00 32.23 30.41 2qta h LYS 340 CO 0.00 0.14 -0.65 0.71 -1.08 0.00 0.00 179.45 178.57 2qta s TYR 341 N -3.79 0.08 0.22 -1.35 2.02 -1.21 -5.05 117.35 108.27 2qta s TYR 341 Ca -0.00 -0.15 -0.09 0.00 -0.37 0.00 0.00 57.07 56.45 2qta s TYR 341 Cb 0.11 -0.07 0.21 0.00 -0.40 0.00 0.00 41.96 41.81 2qta s TYR 341 CO 0.59 -0.13 1.86 -1.35 -1.57 0.00 0.00 175.55 174.95 2qta h PRO 342 N 5.24 0.94 -0.36 -1.71 0.11 -1.86 0.13 132.00 134.49 2qta h PRO 342 Ca -0.28 -0.06 -0.11 0.00 0.11 0.00 0.00 66.00 65.66 2qta h PRO 342 Cb 1.21 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 32.09 2qta h PRO 342 CO 0.44 0.62 -0.24 1.05 -0.21 0.00 0.00 178.00 179.66 2qta h GLU 343 N 0.97 0.72 -0.03 1.05 9.09 -1.96 -0.20 114.58 124.21 2qta h GLU 343 Ca 0.31 -0.29 -0.15 0.00 0.05 0.00 0.00 59.36 59.28 2qta h GLU 343 Cb -0.00 -0.03 -0.01 0.00 -1.65 0.00 0.00 28.75 27.05 2qta h GLU 343 CO -0.11 0.89 -0.65 1.79 0.05 0.00 0.00 179.01 180.98 2qta h THR 344 N 0.63 1.43 -0.71 -1.06 1.35 -1.63 -2.62 112.91 110.30 2qta h THR 344 Ca 0.09 -2.15 -0.06 0.00 -0.55 0.00 0.00 66.41 63.73 2qta h THR 344 Cb 0.74 2.14 -0.03 0.00 -1.73 0.00 0.00 68.15 69.26 2qta h THR 344 CO 0.06 0.63 0.20 0.00 -0.25 0.00 0.00 175.52 176.15 2qta h ALA 345 N 1.24 1.00 -0.57 6.62 0.00 0.41 -2.74 119.26 125.22 2qta h ALA 345 Ca -0.01 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 2qta h ALA 345 Cb 1.17 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.65 2qta h ALA 345 CO 0.09 0.66 0.33 0.00 0.00 0.00 0.00 179.25 180.33 2qta h ALA 346 N 1.14 1.51 -0.33 0.00 0.00 -0.69 -1.71 119.26 119.18 2qta h ALA 346 Ca 0.23 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 55.07 2qta h ALA 346 Cb 0.33 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2qta h ALA 346 CO -0.00 0.42 0.22 -0.07 0.00 0.00 0.00 179.25 179.81 2qta h LEU 347 N 0.78 0.35 -2.79 0.00 3.38 -1.16 -2.94 115.31 112.93 2qta h LEU 347 Ca 0.20 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.17 2qta h LEU 347 Cb -0.01 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.66 2qta h LEU 347 CO -0.04 0.25 0.00 1.33 0.09 0.00 0.00 178.44 180.07 2qta n VAL 348 N -4.49 0.91 -0.29 1.22 0.24 -1.07 -4.70 118.33 110.15 2qta n VAL 348 Ca 0.02 -0.96 0.19 0.00 -2.04 0.00 0.00 64.34 61.55 2qta n VAL 348 Cb 0.09 0.55 0.47 0.00 -1.47 0.00 0.00 33.84 33.49 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 0.99 2.10 -0.57 2.33 0.00 -1.12 -0.19 119.26 122.79 2qta h ALA 349 Ca 0.00 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 2qta h ALA 349 Cb 0.58 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 2qta h ALA 349 CO 0.00 -0.43 0.04 -0.40 0.00 0.00 0.00 179.25 178.45 2qta n ASP 350 N -4.59 5.46 -4.88 0.00 5.75 -1.26 -4.90 116.55 112.13 2qta n ASP 350 Ca 0.22 -2.93 -0.29 0.00 -0.01 0.00 0.00 54.79 51.77 2qta n ASP 350 Cb 0.71 -0.69 -0.05 0.00 -1.03 0.00 0.00 41.12 40.07 2qta n ASP 350 CO 0.00 0.00 0.00 0.26 -0.11 0.00 0.00 177.20 177.35 2qta s TRP 351 N -2.72 3.39 0.74 2.11 0.52 -0.09 -5.11 118.94 117.78 2qta s TRP 351 Ca 0.52 0.14 -0.10 0.00 0.02 0.00 0.00 56.10 56.69 2qta s TRP 351 Cb 0.40 -1.67 0.05 0.00 -1.15 0.00 0.00 33.47 31.10 2qta s TRP 351 CO 0.15 0.55 1.10 0.95 0.02 0.00 0.00 176.95 179.71 2qta s THR 352 N -1.56 2.54 0.35 2.01 -4.23 -1.26 -4.92 115.64 108.56 2qta s THR 352 Ca 0.33 0.04 0.11 0.00 -1.18 0.00 0.00 61.69 60.99 2qta s THR 352 Cb -0.12 -3.14 0.07 0.00 1.34 0.00 0.00 72.50 70.64 2qta s THR 352 CO 0.26 -0.18 1.78 0.44 -0.54 0.00 0.00 174.62 176.38 2qta h ASP 353 N -0.78 0.05 -0.34 3.99 3.32 -1.96 -2.09 116.42 118.61 2qta h ASP 353 Ca -0.45 -0.02 -0.09 0.00 0.02 0.00 0.00 57.03 56.48 2qta h ASP 353 Cb 1.30 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 40.82 2qta h ASP 353 CO 0.64 0.45 -0.11 -0.33 -1.72 0.00 0.00 179.24 178.17 2qta h GLU 354 N 0.04 0.78 -0.27 3.56 3.07 -1.93 0.11 114.58 119.94 2qta h GLU 354 Ca 0.00 -0.26 -0.15 0.00 -0.50 0.00 0.00 59.36 58.45 2qta h GLU 354 Cb 0.73 -0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 28.57 2qta h GLU 354 CO 0.05 0.86 -0.45 1.96 -1.40 0.00 0.00 179.01 180.03 2qta h GLN 355 N 0.70 0.69 -0.43 2.33 4.20 -1.83 -1.76 115.11 119.01 2qta h GLN 355 Ca 0.12 -0.39 -0.05 0.00 0.06 0.00 0.00 58.65 58.39 2qta h GLN 355 Cb 0.59 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.38 2qta h GLN 355 CO 0.04 1.00 0.06 0.82 -0.67 0.00 0.00 178.83 180.08 2qta h ILE 356 N 0.56 1.25 0.00 2.54 2.04 -1.05 -2.54 117.51 120.30 2qta h ILE 356 Ca 0.04 -0.90 -0.02 0.00 1.00 0.00 0.00 64.86 64.98 2qta h ILE 356 Cb 1.00 1.00 -0.00 0.00 -0.74 0.00 0.00 36.82 38.07 2qta h ILE 356 CO 0.09 0.31 -0.08 -0.25 0.00 0.00 0.00 178.15 178.23 2qta h TRP 357 N 0.57 0.00 0.00 1.37 -0.00 -0.55 -2.06 115.95 115.28 2qta h TRP 357 Ca 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 59.02 2qta h TRP 357 Cb 0.38 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 29.54 2qta h TRP 357 CO 0.03 0.08 0.00 0.00 -0.00 0.00 0.00 178.44 178.54 2qta h ALA 358 N 1.92 1.00 -2.45 2.65 0.00 -0.88 -3.45 119.26 118.06 2qta h ALA 358 Ca -0.00 0.00 -0.57 0.00 0.00 0.00 0.00 54.91 54.34 2qta h ALA 358 Cb 0.21 0.00 0.08 0.00 0.00 0.00 0.00 17.79 18.08 2qta h ALA 358 CO 0.01 0.00 0.74 1.28 0.00 0.00 0.00 179.25 181.28 2qta n LEU 359 N -2.68 3.48 -4.36 0.00 4.77 -0.78 -4.97 117.00 112.46 2qta n LEU 359 Ca 0.02 1.13 -0.18 0.00 -0.03 0.00 0.00 56.01 56.94 2qta n LEU 359 Cb 0.31 -1.48 -0.10 0.00 -2.33 0.00 0.00 43.42 39.81 2qta n LEU 359 CO 0.25 -0.25 -0.31 0.21 -1.33 0.00 0.00 177.39 175.96 2qta s ASN 360 N 0.52 1.95 0.34 -1.43 3.84 -1.26 -5.07 114.94 113.83 2qta s ASN 360 Ca 0.70 -1.27 -0.26 0.00 0.21 0.00 0.00 52.86 52.25 2qta s ASN 360 Cb -0.61 -0.01 -0.10 0.00 -0.55 0.00 0.00 41.25 39.99 2qta s ASN 360 CO 0.46 -0.54 0.95 -0.13 -2.79 0.00 0.00 177.10 175.05 2qta s ARG 361 N -3.87 4.53 0.38 0.43 0.52 -1.26 -1.30 118.95 118.38 2qta s ARG 361 Ca 0.31 1.32 0.13 0.00 -0.52 0.00 0.00 55.73 56.97 2qta s ARG 361 Cb 0.06 -2.73 0.95 0.00 0.52 0.00 0.00 34.95 33.75 2qta s ARG 361 CO 0.11 0.23 1.85 0.78 0.02 0.00 0.00 175.30 178.29 2qta h GLY 362 N 3.03 1.10 1.09 -3.53 0.00 -0.69 -1.98 103.07 102.08 2qta h GLY 362 Ca -0.47 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 46.61 2qta h GLY 362 CO 0.64 0.02 0.00 0.61 0.00 0.00 0.00 176.54 177.81 2qta n GLY 363 N -1.46 -0.31 0.44 4.60 0.00 0.10 -1.16 105.19 107.40 2qta n GLY 363 Ca 0.19 -0.05 0.05 0.00 0.00 0.00 0.00 46.02 46.21 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 0.16 -3.78 1.61 8.25 -0.74 -4.27 115.22 115.41 2qta n HIS 364 Ca 0.06 -0.21 -0.37 0.00 -0.26 0.00 0.00 57.72 56.94 2qta n HIS 364 Cb 0.03 -0.01 -0.13 0.00 1.12 0.00 0.00 29.99 31.01 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 -0.87 5.25 0.41 0.41 -1.08 -0.31 -4.99 116.67 115.49 2qta s ASP 365 Ca 0.14 -1.18 0.17 0.00 -0.52 0.00 0.00 52.55 51.17 2qta s ASP 365 Cb 0.09 -1.84 1.07 0.00 -1.46 0.00 0.00 42.92 40.78 2qta s ASP 365 CO 0.12 -0.32 1.83 -0.65 0.52 0.00 0.00 175.17 176.67 2qta h PRO 366 N 8.18 0.41 -0.55 4.34 0.11 -1.91 -1.46 132.00 141.11 2qta h PRO 366 Ca -0.23 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 65.77 2qta h PRO 366 Cb 1.08 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.08 2qta h PRO 366 CO 0.59 0.27 0.02 0.87 -0.21 0.00 0.00 178.00 179.54 2qta h LYS 367 N 0.42 0.97 -0.13 1.05 1.57 -1.94 0.03 116.57 118.55 2qta h LYS 367 Ca 0.50 -0.30 -0.18 0.00 -1.87 0.00 0.00 60.65 58.80 2qta h LYS 367 Cb 1.25 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 33.46 2qta h LYS 367 CO -0.21 0.96 -0.67 0.87 -0.57 0.00 0.00 179.45 179.83 2qta h LYS 368 N 0.85 0.51 0.20 3.15 1.79 -1.60 -2.60 116.57 118.87 2qta h LYS 368 Ca 0.16 -0.38 -0.01 0.00 -2.18 0.00 0.00 60.65 58.24 2qta h LYS 368 Cb 0.52 0.07 0.00 0.00 -1.58 0.00 0.00 32.23 31.24 2qta h LYS 368 CO 0.03 1.00 -0.10 0.82 -1.08 0.00 0.00 179.45 180.12 2qta h ILE 369 N 0.37 0.88 -0.54 1.86 2.04 -1.22 -2.58 117.51 118.31 2qta h ILE 369 Ca -0.02 -0.45 0.09 0.00 1.00 0.00 0.00 64.86 65.47 2qta h ILE 369 Cb 1.24 1.15 -0.07 0.00 -0.74 0.00 0.00 36.82 38.40 2qta h ILE 369 CO 0.12 0.10 0.16 0.22 0.00 0.00 0.00 178.15 178.75 2qta h TYR 370 N -0.50 0.27 -0.92 1.37 3.20 -1.01 -1.33 116.97 118.04 2qta h TYR 370 Ca -0.03 0.03 0.05 0.00 3.14 0.00 0.00 58.73 61.92 2qta h TYR 370 Cb 0.38 -0.04 -0.06 0.00 1.54 0.00 0.00 36.73 38.55 2qta h TYR 370 CO 0.00 0.05 0.59 0.00 -1.64 0.00 0.00 178.16 177.15 2qta h ALA 371 N 1.39 1.25 -0.23 1.82 0.00 -1.42 0.21 119.26 122.28 2qta h ALA 371 Ca 0.27 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.11 2qta h ALA 371 Cb 0.34 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2qta h ALA 371 CO -0.31 0.39 -0.02 0.00 0.00 0.00 0.00 179.25 179.31 2qta h ALA 372 N 1.41 0.31 -0.15 0.00 0.00 -0.87 -0.92 119.26 119.04 2qta h ALA 372 Ca 0.39 -0.23 -0.12 0.00 0.00 0.00 0.00 54.91 54.95 2qta h ALA 372 Cb 0.11 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2qta h ALA 372 CO -0.15 0.06 -0.41 0.74 0.00 0.00 0.00 179.25 179.49 2qta h PHE 373 N 0.17 0.41 -0.51 0.00 -1.00 -0.84 -1.50 116.94 113.67 2qta h PHE 373 Ca 0.06 -0.11 -0.12 0.00 2.81 0.00 0.00 57.97 60.61 2qta h PHE 373 Cb 0.45 -0.09 -0.02 0.00 3.61 0.00 0.00 35.95 39.90 2qta h PHE 373 CO 0.04 0.71 -0.15 -0.22 -1.61 0.00 0.00 178.31 177.08 2qta h LYS 374 N 0.29 1.01 -0.54 1.51 1.63 -0.52 -2.34 116.57 117.61 2qta h LYS 374 Ca 0.03 -0.40 -0.06 0.00 -0.85 0.00 0.00 60.65 59.37 2qta h LYS 374 Cb 0.85 -0.05 -0.02 0.00 -0.60 0.00 0.00 32.23 32.41 2qta h LYS 374 CO 0.07 1.08 0.11 -0.22 -3.45 0.00 0.00 179.45 177.04 2qta h LYS 375 N 0.87 0.88 -0.87 1.90 1.63 -0.88 -2.51 116.57 117.59 2qta h LYS 375 Ca 0.13 -0.22 0.02 0.00 -0.85 0.00 0.00 60.65 59.72 2qta h LYS 375 Cb 0.72 -0.11 -0.05 0.00 -0.60 0.00 0.00 32.23 32.20 2qta h LYS 375 CO 0.06 0.84 0.58 0.00 -3.45 0.00 0.00 179.45 177.47 2qta h ALA 376 N 1.00 1.41 0.00 5.00 0.00 -1.18 -1.19 119.26 124.31 2qta h ALA 376 Ca 0.17 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 2qta h ALA 376 Cb 0.37 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 2qta h ALA 376 CO 0.01 0.52 -0.06 0.37 0.00 0.00 0.00 179.25 180.09 2qta h GLN 377 N 1.14 0.00 -0.03 0.00 4.15 -0.98 -1.94 115.11 117.45 2qta h GLN 377 Ca 0.33 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.75 2qta h GLN 377 Cb -0.06 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.63 2qta h GLN 377 CO -0.09 0.06 -0.12 -0.85 -1.93 0.00 0.00 178.83 175.90 2qta n GLU 378 N -3.97 2.01 -2.93 1.69 0.28 -0.49 -4.92 120.64 112.31 2qta n GLU 378 Ca -0.03 -1.68 -0.41 0.00 -0.16 0.00 0.00 57.16 54.89 2qta n GLU 378 Cb 0.14 -1.46 -0.04 0.00 1.43 0.00 0.00 31.44 31.51 2qta n GLU 378 CO 0.00 0.00 0.00 0.99 -0.16 0.00 0.00 177.13 177.96 2qta s THR 379 N -2.09 4.89 0.30 3.84 2.01 -0.73 -5.05 115.64 118.82 2qta s THR 379 Ca 0.25 1.53 0.10 0.00 0.31 0.00 0.00 61.69 63.89 2qta s THR 379 Cb 0.19 -4.10 -0.05 0.00 0.01 0.00 0.00 72.50 68.55 2qta s THR 379 CO 0.36 0.01 -0.05 -0.54 -0.69 0.00 0.00 174.62 173.71 2qta s LYS 380 N 2.34 2.02 0.00 4.92 -0.14 -1.26 -4.74 119.74 122.87 2qta s LYS 380 Ca 0.35 -1.68 0.00 0.00 -1.36 0.00 0.00 55.97 53.29 2qta s LYS 380 Cb -0.16 -1.94 0.00 0.00 -1.68 0.00 0.00 37.83 34.05 2qta s LYS 380 CO 0.10 0.25 0.00 0.41 -0.76 0.00 0.00 175.35 175.35 2qta n GLY 381 N -0.84 1.97 3.71 -3.33 0.00 -1.26 -4.97 105.19 100.47 2qta n GLY 381 Ca -0.05 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.38 1.33 0.55 1.61 -2.85 -1.26 -4.43 119.74 114.30 2qta s LYS 382 Ca 0.00 -0.68 -0.07 0.00 -1.00 0.00 0.00 55.97 54.22 2qta s LYS 382 Cb 0.00 0.49 -0.03 0.00 -2.06 0.00 0.00 37.83 36.23 2qta s LYS 382 CO 0.00 -0.60 0.88 0.00 0.10 0.00 0.00 175.35 175.73 2qta s ALA 383 N -3.51 3.29 -0.03 0.59 0.00 -1.20 -3.53 121.76 117.37 2qta s ALA 383 Ca 0.09 -0.44 0.07 0.00 0.00 0.00 0.00 51.96 51.68 2qta s ALA 383 Cb -0.03 -2.73 -0.02 0.00 0.00 0.00 0.00 23.12 20.35 2qta s ALA 383 CO 0.00 -0.56 -0.23 0.99 0.00 0.00 0.00 175.76 175.96 2qta s THR 384 N -2.92 2.30 -0.11 0.00 2.01 -0.99 -1.55 115.64 114.37 2qta s THR 384 Ca 0.51 -1.01 0.04 0.00 0.31 0.00 0.00 61.69 61.53 2qta s THR 384 Cb -0.11 -1.82 0.00 0.00 0.01 0.00 0.00 72.50 70.58 2qta s THR 384 CO 0.47 0.58 -0.23 0.54 -0.69 0.00 0.00 174.62 175.29 2qta s VAL 385 N -0.59 2.09 -0.24 3.82 0.11 0.13 -0.89 120.40 124.82 2qta s VAL 385 Ca 0.09 -1.00 -0.08 0.00 -2.93 0.00 0.00 61.98 58.06 2qta s VAL 385 Cb -0.11 -1.80 -0.03 0.00 -1.53 0.00 0.00 36.38 32.91 2qta s VAL 385 CO -0.00 0.56 0.08 -0.63 -3.33 0.00 0.00 175.10 171.77 2qta s ILE 386 N 0.42 4.46 -0.53 7.04 1.01 0.44 -1.11 121.20 132.93 2qta s ILE 386 Ca -0.17 -0.13 -0.15 0.00 0.00 0.00 0.00 60.65 60.21 2qta s ILE 386 Cb -0.18 -3.08 0.13 0.00 0.01 0.00 0.00 42.46 39.35 2qta s ILE 386 CO 0.07 0.35 0.47 -0.76 0.00 0.00 0.00 174.94 175.08 2qta s LEU 387 N 1.42 6.10 -0.40 2.97 1.43 -0.09 -0.67 118.68 129.44 2qta s LEU 387 Ca 0.06 -1.79 -0.17 0.00 -1.03 0.00 0.00 54.13 51.20 2qta s LEU 387 Cb -0.15 -2.18 0.01 0.00 0.03 0.00 0.00 46.19 43.90 2qta s LEU 387 CO 0.04 -0.83 0.45 0.00 0.23 0.00 0.00 176.35 176.25 2qta s ALA 388 N 1.57 3.44 -0.18 4.21 0.00 -0.66 -0.82 121.76 129.31 2qta s ALA 388 Ca 0.03 -1.36 -0.29 0.00 0.00 0.00 0.00 51.96 50.34 2qta s ALA 388 Cb -0.29 -3.03 -0.00 0.00 0.00 0.00 0.00 23.12 19.79 2qta s ALA 388 CO 0.03 -1.46 1.13 -1.58 0.00 0.00 0.00 175.76 173.87 2qta s HIS 389 N 2.22 3.18 0.26 0.00 2.46 -0.05 0.61 115.29 123.97 2qta s HIS 389 Ca 0.14 1.30 0.02 0.00 0.47 0.00 0.00 55.06 57.00 2qta s HIS 389 Cb -0.16 -3.35 -0.04 0.00 -0.13 0.00 0.00 32.58 28.89 2qta s HIS 389 CO 0.14 -0.94 0.19 0.95 -2.47 0.00 0.00 174.74 172.60 2qta s THR 390 N 3.08 0.04 -0.23 0.89 -4.23 -0.82 0.01 115.64 114.38 2qta s THR 390 Ca 0.49 -2.00 -0.06 0.00 -1.18 0.00 0.00 61.69 58.95 2qta s THR 390 Cb -0.18 -2.50 -0.02 0.00 1.34 0.00 0.00 72.50 71.13 2qta s THR 390 CO 0.12 0.00 0.01 -0.63 -0.54 0.00 0.00 174.62 173.58 2qta s ILE 391 N -3.85 3.92 -0.12 2.99 1.01 -1.26 -4.10 121.20 119.79 2qta s ILE 391 Ca 0.39 -0.31 -0.28 0.00 0.00 0.00 0.00 60.65 60.46 2qta s ILE 391 Cb 0.05 -2.80 -0.01 0.00 0.01 0.00 0.00 42.46 39.70 2qta s ILE 391 CO 0.18 0.39 0.93 -0.75 0.00 0.00 0.00 174.94 175.69 2qta s LYS 392 N 1.38 4.38 0.00 2.79 2.20 -1.26 -2.79 119.74 126.45 2qta s LYS 392 Ca 0.05 1.23 0.00 0.00 -0.36 0.00 0.00 55.97 56.89 2qta s LYS 392 Cb -0.15 -3.55 0.00 0.00 -1.51 0.00 0.00 37.83 32.63 2qta s LYS 392 CO 0.01 -0.29 0.00 0.41 -0.36 0.00 0.00 175.35 175.12 2qta n GLY 393 N 3.21 1.29 3.68 5.54 0.00 -1.18 -4.96 105.19 112.79 2qta n GLY 393 Ca 0.07 -0.37 -0.45 0.00 0.00 0.00 0.00 46.02 45.27 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 -2.24 2.46 -0.25 1.61 9.36 -1.12 -1.94 117.16 125.04 2qta n TYR 394 Ca 0.00 -0.01 0.00 0.00 3.32 0.00 0.00 57.90 61.21 2qta n TYR 394 Cb 0.19 -2.67 0.00 0.00 -0.63 0.00 0.00 39.34 36.23 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 4.06 2.08 0.04 2.98 0.00 -1.26 -4.76 105.19 108.34 2qta n GLY 395 Ca 0.19 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.27 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 -2.00 0.66 0.00 1.61 2.81 -0.82 -4.47 117.12 114.91 2qta n MET 396 Ca 0.00 -0.10 0.00 0.00 -1.81 0.00 0.00 57.70 55.79 2qta n MET 396 Cb 0.00 -1.57 0.00 0.00 -0.71 0.00 0.00 33.22 30.94 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 1.36 0.21 0.19 3.03 0.00 -1.05 -1.77 105.19 107.16 2qta n GLY 397 Ca -0.10 0.53 -0.04 0.00 0.00 0.00 0.00 46.02 46.40 2qta n GLY 397 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2qta h ASP 398 N 0.00 0.34 -0.36 1.61 3.32 -1.91 -2.95 116.42 116.46 2qta h ASP 398 Ca 0.00 -0.16 -0.28 0.00 0.02 0.00 0.00 57.03 56.61 2qta h ASP 398 Cb 0.00 -0.10 -0.34 0.00 0.22 0.00 0.00 39.33 39.12 2qta h ASP 398 CO 0.00 0.77 -0.91 0.00 -1.72 0.00 0.00 179.24 177.38 2qta n ALA 399 N -2.48 3.44 -0.19 3.45 0.00 -0.73 -5.27 120.51 118.73 2qta n ALA 399 Ca -0.02 -3.07 0.00 0.00 0.00 0.00 0.00 53.44 50.35 2qta n ALA 399 Cb 0.54 -0.60 0.00 0.00 0.00 0.00 0.00 19.45 19.39 2qta n ALA 399 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qta n ALA 400 N -0.50 0.00 0.00 0.00 0.00 -1.12 -4.98 120.51 113.91 2qta n ALA 400 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.64 2qta n ALA 400 Cb 0.90 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.35 2qta n ALA 400 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 2qta n MET 414 N 1.38 0.00 0.00 0.00 0.00 -1.26 -4.58 117.12 112.66 2qta n MET 414 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.70 57.70 2qta n MET 414 Cb 0.00 -0.60 0.00 0.00 0.00 0.00 0.00 33.22 32.62 2qta n MET 414 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 175.97 172.50 2qta n ASP 415 N 0.00 0.00 0.00 6.12 2.03 -1.26 -3.62 116.55 119.82 2qta n ASP 415 Ca 0.00 0.00 0.02 0.00 0.52 0.00 0.00 54.79 55.33 2qta n ASP 415 Cb 0.00 0.00 0.10 0.00 -0.72 0.00 0.00 41.12 40.50 2qta n ASP 415 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2qta n GLY 416 N -0.05 -0.39 0.00 0.27 0.00 -1.26 0.14 105.19 103.90 2qta n GLY 416 Ca 0.00 -0.02 0.07 0.00 0.00 0.00 0.00 46.02 46.07 2qta n GLY 416 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2qta n VAL 417 N -0.63 0.00 0.28 1.61 0.24 -1.26 -4.29 118.33 114.28 2qta n VAL 417 Ca 0.02 -0.19 0.13 0.00 -2.04 0.00 0.00 64.34 62.27 2qta