#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qtc s SER 57 N 0.00 4.64 0.76 7.28 1.04 -1.26 -5.10 113.70 121.07 2qtc s SER 57 Ca 0.00 -1.16 -0.15 0.00 0.48 0.00 0.00 55.95 55.12 2qtc s SER 57 Cb 0.00 0.12 0.03 0.00 0.10 0.00 0.00 66.02 66.27 2qtc s SER 57 CO 0.00 -0.93 0.99 0.59 0.98 0.00 0.00 173.24 174.87 2qtc n ASN 58 N -1.63 0.45 -3.02 7.02 3.02 -1.26 -4.85 115.26 114.99 2qtc n ASN 58 Ca -0.01 0.62 -0.33 0.00 -0.03 0.00 0.00 54.58 54.83 2qtc n ASN 58 Cb 0.64 -1.42 -0.06 0.00 -0.61 0.00 0.00 39.78 38.33 2qtc n ASN 58 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2qtc n TYR 59 N -2.81 1.90 -4.15 3.10 9.36 -1.26 -4.82 117.16 118.48 2qtc n TYR 59 Ca 0.13 -2.69 -0.14 0.00 3.32 0.00 0.00 57.90 58.52 2qtc n TYR 59 Cb 0.50 -2.19 -0.07 0.00 -0.63 0.00 0.00 39.34 36.94 2qtc n TYR 59 CO 0.00 0.00 0.00 0.96 0.22 0.00 0.00 176.86 178.04 2qtc s ILE 60 N 1.39 0.00 0.33 2.97 -4.36 -1.26 -4.83 121.20 115.44 2qtc s ILE 60 Ca 0.67 -1.79 -0.29 0.00 -0.26 0.00 0.00 60.65 58.99 2qtc s ILE 60 Cb 0.22 -2.48 -0.12 0.00 1.25 0.00 0.00 42.46 41.33 2qtc s ILE 60 CO -0.06 0.00 1.39 0.59 0.24 0.00 0.00 174.94 177.10 2qtc n ASN 61 N -0.84 3.14 -0.20 4.36 3.02 -1.26 -4.71 115.26 118.77 2qtc n ASN 61 Ca 0.02 1.20 -0.09 0.00 -0.03 0.00 0.00 54.58 55.68 2qtc n ASN 61 Cb 0.63 -1.52 0.03 0.00 -0.61 0.00 0.00 39.78 38.31 2qtc n ASN 61 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 2qtc h THR 62 N 2.80 1.27 -3.41 3.41 2.02 -1.56 -3.40 112.91 114.04 2qtc h THR 62 Ca -0.47 -1.17 -0.71 0.00 0.77 0.00 0.00 66.41 64.83 2qtc h THR 62 Cb 1.27 0.83 -0.20 0.00 -1.74 0.00 0.00 68.15 68.30 2qtc h THR 62 CO 0.66 0.42 -0.21 -0.63 0.37 0.00 0.00 175.52 176.14 2qtc s ILE 63 N -4.99 5.10 0.71 3.11 1.01 -1.26 -5.01 121.20 119.87 2qtc s ILE 63 Ca -0.12 -0.60 -0.14 0.00 0.00 0.00 0.00 60.65 59.80 2qtc s ILE 63 Cb 0.14 -4.11 0.03 0.00 0.01 0.00 0.00 42.46 38.53 2qtc s ILE 63 CO 0.86 -0.54 1.13 -2.16 0.00 0.00 0.00 174.94 174.24 2qtc s PRO 64 N 2.07 2.41 0.36 2.79 0.04 -1.26 -4.85 135.00 136.56 2qtc s PRO 64 Ca 0.10 1.46 0.12 0.00 0.04 0.00 0.00 61.00 62.72 2qtc s PRO 64 Cb -0.20 -1.90 0.90 0.00 0.04 0.00 0.00 34.50 33.35 2qtc s PRO 64 CO 0.11 -1.57 1.83 0.28 0.04 0.00 0.00 177.00 177.70 2qtc h VAL 65 N -0.37 0.73 0.00 -0.36 2.07 -1.96 -1.33 116.25 115.02 2qtc h VAL 65 Ca -0.46 -0.21 0.00 0.00 0.82 0.00 0.00 66.70 66.85 2qtc h VAL 65 Cb 1.26 0.07 0.00 0.00 -1.52 0.00 0.00 31.29 31.10 2qtc h VAL 65 CO 0.52 0.11 0.00 -1.84 0.02 0.00 0.00 177.57 176.38 2qtc n GLU 66 N -4.60 0.26 -0.03 1.57 0.00 -1.26 -1.74 120.64 114.84 2qtc n GLU 66 Ca 0.20 0.12 0.01 0.00 0.00 0.00 0.00 57.16 57.50 2qtc n GLU 66 Cb 0.60 -1.50 0.03 0.00 0.00 0.00 0.00 31.44 30.57 2qtc n GLU 66 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 2qtc n GLU 67 N -1.25 1.63 -2.99 3.44 1.02 -0.52 -5.00 120.64 116.98 2qtc n GLU 67 Ca 0.08 -1.27 -0.40 0.00 -0.02 0.00 0.00 57.16 55.55 2qtc n GLU 67 Cb 0.11 -1.06 -0.04 0.00 -0.02 0.00 0.00 31.44 30.43 2qtc n GLU 67 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 2qtc s GLN 68 N -0.71 4.42 0.70 3.49 0.74 -0.71 -4.94 119.66 122.65 2qtc s GLN 68 Ca 0.04 0.95 -0.11 0.00 0.05 0.00 0.00 55.36 56.29 2qtc s GLN 68 Cb 0.03 -3.47 0.01 0.00 1.10 0.00 0.00 33.01 30.67 2qtc s GLN 68 CO 0.03 -0.02 1.07 -1.25 -0.55 0.00 0.00 175.29 174.57 2qtc s PRO 69 N 1.08 2.84 0.33 1.67 0.04 -1.26 -4.98 135.00 134.72 2qtc s PRO 69 Ca 0.39 1.01 -0.29 0.00 0.04 0.00 0.00 61.00 62.15 2qtc s PRO 69 Cb -0.18 -1.98 -0.10 0.00 0.04 0.00 0.00 34.50 32.28 2qtc s PRO 69 CO 0.18 -1.18 1.36 -2.00 0.04 0.00 0.00 177.00 175.40 2qtc s GLU 70 N -4.95 4.29 0.11 4.56 2.12 -1.26 -4.92 118.70 118.66 2qtc s GLU 70 Ca 0.59 2.30 -0.31 0.00 0.36 0.00 0.00 54.97 57.92 2qtc s GLU 70 Cb -0.15 -3.05 -0.07 0.00 0.26 0.00 0.00 34.13 31.12 2qtc s GLU 70 CO 0.54 -0.29 1.28 -0.47 -0.54 0.00 0.00 175.26 175.78 2qtc s TYR 71 N -1.00 3.35 -0.34 5.30 5.04 -1.26 -4.94 117.35 123.49 2qtc s TYR 71 Ca 0.51 1.19 0.21 0.00 -2.44 0.00 0.00 57.07 56.54 2qtc s TYR 71 Cb -0.41 -3.53 0.22 0.00 0.35 0.00 0.00 41.96 38.58 2qtc s TYR 71 CO 0.54 -1.72 1.47 -1.00 -1.34 0.00 0.00 175.55 173.49 2qtc h PRO 72 N 6.41 0.00 0.00 4.97 0.13 -2.00 -3.48 132.00 138.03 2qtc h PRO 72 Ca -0.43 0.00 -0.35 0.00 -0.87 0.00 0.00 66.00 64.36 2qtc h PRO 72 Cb 1.21 0.00 0.04 0.00 0.13 0.00 0.00 31.00 32.38 2qtc h PRO 72 CO 0.82 0.12 0.02 0.41 -0.23 0.00 0.00 178.00 179.13 2qtc n GLY 73 N 1.15 1.34 3.40 1.56 0.00 -1.26 -5.03 105.19 106.34 2qtc n GLY 73 Ca 0.03 -2.11 -0.45 0.00 0.00 0.00 0.00 46.02 43.48 2qtc n GLY 73 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2qtc s ASN 74 N -3.79 6.72 0.23 1.61 3.84 -1.26 -4.92 114.94 117.37 2qtc s ASN 74 Ca 0.46 -2.39 -0.08 0.00 0.21 0.00 0.00 52.86 51.06 2qtc s ASN 74 Cb -0.03 -2.32 0.38 0.00 -0.55 0.00 0.00 41.25 38.73 2qtc s ASN 74 CO 0.30 -0.83 1.65 -0.07 -2.79 0.00 0.00 177.10 175.37 2qtc h LEU 75 N 9.19 -0.26 -0.24 3.21 3.38 -1.96 0.36 115.31 128.98 2qtc h LEU 75 Ca 0.14 0.17 -0.01 0.00 0.09 0.00 0.00 57.88 58.28 2qtc h LEU 75 Cb 1.02 0.29 -0.01 0.00 0.09 0.00 0.00 40.66 42.05 2qtc h LEU 75 CO 0.96 -0.13 0.12 -0.33 0.09 0.00 0.00 178.44 179.15 2qtc h GLU 76 N 0.13 0.34 -0.43 1.13 3.07 -2.00 -0.95 114.58 115.88 2qtc h GLU 76 Ca 0.38 -0.05 -0.14 0.00 -0.50 0.00 0.00 59.36 59.04 2qtc h GLU 76 Cb 0.64 -0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 28.48 2qtc h GLU 76 CO -0.58 0.34 -0.29 1.25 -1.40 0.00 0.00 179.01 178.33 2qtc h LEU 77 N 0.25 0.98 -0.83 1.33 6.46 -1.78 -2.84 115.31 118.89 2qtc h LEU 77 Ca 0.08 -0.40 -0.00 0.00 -0.12 0.00 0.00 57.88 57.43 2qtc h LEU 77 Cb 0.11 -0.27 -0.04 0.00 -0.73 0.00 0.00 40.66 39.73 2qtc h LEU 77 CO -0.01 1.19 0.51 -0.33 -0.62 0.00 0.00 178.44 179.18 2qtc h GLU 78 N 0.79 1.12 -0.80 1.25 5.08 -0.10 -2.20 114.58 119.73 2qtc h GLU 78 Ca 0.09 -0.10 -0.03 0.00 -1.00 0.00 0.00 59.36 58.32 2qtc h GLU 78 Cb 0.87 -0.24 -0.04 0.00 0.50 0.00 0.00 28.75 29.85 2qtc h GLU 78 CO 0.08 0.78 0.39 -0.09 -1.00 0.00 0.00 179.01 179.17 2qtc h ARG 79 N 1.13 1.14 -0.32 2.33 2.43 -1.10 0.31 114.38 120.31 2qtc h ARG 79 Ca 0.30 -0.16 0.00 0.00 -0.81 0.00 0.00 59.98 59.31 2qtc h ARG 79 Cb -0.06 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 29.27 2qtc h ARG 79 CO -0.06 0.87 0.20 -0.09 -1.51 0.00 0.00 179.97 179.38 2qtc h ARG 80 N 1.13 0.42 -0.35 0.20 2.43 -1.19 0.34 114.38 117.37 2qtc h ARG 80 Ca 0.28 -0.03 -0.15 0.00 -0.81 0.00 0.00 59.98 59.27 