n VAL 417 Cb 0.01 0.90 0.64 0.00 -1.47 0.00 0.00 33.84 33.92 2qta n VAL 417 CO 0.00 0.00 0.00 0.08 -2.14 0.00 0.00 176.83 174.77 2qta h ARG 418 N 0.00 0.00 -0.28 7.34 0.11 0.91 0.25 114.38 122.71 2qta h ARG 418 Ca 0.00 0.00 -0.13 0.00 0.10 0.00 0.00 59.98 59.95 2qta h ARG 418 Cb 0.37 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.44 2qta h ARG 418 CO 0.00 0.00 -0.37 1.25 0.10 0.00 0.00 179.97 180.95 2qta h HIS 419 N 0.00 0.75 -0.12 4.08 2.76 -1.75 -0.66 115.15 120.21 2qta h HIS 419 Ca 0.00 -0.21 -0.16 0.00 -2.20 0.00 0.00 60.37 57.80 2qta h HIS 419 Cb 0.20 -0.16 0.01 0.00 1.55 0.00 0.00 27.41 29.00 2qta h HIS 419 CO 0.00 0.91 -0.56 0.97 -1.30 0.00 0.00 177.93 177.96 2qta h ILE 420 N 0.53 1.34 -0.31 6.26 6.09 -0.75 0.34 117.51 131.01 2qta h ILE 420 Ca 0.05 -1.85 -0.02 0.00 -1.37 0.00 0.00 64.86 61.67 2qta h ILE 420 Cb 0.88 2.13 -0.02 0.00 0.47 0.00 0.00 36.82 40.29 2qta h ILE 420 CO 0.08 0.56 0.09 0.08 -3.07 0.00 0.00 178.15 175.89 2qta h ARG 421 N 0.22 0.44 0.13 2.19 -0.00 -1.18 -1.19 114.38 115.00 2qta h ARG 421 Ca -0.04 -0.06 -0.29 0.00 -0.00 0.00 0.00 59.98 59.60 2qta h ARG 421 Cb 1.20 -0.08 0.00 0.00 -0.00 0.00 0.00 29.97 31.09 2qta h ARG 421 CO 0.12 0.40 -1.34 -0.44 -0.00 0.00 0.00 179.97 178.71 2qta h ASP 422 N 0.44 0.44 -0.91 0.08 3.32 -1.08 1.45 116.42 120.16 2qta h ASP 422 Ca 0.11 -0.50 -0.01 0.00 0.02 0.00 0.00 57.03 56.65 2qta h ASP 422 Cb 0.15 -0.14 -0.04 0.00 0.22 0.00 0.00 39.33 39.52 2qta h ASP 422 CO -0.01 1.40 0.54 -0.09 -1.72 0.00 0.00 179.24 179.36 2qta h ARG 423 N 0.08 1.24 -0.20 3.56 1.12 -0.36 -2.89 114.38 116.92 2qta h ARG 423 Ca -0.17 -0.12 0.00 0.00 -1.11 0.00 0.00 59.98 58.58 2qta h ARG 423 Cb 2.00 -0.26 0.00 0.00 -0.01 0.00 0.00 29.97 31.70 2qta h ARG 423 CO 0.20 0.87 0.00 1.19 -3.11 0.00 0.00 179.97 179.12 2qta n PHE 424 N -4.35 0.65 -3.83 2.20 3.72 -0.50 -5.00 117.46 110.35 2qta n PHE 424 Ca 0.10 -0.86 -0.37 0.00 -0.05 0.00 0.00 57.45 56.28 2qta n PHE 424 Cb 0.07 -0.24 0.03 0.00 -0.94 0.00 0.00 39.48 38.40 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 -0.63 -4.91 -4.70 4.37 5.03 -0.37 -4.85 115.26 109.20 2qta n ASN 425 Ca 0.18 -1.11 -0.39 0.00 0.87 0.00 0.00 54.58 54.13 2qta n ASN 425 Cb 0.77 -2.64 -0.05 0.00 -1.02 0.00 0.00 39.78 36.84 2qta n ASN 425 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 2qta s VAL 426 N -3.45 5.07 -1.02 2.41 1.01 0.48 -4.99 120.40 119.92 2qta s VAL 426 Ca 0.44 1.24 -0.21 0.00 0.00 0.00 0.00 61.98 63.46 2qta s VAL 426 Cb -0.20 -3.96 -0.10 0.00 0.00 0.00 0.00 36.38 32.13 2qta s VAL 426 CO 0.91 0.22 1.95 -0.81 0.00 0.00 0.00 175.10 177.36 2qta n PRO 427 N 4.21 1.84 -3.68 2.72 -0.04 -1.26 -4.79 135.00 134.00 2qta n PRO 427 Ca -0.03 -2.24 -0.11 0.00 -0.04 0.00 0.00 63.50 61.08 2qta n PRO 427 Cb 0.51 -3.24 -0.12 0.00 -0.04 0.00 0.00 33.50 30.61 2qta n PRO 427 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2qta s VAL 428 N 6.44 -0.36 1.01 0.52 0.11 -1.26 -5.09 120.40 121.77 2qta s VAL 428 Ca 0.59 0.19 -0.12 0.00 -2.93 0.00 0.00 61.98 59.71 2qta s VAL 428 Cb 0.09 -0.53 0.20 0.00 -1.53 0.00 0.00 36.38 34.61 2qta s VAL 428 CO 0.10 0.08 1.08 -0.94 -3.33 0.00 0.00 175.10 172.09 2qta s SER 429 N 2.13 2.41 -0.01 3.54 1.04 -1.26 -4.85 113.70 116.70 2qta s SER 429 Ca -0.03 1.38 0.00 0.00 0.48 0.00 0.00 55.95 57.78 2qta s SER 429 Cb -0.11 -2.07 0.01 0.00 0.10 0.00 0.00 66.02 63.95 2qta s SER 429 CO -0.11 -3.29 1.30 -0.67 0.98 0.00 0.00 173.24 171.45 2qta n ASP 430 N -4.30 3.69 0.00 7.02 2.03 -1.26 -2.69 116.55 121.05 2qta n ASP 430 Ca 0.05 -2.14 0.00 0.00 0.52 0.00 0.00 54.79 53.22 2qta n ASP 430 Cb 0.56 -0.68 0.00 0.00 -0.72 0.00 0.00 41.12 40.27 2qta n ASP 430 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2qta n ALA 431 N 0.75 0.11 0.00 -1.67 0.00 -1.26 -4.80 120.51 113.65 2qta n ALA 431 Ca 0.01 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.49 2qta n ALA 431 Cb 0.52 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.85 2qta n ALA 431 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2qta n ASP 432 N -0.07 0.39 -0.30 0.00 8.00 -1.17 -4.24 116.55 119.16 2qta n ASP 432 Ca 0.00 0.16 0.24 0.00 0.71 0.00 0.00 54.79 55.90 2qta n ASP 432 Cb 0.00 1.02 0.56 0.00 -0.02 0.00 0.00 41.12 42.68 2qta n ASP 432 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 2qta h ILE 433 N 0.00 0.54 0.00 0.53 2.04 -1.82 0.33 117.51 119.13 2qta h ILE 433 Ca -0.15 -0.11 0.00 0.00 1.00 0.00 0.00 64.86 65.60 2qta h ILE 433 Cb 1.41 0.20 0.00 0.00 -0.74 0.00 0.00 36.82 37.69 2qta h ILE 433 CO 0.02 0.06 0.00 -0.33 0.00 0.00 0.00 178.15 177.90 2qta h GLU 434 N 0.31 0.00 -0.01 2.37 3.07 -1.73 -2.07 114.58 116.52 2qta h GLU 434 Ca 0.55 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.41 2qta h GLU 434 Cb 1.56 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.47 2qta h GLU 434 CO -0.21 0.00 -0.12 1.63 -1.40 0.00 0.00 179.01 178.91 2qta n LYS 435 N -2.85 1.13 -3.98 2.33 5.02 0.12 -4.82 118.16 115.11 2qta n LYS 435 Ca 0.01 -0.60 -0.42 0.00 -2.02 0.00 0.00 58.31 55.29 2qta n LYS 435 Cb 0.28 -1.49 0.02 0.00 -0.02 0.00 0.00 35.03 33.82 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 -0.41 -0.87 -4.83 -0.35 4.77 -0.78 -4.92 117.00 109.61 2qta n LEU 436 Ca 0.16 -1.21 -0.33 0.00 -0.03 0.00 0.00 56.01 54.60 2qta n LEU 436 Cb 0.32 -1.74 -0.06 0.00 -2.33 0.00 0.00 43.42 39.62 2qta n LEU 436 CO 0.22 0.69 0.63 -2.16 -1.33 0.00 0.00 177.39 175.44 2qta s PRO 437 N -6.86 4.12 0.12 3.23 0.04 -1.26 -4.97 135.00 129.42 2qta s PRO 437 Ca 0.42 1.01 -0.13 0.00 0.04 0.00 0.00 61.00 62.33 2qta s PRO 437 Cb -0.22 -2.20 -0.07 0.00 0.04 0.00 0.00 34.50 32.05 2qta s PRO 437 CO 0.95 -0.07 0.51 0.71 0.04 0.00 0.00 177.00 179.13 2qta s TYR 438 N -2.28 3.61 -0.16 0.56 2.02 -1.26 -4.92 117.35 114.92 2qta s TYR 438 Ca 0.60 1.00 -0.09 0.00 -0.37 0.00 0.00 57.07 58.21 2qta s TYR 438 Cb -0.09 -2.32 -0.05 0.00 -0.40 0.00 0.00 41.96 39.10 2qta s TYR 438 CO 0.19 0.46 0.15 0.42 -1.57 0.00 0.00 175.55 175.20 2qta s ILE 439 N -1.43 5.44 0.22 2.71 1.01 -1.26 -5.10 121.20 122.79 2qta s ILE 439 Ca 0.36 0.23 0.03 0.00 0.00 0.00 0.00 60.65 61.27 2qta s ILE 439 Cb -0.15 -3.45 -0.05 0.00 0.01 0.00 0.00 42.46 38.82 2qta s ILE 439 CO 0.19 0.52 -0.01 0.42 0.00 0.00 0.00 174.94 176.06 2qta s THR 440 N -0.32 1.02 -0.24 2.92 -4.23 -1.26 -4.91 115.64 108.63 2qta s THR 440 Ca 0.12 -2.03 -0.00 0.00 -1.18 0.00 0.00 61.69 58.60 2qta s THR 440 Cb -0.12 -2.27 0.03 0.00 1.34 0.00 0.00 72.50 71.49 2qta s THR 440 CO 0.01 -0.38 -0.10 -0.36 -0.54 0.00 0.00 174.62 173.25 2qta s PHE 441 N -3.43 3.06 0.60 3.99 0.08 -1.26 -5.10 117.98 115.92 2qta s PHE 441 Ca 0.27 -1.75 -0.19 0.00 0.12 0.00 0.00 56.93 55.38 2qta s PHE 441 Cb 0.05 -2.00 -0.03 0.00 -0.57 0.00 0.00 43.02 40.47 2qta s PHE 441 CO 0.07 -0.78 1.20 -1.25 -0.10 0.00 0.00 175.22 174.37 2qta s PRO 442 N 1.27 2.94 0.24 0.24 0.04 -1.26 -4.71 135.00 133.75 2qta s PRO 442 Ca -0.01 1.81 -0.31 0.00 0.04 0.00 0.00 61.00 62.53 2qta s PRO 442 Cb -0.17 -1.93 -0.13 0.00 0.04 0.00 0.00 34.50 32.31 2qta s PRO 442 CO -0.06 -1.23 1.39 -1.91 0.04 0.00 0.00 177.00 175.24 2qta n GLU 443 N -1.65 2.01 0.00 4.56 2.13 -1.26 -1.22 120.64 125.20 2qta n GLU 443 Ca 0.13 0.72 0.00 0.00 0.66 0.00 0.00 57.16 58.67 2qta n GLU 443 Cb 0.50 -2.36 0.00 0.00 0.27 0.00 0.00 31.44 29.84 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 2.09 3.04 3.75 8.31 0.00 -1.26 -5.06 105.19 116.06 2qta n GLY 444 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 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 0.34 4.76 0.24 1.61 1.04 -0.36 -4.85 113.70 116.48 2qta s SER 445 Ca 0.00 2.13 -0.06 0.00 0.48 0.00 0.00 55.95 58.50 2qta s SER 445 Cb 0.00 -2.56 0.30 0.00 0.10 0.00 0.00 66.02 63.86 2qta s SER 445 CO 0.00 -1.87 1.88 -0.08 0.98 0.00 0.00 173.24 174.15 2qta h GLU 446 N -0.11 1.07 -0.07 4.02 4.81 -1.97 -2.16 114.58 120.18 2qta h GLU 446 Ca -0.47 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 58.69 2qta h GLU 446 Cb 1.26 -0.24 -0.00 0.00 0.63 0.00 0.00 28.75 30.40 2qta h GLU 446 CO 0.52 0.71 0.04 0.93 -0.73 0.00 0.00 179.01 180.48 2qta h GLU 447 N 1.10 0.10 -0.03 1.92 3.07 -1.92 -1.87 114.58 116.95 2qta h GLU 447 Ca 0.37 -0.01 0.01 0.00 -0.50 0.00 0.00 59.36 59.22 2qta h GLU 447 Cb 0.05 -0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 27.94 2qta h GLU 447 CO -0.13 0.14 -0.01 1.25 -1.40 0.00 0.00 179.01 178.85 2qta h HIS 448 N 0.03 -0.03 -0.57 4.33 2.76 -1.76 0.81 115.15 120.73 2qta h HIS 448 Ca 0.02 0.00 0.07 0.00 -2.20 0.00 0.00 60.37 58.27 2qta h HIS 448 Cb 0.07 0.02 -0.06 0.00 1.55 0.00 0.00 27.41 28.99 2qta h HIS 448 CO -0.05 -0.02 0.24 1.15 -1.30 0.00 0.00 177.93 177.95 2qta h THR 449 N -0.01 0.85 -0.15 6.26 2.02 -1.35 -2.16 112.91 118.37 2qta h THR 449 Ca 0.02 -0.16 -0.05 0.00 0.77 0.00 0.00 66.41 66.99 2qta h THR 449 Cb 0.03 0.36 -0.00 0.00 -1.74 0.00 0.00 68.15 66.80 2qta h THR 449 CO -0.03 0.08 -0.10 0.22 0.37 0.00 0.00 175.52 176.05 2qta h TYR 450 N 0.45 0.40 -0.25 3.16 5.03 -1.13 0.00 116.97 124.64 2qta h TYR 450 Ca 0.27 -0.11 0.05 0.00 2.58 0.00 0.00 58.73 61.52 2qta h TYR 450 Cb 0.27 -0.09 -0.08 0.00 1.55 0.00 0.00 36.73 38.38 2qta h TYR 450 CO -0.14 0.69 -0.46 1.25 -1.32 0.00 0.00 178.16 178.18 2qta h LEU 451 N -0.01 -1.50 -0.76 2.82 5.85 -0.61 -1.74 115.31 119.36 2qta h LEU 451 Ca 0.03 0.20 -0.12 0.00 0.84 0.00 0.00 57.88 58.83 2qta h LEU 451 Cb 0.60 0.62 -0.01 0.00 0.37 0.00 0.00 40.66 42.24 2qta h LEU 451 CO 0.03 -0.42 -0.41 0.45 -0.34 0.00 0.00 178.44 177.75 2qta h HIS 452 N -0.45 0.54 -0.31 1.25 3.86 -1.42 -2.93 115.15 115.70 2qta h HIS 452 Ca 0.09 -0.15 -0.01 0.00 -1.16 0.00 0.00 60.37 59.14 2qta h HIS 452 Cb 0.62 -0.12 -0.01 0.00 1.06 0.00 0.00 27.41 28.96 2qta h HIS 452 CO -0.58 0.79 0.16 0.00 0.86 0.00 0.00 177.93 179.17 2qta h ALA 453 N 1.19 0.40 -0.64 2.45 0.00 -0.58 0.94 119.26 123.02 2qta h ALA 453 Ca 0.03 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 2qta h ALA 453 Cb 0.87 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.51 2qta h ALA 453 CO 0.07 -0.06 0.32 1.96 0.00 0.00 0.00 179.25 181.54 2qta h GLN 454 N 0.37 0.91 -0.43 0.00 1.08 -1.35 -1.82 115.11 113.87 2qta h GLN 454 Ca 0.11 -0.12 -0.12 0.00 -1.45 0.00 0.00 58.65 57.06 2qta h GLN 454 Cb 0.08 -0.17 -0.01 0.00 -0.05 0.00 0.00 27.48 27.33 2qta h GLN 454 CO -0.02 0.71 -0.22 0.00 -0.95 0.00 0.00 178.83 178.36 2qta h ARG 455 N 0.87 0.87 -0.89 1.46 2.47 -1.30 -2.82 114.38 115.05 2qta h ARG 455 Ca 0.22 -0.36 -0.02 0.00 -1.26 0.00 0.00 59.98 58.56 2qta h ARG 455 Cb 0.09 -0.04 -0.04 0.00 -1.65 0.00 0.00 29.97 28.33 2qta h ARG 455 CO -0.03 1.00 0.47 1.96 0.56 0.00 0.00 179.97 183.93 2qta h GLN 456 N 0.75 1.25 0.00 0.04 1.08 -0.59 0.16 115.11 117.80 2qta h GLN 456 Ca 0.10 -0.16 -0.00 0.00 -1.45 0.00 0.00 58.65 57.15 2qta h GLN 456 Cb 0.76 -0.24 -0.00 0.00 -0.05 0.00 0.00 27.48 27.95 2qta h GLN 456 CO 0.06 0.92 -0.00 0.87 -0.95 0.00 0.00 178.83 179.73 2qta h LYS 457 N 1.25 0.00 -0.58 1.46 1.57 -1.16 -1.23 116.57 117.88 2qta h LYS 457 Ca 0.31 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.89 2qta h LYS 457 Cb 0.05 0.00 -0.12 0.00 0.08 0.00 0.00 32.23 32.24 2qta h LYS 457 CO -0.05 0.00 0.18 1.28 -0.57 0.00 0.00 179.45 180.29 2qta n LEU 458 N -3.64 5.24 -0.28 2.94 4.77 0.41 -4.95 117.00 121.49 2qta n LEU 458 Ca -0.03 -3.37 -0.04 0.00 -0.03 0.00 0.00 56.01 52.54 2qta n LEU 458 Cb 0.08 -0.69 -0.02 0.00 -2.33 0.00 0.00 43.42 40.46 2qta n LEU 458 CO 0.25 0.92 -0.03 1.41 -1.33 0.00 0.00 177.39 178.61 2qta n HIS 459 N -0.60 0.00 0.00 -1.77 8.25 -0.46 -0.86 115.22 119.78 2qta n HIS 459 Ca 0.37 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.83 2qta n HIS 459 Cb 1.24 -1.12 0.00 0.00 1.12 0.00 0.00 29.99 31.23 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 -1.83 0.29 3.51 -1.41 0.00 -0.35 -4.64 105.19 100.77 2qta n GLY 460 Ca -0.04 -1.96 -0.29 0.00 0.00 0.00 0.00 46.02 43.72 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 -0.56 2.60 0.01 1.61 1.51 -1.26 -4.58 117.35 116.68 2qta s TYR 461 Ca 0.00 -0.23 -0.15 0.00 -1.01 0.00 0.00 57.07 55.68 2qta s TYR 461 Cb 0.00 -1.37 0.02 0.00 -0.11 0.00 0.00 41.96 40.50 2qta s TYR 461 CO 0.00 0.40 0.32 -0.48 -1.11 0.00 0.00 175.55 174.68 2qta s LEU 462 N -2.16 0.80 0.61 -1.29 2.34 -1.26 -4.41 118.68 113.31 2qta s LEU 462 Ca 0.19 0.00 -0.14 0.00 0.06 0.00 0.00 54.13 54.24 2qta s LEU 462 Cb -0.11 1.36 -0.03 0.00 -0.56 0.00 0.00 46.19 46.85 2qta s LEU 462 CO 0.11 -0.52 1.04 -2.16 -1.06 0.00 0.00 176.35 173.76 2qta s PRO 463 N -1.82 3.39 0.13 1.48 0.04 -1.26 -5.01 135.00 131.96 2qta s PRO 463 Ca -0.10 1.01 -0.19 0.00 0.04 0.00 0.00 61.00 61.76 2qta s PRO 463 Cb -0.03 -2.05 0.05 0.00 0.04 0.00 0.00 34.50 32.50 2qta s PRO 463 CO 0.01 -0.74 0.48 -1.54 0.04 0.00 0.00 177.00 175.25 2qta s SER 464 N -3.35 -0.36 -0.04 6.66 1.04 -0.98 -4.81 113.70 111.86 2qta s SER 464 Ca 0.60 -0.18 -0.06 0.00 0.48 0.00 0.00 55.95 56.79 2qta s SER 464 Cb -0.13 0.52 0.01 0.00 0.10 0.00 0.00 66.02 66.51 2qta s SER 464 CO 0.43 -0.88 0.14 -0.60 0.98 0.00 0.00 173.24 173.31 2qta s ARG 465 N -3.70 0.27 -0.28 4.02 3.52 -0.31 -4.81 118.95 117.65 2qta s ARG 465 Ca 0.02 0.01 -0.11 0.00 -0.13 0.00 0.00 55.73 55.52 2qta s ARG 465 Cb 0.01 0.12 -0.04 0.00 -1.56 0.00 0.00 34.95 33.47 2qta s ARG 465 CO -0.12 -0.05 0.17 -1.14 -0.81 0.00 0.00 175.30 173.36 2qta s GLN 466 N -0.38 3.83 0.29 5.12 0.74 -1.26 -4.29 119.66 123.70 2qta s GLN 466 Ca -0.05 -0.40 0.12 0.00 0.05 0.00 0.00 55.36 55.08 2qta s GLN 466 Cb -0.03 -3.62 0.39 0.00 1.10 0.00 0.00 33.01 30.86 2qta s GLN 466 CO 0.01 -0.22 1.62 -1.35 -0.55 0.00 0.00 175.29 174.80 2qta h PRO 467 N 8.36 0.00 -5.75 1.67 0.11 -1.92 -3.42 132.00 131.05 2qta h PRO 467 Ca -0.35 0.00 -0.48 0.00 0.11 0.00 0.00 66.00 65.28 2qta h PRO 467 Cb 1.18 0.00 -0.20 0.00 0.11 0.00 0.00 31.00 32.09 2qta h PRO 467 CO 0.57 0.59 -0.79 -0.80 -0.21 0.00 0.00 178.00 177.35 2qta s ASN 468 N -6.77 2.27 0.41 -2.05 0.01 -1.26 -4.88 114.94 102.66 2qta s ASN 468 Ca -0.01 -0.75 -0.09 0.00 -0.71 0.00 0.00 52.86 51.30 2qta s ASN 468 Cb 0.12 -0.11 -0.06 0.00 0.41 0.00 0.00 41.25 41.62 2qta s ASN 468 CO 0.75 -0.05 0.75 0.72 -1.51 0.00 0.00 177.10 177.76 2qta s PHE 469 N -1.68 3.49 -0.06 2.20 -0.71 -1.26 -4.89 117.98 115.07 2qta s PHE 469 Ca 0.08 0.95 0.07 0.00 -1.04 0.00 0.00 56.93 56.99 2qta s PHE 469 Cb -0.07 -2.38 -0.24 0.00 -1.21 0.00 0.00 43.02 39.12 2qta s PHE 469 CO 0.04 -0.11 0.59 1.79 -1.34 0.00 0.00 175.22 176.19 2qta h THR 470 N 0.95 0.80 -4.31 -4.49 1.35 -1.88 -3.48 112.91 101.85 2qta h THR 470 Ca -0.47 -2.61 -0.51 0.00 -0.55 0.00 0.00 66.41 62.26 2qta h THR 470 Cb 1.19 2.46 0.12 0.00 -1.73 0.00 0.00 68.15 70.19 2qta h THR 470 CO 0.64 0.61 0.34 -1.83 -0.25 0.00 0.00 175.52 175.03 2qta s GLU 471 N -2.59 2.49 -0.20 4.72 -1.05 -1.26 -5.03 118.70 115.78 2qta s GLU 471 Ca -0.10 1.13 -0.07 0.00 -0.15 0.00 0.00 54.97 55.78 2qta s GLU 471 Cb 0.08 -1.93 -0.04 0.00 -0.44 0.00 0.00 34.13 31.80 2qta s GLU 471 CO 0.81 -1.46 0.06 0.21 0.95 0.00 0.00 175.26 175.84 2qta s LYS 472 N -4.87 3.88 0.14 -4.83 2.20 -1.26 -5.09 119.74 109.91 2qta s LYS 472 Ca 0.61 -0.39 -0.06 0.00 -0.36 0.00 0.00 55.97 55.77 2qta s LYS 472 Cb -0.16 -3.24 -0.06 0.00 -1.51 0.00 0.00 37.83 32.85 2qta s LYS 472 CO 0.54 0.14 0.40 -0.51 -0.36 0.00 0.00 175.35 175.56 2qta s LEU 473 N 0.74 4.27 -0.98 5.43 1.43 -1.26 -5.02 118.68 123.28 2qta s LEU 473 Ca 0.03 0.67 -0.07 0.00 -1.03 0.00 0.00 54.13 53.73 2qta s LEU 473 Cb -0.13 -3.30 0.25 0.00 0.03 0.00 0.00 46.19 43.04 2qta s LEU 473 CO 0.02 0.06 0.93 -1.61 0.23 0.00 0.00 176.35 175.98 2qta s GLU 474 N -2.54 3.75 0.65 1.70 0.41 -1.26 -4.98 118.70 116.44 2qta s GLU 474 Ca 0.40 -3.12 -0.17 0.00 -0.41 0.00 0.00 54.97 51.68 2qta s GLU 474 Cb -0.12 -4.31 -0.00 0.00 -1.78 0.00 0.00 34.13 27.92 2qta s GLU 474 CO 0.23 -1.25 1.18 -0.51 -0.49 0.00 0.00 175.26 174.42 2qta s LEU 475 N -1.07 3.49 0.55 1.80 1.02 -1.26 -4.57 118.68 118.64 2qta s LEU 475 Ca 0.27 2.28 -0.20 0.00 0.02 0.00 0.00 54.13 56.50 2qta s LEU 475 Cb -0.10 -4.58 -0.05 0.00 0.02 0.00 0.00 46.19 41.48 2qta s LEU 475 CO -0.09 -1.81 1.19 -2.16 0.02 0.00 0.00 176.35 173.49 2qta s PRO 476 N -3.70 3.22 0.63 1.29 0.04 -1.26 -5.02 135.00 130.21 2qta s PRO 476 Ca 0.74 1.78 -0.04 0.00 0.04 0.00 0.00 61.00 63.51 2qta s PRO 476 Cb -0.27 -2.05 0.04 0.00 0.04 0.00 0.00 34.50 32.26 2qta s PRO 476 CO 0.39 -0.99 0.92 -1.54 0.04 0.00 0.00 177.00 175.82 2qta s SER 477 N -1.57 5.14 0.30 6.66 1.04 -1.26 -4.96 113.70 119.05 2qta s SER 477 Ca 0.74 0.40 0.02 0.00 0.48 0.00 0.00 55.95 57.59 2qta s SER 477 Cb -0.29 -1.21 0.48 0.00 0.10 0.00 0.00 66.02 65.10 2qta s SER 477 CO 0.32 -1.34 1.79 0.25 0.98 0.00 0.00 173.24 175.25 2qta h LEU 478 N -0.31 0.54 -2.42 2.42 5.85 -1.96 -1.69 115.31 117.73 2qta h LEU 478 Ca -0.44 -0.14 -0.00 0.00 0.84 0.00 0.00 57.88 58.14 2qta h LEU 478 Cb 1.30 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 42.18 2qta h LEU 478 CO 0.58 0.68 -0.00 -0.61 -0.34 0.00 0.00 178.44 178.75 2qta h GLN 479 N 0.52 0.00 0.00 1.25 5.75 -2.00 0.52 115.11 121.15 2qta h GLN 479 Ca 0.10 0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.59 2qta h GLN 479 Cb 0.48 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.03 2qta h GLN 479 CO 0.03 0.00 -0.02 -0.44 -2.65 0.00 0.00 178.83 175.75 2qta h ASP 480 N 0.00 0.00 -0.63 -0.69 3.32 -1.67 0.61 