2qtc h ARG 80 Cb 0.10 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.55 2qtc h ARG 80 CO -0.04 0.30 -0.35 0.82 -1.51 0.00 0.00 179.97 179.19 2qtc h ILE 81 N 0.42 1.28 -0.79 1.20 2.04 -0.98 -2.76 117.51 117.93 2qtc h ILE 81 Ca 0.12 -1.53 -0.02 0.00 1.00 0.00 0.00 64.86 64.43 2qtc h ILE 81 Cb -0.02 1.45 -0.04 0.00 -0.74 0.00 0.00 36.82 37.47 2qtc h ILE 81 CO -0.02 0.50 0.41 -0.09 0.00 0.00 0.00 178.15 178.95 2qtc h ARG 82 N 0.65 1.10 -0.40 2.37 2.43 0.02 -1.68 114.38 118.88 2qtc h ARG 82 Ca 0.06 -0.13 -0.05 0.00 -0.81 0.00 0.00 59.98 59.04 2qtc h ARG 82 Cb 0.94 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 30.26 2qtc h ARG 82 CO 0.09 0.82 0.03 0.77 -1.51 0.00 0.00 179.97 180.17 2qtc h SER 83 N 1.11 0.59 0.08 -3.80 0.02 -0.21 0.07 113.55 111.40 2qtc h SER 83 Ca 0.28 -0.11 -0.13 0.00 -0.84 0.00 0.00 61.79 60.99 2qtc h SER 83 Cb 0.05 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.43 2qtc h SER 83 CO -0.04 0.64 -0.43 0.00 -1.14 0.00 0.00 176.83 175.86 2qtc h ALA 84 N 1.44 0.92 -0.23 3.77 0.00 -1.08 -1.06 119.26 123.02 2qtc h ALA 84 Ca 0.13 -0.44 -0.08 0.00 0.00 0.00 0.00 54.91 54.51 2qtc h ALA 84 Cb 0.34 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 2qtc h ALA 84 CO 0.01 0.64 -0.18 0.82 0.00 0.00 0.00 179.25 180.54 2qtc h ILE 85 N 0.36 1.31 -0.50 0.00 2.04 -0.72 0.60 117.51 120.60 2qtc h ILE 85 Ca 0.03 -1.31 0.04 0.00 1.00 0.00 0.00 64.86 64.62 2qtc h ILE 85 Cb 0.90 1.65 -0.04 0.00 -0.74 0.00 0.00 36.82 38.60 2qtc h ILE 85 CO 0.08 0.40 0.27 0.03 0.00 0.00 0.00 178.15 178.93 2qtc h ARG 86 N 0.23 0.52 0.19 2.37 3.08 -0.83 -1.27 114.38 118.67 2qtc h ARG 86 Ca 0.04 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 2qtc h ARG 86 Cb 0.71 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.64 2qtc h ARG 86 CO 0.05 0.34 -0.09 2.35 -1.07 0.00 0.00 179.97 181.55 2qtc h TRP 87 N 0.53 -0.24 -0.23 3.04 2.91 -1.06 -2.37 115.95 118.54 2qtc h TRP 87 Ca 0.21 -0.01 0.00 0.00 1.13 0.00 0.00 58.89 60.23 2qtc h TRP 87 Cb 0.09 0.08 -0.01 0.00 -0.51 0.00 0.00 29.16 28.81 2qtc h TRP 87 CO -0.09 -0.08 0.15 -0.91 -1.03 0.00 0.00 178.44 176.49 2qtc h ASN 88 N -0.35 0.26 -0.17 2.65 2.35 -0.63 0.13 115.58 119.82 2qtc h ASN 88 Ca -0.03 -0.01 -0.05 0.00 -0.55 0.00 0.00 56.30 55.67 2qtc h ASN 88 Cb 0.27 -0.06 -0.00 0.00 0.05 0.00 0.00 38.32 38.57 2qtc h ASN 88 CO 0.04 0.19 -0.08 0.00 -1.65 0.00 0.00 177.43 175.93 2qtc h ALA 89 N 1.86 0.23 -0.61 -0.83 0.00 -1.08 -0.83 119.26 118.00 2qtc h ALA 89 Ca 0.09 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.67 2qtc h ALA 89 Cb -0.02 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 2qtc h ALA 89 CO -0.02 0.04 0.17 0.82 0.00 0.00 0.00 179.25 180.26 2qtc h ILE 90 N 0.02 1.25 -0.74 0.00 2.04 -0.85 -2.32 117.51 116.91 2qtc h ILE 90 Ca 0.04 -0.88 0.00 0.00 1.00 0.00 0.00 64.86 65.02 2qtc h ILE 90 Cb 0.55 0.65 -0.04 0.00 -0.74 0.00 0.00 36.82 37.24 2qtc h ILE 90 CO 0.02 0.33 0.48 0.24 0.00 0.00 0.00 178.15 179.22 2qtc h MET 91 N 0.89 0.98 -0.25 2.37 2.86 -0.66 0.07 114.93 121.19 2qtc h MET 91 Ca 0.20 -0.06 0.04 0.00 -2.06 0.00 0.00 59.70 57.81 2qtc h MET 91 Cb 0.32 -0.22 -0.04 0.00 0.06 0.00 0.00 31.60 31.73 2qtc h MET 91 CO -0.00 0.66 0.02 1.15 1.06 0.00 0.00 176.91 179.79 2qtc h THR 92 N 1.00 0.84 -0.31 2.22 2.02 -0.80 -0.36 112.91 117.52 2qtc h THR 92 Ca 0.27 -0.03 -0.18 0.00 0.77 0.00 0.00 66.41 67.24 2qtc h THR 92 Cb -0.10 0.74 -0.00 0.00 -1.74 0.00 0.00 68.15 67.05 2qtc h THR 92 CO -0.06 0.02 -0.50 0.58 0.37 0.00 0.00 175.52 175.93 2qtc h VAL 93 N 0.10 1.27 -0.57 3.16 2.07 -1.14 -2.62 116.25 118.52 2qtc h VAL 93 Ca 0.12 -1.68 -0.08 0.00 0.82 0.00 0.00 66.70 65.88 2qtc h VAL 93 Cb 0.14 1.56 -0.02 0.00 -1.52 0.00 0.00 31.29 31.45 2qtc h VAL 93 CO -0.18 0.55 0.05 -0.07 0.02 0.00 0.00 177.57 177.94 2qtc h LEU 94 N 0.69 0.94 -1.21 2.57 3.38 -0.86 -0.73 115.31 120.09 2qtc h LEU 94 Ca 0.03 -0.28 -0.03 0.00 0.09 0.00 0.00 57.88 57.69 2qtc h LEU 94 Cb 1.11 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.58 2qtc h LEU 94 CO 0.11 0.99 0.24 0.03 0.09 0.00 0.00 178.44 179.90 2qtc h ARG 95 N 0.86 0.79 -0.38 1.13 3.08 -1.07 -0.65 114.38 118.14 2qtc h ARG 95 Ca 0.17 -0.11 -0.12 0.00 0.07 0.00 0.00 59.98 59.99 2qtc h ARG 95 Cb 0.48 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.37 2qtc h ARG 95 CO 0.02 0.63 -0.21 0.00 -1.07 0.00 0.00 179.97 179.34 2qtc h ALA 96 N 1.48 0.54 0.00 0.04 0.00 -1.10 -2.98 119.26 117.24 2qtc h ALA 96 Ca 0.19 -0.38 -0.07 0.00 0.00 0.00 0.00 54.91 54.66 2qtc h ALA 96 Cb 0.13 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2qtc h ALA 96 CO -0.02 0.51 -0.33 0.66 0.00 0.00 0.00 179.25 180.07 2qtc h SER 97 N 0.62 0.00 0.15 0.00 4.64 -0.53 -2.60 113.55 115.83 2qtc h SER 97 Ca 0.08 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.39 2qtc h SER 97 Cb 0.77 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.86 2qtc h SER 97 CO 0.06 0.33 -0.07 0.11 -0.87 0.00 0.00 176.83 176.39 2qtc h LYS 98 N 0.00 0.00 0.00 4.77 1.57 -0.97 -1.89 116.57 120.05 2qtc h LYS 98 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2qtc h LYS 98 Cb 0.68 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.99 2qtc h LYS 98 CO 0.04 0.07 0.00 0.87 -0.57 0.00 0.00 179.45 179.86 2qtc h LYS 99 N 0.00 0.00 -6.09 3.15 1.57 -1.51 -3.46 116.57 110.23 2qtc h LYS 99 Ca -0.00 0.00 -0.42 0.00 -1.87 0.00 0.00 60.65 58.36 2qtc h LYS 99 Cb 0.16 0.00 0.05 0.00 0.08 0.00 0.00 32.23 32.53 2qtc h LYS 99 CO 0.01 0.00 -0.83 -3.47 -0.57 0.00 0.00 179.45 174.59 2qtc n ASP 100 N -2.40 -1.19 -0.12 0.86 2.03 -0.71 -4.89 116.55 110.14 2qtc n ASP 100 Ca 0.01 -0.82 0.08 0.00 0.52 0.00 0.00 54.79 54.58 2qtc n ASP 100 Cb 0.21 -4.05 0.12 0.00 -0.72 0.00 0.00 41.12 36.68 2qtc n ASP 100 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2qtc n LEU 101 N -4.26 2.03 -3.78 -2.67 4.77 -1.26 -4.98 117.00 106.84 2qtc n LEU 101 Ca -0.30 -2.76 -0.29 0.00 -0.03 0.00 0.00 56.01 52.63 2qtc n LEU 101 Cb 0.68 -0.36 0.03 0.00 -2.33 0.00 0.00 43.42 41.44 2qtc n LEU 101 CO 0.68 0.64 0.11 -0.62 -1.33 0.00 0.00 177.39 176.87 2qtc n GLU 102 N -1.21 -5.68 -0.01 3.23 -0.58 -1.26 -4.89 120.64 110.24 2qtc n GLU 102 Ca 0.13 0.64 -0.08 0.00 -0.42 0.00 0.00 57.16 57.43 2qtc n GLU 102 Cb 0.63 -5.54 0.09 0.00 -0.57 0.00 0.00 31.44 26.05 2qtc n GLU 102 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 2qtc h LEU 103 N -2.05 0.63 0.00 -4.62 3.38 -1.94 -3.49 115.31 107.21 2qtc h LEU 103 Ca -0.57 