116.42 117.35 2qta h ASP 480 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2qta h ASP 480 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2qta h ASP 480 CO 0.00 0.02 0.00 0.49 -1.72 0.00 0.00 179.24 178.03 2qta n PHE 481 N -3.18 1.49 -0.33 4.55 3.01 0.17 -4.68 117.46 118.49 2qta n PHE 481 Ca -0.01 -0.59 0.25 0.00 1.01 0.00 0.00 57.45 58.11 2qta n PHE 481 Cb 0.20 -0.26 0.49 0.00 -0.01 0.00 0.00 39.48 39.90 2qta n PHE 481 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 2qta h GLY 482 N 4.26 2.10 1.45 1.37 0.00 -0.87 0.76 103.07 112.13 2qta h GLY 482 Ca 0.00 -0.23 0.04 0.00 0.00 0.00 0.00 47.33 47.14 2qta h GLY 482 CO 0.24 -0.54 0.28 0.00 0.00 0.00 0.00 176.54 176.53 2qta h ALA 483 N 1.87 1.88 0.00 3.60 0.00 -1.84 -0.94 119.26 123.83 2qta h ALA 483 Ca 0.75 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.64 2qta h ALA 483 Cb 1.76 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.44 2qta h ALA 483 CO -0.63 0.06 -0.01 1.28 0.00 0.00 0.00 179.25 179.96 2qta n LEU 484 N -4.48 0.30 0.03 0.00 4.77 0.25 -3.07 117.00 114.80 2qta n LEU 484 Ca 0.05 0.52 0.12 0.00 -0.03 0.00 0.00 56.01 56.67 2qta n LEU 484 Cb 0.18 -0.43 0.23 0.00 -2.33 0.00 0.00 43.42 41.07 2qta n LEU 484 CO 0.35 -0.06 0.43 0.18 -1.33 0.00 0.00 177.39 176.95 2qta n LEU 485 N -1.77 0.57 -4.94 2.23 4.77 -0.36 -3.06 117.00 114.43 2qta n LEU 485 Ca 0.06 0.15 -0.24 0.00 -0.03 0.00 0.00 56.01 55.95 2qta n LEU 485 Cb 0.37 -0.23 0.04 0.00 -2.33 0.00 0.00 43.42 41.27 2qta n LEU 485 CO 0.28 0.03 0.45 -1.61 -1.33 0.00 0.00 177.39 175.21 2qta s GLU 486 N -3.09 2.73 0.33 3.23 2.02 -1.17 -0.77 118.70 121.98 2qta s GLU 486 Ca 0.09 -0.34 -0.29 0.00 0.02 0.00 0.00 54.97 54.45 2qta s GLU 486 Cb 0.16 -2.37 -0.11 0.00 0.10 0.00 0.00 34.13 31.91 2qta s GLU 486 CO 0.70 -0.71 1.39 -2.00 0.02 0.00 0.00 175.26 174.66 2qta s GLU 487 N -4.89 4.26 0.36 1.61 2.12 -1.26 -4.38 118.70 116.51 2qta s GLU 487 Ca 0.55 2.35 -0.11 0.00 0.36 0.00 0.00 54.97 58.12 2qta s GLU 487 Cb -0.10 -3.04 -0.07 0.00 0.26 0.00 0.00 34.13 31.17 2qta s GLU 487 CO 0.42 -0.34 0.73 -0.65 -0.54 0.00 0.00 175.26 174.87 2qta s GLN 488 N -1.67 3.84 0.02 4.30 -1.52 -0.41 -4.90 119.66 119.32 2qta s GLN 488 Ca 0.52 0.48 -0.22 0.00 -1.95 0.00 0.00 55.36 54.19 2qta s GLN 488 Cb -0.42 -2.44 -0.16 0.00 -0.22 0.00 0.00 33.01 29.76 2qta s GLN 488 CO 0.55 0.07 1.34 0.77 -0.25 0.00 0.00 175.29 177.76 2qta h SER 489 N 1.70 0.25 -2.08 5.90 0.02 -1.93 -3.44 113.55 113.96 2qta h SER 489 Ca -0.47 -0.46 -0.56 0.00 -0.84 0.00 0.00 61.79 59.45 2qta h SER 489 Cb 1.18 -0.07 -0.09 0.00 0.14 0.00 0.00 62.40 63.56 2qta h SER 489 CO 0.65 0.66 -0.61 -0.54 -1.14 0.00 0.00 176.83 175.85 2qta s LYS 490 N -4.36 2.28 0.03 3.45 1.02 -1.26 -5.08 119.74 115.82 2qta s LYS 490 Ca -0.15 -1.50 -0.30 0.00 0.02 0.00 0.00 55.97 54.04 2qta s LYS 490 Cb 0.04 -2.13 -0.06 0.00 -0.52 0.00 0.00 37.83 35.16 2qta s LYS 490 CO 0.72 0.26 1.35 -1.21 -0.92 0.00 0.00 175.35 175.56 2qta s GLU 491 N -3.73 4.32 0.43 1.68 2.02 -1.26 -4.72 118.70 117.44 2qta s GLU 491 Ca 0.34 1.94 0.04 0.00 0.02 0.00 0.00 54.97 57.30 2qta s GLU 491 Cb -0.04 -3.47 -0.02 0.00 0.10 0.00 0.00 34.13 30.69 2qta s GLU 491 CO 0.21 -0.49 0.15 0.96 0.02 0.00 0.00 175.26 176.11 2qta s ILE 492 N 1.94 0.47 0.42 -1.63 -4.36 -1.06 -4.64 121.20 112.34 2qta s ILE 492 Ca 0.63 -2.00 0.07 0.00 -0.26 0.00 0.00 60.65 59.09 2qta s ILE 492 Cb -0.32 -2.27 -0.05 0.00 1.25 0.00 0.00 42.46 41.08 2qta s ILE 492 CO 0.27 0.00 0.18 -0.94 0.24 0.00 0.00 174.94 174.69 2qta s SER 493 N -3.63 4.41 0.34 4.36 1.04 -1.26 -1.38 113.70 117.59 2qta s SER 493 Ca 0.22 -1.10 0.27 0.00 0.48 0.00 0.00 55.95 55.81 2qta s SER 493 Cb 0.01 -0.42 1.05 0.00 0.10 0.00 0.00 66.02 66.76 2qta s SER 493 CO 0.15 -0.57 1.79 0.71 0.98 0.00 0.00 173.24 176.31 2qta h THR 494 N 1.41 0.00 -0.01 2.02 1.35 -1.79 -1.66 112.91 114.22 2qta h THR 494 Ca -0.43 -0.36 -0.23 0.00 -0.55 0.00 0.00 66.41 64.84 2qta h THR 494 Cb 1.26 1.19 0.02 0.00 -1.73 0.00 0.00 68.15 68.89 2qta h THR 494 CO 0.70 0.00 -0.90 0.74 -0.25 0.00 0.00 175.52 175.81 2qta h THR 495 N 0.00 1.32 -0.87 6.82 2.02 -1.86 -0.87 112.91 119.47 2qta h THR 495 Ca 0.00 -2.17 -0.01 0.00 0.77 0.00 0.00 66.41 65.00 2qta h THR 495 Cb 0.46 2.40 -0.04 0.00 -1.74 0.00 0.00 68.15 69.23 2qta h THR 495 CO 0.00 0.66 0.51 0.40 0.37 0.00 0.00 175.52 177.46 2qta h ILE 496 N 0.28 1.24 -0.63 3.11 2.04 -1.73 -0.63 117.51 121.20 2qta h ILE 496 Ca -0.11 -0.56 0.01 0.00 1.00 0.00 0.00 64.86 65.21 2qta h ILE 496 Cb 1.57 0.04 -0.03 0.00 -0.74 0.00 0.00 36.82 37.65 2qta h ILE 496 CO 0.18 0.26 0.40 0.00 0.00 0.00 0.00 178.15 179.00 2qta h ALA 497 N 1.28 0.80 -0.41 1.87 0.00 -1.20 0.44 119.26 122.04 2qta h ALA 497 Ca 0.31 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.19 2qta h ALA 497 Cb -0.03 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 2qta h ALA 497 CO -0.06 0.19 0.26 0.35 0.00 0.00 0.00 179.25 180.00 2qta h PHE 498 N 0.82 0.50 -0.68 0.00 3.57 -0.36 -0.03 116.94 120.75 2qta h PHE 498 Ca 0.24 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.68 2qta h PHE 498 Cb -0.05 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 38.49 2qta h PHE 498 CO -0.04 0.31 0.16 0.28 -2.23 0.00 0.00 178.31 176.79 2qta h VAL 499 N 0.54 1.26 -0.38 1.41 2.07 -0.68 -0.40 116.25 120.07 2qta h VAL 499 Ca 0.15 -0.97 -0.05 0.00 0.82 0.00 0.00 66.70 66.65 2qta h VAL 499 Cb -0.05 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 30.27 2qta h VAL 499 CO -0.04 0.37 0.00 0.03 0.02 0.00 0.00 177.57 177.95 2qta h ARG 500 N 1.03 0.59 -0.47 1.57 3.08 -0.49 -1.08 114.38 118.61 2qta h ARG 500 Ca 0.21 -0.13 -0.09 0.00 0.07 0.00 0.00 59.98 60.04 2qta h ARG 500 Cb 0.38 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.33 2qta h ARG 500 CO 0.00 0.61 -0.05 0.00 -1.07 0.00 0.00 179.97 179.46 2qta h ALA 501 N 1.45 0.64 -0.69 0.04 0.00 -0.28 -2.23 119.26 118.20 2qta h ALA 501 Ca 0.12 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 2qta h ALA 501 Cb 0.35 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 2qta h ALA 501 CO 0.01 0.49 0.41 1.25 0.00 0.00 0.00 179.25 181.41 2qta h LEU 502 N 0.72 0.83 -1.03 0.00 6.46 -0.63 -1.61 115.31 120.05 2qta h LEU 502 Ca 0.13 -0.05 -0.03 0.00 -0.12 0.00 0.00 57.88 57.81 2qta h LEU 502 Cb 0.58 -0.21 -0.03 0.00 -0.73 0.00 0.00 40.66 40.27 2qta h LEU 502 CO 0.03 0.64 0.32 0.78 -0.62 0.00 0.00 178.44 179.59 2qta h ASN 503 N 0.95 0.92 -0.54 1.25 2.35 -0.72 0.21 115.58 120.01 2qta h ASN 503 Ca 0.25 -0.11 -0.03 0.00 -0.55 0.00 0.00 56.30 55.86 2qta h ASN 503 Cb -0.03 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.08 2qta h ASN 503 CO -0.05 0.79 0.21 0.58 -1.65 0.00 0.00 177.43 177.32 2qta h VAL 504 N 1.00 1.22 -0.31 2.81 2.07 -0.74 -2.39 116.25 119.91 2qta h VAL 504 Ca 0.24 -0.68 -0.04 0.00 0.82 0.00 0.00 66.70 67.03 2qta h VAL 504 Cb 0.13 0.67 -0.02 0.00 -1.52 0.00 0.00 31.29 30.55 2qta h VAL 504 CO -0.03 0.26 -0.00 0.24 0.02 0.00 0.00 177.57 178.06 2qta h MET 505 N 0.73 0.47 0.00 1.57 2.86 -0.67 -1.80 114.93 118.08 2qta h MET 505 Ca 0.18 -0.09 0.00 0.00 -2.06 0.00 0.00 59.70 57.72 2qta h MET 505 Cb 0.20 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 31.79 2qta h MET 505 CO -0.01 0.50 0.00 1.28 1.06 0.00 0.00 176.91 179.73 2qta n LEU 506 N -4.30 0.00 -0.14 1.22 4.77 -0.00 -1.93 117.00 116.62 2qta n LEU 506 Ca 0.01 0.44 0.11 0.00 -0.03 0.00 0.00 56.01 56.54 2qta n LEU 506 Cb 0.23 -0.44 0.02 0.00 -2.33 0.00 0.00 43.42 40.91 2qta n LEU 506 CO 0.38 -0.21 0.19 0.29 -1.33 0.00 0.00 177.39 176.72 2qta n LYS 507 N -1.44 0.36 -2.77 3.23 5.02 -0.68 -4.76 118.16 117.13 2qta n LYS 507 Ca 0.05 -0.28 -0.42 0.00 -2.02 0.00 0.00 58.31 55.63 2qta n LYS 507 Cb 0.16 -1.49 -0.03 0.00 -0.02 0.00 0.00 35.03 33.65 2qta n LYS 507 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 2qta s ASN 508 N -2.83 6.99 0.39 4.39 3.84 -0.81 -4.93 114.94 121.97 2qta s ASN 508 Ca 0.13 1.23 0.05 0.00 0.21 0.00 0.00 52.86 54.48 2qta s ASN 508 Cb 0.17 -2.49 0.79 0.00 -0.55 0.00 0.00 41.25 39.16 2qta s ASN 508 CO 0.74 -0.59 2.04 0.07 -2.79 0.00 0.00 177.10 176.57 2qta h LYS 509 N 7.53 0.63 -0.25 0.43 2.10 -1.89 0.06 116.57 125.17 2qta h LYS 509 Ca -0.21 -0.04 -0.10 0.00 -2.00 0.00 0.00 60.65 58.29 2qta h LYS 509 Cb 1.08 -0.14 -0.00 0.00 -0.90 0.00 0.00 32.23 32.26 2qta h LYS 509 CO 0.93 0.42 -0.24 1.03 -2.00 0.00 0.00 179.45 179.59 2qta h SER 510 N 0.65 0.65 -0.01 7.07 0.87 -1.92 -3.36 113.55 117.49 2qta h SER 510 Ca 0.18 -0.47 0.00 0.00 -1.23 0.00 0.00 61.79 60.27 2qta h SER 510 Cb -0.07 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 61.71 2qta h SER 510 CO -0.04 0.98 -0.27 2.30 -0.53 0.00 0.00 176.83 179.27 2qta n ILE 511 N -4.35 0.00 -0.29 2.23 -5.35 -1.16 -4.72 119.36 105.71 2qta n ILE 511 Ca -0.04 -0.36 0.08 0.00 -0.27 0.00 0.00 62.75 62.15 2qta n ILE 511 Cb 0.43 1.12 0.23 0.00 -1.74 0.00 0.00 39.64 39.69 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 1.17 0.55 -0.01 6.28 2.10 -1.10 0.92 116.57 126.48 2qta h LYS 512 Ca 0.00 -0.03 0.00 0.00 -2.00 0.00 0.00 60.65 58.62 2qta h LYS 512 Cb 0.38 -0.12 0.00 0.00 -0.90 0.00 0.00 32.23 31.59 2qta h LYS 512 CO 0.00 0.36 -0.05 -0.25 -2.00 0.00 0.00 179.45 177.51 2qta n ASP 513 N -4.91 0.64 -0.12 7.07 8.00 -1.26 -3.29 116.55 122.66 2qta n ASP 513 Ca 0.18 -0.96 0.12 0.00 0.71 0.00 0.00 54.79 54.83 2qta n ASP 513 Cb 0.47 -0.03 0.16 0.00 -0.02 0.00 0.00 41.12 41.70 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 -0.65 0.36 -2.48 -1.24 5.12 0.29 -4.91 116.66 113.16 2qta n ARG 514 Ca 0.18 -0.25 -0.41 0.00 -1.93 0.00 0.00 57.85 55.45 2qta n ARG 514 Cb 0.25 -1.49 -0.04 0.00 -1.16 0.00 0.00 32.46 30.02 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 -2.81 4.53 -0.47 0.55 1.43 -1.07 -0.56 118.68 120.27 2qta s LEU 515 Ca 0.14 2.20 0.03 0.00 -1.03 0.00 0.00 54.13 55.48 2qta s LEU 515 Cb 0.18 -3.62 0.13 0.00 0.03 0.00 0.00 46.19 42.91 2qta s LEU 515 CO 0.68 -0.18 0.25 -0.69 0.23 0.00 0.00 176.35 176.64 2qta s VAL 516 N -0.78 1.75 0.15 -1.59 1.01 -0.57 -4.87 120.40 115.49 2qta s VAL 516 Ca 0.47 -2.80 -0.30 0.00 0.00 0.00 0.00 61.98 59.34 2qta s VAL 516 Cb -0.31 -2.22 -0.07 0.00 0.00 0.00 0.00 36.38 33.77 2qta s VAL 516 CO 0.39 -0.87 1.20 -2.84 0.00 0.00 0.00 175.10 172.97 2qta s PRO 517 N 0.14 4.48 -0.04 2.72 0.02 -1.26 -1.42 135.00 139.63 2qta s PRO 517 Ca 0.18 1.84 0.03 0.00 0.02 0.00 0.00 61.00 63.06 2qta s PRO 517 Cb -0.24 -3.27 0.00 0.00 0.02 0.00 0.00 34.50 31.01 2qta s PRO 517 CO -0.00 -0.13 -0.12 0.42 -0.33 0.00 0.00 177.00 176.83 2qta s ILE 518 N 0.27 1.09 0.10 2.83 1.01 0.02 -0.60 121.20 125.92 2qta s ILE 518 Ca 0.54 -0.50 0.04 0.00 0.00 0.00 0.00 60.65 60.73 2qta s ILE 518 Cb -0.32 -0.96 -0.04 0.00 0.01 0.00 0.00 42.46 41.15 2qta s ILE 518 CO 0.34 0.33 -0.11 0.27 0.00 0.00 0.00 174.94 175.77 2qta s ILE 519 N 0.30 0.99 -0.77 2.92 -4.36 -0.31 -1.69 121.20 118.29 2qta s ILE 519 Ca -0.07 -1.62 -0.00 0.00 -0.26 0.00 0.00 60.65 58.70 2qta s ILE 519 Cb -0.12 -1.35 0.19 0.00 1.25 0.00 0.00 42.46 42.43 2qta s ILE 519 CO 0.02 -0.52 0.60 0.00 0.24 0.00 0.00 174.94 175.29 2qta s ALA 520 N -2.31 3.94 0.00 2.27 0.00 -1.26 -0.92 121.76 123.48 2qta s ALA 520 Ca 0.05 -3.67 0.00 0.00 0.00 0.00 0.00 51.96 48.34 2qta s ALA 520 Cb -0.04 -2.61 0.00 0.00 0.00 0.00 0.00 23.12 20.48 2qta s ALA 520 CO 0.01 -2.12 0.00 -3.47 0.00 0.00 0.00 175.76 170.17 2qta n ASP 521 N 2.58 0.00 -4.69 0.00 2.03 -0.63 -4.55 116.55 111.29 2qta n ASP 521 Ca 0.17 0.00 -0.49 0.00 0.52 0.00 0.00 54.79 54.98 2qta n ASP 521 Cb 0.36 0.00 -0.05 0.00 -0.72 0.00 0.00 41.12 40.71 2qta n ASP 521 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2qta n GLU 522 N 0.00 2.06 0.00 -0.67 4.71 -1.26 -4.83 120.64 120.65 2qta n GLU 522 Ca 0.00 0.75 0.00 0.00 -0.01 0.00 0.00 57.16 57.90 2qta n GLU 522 Cb 0.00 -2.58 0.00 0.00 -1.01 0.00 0.00 31.44 27.85 2qta n GLU 522 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2qta n ALA 523 N 6.46 2.31 -0.15 0.62 0.00 -1.26 -4.72 120.51 123.76 2qta n ALA 523 Ca 0.23 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.68 2qta n ALA 523 Cb 0.27 0.42 0.29 0.00 0.00 0.00 0.00 19.45 20.44 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 0.86 -0.08 0.00 3.08 -1.93 -0.34 114.38 115.96 2qta h ARG 524 Ca 0.00 -0.06 0.02 0.00 0.07 0.00 0.00 59.98 60.02 2qta h ARG 524 Cb 0.84 -0.19 -0.00 0.00 0.08 0.00 0.00 29.97 30.69 2qta h ARG 524 CO 0.00 0.58 0.06 1.15 -1.07 0.00 0.00 179.97 180.69 2qta h THR 525 N 0.89 0.93 -0.46 2.04 2.02 -1.97 -1.50 112.91 114.86 2qta h THR 525 Ca 0.24 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.42 2qta h THR 525 Cb -0.09 0.96 0.00 0.00 -1.74 0.00 0.00 68.15 67.28 2qta h THR 525 CO -0.05 0.00 0.00 0.49 0.37 0.00 0.00 175.52 176.33 2qta n PHE 526 N -4.48 0.92 -2.52 3.16 3.72 -0.26 -4.96 117.46 113.04 2qta n PHE 526 Ca -0.01 -0.61 -0.20 0.00 -0.05 0.00 0.00 57.45 56.57 2qta n PHE 526 Cb 0.17 -0.15 0.00 0.00 -0.94 0.00 0.00 39.48 38.56 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 0.60 -0.46 0.20 1.37 0.00 -0.56 -4.83 105.19 101.50 2qta n GLY 527 Ca 0.19 -0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.33 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 -3.15 0.64 -0.02 1.61 2.81 -0.48 -4.33 117.12 114.19 2qta n MET 528 Ca -0.21 -0.40 0.02 0.00 -1.81 0.00 0.00 57.70 55.31 2qta n MET 528 Cb 0.67 -1.49 0.36 0.00 -0.71 0.00 0.00 33.22 32.05 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 0.97 0.57 -0.81 0.03 9.09 -1.90 -2.20 114.58 120.32 2qta h GLU 529 Ca 0.00 -0.06 0.04 0.00 0.05 0.00 0.00 59.36 59.38 2qta h GLU 529 Cb 0.52 -0.11 -0.05 0.00 -1.65 0.00 0.00 28.75 27.46 2qta h GLU 529 CO 0.00 0.45 0.53 0.78 0.05 0.00 0.00 179.01 180.82 2qta h GLY 530 N 0.69 1.14 1.93 1.06 0.00 -1.96 -2.06 103.07 103.87 2qta h GLY 530 Ca 0.15 -0.39 -0.04 0.00 0.00 0.00 0.00 47.33 47.05 2qta h GLY 530 CO -0.02 0.33 -0.13 1.41 0.00 0.00 0.00 176.54 178.13 2qta h LEU 531 N 0.99 0.08 -0.80 3.11 3.38 -1.69 -3.03 115.31 117.35 2qta h LEU 531 Ca 0.33 -0.01 0.15 0.00 0.09 0.00 0.00 57.88 58.43 2qta h LEU 531 Cb 0.06 -0.02 -0.10 0.00 0.09 0.00 0.00 40.66 40.69 2qta h LEU 531 CO -0.10 0.22 0.37 -0.26 0.09 0.00 0.00 178.44 178.76 2qta h PHE 532 N 0.08 0.63 -0.18 1.13 0.04 -1.42 0.38 116.94 117.60 2qta h PHE 532 Ca 0.02 0.04 -0.14 0.00 2.80 0.00 0.00 57.97 60.69 2qta h PHE 532 Cb 0.29 -0.16 -0.01 0.00 2.20 0.00 0.00 35.95 38.27 2qta h PHE 532 CO 0.00 0.11 -0.46 0.00 -0.60 0.00 0.00 178.31 177.36 2qta h ARG 533 N 0.52 0.47 0.05 1.51 3.08 -1.65 -0.82 114.38 117.53 2qta h ARG 533 Ca 0.44 -0.25 -0.00 0.00 0.07 0.00 0.00 59.98 60.24 2qta h ARG 533 Cb 0.66 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.73 2qta h ARG 533 CO -0.39 0.83 -0.02 0.37 -1.07 0.00 0.00 179.97 179.69 2qta h GLN 534 N 0.38 -0.06 -0.01 0.04 4.15 -1.18 -3.40 115.11 115.02 2qta h GLN 534 Ca 0.02 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.45 2qta h GLN 534 Cb 0.95 0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.66 2qta h GLN 534 CO 0.08 0.55 -0.27 0.44 -1.93 0.00 0.00 178.83 177.71 2qta n ILE 535 N -4.75 0.00 -0.44 2.39 -5.35 -0.03 -5.09 119.36 106.09 2qta n ILE 535 Ca -0.07 -0.37 0.05 0.00 -0.27 0.00 0.00 62.75 62.09 2qta n ILE 535 Cb 0.31 1.10 -0.02 0.00 -1.74 0.00 0.00 39.64 39.29 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 0.97 -2.39 3.57 3.28 0.00 -0.31 -1.40 105.19 108.90 2qta n GLY 536 Ca 0.04 -1.36 -0.34 0.00 0.00 0.00 0.00 46.02 44.36 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 -2.72 4.16 -0.13 -0.61 1.01 -1.26 -1.44 121.20 120.21 2qta s ILE 537 Ca 0.00 -0.27 -0.29 0.00 0.00 0.00 0.00 60.65 60.09 2qta s ILE 537 Cb 0.00 -2.82 -0.05 0.00 0.01 0.00 0.00 42.46 39.61 2qta s ILE 537 CO 0.00 0.51 1.77 -0.47 0.00 0.00 0.00 174.94 176.75 2qta s TYR 538 N 0.05 1.80 -0.42 3.97 5.04 0.04 -2.74 117.35 125.09 2qta s TYR 538 Ca 0.02 0.28 0.05 0.00 -2.44 0.00 0.00 57.07 54.98 2qta s TYR 538 Cb -0.13 -4.00 0.17 0.00 0.35 0.00 0.00 41.96 38.35 2qta s TYR 538 CO 0.02 -3.78 0.52 0.45 -1.34 0.00 0.00 175.55 171.42 2qta s SER 539 N 4.59 -0.10 -0.29 4.32 0.15 0.78 -4.75 113.70 118.40 2qta s SER 539 Ca 0.79 -1.58 -0.03 0.00 0.70 0.00 0.00 55.95 55.83 2qta s SER 539 Cb -0.31 1.11 -0.08 0.00 -1.71 0.00 0.00 66.02 65.03 2qta s SER 539 CO 0.32 -0.18 1.78 -0.81 1.20 0.00 0.00 173.24 175.55 2qta n PRO 540 N 3.84 1.12 0.00 5.44 -0.04 -1.26 -2.27 135.00 141.83 2qta n PRO 540 Ca 0.15 -0.75 0.00 0.00 -0.04 0.00 0.00 63.50 62.86 2qta n PRO 540 Cb 0.51 -1.98 0.00 0.00 -0.04 0.00 0.00 33.50 31.99 2qta n PRO 540 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2qta n GLU 558 N 3.52 0.00 -1.50 0.54 2.13 -1.25 -4.86 120.64 119.23 2qta n GLU 558 Ca 0.24 0.00 0.00 0.00 0.66 0.00 0.00 57.16 58.06 2qta n GLU 558 Cb 0.25 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.96 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 0.00 0.00 4.31 5.68 -1.11 -4.97 116.55 120.47 2qta n ASP 559 Ca 0.00 -0.84 0.11 0.00 -0.50 0.00 0.00 54.79 53.56 2qta n ASP 559 Cb 0.00 0.00 0.55 0.00 -1.14 0.00 0.00 41.12 40.53 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 0.00 0.31 0.00 0.11 0.00 -0.96 -0.16 120.64 119.94 2qta n GLU 560 Ca 0.00 0.08 0.12 0.00 0.00 0.00 0.00 57.16 57.36 2qta n GLU 560 Cb 0.00 -1.50 0.13 0.00 0.00 0.00 0.00 31.44 30.07 2qta n GLU 560 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 