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.12 2qtc h LEU 103 Cb 1.37 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.94 2qtc h LEU 103 CO 0.64 0.96 0.00 0.61 0.09 0.00 0.00 178.44 180.75 2qtc n GLY 104 N 0.01 -1.87 0.00 0.83 0.00 -1.26 -5.01 105.19 97.89 2qtc n GLY 104 Ca -0.02 -1.56 0.00 0.00 0.00 0.00 0.00 46.02 44.44 2qtc n GLY 104 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qtc n GLY 105 N 0.00 3.64 3.47 -0.02 0.00 -1.26 -4.80 105.19 106.22 2qtc n GLY 105 Ca 0.00 -1.69 -0.24 0.00 0.00 0.00 0.00 46.02 44.09 2qtc n GLY 105 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2qtc s HIS 106 N -2.17 2.30 0.00 1.61 3.76 -1.26 -5.05 115.29 114.48 2qtc s HIS 106 Ca 0.00 -0.33 0.00 0.00 -0.15 0.00 0.00 55.06 54.58 2qtc s HIS 106 Cb 0.00 -1.01 0.00 0.00 1.11 0.00 0.00 32.58 32.68 2qtc s HIS 106 CO 0.00 0.70 0.00 -1.33 -0.85 0.00 0.00 174.74 173.26 2qtc n MET 107 N -0.55 0.23 -0.28 1.40 2.81 -1.26 -4.84 117.12 114.62 2qtc n MET 107 Ca -0.06 0.00 -0.02 0.00 -1.81 0.00 0.00 57.70 55.81 2qtc n MET 107 Cb 0.60 -0.63 0.09 0.00 -0.71 0.00 0.00 33.22 32.57 2qtc n MET 107 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2qtc h ALA 108 N 0.00 1.03 -0.05 3.04 0.00 -1.96 -1.92 119.26 119.41 2qtc h ALA 108 Ca 0.00 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 2qtc h ALA 108 Cb 0.26 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 2qtc h ALA 108 CO 0.00 0.32 0.01 1.03 0.00 0.00 0.00 179.25 180.62 2qtc h SER 109 N 0.99 0.07 -0.29 0.00 0.87 -1.91 -2.09 113.55 111.19 2qtc h SER 109 Ca 0.31 -0.21 -0.04 0.00 -1.23 0.00 0.00 61.79 60.62 2qtc h SER 109 Cb -0.00 -0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 61.92 2qtc h SER 109 CO -0.11 0.26 0.06 0.15 -0.53 0.00 0.00 176.83 176.67 2qtc h PHE 110 N -0.13 0.57 -0.27 2.24 3.57 -1.83 -0.77 116.94 120.33 2qtc h PHE 110 Ca 0.01 -0.04 0.01 0.00 3.53 0.00 0.00 57.97 61.48 2qtc h PHE 110 Cb 0.22 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 38.77 2qtc h PHE 110 CO -0.00 0.52 0.18 1.96 -2.23 0.00 0.00 178.31 178.73 2qtc h GLN 111 N 0.55 0.31 0.00 1.11 1.08 -1.15 0.20 115.11 117.21 2qtc h GLN 111 Ca 0.12 -0.02 -0.15 0.00 -1.45 0.00 0.00 58.65 57.16 2qtc h GLN 111 Cb 0.26 -0.07 -0.02 0.00 -0.05 0.00 0.00 27.48 27.59 2qtc h GLN 111 CO 0.00 0.21 -0.71 0.66 -0.95 0.00 0.00 178.83 178.04 2qtc h SER 112 N 0.32 0.00 -0.12 1.46 4.64 -0.71 -3.36 113.55 115.78 2qtc h SER 112 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 2qtc h SER 112 Cb 0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 2qtc h SER 112 CO -0.02 0.71 0.00 -1.54 -0.87 0.00 0.00 176.83 175.11 2qtc n SER 113 N -3.37 2.12 -0.25 4.97 3.41 -0.74 -4.59 113.62 115.17 2qtc n SER 113 Ca 0.01 -1.62 0.04 0.00 -0.26 0.00 0.00 58.87 57.04 2qtc n SER 113 Cb 0.78 -0.07 0.17 0.00 -0.26 0.00 0.00 64.21 64.83 2qtc n SER 113 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qtc h ALA 114 N 1.65 1.01 -0.02 7.33 0.00 -0.78 -0.95 119.26 127.50 2qtc h ALA 114 Ca 0.00 0.11 -0.10 0.00 0.00 0.00 0.00 54.91 54.92 2qtc h ALA 114 Cb 0.49 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 2qtc h ALA 114 CO 0.00 -0.21 -0.47 1.15 0.00 0.00 0.00 179.25 179.71 2qtc h THR 115 N 0.43 1.34 -0.06 0.00 2.02 -1.85 0.16 112.91 114.95 2qtc h THR 115 Ca 0.40 -1.64 -0.01 0.00 0.77 0.00 0.00 66.41 65.93 2qtc h THR 115 Cb 0.59 1.86 -0.00 0.00 -1.74 0.00 0.00 68.15 68.86 2qtc h THR 115 CO -0.40 0.47 0.00 0.40 0.37 0.00 0.00 175.52 176.37 2qtc h ILE 116 N 0.05 1.24 -0.62 3.11 2.04 -1.38 -1.78 117.51 120.16 2qtc h ILE 116 Ca -0.00 -0.73 -0.08 0.00 1.00 0.00 0.00 64.86 65.05 2qtc h ILE 116 Cb 0.86 1.60 -0.02 0.00 -0.74 0.00 0.00 36.82 38.52 2qtc h ILE 116 CO 0.06 0.20 0.09 1.88 0.00 0.00 0.00 178.15 180.38 2qtc h TYR 117 N -0.16 1.10 -0.29 1.37 0.05 -1.14 -2.72 116.97 115.17 2qtc h TYR 117 Ca 0.02 -0.16 0.04 0.00 0.05 0.00 0.00 58.73 58.68 2qtc h TYR 117 Cb 0.32 -0.30 -0.04 0.00 1.01 0.00 0.00 36.73 37.72 2qtc h TYR 117 CO 0.03 0.95 0.06 0.22 -1.05 0.00 0.00 178.16 178.36 2qtc h ASP 118 N 0.94 0.02 -0.72 3.88 3.58 -0.55 0.14 116.42 123.71 2qtc h ASP 118 Ca 0.19 0.04 -0.01 0.00 0.42 0.00 0.00 57.03 57.67 2qtc h ASP 118 Cb 0.45 0.06 -0.04 0.00 1.72 0.00 0.00 39.33 41.52 2qtc h ASP 118 CO 0.01 0.05 0.42 0.58 -2.88 0.00 0.00 179.24 177.42 2qtc h VAL 119 N 0.17 1.21 -0.48 2.25 2.07 -1.26 0.50 116.25 120.72 2qtc h VAL 119 Ca 0.13 -0.49 -0.12 0.00 0.82 0.00 0.00 66.70 67.04 2qtc h VAL 119 Cb 0.14 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.09 2qtc h VAL 119 CO -0.17 0.23 -0.18 0.00 0.02 0.00 0.00 177.57 177.46 2qtc h PHE 121 N 0.82 0.32 0.00 0.00 0.04 -0.29 0.30 116.94 118.13 2qtc h PHE 121 Ca 0.11 -0.08 -0.06 0.00 2.80 0.00 0.00 57.97 60.74 2qtc h PHE 121 Cb 0.75 -0.08 -0.01 0.00 2.20 0.00 0.00 35.95 38.82 2qtc h PHE 121 CO 0.05 0.61 -0.74 -0.91 -0.60 0.00 0.00 178.31 176.72 2qtc h ASN 122 N 0.24 0.00 0.00 2.17 2.35 -0.70 -3.42 115.58 116.22 2qtc h ASN 122 Ca 0.03 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.78 2qtc h ASN 122 Cb 0.75 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.12 2qtc h ASN 122 CO 0.06 0.25 0.00 1.41 -1.65 0.00 0.00 177.43 177.50 2qtc n HIS 123 N -2.96 0.00 0.00 1.19 8.25 -0.02 -4.86 115.22 116.83 2qtc n HIS 123 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 2qtc n HIS 123 Cb 0.66 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.77 2qtc n HIS 123 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 2qtc n PHE 124 N -0.14 0.00 -1.65 4.41 3.72 0.07 -5.02 117.46 118.86 2qtc n PHE 124 Ca 0.00 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.97 2qtc n PHE 124 Cb 0.01 0.11 -0.03 0.00 -0.94 0.00 0.00 39.48 38.63 2qtc n PHE 124 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 2qtc s PHE 125 N -1.92 1.23 -0.08 1.38 0.08 0.82 -4.97 117.98 114.52 2qtc s PHE 125 Ca 0.00 0.12 -0.20 0.00 0.12 0.00 0.00 56.93 56.97 2qtc s PHE 125 Cb 0.00 -4.06 -0.04 0.00 -0.57 0.00 0.00 43.02 38.34 2qtc s PHE 125 CO 0.00 -4.68 0.57 1.03 -0.10 0.00 0.00 175.22 172.04 2qtc s ARG 126 N 5.53 4.36 0.61 0.44 0.52 -1.26 -4.80 118.95 124.35 2qtc s ARG 126 Ca 0.95 0.63 -0.05 0.00 -0.52 0.00 0.00 55.73 56.74 2qtc s ARG 126 Cb -0.37 -3.42 0.03 0.00 0.52 0.00 0.00 34.95 31.71 2qtc s ARG 126 CO 0.38 0.17 0.91 0.00 0.02 0.00 0.00 175.30 176.77 2qtc s ALA 127 N 0.52 3.34 0.34 2.13 0.00 0.37 -0.16 121.76 128.30 2qtc s ALA 127 Ca 0.30 -0.85 -0.28 0.00 0.00 0.00 0.00 51.96 51.14 2qtc s ALA 127 Cb -0.16 -2.52 -0.12 0.00 0.00 0.00 0.00 23.12 20.31 2qtc s ALA 127 CO 0.14 -0.92 1.29 -2.13 0.00 0.00 0.00 175.76 174.14 2qtc n ARG 128 N -2.63 2.12 -2.84 0.00 0.63 -1.23 -4.06 116.66 108.66 2qtc n ARG 128 Ca 0.06 0.74 -0.07 0.00 -0.92 0.00 0.00 57.85 57.66 2qtc n ARG 128 Cb 0.59 -2.33 -0.03 0.00 0.45 0.00 0.00 32.46 31.14 2qtc n ARG 128 CO 0.00 0.00 0.00 0.27 -2.51 0.00 0.00 177.63 175.39 2qtc n ASN 129 N 0.82 -0.30 0.29 6.15 0.23 -0.54 -4.84 115.26 117.07 2qtc n ASN 129 Ca 0.05 -1.84 0.17 0.00 -0.53 0.00 0.00 54.58 52.42 2qtc n ASN 129 Cb 0.36 0.68 0.83 0.00 -2.08 0.00 0.00 39.78 39.57 2qtc n ASN 129 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 2qtc h GLU 130 N 0.00 0.00 0.03 -3.83 4.81 -1.96 -3.27 114.58 110.36 2qtc h GLU 130 Ca -0.09 0.00 -0.36 0.00 -0.13 0.00 0.00 59.36 58.78 2qtc h GLU 130 Cb 0.47 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.79 2qtc h GLU 130 CO 0.13 0.06 -2.15 1.04 -0.73 0.00 0.00 179.01 177.36 2qtc n GLN 131 N -3.32 0.68 -3.90 1.92 1.13 -1.26 -5.05 117.38 107.58 2qtc n GLN 131 Ca -0.01 0.17 -0.08 0.00 -1.94 0.00 0.00 57.00 55.14 2qtc n GLN 131 Cb 0.22 -1.63 -0.02 0.00 0.11 0.00 0.00 30.24 28.92 2qtc n GLN 131 CO 0.00 0.00 0.00 0.16 -1.44 0.00 0.00 177.06 175.78 2qtc s ASP 132 N -6.28 -0.12 0.00 1.08 1.47 -1.23 -4.92 116.67 106.67 2qtc s ASP 132 Ca -0.18 -0.82 0.10 0.00 1.18 0.00 0.00 52.55 52.83 2qtc s ASP 132 Cb 0.07 0.70 0.60 0.00 -0.34 0.00 0.00 42.92 43.96 2qtc s ASP 132 CO 0.75 -1.33 1.09 0.61 0.68 0.00 0.00 175.17 176.97 2qtc n GLY 133 N -0.45 -0.59 7.00 2.12 0.00 -1.25 -1.47 105.19 110.55 2qtc n GLY 133 Ca -0.04 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.92 2qtc n GLY 133 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qtc n GLY 134 N 0.14 -1.69 3.76 -0.02 0.00 -1.26 -3.48 105.19 102.65 2qtc n GLY 134 Ca 0.08 -1.35 -0.39 0.00 0.00 0.00 0.00 46.02 44.36 2qtc n GLY 134 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2qtc s ASP 135 N -4.00 7.45 -0.53 1.61 1.01 0.77 -4.49 116.67 118.49 2qtc s ASP 135 Ca 0.00 1.93 -0.16 0.00 0.71 0.00 0.00 52.55 55.03 2qtc s ASP 135 Cb 0.00 -2.60 0.11 0.00 1.01 0.00 0.00 42.92 41.44 2qtc s ASP 135 CO 0.00 0.01 0.51 -0.76 0.21 0.00 0.00 175.17 175.14 2qtc s LEU 136 N -1.62 5.87 -0.29 1.23 1.43 -0.27 -4.86 118.68 120.16 2qtc s LEU 136 Ca 0.46 -1.57 -0.12 0.00 -1.03 0.00 0.00 54.13 51.86 2qtc s LEU 136 Cb -0.23 -2.23 -0.04 0.00 0.03 0.00 0.00 46.19 43.72 2qtc s LEU 136 CO 0.29 -0.84 0.26 -0.69 0.23 0.00 0.00 176.35 175.59 2qtc s VAL 137 N 1.82 5.26 -1.10 -1.59 1.01 -1.26 -1.16 120.40 123.37 2qtc s VAL 137 Ca 0.05 0.25 -0.12 0.00 0.00 0.00 0.00 61.98 62.15 2qtc s VAL 137 Cb -0.27 -3.61 0.21 0.00 0.00 0.00 0.00 36.38 32.71 2qtc s VAL 137 CO 0.05 0.18 1.21 -0.31 0.00 0.00 0.00 175.10 176.23 2qtc s TYR 138 N 1.86 3.80 0.24 5.22 1.51 0.18 -4.78 117.35 125.37 2qtc s TYR 138 Ca 0.09 -2.27 -0.31 0.00 -1.01 0.00 0.00 57.07 53.57 2qtc s TYR 138 Cb -0.16 -4.07 -0.12 0.00 -0.11 0.00 0.00 41.96 37.50 2qtc s TYR 138 CO 0.11 -1.19 1.69 -0.06 -1.11 0.00 0.00 175.55 174.99 2qtc s PHE 139 N 0.42 2.85 0.22 2.71 0.08 -1.26 -1.39 117.98 121.61 2qtc s PHE 139 Ca 0.34 0.46 -0.32 0.00 0.12 0.00 0.00 56.93 57.53 2qtc s PHE 139 Cb -0.07 -4.13 -0.13 0.00 -0.57 0.00 0.00 43.02 38.13 2qtc s PHE 139 CO -0.05 -4.16 1.62 0.94 -0.10 0.00 0.00 175.22 173.47 2qtc n GLN 140 N 3.45 2.52 -0.07 0.44 7.27 -1.23 -4.69 117.38 125.07 2qtc n GLN 140 Ca 0.14 0.90 -0.07 0.00 0.07 0.00 0.00 57.00 58.04 2qtc n GLN 140 Cb 0.36 -2.69 -0.01 0.00 2.41 0.00 0.00 30.24 30.30 2qtc n GLN 140 CO 0.00 0.00 0.00 0.78 0.07 0.00 0.00 177.06 177.91 2qtc h GLY 141 N 5.77 0.08 0.34 1.69 0.00 -1.88 -3.04 103.07 106.03 2qtc h GLY 141 Ca -0.45 0.18 0.00 0.00 0.00 0.00 0.00 47.33 47.07 2qtc h GLY 141 CO 0.88 -0.16 0.00 -2.39 0.00 0.00 0.00 176.54 174.87 2qtc n HIS 142 N -5.32 0.00 -0.56 5.60 -0.00 -1.26 -2.61 115.22 111.07 2qtc n HIS 142 Ca -0.00 0.00 0.09 0.00 -0.00 0.00 0.00 57.72 57.81 2qtc n HIS 142 Cb 0.23 0.00 0.32 0.00 -0.00 0.00 0.00 29.99 30.54 2qtc n HIS 142 CO 0.00 0.00 0.00 0.44 -0.00 0.00 0.00 176.34 176.78 2qtc n ILE 143 N -0.67 1.64 -0.28 0.61 -6.64 -1.15 -4.55 119.36 108.33 2qtc n ILE 143 Ca 0.07 -1.20 0.16 0.00 -1.77 0.00 0.00 62.75 60.01 2qtc n ILE 143 Cb 0.03 0.20 0.44 0.00 -1.44 0.00 0.00 39.64 38.88 2qtc n ILE 143 CO 0.00 0.00 0.00 0.77 -1.77 0.00 0.00 176.55 175.55 2qtc h SER 144 N 3.65 0.55 -0.81 7.28 4.64 -1.67 -0.33 113.55 126.85 2qtc h SER 144 Ca 0.00 0.06 0.10 0.00 -0.47 0.00 0.00 61.79 61.48 2qtc h SER 144 Cb 1.29 -0.05 -0.06 0.00 -0.31 0.00 0.00 62.40 63.28 2qtc h SER 144 CO 0.17 0.22 0.53 -0.65 -0.87 0.00 0.00 176.83 176.23 2qtc h PRO 145 N 0.55 0.70 -0.30 4.77 0.11 -1.87 0.24 132.00 136.20 2qtc h PRO 145 Ca 0.50 -0.04 -0.11 0.00 0.11 0.00 0.00 66.00 66.45 2qtc h PRO 145 Cb 1.03 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.97 2qtc h PRO 145 CO -0.23 0.46 -0.28 0.78 -0.21 0.00 0.00 178.00 178.52 2qtc h GLY 146 N 0.72 0.65 0.93 -0.55 0.00 -1.40 0.91 103.07 104.33 2qtc h GLY 146 Ca 0.38 -0.57 -0.11 0.00 0.00 0.00 0.00 47.33 47.04 2qtc h GLY 146 CO -0.15 0.51 -0.24 -2.08 0.00 0.00 0.00 176.54 174.58 2qtc h VAL 147 N 0.52 1.31 -0.62 4.60 2.07 -1.03 -1.81 116.25 121.28 2qtc h VAL 147 Ca 0.07 -1.40 -0.02 0.00 0.82 0.00 0.00 66.70 66.17 2qtc h VAL 147 Cb 0.75 1.60 -0.03 0.00 -1.52 0.00 0.00 31.29 32.09 2qtc h VAL 147 CO 0.06 0.44 0.31 1.88 0.02 0.00 0.00 177.57 180.28 2qtc h TYR 148 N 0.37 0.88 -0.60 1.57 0.05 -0.43 -0.77 116.97 118.03 2qtc h TYR 148 Ca 0.05 -0.04 0.05 0.00 0.05 0.00 0.00 58.73 58.84 2qtc h TYR 148 Cb 0.80 -0.27 -0.05 0.00 1.01 0.00 0.00 36.73 38.22 2qtc h TYR 148 CO 0.07 0.66 0.32 0.00 -1.05 0.00 0.00 178.16 178.16 2qtc h ALA 149 N 1.14 0.79 -0.26 3.88 0.00 -0.72 0.56 119.26 124.65 2qtc h ALA 149 Ca 0.21 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.09 2qtc h ALA 149 Cb 0.10 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2qtc h ALA 149 CO -0.03 -0.02 -0.07 -0.09 0.00 0.00 0.00 179.25 179.04 2qtc h ARG 150 N 0.60 0.50 -0.97 0.00 2.43 -1.04 -1.60 114.38 114.29 2qtc h ARG 150 Ca 0.27 -0.20 0.04 0.00 -0.81 0.00 0.00 59.98 59.29 2qtc h ARG 150 Cb 0.17 -0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 29.64 2qtc h ARG 150 CO -0.18 0.73 0.63 0.00 -1.51 0.00 0.00 179.97 179.64 2qtc h ALA 151 N 0.76 1.30 -0.42 2.80 0.00 -0.76 0.61 119.26 123.55 2qtc h ALA 151 Ca 0.06 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 