2qta n LYS 561 N -1.29 1.40 -1.70 3.44 4.76 -1.26 -4.10 118.16 119.41 2qta n LYS 561 Ca 0.10 -1.09 -0.42 0.00 -2.87 0.00 0.00 58.31 54.04 2qta n LYS 561 Cb 0.18 -1.48 0.00 0.00 -1.84 0.00 0.00 35.03 31.89 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 1.37 0.57 0.10 0.72 0.00 -0.81 -4.92 105.19 102.22 2qta n GLY 562 Ca 0.11 0.26 -0.13 0.00 0.00 0.00 0.00 46.02 46.27 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 0.32 0.68 -2.70 1.61 7.27 -0.50 -3.54 117.38 120.52 2qta n GLN 563 Ca 0.05 0.18 -0.41 0.00 0.07 0.00 0.00 57.00 56.89 2qta n GLN 563 Cb 0.38 -1.65 -0.04 0.00 2.41 0.00 0.00 30.24 31.33 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 -2.55 4.43 -0.30 1.69 1.01 -0.52 -4.44 121.20 120.53 2qta s ILE 564 Ca -0.14 2.01 -0.16 0.00 0.00 0.00 0.00 60.65 62.36 2qta s ILE 564 Cb 0.07 -4.29 -0.02 0.00 0.01 0.00 0.00 42.46 38.23 2qta s ILE 564 CO 0.78 0.31 0.42 -0.76 0.00 0.00 0.00 174.94 175.70 2qta s LEU 565 N -0.01 4.16 -0.43 2.97 1.43 0.23 -0.78 118.68 126.25 2qta s LEU 565 Ca 0.47 0.18 -0.08 0.00 -1.03 0.00 0.00 54.13 53.67 2qta s LEU 565 Cb -0.24 -2.49 0.09 0.00 0.03 0.00 0.00 46.19 43.58 2qta s LEU 565 CO 0.30 -0.29 0.27 -1.58 0.23 0.00 0.00 176.35 175.29 2qta s GLN 566 N 2.17 2.51 0.00 1.70 2.00 -1.26 -1.16 119.66 125.62 2qta s GLN 566 Ca 0.16 -1.56 0.20 0.00 -2.00 0.00 0.00 55.36 52.16 2qta s GLN 566 Cb -0.16 -3.78 0.53 0.00 0.80 0.00 0.00 33.01 30.40 2qta s GLN 566 CO 0.11 -1.02 1.44 0.39 -0.50 0.00 0.00 175.29 175.71 2qta n GLU 567 N 4.88 2.27 0.00 1.67 -0.58 -0.09 -4.92 120.64 123.86 2qta n GLU 567 Ca -0.09 -1.95 0.00 0.00 -0.42 0.00 0.00 57.16 54.70 2qta n GLU 567 Cb 0.42 -1.46 0.00 0.00 -0.57 0.00 0.00 31.44 29.84 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 1.39 -0.31 3.50 0.62 0.00 -1.26 -4.19 105.19 104.93 2qta n GLY 568 Ca 0.19 -1.07 -0.43 0.00 0.00 0.00 0.00 46.02 44.71 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 4.63 -0.44 -0.61 1.01 -1.26 -1.61 121.20 122.92 2qta s ILE 569 Ca 0.00 -1.99 0.01 0.00 0.00 0.00 0.00 60.65 58.67 2qta s ILE 569 Cb 0.00 -4.96 0.20 0.00 0.01 0.00 0.00 42.46 37.71 2qta s ILE 569 CO 0.00 -1.72 0.87 0.21 0.00 0.00 0.00 174.94 174.30 2qta s ASN 570 N 3.59 -0.98 0.27 3.58 2.47 -1.26 -5.03 114.94 117.58 2qta s ASN 570 Ca 0.43 -1.08 -0.03 0.00 0.42 0.00 0.00 52.86 52.61 2qta s ASN 570 Cb -0.02 1.28 0.35 0.00 -1.45 0.00 0.00 41.25 41.42 2qta s ASN 570 CO -0.02 -0.04 1.83 -0.33 -3.72 0.00 0.00 177.10 174.82 2qta h GLU 571 N 4.90 0.93 -0.62 0.43 3.07 -1.92 -1.23 114.58 120.15 2qta h GLU 571 Ca 0.03 -0.17 -0.10 0.00 -0.50 0.00 0.00 59.36 58.62 2qta h GLU 571 Cb 1.14 -0.15 -0.02 0.00 -0.84 0.00 0.00 28.75 28.88 2qta h GLU 571 CO -0.03 0.79 0.01 1.25 -1.40 0.00 0.00 179.01 179.63 2qta h LEU 572 N 0.91 1.07 -0.47 1.33 5.85 -1.93 0.25 115.31 122.32 2qta h LEU 572 Ca 0.21 -0.30 -0.05 0.00 0.84 0.00 0.00 57.88 58.58 2qta h LEU 572 Cb 0.24 -0.29 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 2qta h LEU 572 CO -0.01 1.10 0.09 1.23 -0.34 0.00 0.00 178.44 180.52 2qta h GLY 573 N 0.99 0.82 1.05 3.75 0.00 -1.86 0.63 103.07 108.45 2qta h GLY 573 Ca 0.18 -0.53 -0.02 0.00 0.00 0.00 0.00 47.33 46.95 2qta h GLY 573 CO 0.03 0.49 0.45 0.00 0.00 0.00 0.00 176.54 177.51 2qta h ALA 574 N 0.97 1.15 -0.47 3.60 0.00 -0.93 -0.45 119.26 123.13 2qta h ALA 574 Ca 0.14 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 2qta h ALA 574 Cb 0.36 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2qta h ALA 574 CO 0.01 0.66 -0.04 0.78 0.00 0.00 0.00 179.25 180.66 2qta h GLY 575 N 1.23 0.87 1.43 0.00 0.00 -0.09 -0.42 103.07 106.09 2qta h GLY 575 Ca 0.30 -0.61 -0.10 0.00 0.00 0.00 0.00 47.33 46.92 2qta h GLY 575 CO -0.04 0.57 -0.20 0.00 0.00 0.00 0.00 176.54 176.86 2qta h SER 577 N 0.59 0.59 -0.63 0.00 0.02 -0.85 -1.80 113.55 111.46 2qta h SER 577 Ca 0.09 -0.36 0.07 0.00 -0.84 0.00 0.00 61.79 60.75 2qta h SER 577 Cb 0.67 -0.16 -0.06 0.00 0.14 0.00 0.00 62.40 62.99 2qta h SER 577 CO 0.05 0.81 0.31 -0.25 -1.14 0.00 0.00 176.83 176.61 2qta h TRP 578 N 0.35 0.57 -0.60 3.45 7.01 -0.86 -0.88 115.95 125.00 2qta h TRP 578 Ca 0.08 0.03 -0.06 0.00 2.11 0.00 0.00 58.89 61.04 2qta h TRP 578 Cb 0.55 -0.16 -0.02 0.00 -2.10 0.00 0.00 29.16 27.42 2qta h TRP 578 CO 0.05 0.23 0.13 1.25 -2.79 0.00 0.00 178.44 177.31 2qta h LEU 579 N 0.57 0.92 -0.36 0.65 5.85 -0.67 0.36 115.31 122.64 2qta h LEU 579 Ca 0.30 -0.24 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 2qta h LEU 579 Cb 0.26 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.03 2qta h LEU 579 CO -0.22 0.92 0.18 0.00 -0.34 0.00 0.00 178.44 178.98 2qta h ALA 580 N 1.03 0.46 -0.34 1.25 0.00 -0.89 -2.02 119.26 118.75 2qta h ALA 580 Ca 0.19 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 2qta h ALA 580 Cb 0.37 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 2qta h ALA 580 CO 0.00 0.01 0.14 0.00 0.00 0.00 0.00 179.25 179.40 2qta h ALA 581 N 1.04 0.45 0.00 0.00 0.00 -0.90 -2.18 119.26 117.67 2qta h ALA 581 Ca 0.12 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2qta h ALA 581 Cb 0.10 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2qta h ALA 581 CO -0.02 0.04 0.00 0.00 0.00 0.00 0.00 179.25 179.28 2qta n ALA 582 N -2.28 1.51 -0.22 0.00 0.00 0.13 -2.21 120.51 117.43 2qta n ALA 582 Ca -0.01 -0.03 0.01 0.00 0.00 0.00 0.00 53.44 53.40 2qta n ALA 582 Cb 0.14 -1.19 0.01 0.00 0.00 0.00 0.00 19.45 18.41 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 -1.54 0.93 0.24 0.00 -2.24 -0.78 -1.25 114.28 109.64 2qta n THR 583 Ca 0.03 -0.95 0.09 0.00 -2.27 0.00 0.00 64.05 60.94 2qta n THR 583 Cb 0.13 0.51 0.61 0.00 -2.10 0.00 0.00 70.33 69.48 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 -0.23 3.42 0.87 -0.91 -0.94 113.55 115.76 2qta h SER 584 Ca 0.00 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2qta h SER 584 Cb 0.61 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.55 2qta h SER 584 CO 0.00 0.17 0.14 0.10 -0.53 0.00 0.00 176.83 176.71 2qta h TYR 585 N 0.00 0.32 0.00 2.24 -0.00 -1.77 -1.42 116.97 116.35 2qta h TYR 585 Ca -0.00 0.00 -0.29 0.00 0.00 0.00 0.00 58.73 58.44 2qta h TYR 585 Cb 0.39 -0.11 -0.04 0.00 0.00 0.00 0.00 36.73 36.97 2qta h TYR 585 CO 0.00 0.23 -1.64 0.45 -0.00 0.00 0.00 178.16 177.20 2qta n SER 586 N -4.47 1.89 -0.26 0.10 2.88 -0.77 -3.12 113.62 109.87 2qta n SER 586 Ca 0.01 0.40 -0.04 0.00 -1.33 0.00 0.00 58.87 57.91 2qta n SER 586 Cb 0.09 -0.90 0.07 0.00 -0.75 0.00 0.00 64.21 62.72 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 1.13 -0.03 2.46 2.02 -1.18 -3.25 112.91 113.07 2qta h THR 587 Ca -0.44 -0.32 0.00 0.00 0.77 0.00 0.00 66.41 66.43 2qta h THR 587 Cb 1.35 0.13 0.00 0.00 -1.74 0.00 0.00 68.15 67.89 2qta h THR 587 CO -0.27 0.17 0.00 0.59 0.37 0.00 0.00 175.52 176.38 2qta n ASN 588 N -4.62 1.95 -4.06 4.18 3.02 -0.58 -4.13 115.26 111.02 2qta n ASN 588 Ca 0.07 -1.87 -0.32 0.00 -0.03 0.00 0.00 54.58 52.44 2qta n ASN 588 Cb 0.06 -0.02 -0.01 0.00 -0.61 0.00 0.00 39.78 39.20 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 -0.34 -3.12 -3.47 6.41 5.15 -1.10 -4.74 115.26 114.06 2qta n ASN 589 Ca 0.01 -0.93 -0.29 0.00 -0.60 0.00 0.00 54.58 52.77 2qta n ASN 589 Cb 0.23 -3.20 -0.12 0.00 -0.53 0.00 0.00 39.78 36.16 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 -7.20 0.93 -0.15 1.20 2.96 -0.93 -4.76 118.68 110.74 2qta s LEU 590 Ca 0.55 -2.10 -0.31 0.00 -0.22 0.00 0.00 54.13 52.05 2qta s LEU 590 Cb -0.29 -0.39 -0.09 0.00 0.50 0.00 0.00 46.19 45.92 2qta s LEU 590 CO 0.89 -0.32 2.08 -0.81 -1.32 0.00 0.00 176.35 176.86 2qta n PRO 591 N 4.15 2.08 -4.26 0.98 -0.04 -1.26 -3.17 135.00 133.48 2qta n PRO 591 Ca 0.10 0.68 -0.29 0.00 -0.04 0.00 0.00 63.50 63.95 2qta n PRO 591 Cb 0.37 -2.91 -0.10 0.00 -0.04 0.00 0.00 33.50 30.82 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 5.32 1.98 -0.44 0.54 -1.94 -1.26 -4.87 119.30 118.63 2qta s MET 592 Ca 0.98 -1.11 0.03 0.00 -1.71 0.00 0.00 55.69 53.88 2qta s MET 592 Cb -0.53 -2.22 0.12 0.00 2.01 0.00 0.00 34.83 34.21 2qta s MET 592 CO 0.43 0.49 0.19 0.42 -0.01 0.00 0.00 175.02 176.55 2qta s ILE 593 N -1.22 2.06 0.35 2.53 1.01 0.27 -4.43 121.20 121.77 2qta s ILE 593 Ca 0.20 -2.75 -0.20 0.00 0.00 0.00 0.00 60.65 57.91 2qta s ILE 593 Cb -0.11 -2.46 -0.10 0.00 0.01 0.00 0.00 42.46 39.80 2qta s ILE 593 CO 0.12 -0.77 0.85 -2.16 0.00 0.00 0.00 174.94 172.98 2qta s PRO 594 N 0.30 4.21 -0.28 2.79 0.04 -1.26 -1.52 135.00 139.27 2qta s PRO 594 Ca 0.15 0.97 -0.02 0.00 0.04 0.00 0.00 61.00 62.13 2qta s PRO 594 Cb -0.23 -2.45 0.09 0.00 0.04 0.00 0.00 34.50 31.95 2qta s PRO 594 CO -0.04 0.13 0.10 -0.06 0.04 0.00 0.00 177.00 177.18 2qta s PHE 595 N -1.95 1.04 -0.34 0.56 0.40 -0.51 -1.15 117.98 116.04 2qta s PHE 595 Ca 0.55 -1.26 -0.13 0.00 -0.60 0.00 0.00 56.93 55.49 2qta s PHE 595 Cb -0.12 -1.29 -0.01 0.00 0.51 0.00 0.00 43.02 42.11 2qta s PHE 595 CO 0.17 -0.82 0.24 -0.47 0.70 0.00 0.00 175.22 175.04 2qta s TYR 596 N 1.85 3.23 -0.08 0.36 5.04 -0.84 -0.80 117.35 126.10 2qta s TYR 596 Ca 0.08 -0.28 0.01 0.00 -2.44 0.00 0.00 57.07 54.44 2qta s TYR 596 Cb -0.17 -2.47 -0.03 0.00 0.35 0.00 0.00 41.96 39.64 2qta s TYR 596 CO -0.27 -0.39 -0.09 -1.50 -1.34 0.00 0.00 175.55 171.95 2qta s ILE 597 N 1.71 3.47 0.31 3.14 2.07 -0.68 -1.29 121.20 129.93 2qta s ILE 597 Ca 0.06 -0.55 -0.18 0.00 -1.41 0.00 0.00 60.65 58.56 2qta s ILE 597 Cb -0.17 -2.42 0.05 0.00 0.13 0.00 0.00 42.46 40.05 2qta s ILE 597 CO 0.10 0.58 0.84 -0.72 -1.91 0.00 0.00 174.94 173.83 2qta s TYR 598 N -0.51 0.04 -0.03 3.50 -0.85 -1.12 -4.22 117.35 114.18 2qta s TYR 598 Ca 0.07 -0.61 -0.30 0.00 -0.52 0.00 0.00 57.07 55.71 2qta s TYR 598 Cb -0.12 0.78 -0.05 0.00 0.38 0.00 0.00 41.96 42.95 2qta s TYR 598 CO 0.02 -1.34 1.42 0.71 -1.52 0.00 0.00 175.55 174.84 2qta s TYR 599 N -2.59 2.73 0.43 -3.49 1.51 -1.26 -0.52 117.35 114.15 2qta s TYR 599 Ca 0.16 0.75 0.17 0.00 -1.01 0.00 0.00 57.07 57.14 2qta s TYR 599 Cb -0.04 -3.68 1.08 0.00 -0.11 0.00 0.00 41.96 39.20 2qta s TYR 599 CO 0.09 -2.56 1.90 0.66 -1.11 0.00 0.00 175.55 174.53 2qta h SER 600 N 8.12 0.38 -0.33 2.29 4.64 -1.26 0.11 113.55 127.50 2qta h SER 600 Ca -0.37 0.03 0.06 0.00 -0.47 0.00 0.00 61.79 61.04 2qta h SER 600 Cb 1.17 -0.05 -0.02 0.00 -0.31 0.00 0.00 62.40 63.20 2qta h SER 600 CO 0.92 0.18 0.22 -0.03 -0.87 0.00 0.00 176.83 177.26 2qta h MET 601 N 0.40 0.16 -0.87 4.77 -1.53 -1.84 -2.03 114.93 113.99 2qta h MET 601 Ca 0.40 -0.01 -0.25 0.00 -3.44 0.00 0.00 59.70 56.40 2qta h MET 601 Cb 0.97 -0.04 -0.15 0.00 -0.55 0.00 0.00 31.60 31.84 2qta h MET 601 CO -0.13 0.11 0.31 1.19 0.14 0.00 0.00 176.91 178.53 2qta n PHE 602 N -4.47 2.10 0.00 1.39 3.72 0.03 -4.28 117.46 115.94 2qta n PHE 602 Ca 0.04 -1.17 0.00 0.00 -0.05 0.00 0.00 57.45 56.27 2qta n PHE 602 Cb 0.28 -0.65 0.00 0.00 -0.94 0.00 0.00 39.48 38.17 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 -0.28 0.60 0.37 1.37 0.00 -0.76 -4.45 105.19 102.04 2qta n GLY 603 Ca 0.37 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.56 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 0.88 -0.71 1.61 -1.00 -1.85 0.15 116.94 116.02 2qta h PHE 604 Ca 0.00 0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.81 2qta h PHE 604 Cb 0.00 -0.26 -0.03 0.00 3.61 0.00 0.00 35.95 39.26 2qta h PHE 604 CO 0.00 0.17 0.45 0.37 -1.61 0.00 0.00 178.31 177.68 2qta h GLN 605 N 0.60 0.95 0.01 1.51 4.15 -1.87 0.70 115.11 121.16 2qta h GLN 605 Ca 0.57 -0.07 -0.36 0.00 0.77 0.00 0.00 58.65 59.56 2qta h GLN 605 Cb 1.11 -0.21 -0.06 0.00 0.21 0.00 0.00 27.48 28.53 2qta h GLN 605 CO -0.33 0.65 -2.24 -2.13 -1.93 0.00 0.00 178.83 172.85 2qta n ARG 606 N -4.41 0.68 -0.67 1.69 3.00 -0.27 -4.55 116.66 112.13 2qta n ARG 606 Ca 0.07 0.12 0.06 0.00 -0.00 0.00 0.00 57.85 58.10 2qta n ARG 606 Cb 0.05 -1.59 0.15 0.00 0.00 0.00 0.00 32.46 31.07 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 -3.00 1.60 -0.08 5.15 -5.35 0.37 -4.86 119.36 113.19 2qta n ILE 607 Ca -0.33 -2.44 0.17 0.00 -0.27 0.00 0.00 62.75 59.88 2qta n ILE 607 Cb 1.09 0.04 0.59 0.00 -1.74 0.00 0.00 39.64 39.61 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 0.76 0.37 1.93 3.28 0.00 -0.98 0.12 103.07 108.54 2qta h GLY 608 Ca -0.04 -0.10 -0.14 0.00 0.00 0.00 0.00 47.33 47.04 2qta h GLY 608 CO 0.02 0.04 -0.66 -1.80 0.00 0.00 0.00 176.54 174.13 2qta h ASP 609 N 0.23 0.08 0.44 0.19 3.58 -1.89 -1.88 116.42 117.17 2qta h ASP 609 Ca 0.30 -0.05 -0.17 0.00 0.42 0.00 0.00 57.03 57.53 2qta h ASP 609 Cb 0.87 -0.02 -0.01 0.00 1.72 0.00 0.00 39.33 41.88 2qta h ASP 609 CO -0.06 0.72 -0.71 0.25 -2.88 0.00 0.00 179.24 176.56 2qta h LEU 610 N 0.05 0.28 -0.86 2.28 7.12 -1.21 -1.92 115.31 121.05 2qta h LEU 610 Ca -0.01 -0.19 -0.11 0.00 0.13 0.00 0.00 57.88 57.71 2qta h LEU 610 Cb 1.18 -0.08 -0.01 0.00 -0.53 0.00 0.00 40.66 41.21 2qta h LEU 610 CO 0.09 0.90 -0.28 0.00 -0.13 0.00 0.00 178.44 179.02 2qta h TRP 612 N 0.45 0.45 -0.64 0.00 2.91 -1.23 -2.35 115.95 115.54 2qta h TRP 612 Ca 0.06 -0.08 -0.01 0.00 1.13 0.00 0.00 58.89 59.99 2qta h TRP 612 Cb 0.73 -0.12 -0.03 0.00 -0.51 0.00 0.00 29.16 29.23 2qta h TRP 612 CO 0.03 0.59 0.36 0.00 -1.03 0.00 0.00 178.44 178.38 2qta h ALA 613 N 0.80 1.44 -0.67 2.65 0.00 -0.99 -1.63 119.26 120.86 2qta h ALA 613 Ca 0.07 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 2qta h ALA 613 Cb 0.41 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 2qta h ALA 613 CO 0.01 0.47 0.25 0.00 0.00 0.00 0.00 179.25 179.98 2qta h ALA 614 N 1.52 1.18 -0.55 0.00 0.00 -0.41 0.99 119.26 121.98 2qta h ALA 614 Ca 0.23 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 2qta h ALA 614 Cb 0.00 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.50 2qta h ALA 614 CO -0.04 0.59 0.28 0.78 0.00 0.00 0.00 179.25 180.86 2qta h GLY 615 N 1.05 0.84 1.08 0.00 0.00 -0.78 -0.62 103.07 104.64 2qta h GLY 615 Ca 0.22 -0.40 -0.03 0.00 0.00 0.00 0.00 47.33 47.12 2qta h GLY 615 CO -0.02 0.38 0.39 -1.80 0.00 0.00 0.00 176.54 175.50 2qta h ASP 616 N 0.74 1.07 -0.02 0.19 3.58 -0.76 -2.19 116.42 119.04 2qta h ASP 616 Ca 0.19 -0.13 0.00 0.00 0.42 0.00 0.00 57.03 57.51 2qta h ASP 616 Cb 0.09 -0.28 0.00 0.00 1.72 0.00 0.00 39.33 40.87 2qta h ASP 616 CO -0.03 0.91 0.00 1.67 -2.88 0.00 0.00 179.24 178.91 2qta n GLN 617 N -4.31 1.07 -3.52 0.28 7.27 0.28 -0.74 117.38 117.71 2qta n GLN 617 Ca 0.08 -0.10 -0.21 0.00 0.07 0.00 0.00 57.00 56.84 2qta n GLN 617 Cb 0.14 -1.29 0.08 0.00 2.41 0.00 0.00 30.24 31.59 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 -0.67 -7.39 -1.97 3.69 1.13 -0.64 -4.93 117.38 106.60 2qta n GLN 618 Ca 0.13 0.82 -0.41 0.00 -1.94 0.00 0.00 57.00 55.60 2qta n GLN 618 Cb 0.08 -5.81 -0.02 0.00 0.11 0.00 0.00 30.24 24.60 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 -3.33 3.63 -0.31 -1.58 0.00 -0.33 -4.83 121.76 115.00 2qta s ALA 619 Ca 0.38 1.37 0.02 0.00 0.00 0.00 0.00 51.96 53.74 2qta s ALA 619 Cb -0.17 -3.57 0.09 0.00 0.00 0.00 0.00 23.12 19.48 2qta s ALA 619 CO 0.71 -0.79 0.03 1.03 0.00 0.00 0.00 175.76 176.75 2qta s ARG 620 N -0.64 1.40 0.01 0.00 0.52 -0.38 -3.56 118.95 116.31 2qta s ARG 620 Ca 0.58 -1.55 -0.02 0.00 -0.52 0.00 0.00 55.73 54.23 2qta s ARG 620 Cb -0.43 -2.84 0.01 0.00 0.52 0.00 0.00 34.95 32.21 2qta s ARG 620 CO 0.46 -0.87 0.08 0.41 0.02 0.00 0.00 175.30 175.39 2qta n GLY 621 N 4.45 1.25 3.13 -3.53 0.00 -1.26 -4.51 105.19 104.72 2qta n GLY 621 Ca -0.01 -0.94 -0.32 0.00 0.00 0.00 0.00 46.02 44.75 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 -5.70 2.66 -0.37 1.61 0.40 -0.30 -1.37 117.98 114.91 2qta s PHE 622 Ca 0.02 -1.46 -0.17 0.00 -0.60 0.00 0.00 56.93 54.72 2qta s PHE 622 Cb -0.00 -1.83 0.00 0.00 0.51 0.00 0.00 43.02 41.70 2qta s PHE 622 CO 0.00 -0.70 0.44 -0.51 0.70 0.00 0.00 175.22 175.15 2qta s LEU 623 N 1.07 4.53 -0.47 -0.37 1.43 0.12 -1.99 118.68 123.01 2qta s LEU 623 Ca -0.01 -0.30 -0.13 0.00 -1.03 0.00 0.00 54.13 52.66 2qta s LEU 623 Cb -0.14 -2.44 0.09 0.00 0.03 0.00 0.00 46.19 43.73 2qta s LEU 623 CO -0.07 -0.46 0.37 -0.63 0.23 0.00 0.00 176.35 175.78 2qta s ILE 624 N 2.19 4.82 -0.87 -0.59 -1.09 -0.41 -0.65 121.20 124.61 2qta s ILE 624 Ca 0.14 -1.31 -0.24 0.00 -2.23 0.00 0.00 60.65 57.01 2qta s ILE 624 Cb -0.16 -3.97 0.05 0.00 -1.58 0.00 0.00 42.46 36.80 2qta s ILE 624 CO 0.13 -0.63 1.31 -0.83 -1.23 0.00 0.00 174.94 173.69 2qta s GLY 625 N 2.63 1.17 0.97 6.18 0.00 -0.25 -2.78 107.32 115.24 2qta s GLY 625 Ca 0.04 -1.90 -0.15 0.00 0.00 0.00 0.00 44.72 42.71 2qta s GLY 625 CO 0.04 2.56 1.24 -0.32 0.00 0.00 0.00 173.10 176.62 2qta s GLY 626 N 4.25 1.69 -1.52 0.20 0.00 0.32 -0.67 107.32 111.59 2qta s GLY 626 Ca 0.38 -0.97 -0.08 0.00 0.00 0.00 0.00 44.72 44.05 2qta s GLY 626 CO 0.02 -0.25 0.21 -1.30 0.00 0.00 0.00 173.10 171.77 2qta n THR 627 N -3.87 -0.56 -2.44 0.90 -2.24 -1.16 -0.91 114.28 103.99 2qta n THR 627 Ca 0.12 -0.28 -0.23 0.00 -2.27 0.00 0.00 64.05 61.39 2qta n THR 627 Cb 0.60 -0.73 0.05 0.00 -2.10 0.00 0.00 70.33 68.15 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 -3.79 5.03 0.00 3.42 1.04 -0.95 -4.58 113.70 113.87 2qta s SER 628 Ca 0.29 0.18 0.00 0.00 0.48 0.00 0.00 55.95 56.90 2qta s SER 628 Cb -0.17 -0.94 0.00 0.00 0.10 0.00 0.00 66.02 65.01 2qta s SER 628 CO 0.91 -1.37 0.00 0.61 0.98 0.00 0.00 173.24 174.37 2qta n GLY 629 N -2.62 -0.37 0.09 7.32 0.00 -0.50 -4.36 105.19 104.75 2qta n GLY 629 Ca 0.08 -1.26 -0.10 0.00 0.00 0.00 0.00 46.02 44.74 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 0.18 0.00 1.61 9.65 -0.55 -3.05 114.38 122.22 2qta h ARG 630 Ca 0.00 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.87 2qta h ARG 630 Cb 0.00 -0.04 0.00 0.00 -1.39 0.00 0.00 29.97 28.54 2qta h ARG 630 CO 0.00 0.12 -0.34 0.25 2.80 0.00 0.00 179.97 182.80 2qta n THR 631 N -5.00 0.20 0.05 0.20 -2.24 -1.26 -4.28 114.28 101.95 2qta n THR 631 Ca -0.04 -0.13 -0.14 0.00 -2.27 0.00 0.00 64.05 61.47 2qta n THR 631 Cb 0.04 -0.17 -0.14 0.00 -2.10 0.00 0.00 70.33 67.96 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 0.00 1.19 -2.11 4.28 2.02 -1.76 -3.29 112.91 113.24 2qta h THR 632 Ca 0.00 -2.87 -0.78 0.00 0.77 0.00 0.00 66.41 63.52 2qta h THR 632 Cb 0.61 2.72 -0.22 0.00 -1.74 0.00 0.00 68.15 69.52 2qta h THR 632 CO 0.00 0.80 1.43 -0.11 0.37 0.00 0.00 175.52 178.00 2qta n LEU 633 N -3.38 6.79 -0.30 2.58 7.94 -1.24 -4.85 117.00 124.55 2qta n LEU 633 Ca -0.14 -5.00 -0.04 0.00 -1.11 0.00 0.00 56.01 49.72 2qta n LEU 633 Cb 1.03 -1.34 0.08 0.00 0.53 0.00 0.00 43.42 43.71 2qta n LEU 633 CO 0.49 1.66 1.20 -0.55 -1.11 0.00 0.00 177.39 179.08 2qta h ASN 634 N 5.32 0.98 1.44 1.96 -1.07 -1.82 -3.16 115.58 119.21 2qta h ASN 634 Ca 0.36 -0.05 -0.10 0.00 0.07 0.00 0.00 56.30 56.58 2qta h ASN 634 Cb 0.55 -0.25 -0.01 0.00 -2.07 0.00 0.00 38.32 36.54 2qta h ASN 634 CO 1.44 0.73 -0.49 1.23 0.07 0.00 0.00 177.43 180.42 2qta h GLY 635 N 1.13 0.00 1.92 9.14 0.00 -1.88 -2.23 103.07 111.15 2qta h GLY 635 Ca 0.30 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.58 2qta h GLY 635 CO -0.06 0.00 -0.22 0.83 0.00 0.00 0.00 176.54 177.09 2qta h GLU 636 N 0.00 0.09 0.00 4.80 4.39 -1.88 -3.41 114.58 118.57 2qta h GLU 636 Ca -0.00 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.67 2qta h GLU 636 Cb 1.34 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.98 2qta h GLU 636 CO 0.06 0.31 0.00 0.41 -1.16 0.00 0.00 179.01 178.64 2qta n GLY 637 N -0.81 -1.32 0.29 -3.84 0.00 -1.26 -4.58 105.19 93.67 2qta n GLY 637 Ca -0.02 -1.45 0.06 0.00 0.00 0.00 0.00 46.02 44.61 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 0.31 -2.10 0.99 6.46 -1.81 -0.46 115.31 118.70 2qta h LEU 638 Ca 0.00 0.11 0.00 0.00 -0.12 0.00 0.00 57.88 57.87 2qta h LEU 638 Cb 0.00 0.08 0.00 0.00 -0.73 0.00 0.00 40.66 40.01 2qta h LEU 638 CO 0.00 0.11 0.00 0.00 -0.62 0.00 0.00 178.44 177.93 2qta n GLN 639 N -4.99 2.33 0.00 1.25 6.02 -1.26 -4.30 117.38 116.42 2qta n GLN 639 Ca 0.16 -2.06 0.00 0.00 -0.01 0.00 0.00 57.00 55.09 2qta n GLN 639 Cb 0.45 -1.45 0.00 0.00 1.02 0.00 0.00 30.24 30.26 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 1.18 0.00 -2.24 1.08 8.25 -0.82 -4.94 115.22 117.73 2qta n HIS 640 Ca 0.19 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.25 2qta n HIS 640 Cb 0.49 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.57 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 -1.92 3.08 -0.50 -0.41 2.02 -0.24 -4.51 118.70 116.22 2qta s GLU 641 Ca 0.00 0.57 -0.21 0.00 0.02 0.00 0.00 54.97 55.35 2qta s GLU 641 Cb 0.00 -4.22 0.04 0.00 0.10 0.00 0.00 34.13 30.05 2qta s GLU 641 CO 0.00 -2.20 0.73 0.34 0.02 0.00 0.00 175.26 174.15 2qta s ASP 642 N 5.74 6.29 -0.16 -0.19 2.15 -1.25 -4.71 116.67 124.53 2qta s ASP 642 Ca 0.59 -0.59 0.15 0.00 0.43 0.00 0.00 52.55 53.13 2qta s ASP 642 Cb -0.13 -2.34 0.35 0.00 -0.30 0.00 0.00 42.92 40.50 2qta s ASP 642 CO 0.24 -0.96 1.18 0.61 -0.17 0.00 0.00 175.17 176.07 2qta n GLY 643 N 5.12 4.89 0.00 2.66 0.00 -1.26 -1.41 105.19 115.19 2qta n GLY 643 Ca -0.03 -1.20 0.00 0.00 0.00 0.00 0.00 46.02 44.79 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 -1.24 0.00 0.26 1.61 1.44 -1.26 -0.56 115.22 115.47 2qta n HIS 644 Ca 0.17 0.00 0.10 0.00 -2.01 0.00 0.00 57.72 55.98 2qta n HIS 644 Cb 0.67 0.03 0.67 0.00 0.12 0.00 0.00 29.99 31.49 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 0.00 0.75 4.39 4.64 -1.91 -0.10 113.55 121.32 2qta h SER 645 Ca 0.00 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.27 2qta h SER 645 Cb 0.54 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.62 2qta h SER 645 CO 0.00 0.11 -0.23 0.45 -0.87 0.00 0.00 176.83 176.28 2qta h HIS 646 N 0.00 0.00 -0.08 4.77 3.86 -1.96 0.22 115.15 121.96 2qta h HIS 646 Ca -0.00 0.00 -0.19 0.00 -1.16 0.00 0.00 60.37 59.02 2qta h HIS 646 Cb 0.22 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.69 2qta h HIS 646 CO 0.00 0.23 -0.73 0.82 0.86 0.00 0.00 177.93 179.11 2qta h ILE 647 N 0.00 1.37 -0.11 2.45 1.08 -1.38 -1.68 117.51 119.24 2qta h ILE 647 Ca -0.00 -2.12 -0.14 0.00 -0.39 0.00 0.00 64.86 62.20 2qta h ILE 647 Cb 0.67 2.10 0.01 0.00 -3.07 0.00 0.00 36.82 36.52 2qta h ILE 647 CO 0.03 0.64 -0.49 1.56 -0.69 0.00 0.00 178.15 179.21 2qta h GLN 648 N 0.29 0.52 0.00 2.37 4.20 -1.05 -3.29 115.11 118.15 2qta h GLN 648 Ca -0.03 -0.41 -0.06 0.00 0.06 0.00 0.00 58.65 58.20 2qta h GLN 648 Cb 1.31 0.08 -0.01 0.00 0.30 0.00 0.00 27.48 29.16 2qta h GLN 648 CO 0.13 1.04 -0.30 0.66 -0.67 0.00 0.00 178.83 179.69 2qta h SER 649 N 0.12 0.00 0.53 1.46 4.64 -0.52 -2.45 113.55 117.33 2qta h SER 649 Ca -0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 2qta h SER 649 Cb 1.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 2qta h SER 649 CO 0.10 0.30 0.00 0.00 -0.87 0.00 0.00 176.83 176.36 2qta n LEU 650 N -3.96 0.01 0.10 5.97 -0.00 -0.64 -2.33 117.00 116.15 2qta n LEU 650 Ca -0.02 0.50 0.13 0.00 -0.00 0.00 0.00 56.01 56.62 2qta n LEU 650 Cb 0.37 -0.50 0.43 0.00 -0.00 0.00 0.00 43.42 43.72 2qta n LEU 650 CO 0.37 -0.24 0.89 0.35 -0.00 0.00 0.00 177.39 178.75 2qta n THR 651 N -1.51 0.60 -3.25 1.47 -2.24 -0.92 -4.68 114.28 103.75 2qta n THR 651 Ca 0.04 -0.18 -0.42 0.00 -2.27 0.00 0.00 64.05 61.22 2qta n THR 651 Cb 0.18 -0.68 -0.08 0.00 -2.10 0.00 0.00 70.33 67.65 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 -3.13 5.02 0.33 2.28 1.01 -0.98 -4.97 121.20 120.76 2qta s ILE 652 Ca 0.10 0.15 0.10 0.00 0.00 0.00 0.00 60.65 61.00 2qta s ILE 652 Cb 0.12 -4.00 0.33 0.00 0.01 0.00 0.00 42.46 38.92 2qta s ILE 652 CO 0.56 -0.29 1.78 -0.65 0.00 0.00 0.00 174.94 176.33 2qta h PRO 653 N 8.57 0.62 -0.53 2.79 0.11 -1.88 -2.61 132.00 139.07 2qta h PRO 653 Ca -0.27 -0.04 -0.23 0.00 0.11 0.00 0.00 66.00 65.56 2qta h PRO 653 Cb 1.12 -0.14 -0.14 0.00 0.11 0.00 0.00 31.00 31.95 2qta h PRO 653 CO 0.78 0.41 0.14 0.27 -0.21 0.00 0.00 178.00 179.40 2qta n ASN 654 N -4.73 3.27 -4.52 -2.05 6.94 -1.26 -4.89 115.26 108.03 2qta n ASN 654 Ca 0.24 -3.56 -0.35 0.00 -0.02 0.00 0.00 54.58 50.89 2qta n ASN 654 Cb 0.66 -0.68 -0.12 0.00 -2.36 0.00 0.00 39.78 37.28 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 0.74 4.71 -0.10 0.00 -1.09 0.44 -4.90 121.20 121.00 2qta s ILE 656 Ca 0.01 -0.05 -0.00 0.00 -2.23 0.00 0.00 60.65 58.38 2qta s ILE 656 Cb -0.14 -3.23 -0.03 0.00 -1.58 0.00 0.00 42.46 37.48 2qta s ILE 656 CO 0.02 0.29 -0.07 -0.44 -1.23 0.00 0.00 174.94 173.51 2qta s SER 657 N 1.67 4.61 0.03 3.58 0.01 -1.26 -0.79 113.70 121.55 2qta s SER 657 Ca 0.07 -0.08 0.03 0.00 1.31 0.00 0.00 55.95 57.27 2qta s SER 657 Cb -0.16 -1.37 -0.02 0.00 0.21 0.00 0.00 66.02 64.69 2qta s SER 657 CO 0.07 0.29 -0.09 -0.31 0.41 0.00 0.00 173.24 173.61 2qta s TYR 658 N -0.39 0.78 -0.49 2.43 2.02 -0.26 -4.59 117.35 116.85 2qta s TYR 658 Ca 0.06 -0.36 0.07 0.00 -0.37 0.00 0.00 57.07 56.47 2qta s TYR 658 Cb -0.12 -0.47 0.25 0.00 -0.40 0.00 0.00 41.96 41.21 2qta s TYR 658 CO 0.02 -0.03 0.61 -3.47 -1.57 0.00 0.00 175.55 171.12 2qta n ASP 659 N 1.92 1.64 -4.77 2.29 2.03 -0.26 -1.92 116.55 117.48 2qta n ASP 659 Ca -0.19 -3.00 -0.35 0.00 0.52 0.00 0.00 54.79 51.77 2qta n ASP 659 Cb 0.55 -0.65 0.01 0.00 -0.72 0.00 0.00 41.12 40.32 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 -1.70 3.20 -0.16 -0.67 0.04 -1.26 -1.03 135.00 133.41 2qta s PRO 660 Ca 0.37 1.71 0.15 0.00 0.04 0.00 0.00 61.00 63.26 2qta s PRO 660 Cb 0.16 -1.98 -0.24 0.00 0.04 0.00 0.00 34.50 32.48 2qta s PRO 660 CO -0.07 -0.99 0.20 0.00 0.04 0.00 0.00 177.00 176.18 2qta n ALA 661 N -1.41 1.47 -2.47 8.56 0.00 -1.26 -3.87 120.51 121.54 2qta n ALA 661 Ca 0.12 -1.15 -0.26 0.00 0.00 0.00 0.00 53.44 52.15 2qta n ALA 661 Cb 0.50 -0.36 -0.11 0.00 0.00 0.00 0.00 19.45 19.49 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 -2.52 2.36 0.25 0.00 2.02 -1.26 -4.81 117.35 113.39 2qta s TYR 662 Ca -0.11 -0.33 -0.05 0.00 -0.37 0.00 0.00 57.07 56.22 2qta s TYR 662 Cb 0.07 -1.12 0.34 0.00 -0.40 0.00 0.00 41.96 40.85 2qta s TYR 662 CO 0.81 0.57 1.86 0.00 -1.57 0.00 0.00 175.55 177.22 2qta h ALA 663 N 2.83 1.23 0.00 3.71 0.00 -1.89 -1.34 119.26 123.81 2qta h ALA 663 Ca -0.45 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.37 2qta h ALA 663 Cb 1.22 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 2qta h ALA 663 CO 0.53 0.35 -0.35 0.10 0.00 0.00 0.00 179.25 179.87 2qta h TYR 664 N 1.05 0.00 -0.44 0.00 -0.00 -1.83 -2.17 116.97 113.58 2qta h TYR 664 Ca 0.39 0.00 -0.14 0.00 0.00 0.00 0.00 58.73 58.98 2qta h TYR 664 Cb 0.14 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 36.86 2qta h TYR 664 CO -0.02 0.35 -0.27 0.93 -0.00 0.00 0.00 178.16 179.15 2qta h GLU 665 N 0.00 0.94 -0.53 0.10 5.08 -1.59 -1.87 114.58 116.71 2qta h GLU 665 Ca -0.00 -0.43 0.04 0.00 -1.00 0.00 0.00 59.36 57.97 2qta h GLU 665 Cb 0.68 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.87 2qta h GLU 665 CO 0.05 1.09 0.28 0.28 -1.00 0.00 0.00 179.01 179.70 2qta h VAL 666 N 0.80 0.97 0.02 3.13 2.07 -0.91 -0.71 116.25 121.63 2qta h VAL 666 Ca 0.09 -0.19 -0.00 0.00 0.82 0.00 0.00 66.70 67.43 2qta h VAL 666 Cb 0.85 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 31.00 2qta h VAL 666 CO 0.07 0.10 -0.01 0.00 0.02 0.00 0.00 177.57 177.75 2qta h ALA 667 N 1.27 -0.03 -0.53 1.67 0.00 -1.17 -0.78 119.26 119.69 2qta h ALA 667 Ca 0.23 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 2qta h ALA 667 Cb 0.12 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 2qta h ALA 667 CO -0.15 -0.51 0.33 0.28 0.00 0.00 0.00 179.25 179.21 2qta h VAL 668 N -0.06 1.15 -0.33 0.00 2.07 -1.06 -0.77 116.25 117.26 2qta h VAL 668 Ca -0.00 -0.32 -0.02 0.00 0.82 0.00 0.00 66.70 67.17 2qta h VAL 668 Cb 0.05 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 30.22 2qta h VAL 668 CO 0.01 0.15 0.11 0.40 0.02 0.00 0.00 177.57 178.26 2qta h ILE 669 N 0.71 1.20 -0.60 4.57 2.04 -1.00 -0.64 117.51 123.79 2qta h ILE 669 Ca 0.19 -0.62 -0.09 0.00 1.00 0.00 0.00 64.86 65.34 2qta h ILE 669 Cb -0.04 1.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.02 2qta h ILE 669 CO -0.04 0.21 0.01 0.24 0.00 0.00 0.00 178.15 178.58 2qta h MET 670 N 0.37 1.03 -0.36 2.37 2.86 -1.00 -0.03 114.93 120.17 2qta h MET 670 Ca 0.11 -0.31 -0.03 0.00 -2.06 0.00 0.00 59.70 57.40 2qta h MET 670 Cb 0.22 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 31.77 2qta h MET 670 CO -0.01 1.00 0.10 1.25 1.06 0.00 0.00 176.91 180.32 2qta h HIS 671 N 0.95 0.60 -0.53 -0.22 -0.00 -0.99 -1.45 115.15 113.50 2qta h HIS 671 Ca 0.17 -0.07 -0.01 0.00 -0.00 0.00 0.00 60.37 60.46 2qta h HIS 671 Cb 0.53 -0.17 -0.02 0.00 -0.00 0.00 0.00 27.41 27.74 2qta h HIS 671 CO 0.04 0.59 0.28 0.22 -0.00 0.00 0.00 177.93 179.05 2qta h ASP 672 N 0.44 0.68 -0.64 3.26 3.58 -0.87 -1.58 116.42 121.29 2qta h ASP 672 Ca 0.12 -0.11 0.02 0.00 0.42 0.00 0.00 57.03 57.48 2qta h ASP 672 Cb 0.28 -0.17 -0.04 0.00 1.72 0.00 0.00 39.33 41.12 2qta h ASP 672 CO -0.00 0.60 0.41 1.23 -2.88 0.00 0.00 179.24 178.59 2qta h GLY 673 N 0.72 0.91 0.81 -0.78 0.00 -0.88 0.14 103.07 103.98 2qta h GLY 673 Ca 0.19 -0.32 0.02 0.00 0.00 0.00 0.00 47.33 47.22 2qta h GLY 673 CO -0.03 0.29 -0.02 -2.00 0.00 0.00 0.00 176.54 174.79 2qta h LEU 674 N 0.82 -0.07 -0.74 3.11 5.85 -0.92 -1.02 115.31 122.34 2qta h LEU 674 Ca 0.25 0.03 -0.07 0.00 0.84 0.00 0.00 57.88 58.92 2qta h LEU 674 Cb -0.04 0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.02 2qta h LEU 674 CO -0.08 -0.02 0.16 -0.33 -0.34 0.00 0.00 178.44 177.83 2qta h GLU 675 N 0.01 1.12 -0.09 1.25 5.08 -0.79 -0.14 114.58 121.01 2qta h GLU 675 Ca 0.05 -0.27 -0.02 0.00 -1.00 0.00 0.00 59.36 58.12 2qta h GLU 675 Cb 0.07 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.17 2qta h GLU 675 CO -0.10 0.99 -0.00 0.00 -1.00 0.00 0.00 179.01 178.90 2qta h ARG 676 N 1.06 0.17 0.24 2.33 3.08 -0.45 -1.04 114.38 119.77 2qta h ARG 676 Ca 0.22 -0.05 -0.33 0.00 0.07 0.00 0.00 59.98 59.88 2qta h ARG 676 Cb 0.38 -0.01 0.04 0.00 0.08 0.00 0.00 29.97 30.45 2qta h ARG 676 CO 0.00 0.43 -1.48 0.52 -1.07 0.00 0.00 179.97 178.37 2qta h MET 677 N -0.11 0.52 -0.11 0.04 2.86 -1.22 0.22 114.93 117.13 2qta h MET 677 Ca 0.03 -0.88 0.00 0.00 -2.06 0.00 0.00 59.70 56.78 2qta h MET 677 Cb 0.36 0.33 0.00 0.00 0.06 0.00 0.00 31.60 32.34 2qta h MET 677 CO 0.01 1.42 0.00 0.66 1.06 0.00 0.00 176.91 180.06 2qta n TYR 678 N -3.70 0.14 -2.30 -0.22 4.01 -0.07 -4.15 117.16 110.87 2qta n TYR 678 Ca -0.17 -0.23 -0.02 0.00 -0.16 0.00 0.00 57.90 57.32 2qta n TYR 678 Cb 1.10 -0.02 0.01 0.00 -0.31 0.00 0.00 39.34 40.13 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 0.30 0.80 0.30 2.72 0.00 -0.39 -4.60 105.19 104.32 2qta n GLY 679 Ca 0.06 -1.97 0.15 0.00 0.00 0.00 0.00 46.02 44.26 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 0.00 -0.67 1.61 5.08 -1.91 -2.22 114.58 116.47 2qta h GLU 680 Ca -0.03 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.30 2qta h GLU 680 Cb 0.11 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.33 2qta h GLU 680 CO 0.03 0.02 0.31 -0.22 -1.00 0.00 0.00 179.01 178.15 2qta h LYS 681 N 0.00 0.96 -6.43 2.33 3.64 -1.79 -3.47 116.57 111.81 2qta h LYS 681 Ca -0.00 -0.13 -0.48 0.00 -1.27 0.00 0.00 60.65 58.76 2qta h LYS 681 Cb 0.05 -0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 31.69 2qta h LYS 681 CO 0.00 0.75 -0.91 1.04 -2.27 0.00 0.00 179.45 178.06 2qta n GLN 682 N -4.33 -2.44 -2.36 1.90 6.02 -0.84 -4.90 117.38 110.44 2qta n GLN 682 Ca 0.06 0.40 -0.41 0.00 -0.01 0.00 0.00 57.00 57.04 2qta n GLN 682 Cb 0.14 -4.27 -0.03 0.00 1.02 0.00 0.00 30.24 27.10 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 -6.42 4.47 -1.21 -1.09 2.12 0.76 -4.95 118.70 112.39 2qta s GLU 683 Ca 0.19 1.88 -0.16 0.00 0.36 0.00 0.00 54.97 57.24 2qta s GLU 683 Cb -0.07 -3.25 0.13 0.00 0.26 0.00 0.00 34.13 31.20 2qta s GLU 683 CO 0.88 -0.12 1.52 -0.80 -0.54 0.00 0.00 175.26 176.20 2qta s ASN 684 N 0.24 6.93 0.06 -1.70 0.01 -1.26 -4.41 114.94 114.81 2qta s ASN 684 Ca 0.54 -2.65 -0.09 0.00 -0.71 0.00 0.00 52.86 49.94 2qta s ASN 684 Cb -0.33 -2.47 0.00 0.00 0.41 0.00 0.00 41.25 38.86 2qta s ASN 684 CO 0.36 -0.96 0.20 0.68 -1.51 0.00 0.00 177.10 175.87 2qta s VAL 685 N 2.76 0.12 0.28 1.60 -7.23 -1.26 -4.87 120.40 111.80 2qta s VAL 685 Ca 0.46 -1.02 0.09 0.00 -1.81 0.00 0.00 61.98 59.70 2qta s VAL 685 Cb -0.00 -1.12 -0.06 0.00 0.56 0.00 0.00 36.38 35.76 2qta s VAL 685 CO 0.02 -0.56 -0.11 -0.72 -0.31 0.00 0.00 175.10 173.41 2qta s TYR 686 N -3.21 2.08 0.09 2.82 -0.85 0.19 -4.30 117.35 114.18 2qta s TYR 686 Ca -0.00 -0.56 0.05 0.00 -0.52 0.00 0.00 57.07 56.05 2qta s TYR 686 Cb 0.02 -1.10 -0.04 0.00 0.38 0.00 0.00 41.96 41.22 2qta s TYR 686 CO -0.07 0.45 -0.03 0.71 -1.52 0.00 0.00 175.55 175.09 2qta s TYR 687 N -2.81 2.92 -0.10 -3.49 1.51 -0.47 -0.42 117.35 114.49 2qta s TYR 687 Ca 0.29 -0.06 -0.00 0.00 -1.01 0.00 0.00 57.07 56.28 2qta s TYR 687 Cb 0.01 -1.51 0.02 0.00 -0.11 0.00 0.00 41.96 40.38 2qta s TYR 687 CO 0.13 0.47 -0.06 -0.47 -1.11 0.00 0.00 175.55 174.50 2qta s TYR 688 N -1.28 1.26 -0.12 2.71 5.04 0.03 0.16 117.35 125.15 2qta s TYR 688 Ca 0.24 -0.57 0.00 0.00 -2.44 0.00 0.00 57.07 54.31 2qta s TYR 688 Cb -0.12 -1.09 0.02 0.00 0.35 0.00 0.00 41.96 41.12 2qta s TYR 688 CO 0.17 -0.44 -0.12 0.42 -1.34 0.00 0.00 175.55 174.25 2qta s ILE 689 N 1.64 1.32 0.11 3.14 1.01 0.18 -1.10 121.20 127.49 2qta s ILE 689 Ca 0.03 -0.49 -0.26 0.00 0.00 0.00 0.00 60.65 59.92 2qta s ILE 689 Cb -0.13 -1.26 -0.07 0.00 0.01 0.00 0.00 42.46 41.02 2qta s ILE 689 CO -0.06 0.41 0.80 0.42 0.00 0.00 0.00 174.94 176.51 2qta s THR 690 N 1.40 4.54 0.28 2.92 -4.23 -0.81 -1.09 115.64 118.66 2qta s THR 690 Ca 0.01 1.73 0.05 0.00 -1.18 0.00 0.00 61.69 62.30 2qta s THR 690 Cb -0.13 -4.16 -0.06 0.00 1.34 0.00 0.00 72.50 69.49 2qta s THR 690 CO -0.07 0.42 -0.02 0.42 -0.54 0.00 0.00 174.62 174.84 2qta s THR 691 N -0.50 1.44 0.28 3.99 -4.23 0.16 -4.35 115.64 112.42 2qta s THR 691 Ca 0.39 -2.08 0.11 0.00 -1.18 0.00 0.00 61.69 58.93 2qta s THR 691 Cb -0.22 -2.52 -0.05 0.00 1.34 0.00 0.00 72.50 71.05 2qta s THR 691 CO 0.25 -0.23 -0.16 -0.76 -0.54 0.00 0.00 174.62 173.18 2qta s LEU 692 N -3.43 2.72 -0.07 4.79 1.43 -1.26 -2.24 118.68 120.61 2qta s LEU 692 Ca 0.31 -0.95 0.14 0.00 -1.03 0.00 0.00 54.13 52.60 2qta s LEU 692 Cb 0.05 -1.23 0.45 0.00 0.03 0.00 0.00 46.19 45.49 2qta s LEU 692 CO 0.12 0.03 1.37 -0.46 0.23 0.00 0.00 176.35 177.65 2qta n ASN 693 N -0.67 3.53 -4.44 2.29 6.94 -1.26 -2.78 115.26 118.87 2qta n ASN 693 Ca -0.05 -2.36 -0.34 0.00 -0.02 0.00 0.00 54.58 51.80 2qta n ASN 693 Cb 0.60 -0.39 -0.13 0.00 -2.36 0.00 0.00 39.78 37.50 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 -1.65 3.59 0.10 -3.83 2.12 -1.26 -5.00 118.70 112.77 2qta s GLU 694 Ca 0.34 -0.54 -0.22 0.00 0.36 0.00 0.00 54.97 54.90 2qta s GLU 694 Cb 0.22 -3.00 -0.07 