2qtc h ALA 151 Cb 0.55 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 2qtc h ALA 151 CO 0.03 0.49 0.18 0.35 0.00 0.00 0.00 179.25 180.30 2qtc h PHE 152 N 1.21 0.63 -0.14 0.00 3.57 -0.77 0.16 116.94 121.59 2qtc h PHE 152 Ca 0.40 -0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.85 2qtc h PHE 152 Cb 0.04 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 38.59 2qtc h PHE 152 CO -0.01 0.53 0.06 1.25 -2.23 0.00 0.00 178.31 177.92 2qtc h LEU 153 N 0.54 0.17 -0.49 0.59 5.85 -0.20 0.16 115.31 121.93 2qtc h LEU 153 Ca 0.14 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.85 2qtc h LEU 153 Cb 0.16 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.15 2qtc h LEU 153 CO -0.01 0.16 0.00 -0.62 -0.34 0.00 0.00 178.44 177.62 2qtc n GLU 154 N -4.48 1.33 -1.29 1.25 1.02 0.09 -4.82 120.64 113.73 2qtc n GLU 154 Ca -0.01 -0.49 -0.07 0.00 -0.02 0.00 0.00 57.16 56.57 2qtc n GLU 154 Cb 0.11 -1.37 -0.03 0.00 -0.02 0.00 0.00 31.44 30.13 2qtc n GLU 154 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2qtc n GLY 155 N 0.97 0.87 0.06 0.62 0.00 0.04 -4.90 105.19 102.86 2qtc n GLY 155 Ca 0.16 -0.70 0.12 0.00 0.00 0.00 0.00 46.02 45.60 2qtc n GLY 155 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qtc n ARG 156 N -2.69 0.37 -4.14 1.61 1.74 0.50 -4.88 116.66 109.17 2qtc n ARG 156 Ca -0.07 0.06 -0.15 0.00 -0.77 0.00 0.00 57.85 56.91 2qtc n ARG 156 Cb 0.27 -1.68 -0.12 0.00 -1.02 0.00 0.00 32.46 29.90 2qtc n ARG 156 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2qtc s LEU 157 N -4.40 2.19 0.60 0.55 1.43 -1.21 -4.92 118.68 112.91 2qtc s LEU 157 Ca 0.03 -0.43 -0.05 0.00 -1.03 0.00 0.00 54.13 52.66 2qtc s LEU 157 Cb 0.13 -0.28 0.02 0.00 0.03 0.00 0.00 46.19 46.09 2qtc s LEU 157 CO 0.77 -0.09 0.89 0.42 0.23 0.00 0.00 176.35 178.56 2qtc s THR 158 N -0.99 3.32 0.27 5.49 -4.23 -1.26 -4.49 115.64 113.75 2qtc s THR 158 Ca -0.05 -0.16 -0.01 0.00 -1.18 0.00 0.00 61.69 60.29 2qtc s THR 158 Cb -0.08 -3.32 0.12 0.00 1.34 0.00 0.00 72.50 70.56 2qtc s THR 158 CO 0.01 -0.31 1.77 -0.61 -0.54 0.00 0.00 174.62 174.93 2qtc h GLN 159 N -0.18 0.76 -0.83 3.99 4.15 -1.99 -2.20 115.11 118.81 2qtc h GLN 159 Ca -0.45 -0.20 0.06 0.00 0.77 0.00 0.00 58.65 58.83 2qtc h GLN 159 Cb 1.27 -0.09 -0.06 0.00 0.21 0.00 0.00 27.48 28.81 2qtc h GLN 159 CO 0.59 0.77 0.51 1.49 -1.93 0.00 0.00 178.83 180.26 2qtc h GLU 160 N 0.71 0.90 -0.17 1.69 4.81 -1.94 0.27 114.58 120.86 2qtc h GLU 160 Ca 0.14 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.30 2qtc h GLU 160 Cb 0.44 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.61 2qtc h GLU 160 CO 0.02 0.59 0.06 1.96 -0.73 0.00 0.00 179.01 180.91 2qtc h GLN 161 N 0.92 0.26 -0.72 1.92 4.20 -1.57 -0.95 115.11 119.17 2qtc h GLN 161 Ca 0.36 -0.05 0.01 0.00 0.06 0.00 0.00 58.65 59.03 2qtc h GLN 161 Cb 0.18 -0.04 -0.04 0.00 0.30 0.00 0.00 27.48 27.88 2qtc h GLN 161 CO -0.18 0.37 0.47 -0.07 -0.67 0.00 0.00 178.83 178.76 2qtc h LEU 162 N 0.10 0.80 0.00 1.46 3.38 -0.96 0.20 115.31 120.29 2qtc h LEU 162 Ca 0.05 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2qtc h LEU 162 Cb 0.21 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.77 2qtc h LEU 162 CO -0.00 0.57 0.00 0.47 0.09 0.00 0.00 178.44 179.57 2qtc n ASP 163 N -4.44 0.00 -1.27 -0.43 8.00 0.89 -1.76 116.55 117.54 2qtc n ASP 163 Ca 0.08 0.50 -0.04 0.00 0.71 0.00 0.00 54.79 56.04 2qtc n ASP 163 Cb 0.06 -0.50 0.22 0.00 -0.02 0.00 0.00 41.12 40.88 2qtc n ASP 163 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2qtc n ASN 164 N -1.50 3.04 -4.71 -2.24 3.02 0.68 -4.95 115.26 108.60 2qtc n ASN 164 Ca 0.04 -3.57 -0.42 0.00 -0.03 0.00 0.00 54.58 50.60 2qtc n ASN 164 Cb 0.20 -0.65 -0.03 0.00 -0.61 0.00 0.00 39.78 38.69 2qtc n ASN 164 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 2qtc s PHE 165 N -3.15 2.67 -1.67 3.10 5.36 -0.72 -1.82 117.98 121.74 2qtc s PHE 165 Ca 0.46 0.22 0.00 0.00 -0.96 0.00 0.00 56.93 56.65 2qtc s PHE 165 Cb 0.40 -4.17 0.00 0.00 -0.34 0.00 0.00 43.02 38.92 2qtc s PHE 165 CO 0.04 -4.54 0.00 0.54 -1.46 0.00 0.00 175.22 169.80 2qtc n ARG 166 N 4.48 -1.29 -3.45 10.12 1.74 0.40 -4.87 116.66 123.79 2qtc n ARG 166 Ca 0.17 0.98 -0.28 0.00 -0.77 0.00 0.00 57.85 57.95 2qtc n ARG 166 Cb 0.36 -5.33 -0.11 0.00 -1.02 0.00 0.00 32.46 26.36 2qtc n ARG 166 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 2qtc s GLN 167 N -4.12 0.76 -0.06 5.56 -0.21 -0.76 -4.99 119.66 115.85 2qtc s GLN 167 Ca 0.00 -1.73 0.21 0.00 0.02 0.00 0.00 55.36 53.86 2qtc s GLN 167 Cb 0.00 -1.42 -0.31 0.00 1.00 0.00 0.00 33.01 32.28 2qtc s GLN 167 CO 0.00 -1.29 0.42 0.39 -2.12 0.00 0.00 175.29 172.69 2qtc n GLU 168 N 3.47 0.66 -0.33 2.91 1.02 -1.26 -3.85 120.64 123.27 2qtc n GLU 168 Ca 0.20 -0.15 0.11 0.00 -0.02 0.00 0.00 57.16 57.30 2qtc n GLU 168 Cb 0.42 -1.53 0.28 0.00 -0.02 0.00 0.00 31.44 30.58 2qtc n GLU 168 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2qtc h VAL 169 N 0.00 0.70 -0.16 2.62 2.07 -1.97 -1.70 116.25 117.81 2qtc h VAL 169 Ca -0.12 -0.23 0.00 0.00 0.82 0.00 0.00 66.70 67.17 2qtc h VAL 169 Cb 1.27 -0.04 0.00 0.00 -1.52 0.00 0.00 31.29 31.00 2qtc h VAL 169 CO 0.01 0.12 0.00 1.41 0.02 0.00 0.00 177.57 179.13 2qtc n HIS 170 N -4.83 0.21 -0.09 1.57 8.25 -1.26 -4.95 115.22 114.12 2qtc n HIS 170 Ca 0.21 -0.10 0.00 0.00 -0.26 0.00 0.00 57.72 57.56 2qtc n HIS 170 Cb 0.52 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.63 2qtc n HIS 170 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2qtc n GLY 171 N 0.86 0.97 2.41 -1.41 0.00 -0.64 -4.93 105.19 102.45 2qtc n GLY 171 Ca 0.09 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.96 2qtc n GLY 171 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2qtc n ASN 172 N 0.00 3.48 -3.43 1.61 5.15 -1.26 -5.06 115.26 115.75 2qtc n ASN 172 Ca 0.00 -3.08 -0.17 0.00 -0.60 0.00 0.00 54.58 50.73 2qtc n ASN 172 Cb 0.00 -0.42 -0.03 0.00 -0.53 0.00 0.00 39.78 38.80 2qtc n ASN 172 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2qtc n GLY 173 N -0.58 3.71 3.15 8.20 0.00 -1.25 -4.17 105.19 114.24 2qtc n GLY 173 Ca 0.28 -2.29 -0.26 0.00 0.00 0.00 0.00 46.02 43.76 2qtc n GLY 173 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qtc s LEU 174 N 0.00 1.97 0.55 0.99 1.43 -0.87 -4.87 118.68 117.88 2qtc s LEU 174 Ca 0.03 -0.34 -0.19 0.00 -1.03 0.00 0.00 54.13 52.60 2qtc s LEU 174 Cb -0.00 -0.94 -0.05 0.00 0.03 0.00 0.00 46.19 45.22 2qtc s LEU 174 CO 0.02 0.18 1.12 -0.44 0.23 0.00 0.00 176.35 