0.00 0.26 0.00 0.00 34.13 31.55 2qta s GLU 694 CO 0.16 0.06 0.67 -0.80 -0.54 0.00 0.00 175.26 174.81 2qta s ASN 695 N 0.84 7.20 0.34 -1.70 0.01 -1.26 -4.13 114.94 116.24 2qta s ASN 695 Ca -0.00 1.42 -0.15 0.00 -0.71 0.00 0.00 52.86 53.42 2qta s ASN 695 Cb -0.14 -2.42 0.04 0.00 0.41 0.00 0.00 41.25 39.13 2qta s ASN 695 CO 0.02 0.21 0.71 -0.72 -1.51 0.00 0.00 177.10 175.81 2qta s TYR 696 N -0.95 0.16 0.22 2.20 -0.85 -0.48 -4.85 117.35 112.80 2qta s TYR 696 Ca 0.33 -0.71 -0.30 0.00 -0.52 0.00 0.00 57.07 55.86 2qta s TYR 696 Cb -0.21 0.66 -0.10 0.00 0.38 0.00 0.00 41.96 42.69 2qta s TYR 696 CO 0.22 -1.40 1.47 -1.58 -1.52 0.00 0.00 175.55 172.74 2qta s HIS 697 N -2.94 3.04 -0.37 -3.49 5.65 -1.26 -2.56 115.29 113.35 2qta s HIS 697 Ca 0.16 0.93 -0.03 0.00 0.25 0.00 0.00 55.06 56.38 2qta s HIS 697 Cb -0.05 -3.84 0.09 0.00 -1.18 0.00 0.00 32.58 27.61 2qta s HIS 697 CO 0.11 -2.82 0.14 -1.64 -0.65 0.00 0.00 174.74 169.88 2qta s MET 698 N 0.06 2.18 0.87 2.88 1.00 -1.26 -4.98 119.30 120.05 2qta s MET 698 Ca 0.62 -1.61 -0.12 0.00 0.00 0.00 0.00 55.69 54.58 2qta s MET 698 Cb -0.42 -3.47 0.12 0.00 0.00 0.00 0.00 34.83 31.06 2qta s MET 698 CO 0.40 -0.91 1.11 -1.25 0.00 0.00 0.00 175.02 174.36 2qta s PRO 699 N 1.20 1.44 0.58 2.03 0.04 -1.26 -1.29 135.00 137.75 2qta s PRO 699 Ca 0.04 0.56 -0.15 0.00 0.04 0.00 0.00 61.00 61.48 2qta s PRO 699 Cb -0.22 -1.85 -0.04 0.00 0.04 0.00 0.00 34.50 32.43 2qta s PRO 699 CO -0.03 -2.05 1.04 0.00 0.04 0.00 0.00 177.00 176.00 2qta s ALA 700 N -3.13 2.85 0.28 8.56 0.00 -1.26 -4.42 121.76 124.65 2qta s ALA 700 Ca 0.63 0.26 -0.29 0.00 0.00 0.00 0.00 51.96 52.56 2qta s ALA 700 Cb -0.16 -3.18 -0.10 0.00 0.00 0.00 0.00 23.12 19.68 2qta s ALA 700 CO 0.55 -0.69 1.31 1.41 0.00 0.00 0.00 175.76 178.35 2qta s MET 701 N -4.27 4.37 0.35 0.00 1.75 0.05 -4.89 119.30 116.66 2qta s MET 701 Ca 0.61 2.16 -0.28 0.00 -1.25 0.00 0.00 55.69 56.93 2qta s MET 701 Cb -0.14 -3.11 -0.10 0.00 2.84 0.00 0.00 34.83 34.32 2qta s MET 701 CO 0.39 -0.21 1.27 -2.14 -0.65 0.00 0.00 175.02 173.68 2qta s PRO 702 N -1.15 4.27 0.29 4.11 0.02 -1.26 -4.93 135.00 136.35 2qta s PRO 702 Ca 0.52 2.13 -0.30 0.00 0.02 0.00 0.00 61.00 63.37 2qta s PRO 702 Cb -0.39 -2.98 -0.12 0.00 0.02 0.00 0.00 34.50 31.03 2qta s PRO 702 CO 0.47 -0.23 1.49 -1.91 -0.33 0.00 0.00 177.00 176.49 2qta n GLU 703 N 0.62 2.43 -0.96 5.54 2.13 -1.26 -2.10 120.64 127.03 2qta n GLU 703 Ca 0.01 0.86 0.00 0.00 0.66 0.00 0.00 57.16 58.69 2qta n GLU 703 Cb 0.43 -2.58 0.00 0.00 0.27 0.00 0.00 31.44 29.56 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 1.82 0.61 0.02 8.31 0.00 -1.26 -4.91 105.19 109.78 2qta n GLY 704 Ca 0.08 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.24 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 1.00 2.57 -0.10 4.61 0.00 -0.89 -4.40 120.51 123.29 2qta n ALA 705 Ca 0.00 -0.17 -0.06 0.00 0.00 0.00 0.00 53.44 53.21 2qta n ALA 705 Cb 0.04 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.08 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 0.10 -0.13 -0.43 0.00 3.07 -1.91 -1.05 114.58 114.22 2qta h GLU 706 Ca 0.00 0.01 -0.08 0.00 -0.50 0.00 0.00 59.36 58.79 2qta h GLU 706 Cb 0.40 0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 28.32 2qta h GLU 706 CO 0.00 -0.09 -0.07 1.49 -1.40 0.00 0.00 179.01 178.94 2qta h GLU 707 N -0.14 0.74 -0.32 2.33 4.57 -2.00 -1.86 114.58 117.90 2qta h GLU 707 Ca 0.18 -0.23 -0.04 0.00 -1.18 0.00 0.00 59.36 58.10 2qta h GLU 707 Cb 0.42 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.92 2qta h GLU 707 CO -0.46 0.81 0.03 0.78 -1.18 0.00 0.00 179.01 178.99 2qta h GLY 708 N 0.97 0.52 0.96 1.92 0.00 -1.68 0.34 103.07 106.09 2qta h GLY 708 Ca 0.12 -0.28 -0.06 0.00 0.00 0.00 0.00 47.33 47.11 2qta h GLY 708 CO 0.03 0.27 0.03 -2.22 0.00 0.00 0.00 176.54 174.64 2qta h ILE 709 N 0.47 1.25 -0.47 2.60 2.04 -0.43 -1.07 117.51 121.90 2qta h ILE 709 Ca 0.11 -0.97 -0.06 0.00 1.00 0.00 0.00 64.86 64.94 2qta h ILE 709 Cb 0.26 1.05 -0.02 0.00 -0.74 0.00 0.00 36.82 37.37 2qta h ILE 709 CO 0.00 0.33 0.06 0.03 0.00 0.00 0.00 178.15 178.57 2qta h ARG 710 N 0.57 0.79 0.00 2.37 3.08 -0.67 -3.15 114.38 117.37 2qta h ARG 710 Ca 0.12 -0.22 -0.11 0.00 0.07 0.00 0.00 59.98 59.84 2qta h ARG 710 Cb 0.44 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.39 2qta h ARG 710 CO 0.02 0.81 -0.52 0.87 -1.07 0.00 0.00 179.97 180.08 2qta h LYS 711 N 0.65 0.00 0.00 0.04 1.79 -0.25 -3.48 116.57 115.33 2qta h LYS 711 Ca 0.14 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.61 2qta h LYS 711 Cb 0.42 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.07 2qta h LYS 711 CO 0.01 0.52 0.00 0.41 -1.08 0.00 0.00 179.45 179.31 2qta n GLY 712 N 0.09 1.31 3.54 3.86 0.00 -0.49 -4.37 105.19 109.13 2qta n GLY 712 Ca -0.01 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.84 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 -1.01 0.00 0.04 -0.61 2.07 -0.69 0.12 121.20 121.12 2qta s ILE 713 Ca 0.00 0.00 -0.25 0.00 -1.41 0.00 0.00 60.65 58.99 2qta s ILE 713 Cb 0.00 -1.00 0.06 0.00 0.13 0.00 0.00 42.46 41.65 2qta s ILE 713 CO 0.00 0.00 0.59 -0.72 -1.91 0.00 0.00 174.94 172.90 2qta s TYR 714 N -0.97 -0.53 -0.15 3.50 1.13 -1.14 -4.56 117.35 114.62 2qta s TYR 714 Ca -0.08 0.67 -0.27 0.00 -1.41 0.00 0.00 57.07 55.97 2qta s TYR 714 Cb -0.01 0.41 -0.01 0.00 -1.10 0.00 0.00 41.96 41.25 2qta s TYR 714 CO 0.08 -0.68 0.90 0.21 -2.51 0.00 0.00 175.55 173.55 2qta s LYS 715 N -2.30 4.34 -0.13 -3.49 2.20 -1.26 -2.62 119.74 116.48 2qta s LYS 715 Ca -0.06 1.16 -0.28 0.00 -0.36 0.00 0.00 55.97 56.43 2qta s LYS 715 Cb -0.01 -3.57 -0.26 0.00 -1.51 0.00 0.00 37.83 32.49 2qta s LYS 715 CO -0.00 -0.34 0.80 -0.07 -0.36 0.00 0.00 175.35 175.38 2qta h LEU 716 N 8.28 0.05 -7.64 5.43 3.38 -0.38 -3.48 115.31 120.95 2qta h LEU 716 Ca -0.29 -0.98 0.19 0.00 0.09 0.00 0.00 57.88 56.89 2qta h LEU 716 Cb 1.13 -0.01 -0.08 0.00 0.09 0.00 0.00 40.66 41.78 2qta h LEU 716 CO 0.85 1.02 0.50 -1.83 0.09 0.00 0.00 178.44 179.08 2qta s GLU 717 N -2.31 1.15 -0.06 1.13 -1.05 -1.19 -5.03 118.70 111.35 2qta s GLU 717 Ca -0.18 -0.63 0.03 0.00 -0.15 0.00 0.00 54.97 54.03 2qta s GLU 717 Cb -0.02 0.39 0.01 0.00 -0.44 0.00 0.00 34.13 34.06 2qta s GLU 717 CO 0.70 -0.53 -0.14 0.99 0.95 0.00 0.00 175.26 177.24 2qta s THR 718 N -3.23 1.24 -0.12 1.83 2.01 -1.26 -1.02 115.64 115.07 2qta s THR 718 Ca 0.12 -0.57 0.00 0.00 0.31 0.00 0.00 61.69 61.56 2qta s THR 718 Cb -0.01 -1.10 -0.02 0.00 0.01 0.00 0.00 72.50 71.38 2qta s THR 718 CO 0.02 0.37 -0.13 -0.63 -0.69 0.00 0.00 174.62 173.56 2qta s ILE 719 N 0.40 3.07 0.53 1.82 1.01 0.69 -4.97 121.20 123.74 2qta s ILE 719 Ca -0.10 -0.66 -0.18 0.00 0.00 0.00 0.00 60.65 59.71 2qta s ILE 719 Cb -0.14 -2.28 -0.07 0.00 0.01 0.00 0.00 42.46 39.99 2qta s ILE 719 CO 0.03 0.53 1.03 -1.61 0.00 0.00 0.00 174.94 174.92 2qta s GLU 720 N 0.27 3.66 -0.29 2.79 0.41 -1.26 -1.27 118.70 123.01 2qta s GLU 720 Ca -0.09 1.20 -0.20 0.00 -0.41 0.00 0.00 54.97 55.46 2qta s GLU 720 Cb -0.16 -2.08 0.16 0.00 -1.78 0.00 0.00 34.13 30.27 2qta s GLU 720 CO 0.05 -0.52 1.10 0.20 -0.49 0.00 0.00 175.26 175.60 2qta s GLY 721 N -2.54 0.10 0.00 -1.39 0.00 -1.26 -4.31 107.32 97.92 2qta s GLY 721 Ca 0.64 3.17 0.23 0.00 0.00 0.00 0.00 44.72 48.76 2qta s GLY 721 CO 0.29 2.30 1.16 -1.14 0.00 0.00 0.00 173.10 175.71 2qta n SER 722 N 2.86 1.35 -0.08 1.64 3.41 -0.70 -4.03 113.62 118.08 2qta n SER 722 Ca -0.15 -1.09 0.11 0.00 -0.26 0.00 0.00 58.87 57.47 2qta n SER 722 Cb 0.57 0.54 0.06 0.00 -0.26 0.00 0.00 64.21 65.12 2qta n SER 722 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2qta n LYS 723 N -0.76 0.21 0.00 4.33 5.02 0.54 -5.02 118.16 122.48 2qta n LYS 723 Ca 0.08 -0.16 0.00 0.00 -2.02 0.00 0.00 58.31 56.21 2qta n LYS 723 Cb 0.39 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.90 2qta n LYS 723 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2qta n GLY 724 N 1.48 -0.04 3.10 0.72 0.00 -1.24 -4.88 105.19 104.33 2qta n GLY 724 Ca 0.06 -0.96 -0.12 0.00 0.00 0.00 0.00 46.02 45.00 2qta n GLY 724 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2qta s LYS 725 N -2.00 0.25 0.27 1.61 2.47 -1.26 -1.40 119.74 119.68 2qta s LYS 725 Ca 0.00 0.55 0.02 0.00 -1.56 0.00 0.00 55.97 54.98 2qta s LYS 725 Cb 0.00 -0.07 -0.04 0.00 -1.46 0.00 0.00 37.83 36.25 2qta s LYS 725 CO 0.00 -0.15 0.12 0.14 0.16 0.00 0.00 175.35 175.63 2qta s VAL 726 N 1.15 0.40 -0.01 4.02 -7.23 -0.70 -4.25 120.40 113.78 2qta s VAL 726 Ca -0.08 -2.00 0.08 0.00 -1.81 0.00 0.00 61.98 58.16 2qta s VAL 726 Cb -0.09 -2.57 -0.02 0.00 0.56 0.00 0.00 36.38 34.25 2qta s VAL 726 CO -0.08 0.00 -0.25 -1.10 -0.31 0.00 0.00 175.10 173.36 2qta s GLN 727 N -3.97 2.10 -0.09 4.82 -0.21 0.67 -1.80 119.66 121.18 2qta s GLN 727 Ca 0.37 -0.93 0.01 0.00 0.02 0.00 0.00 55.36 54.83 2qta s GLN 727 Cb 0.07 -2.07 0.02 0.00 1.00 0.00 0.00 33.01 32.03 2qta s GLN 727 CO 0.15 0.56 -0.11 -0.51 -2.12 0.00 0.00 175.29 173.26 2qta s LEU 728 N -0.72 1.52 -0.00 2.90 1.43 0.69 -1.06 118.68 123.44 2qta s LEU 728 Ca 0.10 -0.32 0.08 0.00 -1.03 0.00 0.00 54.13 52.97 2qta s LEU 728 Cb -0.10 -0.87 -0.02 0.00 0.03 0.00 0.00 46.19 45.23 2qta s LEU 728 CO -0.00 -0.02 -0.25 -0.76 0.23 0.00 0.00 176.35 175.55 2qta s LEU 729 N 1.03 2.08 0.16 1.79 1.02 0.36 -0.78 118.68 124.34 2qta s LEU 729 Ca -0.07 -0.48 -0.10 0.00 0.02 0.00 0.00 54.13 53.49 2qta s LEU 729 Cb -0.15 -1.26 -0.00 0.00 0.02 0.00 0.00 46.19 44.80 2qta s LEU 729 CO -0.01 0.29 0.31 -0.83 0.02 0.00 0.00 176.35 176.13 2qta s GLY 730 N -0.74 0.33 0.19 -3.19 0.00 -0.92 -1.66 107.32 101.32 2qta s GLY 730 Ca 0.10 -0.73 -0.06 0.00 0.00 0.00 0.00 44.72 44.02 2qta s GLY 730 CO -0.00 -0.74 0.25 -1.35 0.00 0.00 0.00 173.10 171.26 2qta s SER 731 N -2.94 0.08 0.52 1.64 1.04 -1.24 -0.88 113.70 111.93 2qta s SER 731 Ca 0.14 -1.09 0.00 0.00 0.48 0.00 0.00 55.95 55.48 2qta s SER 731 Cb 0.03 0.43 0.00 0.00 0.10 0.00 0.00 66.02 66.58 2qta s SER 731 CO -0.02 -0.91 0.00 0.61 0.98 0.00 0.00 173.24 173.90 2qta n GLY 732 N -0.25 2.04 0.10 7.32 0.00 -0.20 -2.05 105.19 112.14 2qta n GLY 732 Ca -0.03 -0.35 0.11 0.00 0.00 0.00 0.00 46.02 45.75 2qta n GLY 732 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2qta n SER 733 N -0.72 0.56 0.12 1.61 3.41 -1.26 -3.05 113.62 114.29 2qta n SER 733 Ca 0.00 0.61 0.12 0.00 -0.26 0.00 0.00 58.87 59.34 2qta n SER 733 Cb 0.00 -0.74 0.12 0.00 -0.26 0.00 0.00 64.21 63.33 2qta n SER 733 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 2qta h ILE 734 N 0.00 0.00 -0.86 -1.33 1.08 -1.74 -3.34 117.51 111.32 2qta h ILE 734 Ca 0.00 -0.82 0.10 0.00 -0.39 0.00 0.00 64.86 63.75 2qta h ILE 734 Cb 0.42 1.51 -0.08 0.00 -3.07 0.00 0.00 36.82 35.60 2qta h ILE 734 CO 0.00 0.00 0.49 0.25 -0.69 0.00 0.00 178.15 178.20 2qta h LEU 735 N 0.00 0.70 -2.01 1.44 5.85 -1.41 0.11 115.31 119.99 2qta h LEU 735 Ca 0.00 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.76 2qta h LEU 735 Cb 0.91 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.86 2qta h LEU 735 CO 0.00 0.39 -0.07 0.08 -0.34 0.00 0.00 178.44 178.50 2qta h ARG 736 N 0.81 0.00 0.01 1.25 0.11 -1.81 0.07 114.38 114.82 2qta h ARG 736 Ca 0.42 0.00 -0.22 0.00 0.10 0.00 0.00 59.98 60.28 2qta h ARG 736 Cb 0.41 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.46 2qta h ARG 736 CO -0.26 0.07 -1.09 0.45 0.10 0.00 0.00 179.97 179.24 2qta h HIS 737 N 0.00 0.05 -0.51 4.08 3.86 -1.07 -1.86 115.15 119.69 2qta h HIS 737 Ca -0.00 -0.03 -0.12 0.00 -1.16 0.00 0.00 60.37 59.05 2qta h HIS 737 Cb 0.32 -0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.77 2qta h HIS 737 CO 0.00 1.03 -0.16 0.28 0.86 0.00 0.00 177.93 179.94 2qta h VAL 738 N 0.01 1.27 -0.53 2.45 2.07 0.35 -1.20 116.25 120.67 2qta h VAL 738 Ca -0.05 -1.32 -0.05 0.00 0.82 0.00 0.00 66.70 66.10 2qta h VAL 738 Cb 1.81 1.04 -0.02 0.00 -1.52 0.00 0.00 31.29 32.60 2qta h VAL 738 CO 0.13 0.46 0.12 0.03 0.02 0.00 0.00 177.57 178.34 2qta h ARG 739 N 0.88 0.81 -0.60 1.57 3.08 -1.00 -0.54 114.38 118.57 2qta h ARG 739 Ca 0.13 -0.16 0.00 0.00 0.07 0.00 0.00 59.98 60.01 2qta h ARG 739 Cb 0.73 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.63 2qta h ARG 739 CO 0.06 0.73 0.37 1.49 -1.07 0.00 0.00 179.97 181.55 2qta h GLU 740 N 0.78 0.80 -0.97 0.04 4.81 -0.92 -2.08 114.58 117.05 2qta h GLU 740 Ca 0.17 -0.06 0.02 0.00 -0.13 0.00 0.00 59.36 59.36 2qta h GLU 740 Cb 0.29 -0.17 -0.05 0.00 0.63 0.00 0.00 28.75 29.45 2qta h GLU 740 CO -0.00 0.56 0.64 0.00 -0.73 0.00 0.00 179.01 179.48 2qta h ALA 741 N 1.20 1.25 -0.70 2.92 0.00 -0.31 -0.99 119.26 122.63 2qta h ALA 741 Ca 0.22 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.11 2qta h ALA 741 Cb -0.05 -0.37 -0.05 0.00 0.00 0.00 0.00 17.79 17.32 2qta h ALA 741 CO -0.04 0.58 0.42 0.00 0.00 0.00 0.00 179.25 180.21 2qta h ALA 742 N 1.37 0.92 -0.36 0.00 0.00 -0.53 0.69 119.26 121.35 2qta h ALA 742 Ca 0.37 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 55.18 2qta h ALA 742 Cb -0.10 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 2qta h ALA 742 CO -0.09 0.16 -0.11 0.93 0.00 0.00 0.00 179.25 180.14 2qta h GLU 743 N 0.80 0.71 -0.47 0.00 4.39 -0.71 -2.42 114.58 116.88 2qta h GLU 743 Ca 0.29 -0.28 -0.00 0.00 0.34 0.00 0.00 59.36 59.71 2qta h GLU 743 Cb 0.09 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.68 2qta h GLU 743 CO -0.14 0.87 0.29 0.82 -1.16 0.00 0.00 179.01 179.69 2qta h ILE 744 N 0.50 1.14 -0.63 3.13 2.04 -0.80 -0.05 117.51 122.84 2qta h ILE 744 Ca 0.09 -0.32 0.02 0.00 1.00 0.00 0.00 64.86 65.65 2qta h ILE 744 Cb 0.62 0.51 -0.04 0.00 -0.74 0.00 0.00 36.82 37.17 2qta h ILE 744 CO 0.04 0.14 0.40 -0.07 0.00 0.00 0.00 178.15 178.66 2qta h LEU 745 N 0.63 0.66 -0.08 1.44 3.38 -0.78 0.18 115.31 120.74 2qta h LEU 745 Ca 0.17 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.10 2qta h LEU 745 Cb -0.01 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.59 2qta h LEU 745 CO -0.03 0.47 -0.09 0.00 0.09 0.00 0.00 178.44 178.87 2qta h ALA 746 N 1.26 0.12 0.02 1.53 0.00 -0.91 -0.24 119.26 121.04 2qta h ALA 746 Ca 0.25 -0.30 -0.23 0.00 0.00 0.00 0.00 54.91 54.62 2qta h ALA 746 Cb -0.02 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2qta h ALA 746 CO -0.09 -0.04 -0.98 0.87 0.00 0.00 0.00 179.25 179.01 2qta h LYS 747 N -0.23 0.39 0.00 0.00 1.57 -0.89 -2.22 116.57 115.18 2qta h LYS 747 Ca 0.01 -0.44 -0.06 0.00 -1.87 0.00 0.00 60.65 58.29 2qta h LYS 747 Cb 0.63 0.13 -0.01 0.00 0.08 0.00 0.00 32.23 33.06 2qta h LYS 747 CO 0.02 1.12 -1.86 -0.25 -0.57 0.00 0.00 179.45 177.91 2qta n ASP 748 N -3.72 0.19 0.00 0.86 8.00 0.63 -4.58 116.55 117.93 2qta n ASP 748 Ca -0.07 0.08 0.00 0.00 0.71 0.00 0.00 54.79 55.51 2qta n ASP 748 Cb 0.86 1.50 0.00 0.00 -0.02 0.00 0.00 41.12 43.46 2qta n ASP 748 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2qta n TYR 749 N -2.43 0.00 -1.45 1.24 4.02 -0.40 -4.99 117.16 113.14 2qta n TYR 749 Ca -0.08 0.00 -0.16 0.00 -0.01 0.00 0.00 57.90 57.66 2qta n TYR 749 Cb 0.67 0.00 -0.07 0.00 -0.02 0.00 0.00 39.34 39.92 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 1.57 3.59 2.72 0.00 -0.59 -4.69 105.19 107.86 2qta n GLY 750 Ca 0.00 -0.27 -0.40 0.00 0.00 0.00 0.00 46.02 45.35 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 -2.57 5.12 0.73 1.61 1.01 -0.24 -0.34 120.40 125.72 2qta s VAL 751 Ca 0.00 0.51 -0.09 0.00 0.00 0.00 0.00 61.98 62.40 2qta s VAL 751 Cb 0.00 -3.80 0.06 0.00 0.00 0.00 0.00 36.38 32.64 2qta s VAL 751 CO 0.00 0.02 1.07 -0.83 0.00 0.00 0.00 175.10 175.36 2qta s GLY 752 N 1.66 1.64 -0.14 4.51 0.00 -0.49 -2.09 107.32 112.40 2qta s GLY 752 Ca 0.17 -0.78 -0.22 0.00 0.00 0.00 0.00 44.72 43.88 2qta s GLY 752 CO 0.11 -0.35 0.57 -1.35 0.00 0.00 0.00 173.10 172.07 2qta s SER 753 N -4.52 -0.56 -0.09 1.64 1.04 -0.40 -1.72 113.70 109.09 2qta s SER 753 Ca 0.60 0.89 -0.21 0.00 0.48 0.00 0.00 55.95 57.71 2qta s SER 753 Cb -0.11 0.89 -0.04 0.00 0.10 0.00 0.00 66.02 66.86 2qta s SER 753 CO 0.47 -0.35 0.60 -1.81 0.98 0.00 0.00 173.24 173.12 2qta s ASP 754 N -0.35 6.86 -0.18 7.02 1.01 -0.75 -0.22 116.67 130.06 2qta s ASP 754 Ca -0.05 1.03 -0.03 0.00 0.71 0.00 0.00 52.55 54.20 2qta s ASP 754 Cb -0.03 -2.36 -0.02 0.00 1.01 0.00 0.00 42.92 41.52 2qta s ASP 754 CO 0.04 -0.06 -0.05 -0.69 0.21 0.00 0.00 175.17 174.63 2qta s VAL 755 N 0.68 3.60 -0.08 -1.27 1.01 -0.19 -0.22 120.40 123.92 2qta s VAL 755 Ca 0.32 -0.44 0.03 0.00 0.00 0.00 0.00 61.98 61.89 2qta s VAL 755 Cb -0.17 -2.60 -0.02 0.00 0.00 0.00 0.00 36.38 33.60 2qta s VAL 755 CO 0.15 0.46 -0.17 -0.31 0.00 0.00 0.00 175.10 175.23 2qta s TYR 756 N 0.84 2.67 -0.31 5.22 1.51 0.04 0.43 117.35 127.75 2qta s TYR 756 Ca -0.01 -0.53 -0.26 0.00 -1.01 0.00 0.00 57.07 55.26 2qta s TYR 756 Cb -0.15 -1.71 0.01 0.00 -0.11 0.00 0.00 41.96 40.00 2qta s TYR 756 CO 0.01 -0.10 0.93 0.45 -1.11 0.00 0.00 175.55 175.74 2qta s SER 757 N -0.12 6.81 -0.52 2.29 0.15 -1.08 -2.16 113.70 119.08 2qta s SER 757 Ca -0.02 0.88 -0.18 0.00 0.70 0.00 0.00 55.95 57.33 2qta s SER 757 Cb -0.14 -2.48 0.07 0.00 -1.71 0.00 0.00 66.02 61.76 2qta s SER 757 CO 0.04 -0.74 0.60 -0.69 1.20 0.00 0.00 173.24 173.65 2qta s VAL 758 N 3.28 4.92 -0.40 4.45 1.01 -0.06 -2.87 120.40 130.74 2qta s VAL 758 Ca 0.39 -0.68 0.23 0.00 0.00 0.00 0.00 61.98 61.91 2qta s VAL 758 Cb -0.13 -4.31 0.32 0.00 0.00 0.00 0.00 36.38 32.26 2qta s VAL 758 CO 0.13 -0.83 1.61 0.71 0.00 0.00 0.00 175.10 176.72 2qta h THR 759 N 5.86 0.08 -1.11 3.92 1.35 -0.61 -3.40 112.91 118.99 2qta h THR 759 Ca -0.28 -1.09 -0.08 0.00 -0.55 0.00 0.00 66.41 64.41 2qta h THR 759 Cb 1.10 2.02 -0.21 0.00 -1.73 0.00 0.00 68.15 69.33 2qta h THR 759 CO 0.98 0.04 -0.46 -0.55 -0.25 0.00 0.00 175.52 175.28 2qta s SER 760 N -6.22 -1.25 0.36 5.36 0.15 -0.93 -1.11 113.70 110.06 2qta s SER 760 Ca 0.07 -0.67 0.04 0.00 0.70 0.00 0.00 55.95 56.08 2qta s SER 760 Cb 0.05 1.83 0.69 0.00 -1.71 0.00 0.00 66.02 66.88 2qta s SER 760 CO 0.67 -0.21 2.00 -0.26 1.20 0.00 0.00 173.24 176.64 2qta h PHE 761 N 7.22 0.77 -0.48 3.44 0.04 -1.81 -2.59 116.94 123.53 2qta h PHE 761 Ca 0.04 0.02 -0.08 0.00 2.80 0.00 0.00 57.97 60.74 2qta h PHE 761 Cb 1.17 -0.26 -0.02 0.00 2.20 0.00 0.00 35.95 39.04 2qta h PHE 761 CO 0.19 0.46 -0.02 1.15 -0.60 0.00 0.00 178.31 179.49 2qta h THR 762 N 0.81 1.26 0.00 -1.55 2.02 -1.84 -0.43 112.91 113.18 2qta h THR 762 Ca 0.26 -1.10 -0.09 0.00 0.77 0.00 0.00 66.41 66.25 2qta h THR 762 Cb 0.03 1.02 -0.01 0.00 -1.74 0.00 0.00 68.15 67.45 2qta h THR 762 CO -0.07 0.38 -0.41 -0.33 0.37 0.00 0.00 175.52 175.46 2qta h GLU 763 N 0.71 0.00 -0.17 6.66 4.39 -1.75 -1.20 114.58 123.22 2qta h GLU 763 Ca 0.13 0.00 -0.19 0.00 0.34 0.00 0.00 59.36 59.64 2qta h GLU 763 Cb 0.54 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.19 2qta h GLU 763 CO 0.03 0.41 -0.67 -0.07 -1.16 0.00 0.00 179.01 177.55 2qta h LEU 764 N 0.00 0.78 -0.43 1.33 3.38 -1.16 -1.37 115.31 117.84 2qta h LEU 764 Ca -0.00 -0.47 -0.05 0.00 0.09 0.00 0.00 57.88 57.44 2qta h LEU 764 Cb 0.81 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 2qta h LEU 764 CO 0.05 1.24 0.06 0.00 0.09 0.00 0.00 178.44 179.88 2qta h ALA 765 N 0.76 0.57 -0.78 1.53 0.00 -0.74 -0.83 119.26 119.78 2qta h ALA 765 Ca -0.02 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.62 2qta h ALA 765 Cb 1.27 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.86 2qta h ALA 765 CO 0.13 0.30 0.34 0.00 0.00 0.00 0.00 179.25 180.03 2qta h ARG 766 N 0.58 1.14 -0.59 0.00 3.08 -1.17 0.88 114.38 118.29 2qta h ARG 766 Ca 0.13 -0.19 -0.03 0.00 0.07 0.00 0.00 59.98 59.97 2qta h ARG 766 Cb 0.40 -0.19 -0.03 0.00 0.08 0.00 0.00 29.97 30.22 2qta h ARG 766 CO 0.01 0.91 0.27 0.22 -1.07 0.00 0.00 179.97 180.31 2qta h ASP 767 N 1.11 0.79 -0.57 7.04 3.58 -1.06 -0.39 116.42 126.92 2qta h ASP 767 Ca 0.26 -0.14 -0.08 0.00 0.42 0.00 0.00 57.03 57.49 2qta h ASP 767 Cb 0.17 -0.20 -0.02 0.00 1.72 0.00 0.00 39.33 40.99 2qta h ASP 767 CO -0.03 0.71 0.04 1.23 -2.88 0.00 0.00 179.24 178.32 2qta h GLY 768 N 0.81 1.05 1.01 -0.78 0.00 -0.71 -0.93 103.07 103.52 2qta h GLY 768 Ca 0.20 -0.74 -0.02 0.00 0.00 0.00 0.00 47.33 46.78 2qta h GLY 768 CO -0.02 0.68 0.42 1.46 0.00 0.00 0.00 176.54 179.07 2qta h GLN 769 N 0.86 1.07 -0.54 4.80 4.20 -0.55 -1.05 115.11 123.90 2qta h GLN 769 Ca 0.17 -0.13 -0.02 0.00 0.06 0.00 0.00 58.65 58.73 2qta h GLN 769 Cb 0.49 -0.21 -0.02 0.00 0.30 0.00 0.00 27.48 28.03 2qta h GLN 769 CO 0.02 0.80 0.25 -0.44 -0.67 0.00 0.00 178.83 178.79 2qta h ASP 770 N 1.06 0.72 -0.38 1.46 3.32 -0.83 -0.35 116.42 121.42 2qta h ASP 770 Ca 0.27 -0.14 -0.02 0.00 0.02 0.00 0.00 57.03 57.16 2qta h ASP 770 Cb 0.04 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.39 2qta h ASP 770 CO -0.04 0.65 0.15 0.00 -1.72 0.00 0.00 179.24 178.28 2qta h GLU 772 N 0.47 0.91 -0.15 0.00 4.81 -1.04 -0.03 114.58 119.55 2qta h GLU 772 Ca 0.13 -0.37 -0.01 0.00 -0.13 0.00 0.00 59.36 58.98 2qta h GLU 772 Cb 0.20 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.53 2qta h GLU 772 CO -0.01 1.02 0.07 -0.09 -0.73 0.00 0.00 179.01 179.27 2qta h ARG 773 N 0.80 0.21 -0.51 1.92 2.43 -0.95 -1.46 114.38 116.81 2qta h ARG 773 Ca 0.11 -0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.21 2qta h ARG 773 Cb 0.74 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.23 2qta h ARG 773 CO 0.06 0.26 0.17 2.35 -1.51 0.00 0.00 179.97 181.30 2qta h TRP 774 N 0.11 0.81 -0.42 2.20 7.01 -1.15 -2.37 115.95 122.14 2qta h TRP 774 Ca 0.05 -0.08 0.01 0.00 2.11 0.00 0.00 58.89 60.99 2qta h TRP 774 Cb 0.12 -0.24 -0.03 0.00 -2.10 0.00 0.00 29.16 26.92 2qta h TRP 774 CO -0.03 0.70 0.26 -0.91 -2.79 0.00 0.00 178.44 175.67 2qta h ASN 775 N 0.69 0.43 1.05 2.65 2.35 -0.82 -0.82 115.58 121.11 2qta h ASN 775 Ca 0.16 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.91 2qta h ASN 775 Cb 0.26 -0.10 0.00 0.00 0.05 0.00 0.00 38.32 38.54 2qta h ASN 775 CO -0.01 0.31 0.00 0.24 -1.65 0.00 0.00 177.43 176.32 2qta h MET 776 N 0.53 0.00 0.00 0.81 2.86 -1.18 -1.77 114.93 116.18 2qta h MET 776 Ca 0.16 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.80 2qta h MET 776 Cb -0.02 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.64 2qta h MET 776 CO -0.06 0.00 -0.54 1.28 1.06 0.00 0.00 176.91 178.65 2qta n LEU 777 N -2.74 0.53 -3.09 1.22 4.77 -0.73 -4.14 117.00 112.83 2qta n LEU 777 Ca 0.02 0.07 -0.22 0.00 -0.03 0.00 0.00 56.01 55.85 2qta n LEU 777 Cb 0.31 -0.24 -0.03 0.00 -2.33 0.00 0.00 43.42 41.13 2qta n LEU 777 CO 0.26 0.07 -0.07 1.41 -1.33 0.00 0.00 177.39 177.73 2qta n HIS 778 N -1.66 1.79 0.15 -1.77 8.25 -0.39 -4.97 115.22 116.62 2qta n HIS 778 Ca 0.05 -3.89 0.19 0.00 -0.26 0.00 0.00 57.72 53.80 2qta n HIS 778 Cb 0.36 -0.45 0.75 0.00 1.12 0.00 0.00 29.99 31.78 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 2.99 0.00 0.00 -0.41 0.13 -1.62 -1.95 132.00 131.15 2qta h PRO 779 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 2qta h PRO 779 Cb 0.77 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.90 2qta h PRO 779 CO 0.63 0.00 -0.98 1.28 -0.23 0.00 0.00 178.00 178.70 2qta n LEU 780 N -3.51 0.62 -4.94 1.56 7.99 -1.26 -4.97 117.00 112.49 2qta n LEU 780 Ca 0.05 -0.02 -0.24 0.00 -0.01 0.00 0.00 56.01 55.79 2qta n LEU 780 Cb 0.58 -0.11 0.03 0.00 -0.11 0.00 0.00 43.42 43.82 2qta n LEU 780 CO 0.24 0.05 0.43 -1.61 -1.51 0.00 0.00 177.39 174.99 2qta s GLU 781 N -3.18 2.73 -0.06 3.23 2.02 -0.73 -5.00 118.70 117.71 2qta s GLU 781 Ca 0.04 -0.39 -0.32 0.00 0.02 0.00 0.00 54.97 54.33 2qta s GLU 781 Cb 0.15 -2.39 -0.10 0.00 0.10 0.00 0.00 34.13 31.89 2qta s GLU 781 CO 0.79 -0.68 1.99 2.41 0.02 0.00 0.00 175.26 179.80 2qta n THR 782 N -2.43 0.62 -1.70 3.63 -1.04 -1.26 -4.92 114.28 107.17 2qta n THR 782 Ca 0.05 -0.18 -0.33 0.00 -2.04 0.00 0.00 64.05 61.55 2qta n THR 782 Cb 0.59 -2.17 0.05 0.00 -1.82 0.00 0.00 70.33 66.98 2qta n THR 782 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 2qta s PRO 783 N 4.69 2.71 0.02 -2.82 0.02 -1.26 -5.02 135.00 133.34 2qta s PRO 783 Ca 0.93 1.41 -0.18 0.00 0.02 0.00 0.00 61.00 63.18 2qta s PRO 783 Cb -0.53 -1.94 -0.06 0.00 0.02 0.00 0.00 34.50 31.99 2qta s PRO 783 CO 0.45 -1.32 0.53 1.03 -0.33 0.00 0.00 177.00 177.36 2qta s ARG 784 N -4.12 4.17 -0.22 5.54 0.52 -1.26 -5.07 118.95 118.52 2qta s ARG 784 Ca 0.67 0.63 -0.09 0.00 -0.52 0.00 0.00 55.73 56.43 2qta s ARG 784 Cb -0.21 -3.28 -0.04 0.00 0.52 0.00 0.00 34.95 31.94 2qta s ARG 784 CO 0.42 0.55 0.11 0.08 0.02 0.00 0.00 175.30 176.48 2qta s VAL 785 N -0.74 4.99 0.29 3.52 1.01 -1.26 -4.78 120.40 123.43 2qta s VAL 785 Ca 0.28 0.05 -0.29 0.00 0.00 0.00 0.00 61.98 62.02 2qta s VAL 785 Cb -0.18 -3.30 -0.13 0.00 0.00 0.00 0.00 36.38 32.76 2qta s VAL 785 CO 0.16 0.39 1.23 -2.65 0.00 0.00 0.00 175.10 174.23 2qta n PRO 786 N 4.09 1.83 -0.28 2.72 -0.02 -1.26 -4.86 135.00 137.22 2qta n PRO 786 Ca -0.16 0.64 0.06 0.00 -2.02 0.00 0.00 63.50 62.02 2qta n PRO 786 Cb 0.52 -2.18 0.20 0.00 -0.02 0.00 0.00 33.50 32.02 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 2.83 0.70 -0.32 6.00 3.20 -1.89 0.08 116.97 127.58 2qta h TYR 787 Ca -0.44 0.03 0.01 0.00 3.14 0.00 0.00 58.73 61.47 2qta h TYR 787 Cb 1.30 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 39.37 2qta h TYR 787 CO 0.51 0.18 0.21 0.97 -1.64 0.00 0.00 178.16 178.39 2qta h ILE 788 N 0.59 1.06 0.00 1.81 2.10 -1.89 -0.69 117.51 120.50 2qta h ILE 788 Ca 0.43 -0.14 0.00 0.00 1.08 0.00 0.00 64.86 66.23 2qta h ILE 788 Cb 0.58 0.63 0.00 0.00 -1.09 0.00 0.00 36.82 36.94 2qta h ILE 788 CO -0.35 0.07 0.00 0.00 -1.08 0.00 0.00 178.15 176.80 2qta h ALA 789 N 1.81 1.00 -0.01 0.18 0.00 -1.16 -0.84 119.26 120.24 2qta h ALA 789 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2qta h ALA 789 Cb -0.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2qta h ALA 789 CO -0.03 0.00 -0.22 1.04 0.00 0.00 0.00 179.25 180.04 2qta n GLN 790 N -2.47 0.93 -0.06 0.00 6.02 -0.28 -4.28 117.38 117.24 2qta n GLN 790 Ca 0.03 -0.54 -0.11 0.00 -0.01 0.00 0.00 57.00 56.37 2qta n GLN 790 Cb 0.31 -1.49 -0.05 0.00 1.02 0.00 0.00 30.24 30.03 2qta n GLN 790 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 2qta n VAL 791 N -0.56 0.64 -2.53 5.09 0.31 -0.86 -5.05 118.33 115.37 2qta n VAL 791 Ca 0.13 -0.19 -0.28 0.00 -0.01 0.00 0.00 64.34 63.99 2qta n VAL 791 Cb 0.35 -1.38 0.00 0.00 -0.91 0.00 0.00 33.84 31.90 2qta n VAL 791 CO 0.00 0.00 0.00 -0.04 -1.32 0.00 0.00 176.83 175.47 2qta s MET 792 N -2.22 3.48 0.00 5.55 -1.94 -0.38 -4.94 119.30 118.85 2qta s MET 792 Ca -0.16 0.23 0.00 0.00 -1.71 0.00 0.00 55.69 54.06 2qta s MET 792 Cb 0.05 -2.33 0.00 0.00 2.01 0.00 0.00 34.83 34.56 2qta s MET 792 CO 0.22 -0.30 0.00 0.27 -0.01 0.00 0.00 175.02 175.20 2qta n ASN 793 N -2.35 1.18 -1.13 3.03 0.23 -1.26 -4.80 115.26 110.16 2qta n ASN 793 Ca 0.02 0.00 0.12 0.00 -0.53 0.00 0.00 54.58 54.19 2qta n ASN 793 Cb 0.55 0.00 0.19 0.00 -2.08 0.00 0.00 39.78 38.45 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 0.00 3.39 -4.77 0.53 5.75 -1.25 -3.97 116.55 116.23 2qta n ASP 794 Ca 0.00 -2.00 -0.36 0.00 -0.01 0.00 0.00 54.79 52.42 2qta n ASP 794 Cb 0.00 -0.20 0.01 0.00 -1.03 0.00 0.00 41.12 39.90 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 -1.60 2.74 0.21 2.12 0.00 -1.26 -4.34 121.76 119.63 2qta s ALA 795 Ca 0.37 0.94 -0.32 0.00 0.00 0.00 0.00 51.96 52.95 2qta s ALA 795 Cb 0.22 -3.41 -0.14 0.00 0.00 0.00 0.00 23.12 19.79 2qta s ALA 795 CO 0.32 -0.89 1.28 -0.35 0.00 0.00 0.00 175.76 176.12 2qta n PRO 796 N -1.13 1.62 -4.40 0.00 -0.04 -1.26 -4.45 135.00 125.34 2qta n PRO 796 Ca 0.11 0.58 -0.29 0.00 -0.04 0.00 0.00 63.50 63.85 2qta n PRO 796 Cb 0.49 -2.15 -0.13 0.00 -0.04 0.00 0.00 33.50 31.68 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 -0.16 2.48 -0.03 0.55 0.00 -0.49 -0.24 121.76 123.87 2qta s ALA 797 Ca 0.70 -1.41 0.02 0.00 0.00 0.00 0.00 51.96 51.27 2qta s ALA 797 Cb -0.74 -0.49 0.01 0.00 0.00 0.00 0.00 23.12 21.90 2qta s ALA 797 CO 0.51 0.56 -0.09 0.08 0.00 0.00 0.00 175.76 176.82 2qta s VAL 798 N -1.07 0.82 0.08 0.00 1.01 -0.23 -0.79 120.40 120.23 2qta s VAL 798 Ca 0.15 -0.37 0.08 0.00 0.00 0.00 0.00 61.98 61.85 2qta s VAL 798 Cb -0.10 -0.74 -0.03 0.00 0.00 0.00 0.00 36.38 35.50 2qta s VAL 798 CO 0.07 0.26 -0.22 0.00 0.00 0.00 0.00 175.10 175.21 2qta s ALA 799 N 0.30 1.93 -0.08 5.51 0.00 -0.17 -0.48 121.76 128.76 2qta s ALA 799 Ca -0.05 -1.22 -0.06 0.00 0.00 0.00 0.00 51.96 50.63 2qta s ALA 799 Cb -0.10 -0.32 0.03 0.00 0.00 0.00 0.00 23.12 22.73 2qta s ALA 799 CO 0.01 0.42 0.20 0.45 0.00 0.00 0.00 175.76 176.84 2qta s SER 800 N -1.62 -0.21 0.28 0.00 0.15 -0.66 -0.46 113.70 111.17 2qta s SER 800 Ca 0.09 0.42 -0.01 0.00 0.70 0.00 0.00 55.95 57.14 2qta s SER 800 Cb -0.10 0.37 -0.02 0.00 -1.71 0.00 0.00 66.02 64.56 2qta s SER 800 CO 0.03 -0.11 0.32 0.42 1.20 0.00 0.00 173.24 175.11 2qta s THR 801 N 0.59 0.00 -1.87 6.45 -4.23 -1.23 -3.61 115.64 111.74 2qta s THR 801 Ca -0.04 -1.79 0.07 0.00 -1.18 0.00 0.00 61.69 58.75 2qta s THR 801 Cb -0.05 -2.49 0.21 0.00 1.34 0.00 0.00 72.50 71.51 2qta s THR 801 CO -0.03 0.00 1.14 -0.67 -0.54 0.00 0.00 174.62 174.52 2qta n ASP 802 N -0.91 1.38 -4.45 3.99 2.03 -1.26 -4.25 116.55 113.08 2qta n ASP 802 Ca 0.02 -2.03 -0.23 0.00 0.52 0.00 0.00 54.79 53.07 2qta n ASP 802 Cb 0.63 -0.20 -0.10 0.00 -0.72 0.00 0.00 41.12 40.73 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 -1.67 2.20 0.84 -0.67 1.51 -1.26 -1.91 117.35 116.38 2qta s TYR 803 Ca 0.16 -0.37 -0.13 0.00 -1.01 0.00 0.00 57.07 55.72 2qta s TYR 803 Cb 0.09 -0.96 0.05 0.00 -0.11 0.00 0.00 41.96 41.02 2qta s TYR 803 CO 0.10 0.66 0.82 0.00 -1.11 0.00 0.00 175.55 176.02 2qta n MET 804 N -0.56 0.01 0.08 -0.62 0.00 0.28 -2.29 117.12 114.02 2qta n MET 804 Ca -0.06 0.07 0.10 0.00 0.00 0.00 0.00 57.70 57.81 2qta n MET 804 Cb 0.60 -2.13 0.57 0.00 0.00 0.00 0.00 33.22 32.26 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 -1.06 0.21 -0.24 3.17 1.57 -1.85 -0.07 116.57 118.30 2qta h LYS 805 Ca -0.45 -0.01 0.07 0.00 -1.87 0.00 0.00 60.65 58.39 2qta h LYS 805 Cb 1.30 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 33.55 2qta h LYS 805 CO 0.41 0.14 0.19 1.25 -0.57 0.00 0.00 179.45 180.88 2qta h LEU 806 N 0.22 0.00 -0.85 2.94 5.85 -1.95 -0.54 115.31 120.97 2qta h LEU 806 Ca 0.14 0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.87 2qta h LEU 806 Cb 0.28 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.27 2qta h LEU 806 CO -0.03 0.00 0.56 0.15 -0.34 0.00 0.00 178.44 178.79 2qta h PHE 807 N 0.00 1.08 0.00 1.25 3.57 -1.30 -1.47 116.94 120.07 2qta h PHE 807 Ca 0.11 0.02 -0.19 0.00 3.53 0.00 0.00 57.97 61.44 2qta h PHE 807 Cb 0.50 -0.36 -0.03 0.00 2.79 0.00 0.00 35.95 38.84 2qta h PHE 807 CO 0.00 0.68 -1.46 0.00 -2.23 0.00 0.00 178.31 175.30 2qta h ALA 808 N 1.31 0.68 0.00 2.41 0.00 -1.59 -3.36 119.26 118.72 2qta h ALA 808 Ca 0.31 -0.97 -0.03 0.00 0.00 0.00 0.00 54.91 54.22 2qta h ALA 808 Cb -0.13 0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 2qta h ALA 808 CO -0.07 1.05 -0.13 0.93 0.00 0.00 0.00 179.25 181.03 2qta h GLU 809 N 0.00 0.00 -0.00 0.00 4.39 -0.78 -3.16 114.58 115.03 2qta h GLU 809 Ca -0.19 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.52 2qta h GLU 809 Cb 1.67 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 30.32 2qta h GLU 809 CO 0.05 0.13 0.08 -0.56 -1.16 0.00 0.00 179.01 177.56 2qta h GLN 810 N 0.00 0.00 -0.10 2.33 3.07 -1.42 -0.86 115.11 118.13 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 0.46 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.02 2qta h GLN 810 CO 0.02 0.00 0.00 1.33 0.09 0.00 0.00 178.83 180.27 2qta n VAL 811 N -3.08 0.10 -0.22 1.86 0.24 -1.19 -4.60 118.33 111.44 2qta n VAL 811 Ca -0.03 -0.49 -0.02 0.00 -2.04 0.00 0.00 64.34 61.76 2qta n VAL 811 Cb 0.15 1.18 0.05 0.00 -1.47 0.00 0.00 33.84 33.74 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 4.13 -0.06 -0.86 7.34 9.65 -1.35 0.51 114.38 133.75 2qta h ARG 812 Ca 0.00 0.00 0.21 0.00 -1.10 0.00 0.00 59.98 59.10 2qta h ARG 812 Cb 0.88 0.01 -0.05 0.00 -1.39 0.00 0.00 29.97 29.43 2qta h ARG 812 CO 0.00 -0.04 0.59 1.15 2.80 0.00 0.00 179.97 184.46 2qta h THR 813 N -0.07 0.65 -0.00 0.20 2.02 -1.81 -1.50 112.91 112.39 2qta h THR 813 Ca 0.29 -0.08 0.00 0.00 0.77 0.00 0.00 66.41 67.39 2qta h THR 813 Cb 0.52 0.39 0.00 0.00 -1.74 0.00 0.00 68.15 67.31 2qta h THR 813 CO -0.69 0.04 -0.69 -1.22 0.37 0.00 0.00 175.52 173.34 2qta n TYR 814 N -4.42 0.00 -2.33 3.16 4.01 0.11 -4.90 117.16 112.79 2qta n TYR 814 Ca 0.18 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.50 2qta n TYR 814 Cb 0.76 -0.13 -0.03 0.00 -0.31 0.00 0.00 39.34 39.63 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 -2.96 3.81 -0.44 -0.72 1.01 -0.57 -4.24 120.40 116.30 2qta s VAL 815 Ca 0.11 1.28 0.00 0.00 0.00 0.00 0.00 61.98 63.37 2qta s VAL 815 Cb 0.17 -3.82 0.00 0.00 0.00 0.00 0.00 36.38 32.73 2qta s VAL 815 CO 0.75 0.08 0.76 -0.81 0.00 0.00 0.00 175.10 175.88 2qta n PRO 816 N 4.22 0.97 -4.61 2.72 -0.04 -1.26 -4.82 135.00 132.18 2qta n PRO 816 Ca 0.10 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.27 2qta n PRO 816 Cb 0.45 -1.22 -0.14 0.00 -0.04 0.00 0.00 33.50 32.55 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 -0.42 2.26 -0.44 0.55 0.00 -1.25 -3.92 121.76 118.53 2qta s ALA 817 Ca 0.00 -1.35 0.23 0.00 0.00 0.00 0.00 51.96 50.84 2qta s ALA 817 Cb 0.00 -0.41 0.34 0.00 0.00 0.00 0.00 23.12 23.05 2qta s ALA 817 CO 0.00 0.52 1.60 -0.44 0.00 0.00 0.00 175.76 177.44 2qta h ASP 818 N 4.32 0.00 -3.34 0.00 3.32 -1.88 -3.42 116.42 115.43 2qta h ASP 818 Ca -0.48 -0.00 -0.67 0.00 0.02 0.00 0.00 57.03 55.89 2qta h ASP 818 Cb 1.16 0.00 -0.31 0.00 0.22 0.00 0.00 39.33 40.40 2qta h ASP 818 CO 0.41 0.00 -0.84 -0.62 -1.72 0.00 0.00 179.24 176.47 2qta s ASP 819 N -6.15 3.43 -0.22 6.45 2.15 -1.26 -5.05 116.67 116.02 2qta s ASP 819 Ca 0.07 -0.47 -0.03 0.00 0.43 0.00 0.00 52.55 52.54 2qta s ASP 819 Cb 0.05 -1.48 0.11 0.00 -0.30 0.00 0.00 42.92 41.30 2qta s ASP 819 CO 0.67 0.16 0.26 -0.47 -0.17 0.00 0.00 175.17 175.62 2qta s TYR 820 N 0.34 -0.39 -0.13 -5.34 5.04 -1.25 -1.40 117.35 114.21 2qta s TYR 820 Ca -0.16 0.27 -0.04 0.00 -2.44 0.00 0.00 57.07 54.70 2qta s TYR 820 Cb -0.17 -0.31 -0.03 0.00 0.35 0.00 0.00 41.96 41.79 2qta s TYR 820 CO 0.08 -0.67 0.02 1.03 -1.34 0.00 0.00 175.55 174.67 2qta s ARG 821 N 2.37 3.42 -0.09 4.97 0.52 0.03 -5.00 118.95 125.16 2qta s ARG 821 Ca 0.08 -0.38 0.04 0.00 -0.52 0.00 0.00 55.73 54.95 2qta s ARG 821 Cb -0.15 -2.97 0.00 0.00 0.52 0.00 0.00 34.95 32.35 2qta s ARG 821 CO -0.16 0.52 -0.23 0.08 0.02 0.00 0.00 175.30 175.53 2qta s VAL 822 N -0.35 1.98 0.09 3.52 1.01 -1.26 -1.00 120.40 124.38 2qta s VAL 822 Ca 0.08 -0.98 0.03 0.00 0.00 0.00 0.00 61.98 61.11 2qta s VAL 822 Cb -0.12 -1.71 -0.04 