177.46 2qtc s SER 175 N -0.17 5.69 0.29 2.29 0.01 -1.26 -0.46 113.70 120.09 2qtc s SER 175 Ca 0.01 2.14 -0.01 0.00 1.31 0.00 0.00 55.95 59.41 2qtc s SER 175 Cb -0.09 -2.58 0.47 0.00 0.21 0.00 0.00 66.02 64.03 2qtc s SER 175 CO 0.01 -1.24 1.90 0.77 0.41 0.00 0.00 173.24 175.09 2qtc h SER 176 N 1.09 0.97 -4.69 2.44 4.64 -1.96 -3.43 113.55 112.61 2qtc h SER 176 Ca -0.50 0.01 -0.47 0.00 -0.47 0.00 0.00 61.79 60.36 2qtc h SER 176 Cb 1.26 -0.20 -0.12 0.00 -0.31 0.00 0.00 62.40 63.03 2qtc h SER 176 CO 0.57 0.63 -0.44 -1.22 -0.87 0.00 0.00 176.83 175.50 2qtc n TYR 177 N -4.49 -0.47 -1.96 4.77 4.01 -1.26 -4.71 117.16 113.05 2qtc n TYR 177 Ca 0.14 -2.57 -0.40 0.00 -0.16 0.00 0.00 57.90 54.92 2qtc n TYR 177 Cb 0.18 0.18 -0.03 0.00 -0.31 0.00 0.00 39.34 39.37 2qtc n TYR 177 CO 0.00 0.00 0.00 -2.14 -0.46 0.00 0.00 176.86 174.26 2qtc s PRO 178 N -3.33 2.79 -0.36 -0.72 0.02 -1.26 -4.91 135.00 127.23 2qtc s PRO 178 Ca 0.32 0.99 0.00 0.00 0.02 0.00 0.00 61.00 62.33 2qtc s PRO 178 Cb 0.02 -4.35 0.12 0.00 0.02 0.00 0.00 34.50 30.30 2qtc s PRO 178 CO 0.22 -2.52 0.16 -1.01 -0.33 0.00 0.00 177.00 173.53 2qtc s HIS 179 N 8.78 1.63 0.33 6.54 3.76 -1.26 -3.90 115.29 131.17 2qtc s HIS 179 Ca 0.75 -1.94 0.07 0.00 -0.15 0.00 0.00 55.06 53.79 2qtc s HIS 179 Cb -0.16 -1.64 0.75 0.00 1.11 0.00 0.00 32.58 32.63 2qtc s HIS 179 CO 0.26 -0.84 1.83 -1.35 -0.85 0.00 0.00 174.74 173.79 2qtc h PRO 180 N 7.46 0.75 -0.53 8.40 0.11 -1.79 -0.83 132.00 145.57 2qtc h PRO 180 Ca -0.07 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.00 2qtc h PRO 180 Cb 0.98 -0.17 -0.03 0.00 0.11 0.00 0.00 31.00 31.89 2qtc h PRO 180 CO 0.45 0.49 0.34 -0.22 -0.21 0.00 0.00 178.00 178.85 2qtc h LYS 181 N 0.77 0.69 0.00 1.05 1.63 -1.38 -1.06 116.57 118.27 2qtc h LYS 181 Ca 0.50 -0.04 -0.23 0.00 -0.85 0.00 0.00 60.65 60.02 2qtc h LYS 181 Cb 0.75 -0.16 -0.04 0.00 -0.60 0.00 0.00 32.23 32.19 2qtc h LYS 181 CO -0.27 0.47 -1.40 -0.07 -3.45 0.00 0.00 179.45 174.73 2qtc h LEU 182 N 0.71 0.00 -6.20 5.20 3.38 -1.51 -3.40 115.31 113.49 2qtc h LEU 182 Ca 0.19 0.00 -0.58 0.00 0.09 0.00 0.00 57.88 57.58 2qtc h LEU 182 Cb -0.07 0.00 -0.39 0.00 0.09 0.00 0.00 40.66 40.28 2qtc h LEU 182 CO -0.04 0.87 -0.96 0.23 0.09 0.00 0.00 178.44 178.63 2qtc n MET 183 N -3.09 0.93 0.26 1.13 2.81 -0.56 -4.98 117.12 113.63 2qtc n MET 183 Ca -0.10 -3.52 0.18 0.00 -1.81 0.00 0.00 57.70 52.44 2qtc n MET 183 Cb 0.96 -1.57 0.94 0.00 -0.71 0.00 0.00 33.22 32.84 2qtc n MET 183 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 2qtc h PRO 184 N 4.55 0.00 -0.26 0.03 0.13 -1.42 -1.78 132.00 133.26 2qtc h PRO 184 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 2qtc h PRO 184 Cb 0.84 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.97 2qtc h PRO 184 CO 0.51 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.67 2qtc n GLU 185 N -2.74 2.01 0.02 0.86 1.02 -1.26 -4.30 120.64 116.24 2qtc n GLU 185 Ca -0.02 -1.85 -0.01 0.00 -0.02 0.00 0.00 57.16 55.26 2qtc n GLU 185 Cb 0.07 -1.34 -0.00 0.00 -0.02 0.00 0.00 31.44 30.16 2qtc n GLU 185 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2qtc n PHE 186 N 0.89 0.00 -2.13 -0.32 7.35 -0.69 -1.36 117.46 121.19 2qtc n PHE 186 Ca 0.13 0.00 -0.29 0.00 -0.76 0.00 0.00 57.45 56.52 2qtc n PHE 186 Cb 0.44 -0.03 0.02 0.00 0.35 0.00 0.00 39.48 40.26 2qtc n PHE 186 CO 0.00 0.00 0.00 -1.58 -0.76 0.00 0.00 176.76 174.42 2qtc s TRP 187 N -1.55 3.50 0.00 -5.13 0.52 -1.06 -2.60 118.94 112.62 2qtc s TRP 187 Ca -0.02 1.03 0.00 0.00 0.02 0.00 0.00 56.10 57.14 2qtc s TRP 187 Cb 0.00 -2.69 0.00 0.00 -1.15 0.00 0.00 33.47 29.63 2qtc s TRP 187 CO 0.03 -0.71 0.00 1.04 0.02 0.00 0.00 176.95 177.33 2qtc n GLN 188 N -2.66 0.00 -4.00 4.98 6.02 -1.26 -4.50 117.38 115.95 2qtc n GLN 188 Ca 0.05 0.00 -0.30 0.00 -0.01 0.00 0.00 57.00 56.74 2qtc n GLN 188 Cb 0.55 -0.68 -0.16 0.00 1.02 0.00 0.00 30.24 30.97 2qtc n GLN 188 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 2qtc s PHE 189 N -1.75 2.22 -0.08 1.08 0.08 -1.26 -4.81 117.98 113.47 2qtc s PHE 189 Ca 0.00 -1.33 -0.30 0.00 0.12 0.00 0.00 56.93 55.42 2qtc s PHE 189 Cb 0.00 -1.59 -0.04 0.00 -0.57 0.00 0.00 43.02 40.81 2qtc s PHE 189 CO 0.00 -0.69 1.51 -2.14 -0.10 0.00 0.00 175.22 173.80 2qtc s PRO 190 N 1.47 4.21 0.00 0.24 0.02 -1.25 -4.78 135.00 134.90 2qtc s PRO 190 Ca 0.03 2.01 0.00 0.00 0.02 0.00 0.00 61.00 63.05 2qtc s PRO 190 Cb -0.14 -3.86 0.00 0.00 0.02 0.00 0.00 34.50 30.52 2qtc s PRO 190 CO -0.10 -0.77 0.01 0.25 -0.33 0.00 0.00 177.00 176.07 2qtc n THR 191 N 5.33 0.00 0.30 0.99 -2.24 -1.26 -4.68 114.28 112.72 2qtc n THR 191 Ca 0.16 -0.28 0.18 0.00 -2.27 0.00 0.00 64.05 61.84 2qtc n THR 191 Cb 0.43 1.02 0.94 0.00 -2.10 0.00 0.00 70.33 70.63 2qtc n THR 191 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 2qtc h VAL 192 N 0.02 0.26 -2.89 2.28 3.04 -1.88 -3.32 116.25 113.75 2qtc h VAL 192 Ca 0.00 -0.24 -0.59 0.00 -1.01 0.00 0.00 66.70 64.86 2qtc h VAL 192 Cb 0.01 1.18 -0.11 0.00 -2.01 0.00 0.00 31.29 30.37 2qtc h VAL 192 CO 0.00 0.03 0.76 -0.55 -1.01 0.00 0.00 177.57 176.81 2qtc s SER 193 N -5.71 6.29 0.49 3.17 0.15 -1.26 -4.94 113.70 111.89 2qtc s SER 193 Ca -0.03 -0.41 -0.23 0.00 0.70 0.00 0.00 55.95 55.97 2qtc s SER 193 Cb 0.13 -2.49 -0.07 0.00 -1.71 0.00 0.00 66.02 61.88 2qtc s SER 193 CO 0.51 -1.47 1.19 0.23 1.20 0.00 0.00 173.24 174.90 2qtc n MET 194 N 8.16 1.56 0.00 5.44 2.81 -1.25 -2.67 117.12 131.16 2qtc n MET 194 Ca 0.02 0.57 0.00 0.00 -1.81 0.00 0.00 57.70 56.48 2qtc n MET 194 Cb 0.48 -2.34 0.00 0.00 -0.71 0.00 0.00 33.22 30.65 2qtc n MET 194 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2qtc n GLY 195 N 0.95 3.08 0.15 3.03 0.00 -1.26 -4.86 105.19 106.28 2qtc n GLY 195 Ca 0.10 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.97 2qtc n GLY 195 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2qtc h LEU 196 N 0.00 0.57 -0.42 0.99 4.07 -1.82 -3.29 115.31 115.41 2qtc h LEU 196 Ca 0.00 -0.48 0.04 0.00 0.08 0.00 0.00 57.88 57.52 2qtc h LEU 196 Cb 0.00 -0.18 -0.04 0.00 1.08 0.00 0.00 40.66 41.52 2qtc h LEU 196 CO 0.00 1.30 0.17 1.23 -1.08 0.00 0.00 178.44 180.06 2qtc h GLY 197 N 1.16 0.55 0.86 0.83 0.00 -1.82 0.29 103.07 104.94 2qtc h GLY 197 Ca -0.10 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.12 2qtc h GLY 197 CO 0.18 0.06 -0.15 -2.55 0.00 0.00 0.00 176.54 174.08 2qtc h PRO 198 N 0.36 -0.32 -0.00 4.80 0.11 -1.90 0.15 132.00 135.18 2qtc h PRO 198 Ca 0.19 0.02 -0.13 0.00 0.11 0.00 