0.00 0.00 0.00 0.00 36.38 34.51 2qta s VAL 822 CO 0.02 0.54 0.09 -0.76 0.00 0.00 0.00 175.10 174.99 2qta s LEU 823 N 0.33 3.82 0.23 3.92 1.43 0.39 -4.97 118.68 123.82 2qta s LEU 823 Ca -0.17 -0.01 -0.21 0.00 -1.03 0.00 0.00 54.13 52.70 2qta s LEU 823 Cb -0.17 -2.49 0.06 0.00 0.03 0.00 0.00 46.19 43.62 2qta s LEU 823 CO 0.08 0.16 0.93 -0.83 0.23 0.00 0.00 176.35 176.92 2qta s GLY 824 N -2.45 0.04 -0.54 -3.19 0.00 -1.26 -3.55 107.32 96.37 2qta s GLY 824 Ca 0.30 -0.28 0.01 0.00 0.00 0.00 0.00 44.72 44.75 2qta s GLY 824 CO 0.22 0.79 1.97 -1.30 0.00 0.00 0.00 173.10 174.78 2qta n THR 825 N -0.57 3.39 -1.63 0.90 -2.24 -0.97 -4.73 114.28 108.43 2qta n THR 825 Ca -0.05 -2.35 -0.43 0.00 -2.27 0.00 0.00 64.05 58.94 2qta n THR 825 Cb 0.60 -0.78 -0.01 0.00 -2.10 0.00 0.00 70.33 68.04 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 -1.03 1.84 0.00 3.42 9.92 -1.26 -4.58 116.55 124.85 2qta n ASP 826 Ca 0.61 1.17 0.00 0.00 -0.53 0.00 0.00 54.79 56.04 2qta n ASP 826 Cb 1.22 -1.37 0.00 0.00 -0.64 0.00 0.00 41.12 40.33 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 3.77 0.44 0.00 -1.26 -3.40 105.19 108.64 2qta n GLY 827 Ca 0.08 -1.92 -0.39 0.00 0.00 0.00 0.00 46.02 43.79 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 -2.86 3.10 0.91 1.61 0.08 -1.26 -4.96 117.98 114.60 2qta s PHE 828 Ca 0.00 1.53 -0.12 0.00 0.12 0.00 0.00 56.93 58.46 2qta s PHE 828 Cb 0.00 -3.47 0.14 0.00 -0.57 0.00 0.00 43.02 39.12 2qta s PHE 828 CO 0.00 -1.41 1.14 0.20 -0.10 0.00 0.00 175.22 175.05 2qta s GLY 829 N -0.93 1.57 0.22 4.36 0.00 -1.26 -4.97 107.32 106.32 2qta s GLY 829 Ca 0.54 -0.52 -0.22 0.00 0.00 0.00 0.00 44.72 44.52 2qta s GLY 829 CO 0.43 0.04 0.73 1.09 0.00 0.00 0.00 173.10 175.38 2qta s ARG 830 N -5.27 1.56 -0.11 2.90 1.70 -1.26 -2.99 118.95 115.48 2qta s ARG 830 Ca 0.64 -0.80 -0.20 0.00 -0.47 0.00 0.00 55.73 54.90 2qta s ARG 830 Cb -0.15 0.57 -0.04 0.00 -0.57 0.00 0.00 34.95 34.77 2qta s ARG 830 CO 0.53 -0.71 0.57 -1.12 -1.08 0.00 0.00 175.30 173.50 2qta s SER 831 N -2.86 6.79 0.01 -2.89 0.01 -1.26 -4.17 113.70 109.32 2qta s SER 831 Ca 0.09 0.94 -0.03 0.00 1.31 0.00 0.00 55.95 58.26 2qta s SER 831 Cb -0.04 -2.34 0.01 0.00 0.21 0.00 0.00 66.02 63.86 2qta s SER 831 CO 0.01 -0.08 0.14 -0.67 0.41 0.00 0.00 173.24 173.06 2qta n ASP 832 N 3.91 -0.17 -4.84 2.44 -0.08 -0.84 -4.99 116.55 111.98 2qta n ASP 832 Ca -0.04 -1.06 -0.31 0.00 -1.51 0.00 0.00 54.79 51.87 2qta n ASP 832 Cb 0.51 0.27 0.04 0.00 2.34 0.00 0.00 41.12 44.29 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 -1.33 5.49 0.21 1.67 1.04 -1.26 -3.68 113.70 115.84 2qta s SER 833 Ca 0.03 1.42 -0.10 0.00 0.48 0.00 0.00 55.95 57.79 2qta s SER 833 Cb -0.00 -2.31 0.17 0.00 0.10 0.00 0.00 66.02 63.97 2qta s SER 833 CO 0.00 -1.35 1.87 0.03 0.98 0.00 0.00 173.24 174.78 2qta h ARG 834 N -0.65 0.95 -0.31 4.02 3.08 -1.92 -1.42 114.38 118.12 2qta h ARG 834 Ca -0.45 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.55 2qta h ARG 834 Cb 1.22 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 31.04 2qta h ARG 834 CO 0.60 0.63 0.21 1.49 -1.07 0.00 0.00 179.97 181.82 2qta h GLU 835 N 0.98 0.42 -0.62 0.04 4.81 -1.92 -0.29 114.58 117.99 2qta h GLU 835 Ca 0.28 -0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.43 2qta h GLU 835 Cb -0.07 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.19 2qta h GLU 835 CO -0.08 0.28 0.17 -0.91 -0.73 0.00 0.00 179.01 177.74 2qta h ASN 836 N 0.42 0.90 -0.34 1.04 2.35 -1.84 -2.21 115.58 115.91 2qta h ASN 836 Ca 0.11 -0.17 -0.15 0.00 -0.55 0.00 0.00 56.30 55.54 2qta h ASN 836 Cb -0.04 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.09 2qta h ASN 836 CO -0.02 0.87 -0.37 -0.07 -1.65 0.00 0.00 177.43 176.18 2qta h LEU 837 N 0.93 0.94 -1.40 1.61 3.38 -0.97 -0.29 115.31 119.51 2qta h LEU 837 Ca 0.20 -0.42 -0.04 0.00 0.09 0.00 0.00 57.88 57.70 2qta h LEU 837 Cb 0.31 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 2qta h LEU 837 CO -0.00 1.21 -0.21 0.03 0.09 0.00 0.00 178.44 179.55 2qta h ARG 838 N 0.73 0.00 0.17 1.13 3.08 -0.88 0.20 114.38 118.81 2qta h ARG 838 Ca 0.06 0.00 -0.26 0.00 0.07 0.00 0.00 59.98 59.85 2qta h ARG 838 Cb 0.95 0.00 0.02 0.00 0.08 0.00 0.00 29.97 31.02 2qta h ARG 838 CO 0.09 0.21 -1.20 1.25 -1.07 0.00 0.00 179.97 179.25 2qta h HIS 839 N 0.00 0.65 -0.42 3.04 2.76 -1.29 -2.22 115.15 117.68 2qta h HIS 839 Ca -0.00 -0.47 0.01 0.00 -2.20 0.00 0.00 60.37 57.70 2qta h HIS 839 Cb 0.61 -0.03 -0.02 0.00 1.55 0.00 0.00 27.41 29.52 2qta h HIS 839 CO 0.00 1.46 0.26 1.25 -1.30 0.00 0.00 177.93 179.60 2qta h HIS 840 N -0.19 0.49 0.00 5.26 -0.00 -0.67 -2.15 115.15 117.89 2qta h HIS 840 Ca -0.23 0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.16 2qta h HIS 840 Cb 1.84 -0.16 0.00 0.00 -0.00 0.00 0.00 27.41 29.09 2qta h HIS 840 CO 0.16 0.30 0.00 1.19 -0.00 0.00 0.00 177.93 179.57 2qta n PHE 841 N -4.82 0.00 -3.67 5.26 3.72 0.68 -4.72 117.46 113.90 2qta n PHE 841 Ca 0.01 0.00 -0.23 0.00 -0.05 0.00 0.00 57.45 57.18 2qta n PHE 841 Cb 0.04 0.00 0.05 0.00 -0.94 0.00 0.00 39.48 38.64 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 -0.85 -6.07 0.00 -1.08 1.02 -0.81 -4.54 120.64 108.31 2qta n GLU 842 Ca 0.16 0.71 0.00 0.00 -0.02 0.00 0.00 57.16 58.01 2qta n GLU 842 Cb 0.08 -5.55 0.00 0.00 -0.02 0.00 0.00 31.44 25.94 2qta n GLU 842 CO 0.00 0.00 0.00 1.55 1.18 0.00 0.00 177.13 179.86 2qta n VAL 843 N -4.48 0.00 -1.50 2.62 3.14 -0.87 -4.55 118.33 112.69 2qta n VAL 843 Ca -0.16 -0.37 -0.30 0.00 -2.96 0.00 0.00 64.34 60.55 2qta n VAL 843 Cb 0.62 1.11 0.19 0.00 -1.06 0.00 0.00 33.84 34.70 2qta n VAL 843 CO 0.00 0.00 0.00 1.51 -6.46 0.00 0.00 176.83 171.88 2qta s ASP 844 N -0.43 2.36 0.26 6.55 1.47 -0.97 -4.73 116.67 121.18 2qta s ASP 844 Ca 0.00 0.59 -0.01 0.00 1.18 0.00 0.00 52.55 54.31 2qta s ASP 844 Cb 0.00 -0.85 0.53 0.00 -0.34 0.00 0.00 42.92 42.26 2qta s ASP 844 CO 0.00 -3.23 1.78 0.00 0.68 0.00 0.00 175.17 174.40 2qta h ALA 845 N -1.97 1.31 -0.44 2.11 0.00 -1.93 -1.40 119.26 116.94 2qta h ALA 845 Ca -0.46 0.07 0.07 0.00 0.00 0.00 0.00 54.91 54.59 2qta h ALA 845 Cb 1.28 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.95 2qta h ALA 845 CO 0.43 -0.03 0.07 0.77 0.00 0.00 0.00 179.25 180.48 2qta h SER 846 N 0.69 -0.04 0.02 0.00 0.02 -1.92 -0.72 113.55 111.61 2qta h SER 846 Ca 0.46 0.08 -0.12 0.00 -0.84 0.00 0.00 61.79 61.38 2qta h SER 846 Cb 0.61 0.12 -0.01 0.00 0.14 0.00 0.00 62.40 63.26 2qta h SER 846 CO -0.34 0.01 -0.36 1.88 -1.14 0.00 0.00 176.83 176.88 2qta h TYR 847 N 0.19 0.53 -0.63 3.45 -1.99 -1.61 -1.49 116.97 115.41 2qta h TYR 847 Ca 0.22 -0.14 -0.04 0.00 2.00 0.00 0.00 58.73 60.76 2qta h TYR 847 Cb 0.28 -0.12 -0.03 0.00 2.00 0.00 0.00 36.73 38.87 2qta h TYR 847 CO -0.23 0.76 0.23 0.28 -0.00 0.00 0.00 178.16 179.20 2qta h VAL 848 N 0.39 1.24 -0.19 -2.88 2.07 -0.82 0.19 116.25 116.24 2qta h VAL 848 Ca 0.04 -0.78 -0.00 0.00 0.82 0.00 0.00 66.70 66.78 2qta h VAL 848 Cb 0.82 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 31.14 2qta h VAL 848 CO 0.07 0.30 0.11 0.58 0.02 0.00 0.00 177.57 178.65 2qta h VAL 849 N 0.90 1.10 -0.55 2.57 2.07 -0.86 0.10 116.25 121.59 2qta h VAL 849 Ca 0.21 -0.26 -0.07 0.00 0.82 0.00 0.00 66.70 67.39 2qta h VAL 849 Cb 0.24 0.92 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 2qta h VAL 849 CO -0.01 0.10 0.05 0.58 0.02 0.00 0.00 177.57 178.31 2qta h VAL 850 N 0.22 1.25 -0.48 2.57 2.07 -1.02 -0.09 116.25 120.76 2qta h VAL 850 Ca 0.07 -0.98 -0.01 0.00 0.82 0.00 0.00 66.70 66.60 2qta h VAL 850 Cb 0.06 0.77 -0.02 0.00 -1.52 0.00 0.00 31.29 30.57 2qta h VAL 850 CO -0.01 0.36 0.26 0.00 0.02 0.00 0.00 177.57 178.20 2qta h ALA 851 N 1.22 0.61 -0.16 1.67 0.00 -0.24 -0.37 119.26 121.98 2qta h ALA 851 Ca 0.17 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 2qta h ALA 851 Cb 0.42 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 2qta h ALA 851 CO 0.01 0.13 -0.04 0.00 0.00 0.00 0.00 179.25 179.35 2qta h ALA 852 N 1.11 0.22 -0.98 0.00 0.00 -0.46 -2.72 119.26 116.43 2qta h ALA 852 Ca 0.17 -0.24 0.05 0.00 0.00 0.00 0.00 54.91 54.89 2qta h ALA 852 Cb 0.05 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 17.72 2qta h ALA 852 CO -0.03 -0.01 0.63 -0.07 0.00 0.00 0.00 179.25 179.77 2qta h LEU 853 N 0.02 1.03 -0.52 0.00 3.38 -0.96 -2.05 115.31 116.20 2qta h LEU 853 Ca 0.04 0.00 0.07 0.00 0.09 0.00 0.00 57.88 58.09 2qta h LEU 853 Cb 0.48 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 40.95 2qta h LEU 853 CO 0.02 0.68 0.18 1.23 0.09 0.00 0.00 178.44 180.63 2qta h GLY 854 N 1.18 0.70 1.08 0.83 0.00 -0.89 0.35 103.07 106.32 2qta h GLY 854 Ca 0.41 -0.10 -0.05 0.00 0.00 0.00 0.00 47.33 47.60 2qta h GLY 854 CO -0.15 -0.00 0.31 0.83 0.00 0.00 0.00 176.54 177.53 2qta h GLU 855 N 0.36 1.16 -0.51 4.80 5.08 -1.08 -2.10 114.58 122.30 2qta h GLU 855 Ca 0.25 -0.21 -0.12 0.00 -1.00 0.00 0.00 59.36 58.29 2qta h GLU 855 Cb 0.28 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 2qta h GLU 855 CO -0.26 0.94 -0.15 -0.07 -1.00 0.00 0.00 179.01 178.47 2qta h LEU 856 N 1.14 1.01 -0.94 1.33 3.38 -0.88 -2.93 115.31 117.41 2qta h LEU 856 Ca 0.26 -0.37 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 2qta h LEU 856 Cb 0.21 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.65 2qta h LEU 856 CO -0.02 1.14 0.44 0.00 0.09 0.00 0.00 178.44 180.09 2qta h ALA 857 N 0.90 1.19 0.00 1.53 0.00 -0.74 -0.47 119.26 121.66 2qta h ALA 857 Ca 0.13 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2qta h ALA 857 Cb 0.72 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2qta h ALA 857 CO 0.05 0.64 0.00 1.63 0.00 0.00 0.00 179.25 181.58 2qta n LYS 858 N -4.33 0.08 -0.09 0.00 5.02 -0.81 -0.40 118.16 117.64 2qta n LYS 858 Ca 0.09 0.40 0.10 0.00 -2.02 0.00 0.00 58.31 56.87 2qta n LYS 858 Cb 0.11 -1.68 0.14 0.00 -0.02 0.00 0.00 35.03 33.58 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 -1.84 2.03 -1.72 1.97 1.74 -0.33 -4.94 116.66 113.57 2qta n ARG 859 Ca 0.02 -1.90 -0.16 0.00 -0.77 0.00 0.00 57.85 55.04 2qta n ARG 859 Cb 0.14 -1.40 -0.05 0.00 -1.02 0.00 0.00 32.46 30.13 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 1.15 1.02 0.13 -0.13 0.00 0.46 -4.85 105.19 102.97 2qta n GLY 860 Ca 0.14 -0.25 0.03 0.00 0.00 0.00 0.00 46.02 45.94 2qta n GLY 860 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2qta h GLU 861 N 0.00 0.00 -3.95 1.61 4.81 -1.35 -3.46 114.58 112.24 2qta h GLU 861 Ca -0.34 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 58.79 2qta h GLU 861 Cb 1.11 0.00 -0.15 0.00 0.63 0.00 0.00 28.75 30.34 2qta h GLU 861 CO 0.47 0.37 -0.48 0.96 -0.73 0.00 0.00 179.01 179.59 2qta s ILE 862 N -3.00 0.17 0.30 2.32 -4.36 -1.23 -4.96 121.20 110.44 2qta s ILE 862 Ca 0.02 -1.38 -0.29 0.00 -0.26 0.00 0.00 60.65 58.73 2qta s ILE 862 Cb 0.08 -1.37 -0.10 0.00 1.25 0.00 0.00 42.46 42.32 2qta s ILE 862 CO 0.76 -0.76 1.14 -0.62 0.24 0.00 0.00 174.94 175.70 2qta s ASP 863 N -2.83 7.13 0.58 4.36 -1.08 -1.26 -4.16 116.67 119.40 2qta s ASP 863 Ca 0.05 2.35 0.28 0.00 -0.52 0.00 0.00 52.55 54.71 2qta s ASP 863 Cb 0.06 -2.63 1.53 0.00 -1.46 0.00 0.00 42.92 40.42 2qta s ASP 863 CO -0.10 -0.25 2.00 0.11 0.52 0.00 0.00 175.17 177.45 2qta h LYS 864 N 3.65 0.00 -0.07 4.34 1.57 -1.97 0.53 116.57 124.62 2qta h LYS 864 Ca -0.47 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.27 2qta h LYS 864 Cb 1.22 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.52 2qta h LYS 864 CO 0.66 0.00 -0.13 0.87 -0.57 0.00 0.00 179.45 180.29 2qta h LYS 865 N 0.00 0.11 -0.63 3.15 1.57 -2.00 -2.36 116.57 116.41 2qta h LYS 865 Ca 0.17 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.91 2qta h LYS 865 Cb 0.85 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 33.11 2qta h LYS 865 CO -0.00 0.24 0.31 0.28 -0.57 0.00 0.00 179.45 179.70 2qta h VAL 866 N 0.10 1.20 -0.15 0.50 2.07 -1.26 0.66 116.25 119.38 2qta h VAL 866 Ca 0.02 -0.57 -0.05 0.00 0.82 0.00 0.00 66.70 66.92 2qta h VAL 866 Cb 0.29 0.39 -0.00 0.00 -1.52 0.00 0.00 31.29 30.45 2qta h VAL 866 CO 0.02 0.24 -0.11 0.58 0.02 0.00 0.00 177.57 178.32 2qta h VAL 867 N 0.89 1.33 -0.82 2.57 2.07 -1.54 -0.78 116.25 119.97 2qta h VAL 867 Ca 0.22 -1.20 0.03 0.00 0.82 0.00 0.00 66.70 66.57 2qta h VAL 867 Cb 0.09 1.80 -0.05 0.00 -1.52 0.00 0.00 31.29 31.60 2qta h VAL 867 CO -0.03 0.35 0.52 0.00 0.02 0.00 0.00 177.57 178.44 2qta h ALA 868 N 0.64 1.08 -0.11 1.67 0.00 -1.21 -0.80 119.26 120.53 2qta h ALA 868 Ca 0.03 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 2qta h ALA 868 Cb 0.60 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2qta h ALA 868 CO 0.03 0.34 -0.44 -0.44 0.00 0.00 0.00 179.25 178.73 2qta h ASP 869 N 1.01 0.29 -0.12 0.00 3.32 -0.71 -2.50 116.42 117.71 2qta h ASP 869 Ca 0.33 -0.13 -0.01 0.00 0.02 0.00 0.00 57.03 57.24 2qta h ASP 869 Cb 0.02 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.48 2qta h ASP 869 CO -0.12 0.70 0.04 0.00 -1.72 0.00 0.00 179.24 178.14 2qta h ALA 870 N 1.32 0.16 -0.86 3.45 0.00 -0.37 0.46 119.26 123.41 2qta h ALA 870 Ca 0.02 -0.12 0.15 0.00 0.00 0.00 0.00 54.91 54.96 2qta h ALA 870 Cb 0.88 -0.05 -0.09 0.00 0.00 0.00 0.00 17.79 18.52 2qta h ALA 870 CO 0.07 -0.23 0.45 0.82 0.00 0.00 0.00 179.25 180.36 2qta h ILE 871 N 0.01 0.73 0.10 0.00 2.04 -1.00 -0.81 117.51 118.59 2qta h ILE 871 Ca 0.04 -0.22 -0.01 0.00 1.00 0.00 0.00 64.86 65.67 2qta h ILE 871 Cb 0.21 0.03 0.00 0.00 -0.74 0.00 0.00 36.82 36.32 2qta h ILE 871 CO -0.00 0.12 -0.05 0.00 0.00 0.00 0.00 178.15 178.22 2qta h ALA 872 N 1.56 -0.14 -0.96 1.87 0.00 -1.04 -1.88 119.26 118.67 2qta h ALA 872 Ca 0.47 -0.20 0.16 0.00 0.00 0.00 0.00 54.91 55.34 2qta h ALA 872 Cb 0.67 0.05 -0.10 0.00 0.00 0.00 0.00 17.79 18.42 2qta h ALA 872 CO -0.36 -0.37 0.56 -0.22 0.00 0.00 0.00 179.25 178.86 2qta h LYS 873 N -0.55 0.75 -0.18 0.00 3.64 -0.35 -1.71 116.57 118.17 2qta h LYS 873 Ca -0.01 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 2qta h LYS 873 Cb 0.45 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.10 2qta h LYS 873 CO 0.02 0.50 0.00 1.19 -2.27 0.00 0.00 179.45 178.89 2qta n PHE 874 N -4.77 0.24 -3.72 1.91 3.72 -0.36 -4.92 117.46 109.56 2qta n PHE 874 Ca 0.20 -0.12 -0.25 0.00 -0.05 0.00 0.00 57.45 57.24 2qta n PHE 874 Cb 0.48 0.00 0.05 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 0.10 -3.81 -4.71 4.37 3.02 -0.64 -4.96 115.26 108.63 2qta n ASN 875 Ca 0.11 -0.72 -0.37 0.00 -0.03 0.00 0.00 54.58 53.58 2qta n ASN 875 Cb 0.22 -4.36 -0.07 0.00 -0.61 0.00 0.00 39.78 34.97 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 -3.42 5.23 -0.57 2.41 1.01 -0.72 -5.04 121.20 120.11 2qta s ILE 876 Ca 0.38 0.76 -0.19 0.00 0.00 0.00 0.00 60.65 61.60 2qta s ILE 876 Cb -0.18 -3.73 0.10 0.00 0.01 0.00 0.00 42.46 38.65 2qta s ILE 876 CO 0.79 0.34 0.66 -0.62 0.00 0.00 0.00 174.94 176.11 2qta s ASP 877 N 0.64 6.19 0.36 3.58 -1.08 -1.26 -4.73 116.67 120.38 2qta s ASP 877 Ca 0.21 -1.39 0.26 0.00 -0.52 0.00 0.00 52.55 51.11 2qta s ASP 877 Cb -0.14 -2.29 1.27 0.00 -1.46 0.00 0.00 42.92 40.30 2qta s ASP 877 CO 0.07 -1.05 1.80 0.00 0.52 0.00 0.00 175.17 176.52 2qta h ALA 878 N 9.12 1.00 -0.25 3.66 0.00 -1.96 -2.98 119.26 127.85 2qta h ALA 878 Ca -0.29 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2qta h ALA 878 Cb 1.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.88 2qta h ALA 878 CO 1.07 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 180.07 2qta n ASP 879 N -2.44 2.66 -4.70 0.00 8.00 -1.26 -4.99 116.55 113.81 2qta n ASP 879 Ca -0.00 -1.83 -0.32 0.00 0.71 0.00 0.00 54.79 53.35 2qta n ASP 879 Cb 0.14 -0.16 0.13 0.00 -0.02 0.00 0.00 41.12 41.21 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 -1.00 1.57 0.62 -1.24 -2.85 -1.13 -4.92 119.74 110.80 2qta s LYS 880 Ca 0.21 1.59 -0.17 0.00 -1.00 0.00 0.00 55.97 56.60 2qta s LYS 880 Cb 0.12 -1.79 -0.02 0.00 -2.06 0.00 0.00 37.83 34.09 2qta s LYS 880 CO 0.16 -2.23 1.13 0.54 0.10 0.00 0.00 175.35 175.06 2qta s VAL 881 N -2.43 3.10 0.19 1.79 0.11 -1.26 -4.91 120.40 116.98 2qta s VAL 881 Ca 0.69 0.58 -0.33 0.00 -2.93 0.00 0.00 61.98 59.99 2qta s VAL 881 Cb -0.25 -3.13 -0.13 0.00 -1.53 0.00 0.00 36.38 31.34 2qta s VAL 881 CO 0.53 -0.25 1.57 -3.20 -3.33 0.00 0.00 175.10 170.42 2qta n ASN 882 N -2.03 3.20 0.00 3.54 2.85 -1.26 -4.84 115.26 116.72 2qta n ASN 882 Ca 0.11 1.09 0.19 0.00 -0.11 0.00 0.00 54.58 55.87 2qta n ASN 882 Cb 0.51 -1.46 0.68 0.00 1.24 0.00 0.00 39.78 40.75 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 5.69 0.03 0.00 1.20 0.11 -1.84 -0.51 132.00 136.67 2qta h PRO 883 Ca -0.45 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.65 2qta h PRO 883 Cb 1.25 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.35 2qta h PRO 883 CO 0.87 0.02 -0.04 -0.09 -0.21 0.00 0.00 178.00 178.55 2qta h ARG 884 N 0.03 0.00 0.00 1.05 2.43 -1.88 -2.50 114.38 113.50 2qta h ARG 884 Ca 0.25 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.42 2qta h ARG 884 Cb 0.95 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.50 2qta h ARG 884 CO -0.01 0.04 -1.05 1.28 -1.51 0.00 0.00 179.97 178.72 2qta n LEU 885 N -3.42 0.77 0.00 3.80 4.77 -0.23 -4.56 117.00 118.13 2qta n LEU 885 Ca -0.02 -0.43 0.03 0.00 -0.03 0.00 0.00 56.01 55.56 2qta n LEU 885 Cb 0.16 0.00 0.15 0.00 -2.33 0.00 0.00 43.42 41.40 2qta n LEU 885 CO 0.26 0.19 0.39 0.00 -1.33 0.00 0.00 177.39 176.90