0.00 66.00 66.19 2qtc h PRO 198 Cb 0.14 0.07 -0.02 0.00 0.11 0.00 0.00 31.00 31.31 2qtc h PRO 198 CO -0.17 -0.22 -0.62 0.97 -0.21 0.00 0.00 178.00 177.76 2qtc h ILE 199 N -0.34 1.44 -0.67 4.15 2.10 -1.59 -1.93 117.51 120.67 2qtc h ILE 199 Ca -0.01 -2.12 -0.08 0.00 1.08 0.00 0.00 64.86 63.73 2qtc h ILE 199 Cb 0.30 2.14 -0.03 0.00 -1.09 0.00 0.00 36.82 38.15 2qtc h ILE 199 CO -0.02 0.61 0.11 1.23 -1.08 0.00 0.00 178.15 178.99 2qtc h GLY 200 N 1.84 1.21 0.99 8.18 0.00 -0.24 -2.75 103.07 112.30 2qtc h GLY 200 Ca -0.01 -0.81 -0.08 0.00 0.00 0.00 0.00 47.33 46.44 2qtc h GLY 200 CO 0.08 0.75 -0.03 0.00 0.00 0.00 0.00 176.54 177.34 2qtc h ALA 201 N 1.05 0.61 -0.44 3.60 0.00 -0.43 -1.42 119.26 122.23 2qtc h ALA 201 Ca 0.20 -0.29 0.03 0.00 0.00 0.00 0.00 54.91 54.85 2qtc h ALA 201 Cb 0.45 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.04 2qtc h ALA 201 CO 0.01 0.43 0.23 0.82 0.00 0.00 0.00 179.25 180.75 2qtc h ILE 202 N 0.66 0.99 0.00 0.00 2.04 -1.24 -0.28 117.51 119.67 2qtc h ILE 202 Ca 0.12 -0.16 0.00 0.00 1.00 0.00 0.00 64.86 65.82 2qtc h ILE 202 Cb 0.55 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 37.11 2qtc h ILE 202 CO 0.03 0.08 0.00 1.88 0.00 0.00 0.00 178.15 180.14 2qtc h TYR 203 N 0.46 0.00 0.04 1.37 -1.99 -1.42 -1.64 116.97 113.79 2qtc h TYR 203 Ca 0.19 0.00 -0.19 0.00 2.00 0.00 0.00 58.73 60.72 2qtc h TYR 203 Cb 0.08 0.00 0.02 0.00 2.00 0.00 0.00 36.73 38.82 2qtc h TYR 203 CO -0.09 0.00 -0.78 0.37 -0.00 0.00 0.00 178.16 177.65 2qtc h GLN 204 N 0.00 0.45 -0.76 4.88 5.75 -0.77 -0.98 115.11 123.67 2qtc h GLN 204 Ca 0.00 -0.55 -0.04 0.00 -0.15 0.00 0.00 58.65 57.92 2qtc h GLN 204 Cb 0.79 0.17 -0.03 0.00 1.07 0.00 0.00 27.48 29.48 2qtc h GLN 204 CO 0.00 1.19 0.33 0.00 -2.65 0.00 0.00 178.83 177.71 2qtc h ALA 205 N 0.28 1.14 -0.30 3.38 0.00 -0.90 -0.84 119.26 122.02 2qtc h ALA 205 Ca -0.11 -0.17 -0.10 0.00 0.00 0.00 0.00 54.91 54.53 2qtc h ALA 205 Cb 1.50 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 2qtc h ALA 205 CO 0.15 0.63 -0.22 -0.22 0.00 0.00 0.00 179.25 179.59 2qtc h LYS 206 N 1.10 0.58 -0.31 0.00 3.64 -1.27 -2.41 116.57 117.89 2qtc h LYS 206 Ca 0.26 -0.21 -0.14 0.00 -1.27 0.00 0.00 60.65 59.29 2qtc h LYS 206 Cb 0.17 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 2qtc h LYS 206 CO -0.03 0.75 -0.37 0.35 -2.27 0.00 0.00 179.45 177.88 2qtc h PHE 207 N 0.51 0.86 -0.74 1.91 3.57 -0.43 -1.53 116.94 121.11 2qtc h PHE 207 Ca 0.08 -0.25 -0.00 0.00 3.53 0.00 0.00 57.97 61.33 2qtc h PHE 207 Cb 0.65 -0.19 -0.04 0.00 2.79 0.00 0.00 35.95 39.17 2qtc h PHE 207 CO 0.03 0.99 0.44 -0.07 -2.23 0.00 0.00 178.31 177.47 2qtc h LEU 208 N 0.60 0.89 -0.69 0.59 3.38 -0.88 0.18 115.31 119.38 2qtc h LEU 208 Ca 0.05 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 2qtc h LEU 208 Cb 0.91 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.41 2qtc h LEU 208 CO 0.08 0.69 0.40 0.11 0.09 0.00 0.00 178.44 179.81 2qtc h LYS 209 N 1.01 0.95 -0.43 1.13 1.79 -1.27 -1.93 116.57 117.83 2qtc h LYS 209 Ca 0.26 -0.10 0.04 0.00 -2.18 0.00 0.00 60.65 58.67 2qtc h LYS 209 Cb -0.03 -0.19 -0.04 0.00 -1.58 0.00 0.00 32.23 30.38 2qtc h LYS 209 CO -0.05 0.70 0.19 -0.92 -1.08 0.00 0.00 179.45 178.29 2qtc h TYR 210 N 0.95 0.35 -0.66 -1.35 3.20 -0.34 0.87 116.97 119.99 2qtc h TYR 210 Ca 0.25 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.13 2qtc h TYR 210 Cb 0.00 -0.10 -0.03 0.00 1.54 0.00 0.00 36.73 38.15 2qtc h TYR 210 CO -0.01 0.17 0.37 -0.07 -1.64 0.00 0.00 178.16 176.98 2qtc h LEU 211 N 0.39 0.80 -0.03 2.82 4.07 -0.61 0.47 115.31 123.22 2qtc h LEU 211 Ca 0.19 -0.05 -0.02 0.00 0.08 0.00 0.00 57.88 58.07 2qtc h LEU 211 Cb 0.12 -0.20 0.00 0.00 1.08 0.00 0.00 40.66 41.66 2qtc h LEU 211 CO -0.15 0.64 -0.07 -0.08 -1.08 0.00 0.00 178.44 177.70 2qtc h GLU 212 N 0.91 0.09 -0.05 1.13 4.81 -0.54 -1.07 114.58 119.87 2qtc h GLU 212 Ca 0.24 -0.07 0.01 0.00 -0.13 0.00 0.00 59.36 59.41 2qtc h GLU 212 Cb 0.00 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.39 2qtc h GLU 212 CO -0.04 0.67 0.03 0.45 -0.73 0.00 0.00 179.01 179.39 2qtc h HIS 213 N -0.47 0.03 -0.01 0.92 3.86 -0.52 -0.41 115.15 118.55 2qtc h HIS 213 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2qtc h HIS 213 Cb 0.68 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 29.14 2qtc h HIS 213 CO 0.13 0.02 -0.08 0.54 0.86 0.00 0.00 177.93 179.40 2qtc n ARG 214 N -4.53 1.05 -1.71 2.45 1.74 0.12 -4.37 116.66 111.40 2qtc n ARG 214 Ca -0.02 -0.45 -0.10 0.00 -0.77 0.00 0.00 57.85 56.51 2qtc n ARG 214 Cb 0.11 -1.49 -0.02 0.00 -1.02 0.00 0.00 32.46 30.04 2qtc n ARG 214 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2qtc n GLY 215 N 1.21 0.58 0.10 -0.13 0.00 -0.16 -4.92 105.19 101.88 2qtc n GLY 215 Ca 0.17 -0.53 -0.13 0.00 0.00 0.00 0.00 46.02 45.53 2qtc n GLY 215 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2qtc n LEU 216 N -1.26 1.45 -3.63 0.99 4.77 -0.45 -4.97 117.00 113.89 2qtc n LEU 216 Ca -0.11 0.26 -0.12 0.00 -0.03 0.00 0.00 56.01 56.01 2qtc n LEU 216 Cb 0.45 -0.25 -0.07 0.00 -2.33 0.00 0.00 43.42 41.21 2qtc n LEU 216 CO 0.14 0.58 0.42 -0.75 -1.33 0.00 0.00 177.39 176.45 2qtc s LYS 217 N -2.57 0.79 -0.46 3.23 2.20 -0.94 -5.03 119.74 116.97 2qtc s LYS 217 Ca -0.13 1.03 -0.28 0.00 -0.36 0.00 0.00 55.97 56.24 2qtc s LYS 217 Cb 0.07 0.34 0.03 0.00 -1.51 0.00 0.00 37.83 36.76 2qtc s LYS 217 CO 0.79 -0.11 1.05 0.34 -0.36 0.00 0.00 175.35 177.07 2qtc s ASP 218 N 0.67 6.60 -0.07 1.43 -1.08 -1.26 -3.02 116.67 119.94 2qtc s ASP 218 Ca -0.02 0.38 0.11 0.00 -0.52 0.00 0.00 52.55 52.50 2qtc s ASP 218 Cb -0.05 -2.51 0.27 0.00 -1.46 0.00 0.00 42.92 39.17 2qtc s ASP 218 CO -0.04 -1.15 1.20 0.35 0.52 0.00 0.00 175.17 176.05 2qtc n THR 219 N 6.62 1.52 0.30 1.71 -2.24 -1.26 -4.71 114.28 116.22 2qtc n THR 219 Ca 0.10 -1.52 0.20 0.00 -2.27 0.00 0.00 64.05 60.56 2qtc n THR 219 Cb 0.49 0.14 1.06 0.00 -2.10 0.00 0.00 70.33 69.92 2qtc n THR 219 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 2qtc h SER 220 N 0.92 0.00 -0.11 3.42 4.64 -1.91 -1.31 113.55 119.20 2qtc h SER 220 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2qtc h SER 220 Cb 0.90 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.99 2qtc h SER 220 CO 0.05 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.30 2qtc n LYS 221 N -2.88 1.94 -3.82 4.77 5.02 -1.26 -4.89 118.16 117.04 2qtc n LYS 221 Ca -0.03 -1.38 -0.36 0.00 -2.02 0.00 0.00 58.31 54.53 2qtc n LYS 221 Cb 0.07 -1.46 -0.06 0.00 -0.02 0.00 0.00 35.03 33.56 2qtc n LYS 221 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2qtc s GLN 222 N -1.87 3.52 -0.02 1.97 -0.21 -0.50 -4.85 119.66 117.71 2qtc s GLN 222 Ca 0.34 -0.11 0.06 0.00 0.02 0.00 0.00 55.36 55.67 2qtc s GLN 222 Cb 0.20 -3.14 -0.01 0.00 1.00 0.00 0.00 33.01 31.06 2qtc s GLN 222 CO 0.30 0.71 -0.19 0.99 -2.12 0.00 0.00 175.29 174.99 2qtc s THR 223 N -1.17 1.53 -0.27 -0.19 2.01 -1.26 -4.88 115.64 111.40 2qtc s THR 223 Ca 0.22 -0.82 -0.10 0.00 0.31 0.00 0.00 61.69 61.30 2qtc s THR 223 Cb -0.13 -1.27 -0.04 0.00 0.01 0.00 0.00 72.50 71.07 2qtc s THR 223 CO 0.11 0.43 0.15 -0.69 -0.69 0.00 0.00 174.62 173.93 2qtc s VAL 224 N -0.41 4.95 -0.16 3.82 1.01 0.74 -1.12 120.40 129.23 2qtc s VAL 224 Ca 0.06 0.05 -0.03 0.00 0.00 0.00 0.00 61.98 62.05 2qtc s VAL 224 Cb -0.08 -3.35 -0.02 0.00 0.00 0.00 0.00 36.38 32.93 2qtc s VAL 224 CO -0.00 0.28 -0.04 -0.31 0.00 0.00 0.00 175.10 175.02 2qtc s TYR 225 N 1.71 2.99 -0.30 5.22 2.02 -0.31 -0.66 117.35 128.01 2qtc s TYR 225 Ca 0.07 -0.41 -0.01 0.00 -0.37 0.00 0.00 57.07 56.35 2qtc s TYR 225 Cb -0.16 -1.97 0.06 0.00 -0.40 0.00 0.00 41.96 39.49 2qtc s TYR 225 CO 0.08 -0.13 -0.00 0.00 -1.57 0.00 0.00 175.55 173.94 2qtc s ALA 226 N 0.54 2.80 -0.42 3.71 0.00 -0.52 -0.65 121.76 127.23 2qtc s ALA 226 Ca -0.03 -1.88 -0.22 0.00 0.00 0.00 0.00 51.96 49.82 2qtc s ALA 226 Cb -0.14 -1.91 0.02 0.00 0.00 0.00 0.00 23.12 21.08 2qtc s ALA 226 CO 0.03 -1.33 0.74 -0.06 0.00 0.00 0.00 175.76 175.14 2qtc s PHE 227 N 1.19 3.05 0.25 0.00 0.40 -0.48 -0.87 117.98 121.52 2qtc s PHE 227 Ca -0.04 0.25 0.11 0.00 -0.60 0.00 0.00 56.93 56.64 2qtc s PHE 227 Cb -0.20 -3.49 -0.05 0.00 0.51 0.00 0.00 43.02 39.80 2qtc s PHE 227 CO -0.03 -0.86 -0.12 -0.51 0.70 0.00 0.00 175.22 174.40 2qtc s LEU 228 N 3.10 2.84 0.36 -0.37 1.43 -0.12 -3.56 118.68 122.36 2qtc s LEU 228 Ca 0.28 -0.81 0.03 0.00 -1.03 0.00 0.00 54.13 52.61 2qtc s LEU 228 Cb -0.13 -1.41 -0.01 0.00 0.03 0.00 0.00 46.19 44.67 2qtc s LEU 228 CO 0.20 0.05 0.53 -0.83 0.23 0.00 0.00 176.35 176.52 2qtc s GLY 229 N -3.36 1.49 0.08 -3.19 0.00 -1.26 -0.87 107.32 100.21 2qtc s GLY 229 Ca 0.29 -1.21 -0.07 0.00 0.00 0.00 0.00 44.72 43.73 2qtc s GLY 229 CO 0.16 -1.12 1.16 1.29 0.00 0.00 0.00 173.10 174.59 2qtc h ASP 230 N 0.75 0.55 -0.76 1.64 3.04 -1.81 -3.20 116.42 116.64 2qtc h ASP 230 Ca -0.47 -0.54 -0.05 0.00 -3.24 0.00 0.00 57.03 52.72 2qtc h ASP 230 Cb 1.25 -0.18 -0.03 0.00 -1.04 0.00 0.00 39.33 39.33 2qtc h ASP 230 CO 0.57 1.40 0.28 1.23 -2.04 0.00 0.00 179.24 180.67 2qtc h GLY 231 N 1.20 1.24 1.55 7.15 0.00 -1.88 -1.93 103.07 110.40 2qtc h GLY 231 Ca -0.14 -0.70 0.05 0.00 0.00 0.00 0.00 47.33 46.54 2qtc h GLY 231 CO 0.21 0.65 0.18 -2.09 0.00 0.00 0.00 176.54 175.49 2qtc h GLU 232 N 1.12 0.00 0.00 4.80 4.81 -1.94 -2.05 114.58 121.32 2qtc h GLU 232 Ca 0.25 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.48 2qtc h GLU 232 Cb 0.25 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.63 2qtc h GLU 232 CO -0.02 0.00 0.00 -1.33 -0.73 0.00 0.00 179.01 176.93 2qtc n MET 233 N -3.91 0.02 0.22 1.92 2.81 -0.72 -1.68 117.12 115.78 2qtc n MET 233 Ca 0.01 0.34 0.14 0.00 -1.81 0.00 0.00 57.70 56.38 2qtc n MET 233 Cb 0.30 -1.50 0.37 0.00 -0.71 0.00 0.00 33.22 31.69 2qtc n MET 233 CO 0.00 0.00 0.00 -0.44 1.51 0.00 0.00 175.97 177.04 2qtc h ASP 234 N 0.00 0.00 -3.17 7.83 5.19 -1.53 -3.41 116.42 121.33 2qtc h ASP 234 Ca 0.00 0.00 -0.53 0.00 -0.62 0.00 0.00 57.03 55.88 2qtc h ASP 234 Cb 0.13 0.00 0.03 0.00 0.18 0.00 0.00 39.33 39.68 2qtc h ASP 234 CO 0.00 0.00 0.72 -1.61 -3.12 0.00 0.00 179.24 175.23 2qtc s GLU 235 N -3.35 4.32 0.40 3.56 0.41 -0.68 -4.87 118.70 118.49 2qtc s GLU 235 Ca 0.05 2.14 0.14 0.00 -0.41 0.00 0.00 54.97 56.89 2qtc s GLU 235 Cb 0.07 -3.20 0.98 0.00 -1.78 0.00 0.00 34.13 30.20 2qtc s GLU 235 CO 0.61 -0.39 1.89 -1.35 -0.49 0.00 0.00 175.26 175.53 2qtc h PRO 236 N 6.03 0.49 0.00 0.39 0.11 -1.90 0.16 132.00 137.29 2qtc h PRO 236 Ca -0.44 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.62 2qtc h PRO 236 Cb 1.21 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 32.21 2qtc h PRO 236 CO 0.82 0.33 -0.09 0.93 -0.21 0.00 0.00 178.00 179.78 2qtc h GLU 237 N 0.51 0.00 -0.30 1.05 3.07 -1.89 0.10 114.58 117.12 2qtc h GLU 237 Ca 0.41 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 59.26 2qtc h GLU 237 Cb 0.85 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.74 2qtc h GLU 237 CO -0.16 0.09 0.13 0.77 -1.40 0.00 0.00 179.01 178.45 2qtc h SER 238 N 0.00 0.40 0.00 1.42 0.02 -0.81 -3.34 113.55 111.24 2qtc h SER 238 Ca -0.00 -0.14 0.00 0.00 -0.84 0.00 0.00 61.79 60.81 2qtc h SER 238 Cb 0.22 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.66 2qtc h SER 238 CO 0.01 0.43 -0.45 0.29 -1.14 0.00 0.00 176.83 175.97 2qtc n LYS 239 N -4.76 4.09 0.21 3.45 5.02 -1.21 -4.70 118.16 120.26 2qtc n LYS 239 Ca -0.02 -0.01 0.12 0.00 -2.02 0.00 0.00 58.31 56.38 2qtc n LYS 239 Cb 0.12 -0.89 0.62 0.00 -0.02 0.00 0.00 35.03 34.86 2qtc n LYS 239 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 2qtc h GLY 240 N 1.76 0.00 -0.10 0.72 0.00 -1.09 -2.30 103.07 102.06 2qtc h GLY 240 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2qtc h GLY 240 CO 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 176.54 176.49 2qtc n ALA 241 N -1.76 1.77 0.33 3.60 0.00 -1.26 -4.77 120.51 118.42 2qtc n ALA 241 Ca -0.02 -1.14 0.22 0.00 0.00 0.00 0.00 53.44 52.51 2qtc n ALA 241 Cb 0.20 -0.11 1.18 0.00 0.00 0.00 0.00 19.45 20.72 2qtc n ALA 241 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 177.50 176.66 2qtc h ILE 242 N 1.53 0.07 -0.10 0.00 3.07 -1.70 -0.26 117.51 120.12 2qtc h ILE 242 Ca 0.00 -0.01 -0.07 0.00 1.55 0.00 0.00 64.86 66.34 2qtc h ILE 242 Cb 0.81 1.00 -0.01 0.00 -0.27 0.00 0.00 36.82 38.36 2qtc h ILE 242 CO 0.00 0.00 -0.25 0.74 -1.05 0.00 0.00 178.15 177.59 2qtc h THR 243 N 0.00 1.22 -0.56 0.16 2.02 -1.85 -2.66 112.91 111.24 2qtc h THR 243 Ca -0.00 -1.05 0.00 0.00 0.77 0.00 0.00 66.41 66.13 2qtc h THR 243 Cb 0.00 1.42 -0.03 0.00 -1.74 0.00 0.00 68.15 67.81 2qtc h THR 243 CO 0.00 0.32 0.36 0.40 0.37 0.00 0.00 175.52 176.97 2qtc h ILE 244 N 0.17 1.15 0.00 3.11 5.03 -1.41 -1.10 117.51 124.45 2qtc h ILE 244 Ca 0.03 -0.27 -0.03 0.00 -0.12 0.00 0.00 64.86 64.47 2qtc h ILE 244 Cb 0.53 0.33 -0.00 0.00 -3.03 0.00 0.00 36.82 34.65 2qtc h ILE 244 CO 0.04 0.14 -0.13 0.00 -0.68 0.00 0.00 178.15 177.52 2qtc h ALA 245 N 1.65 1.66 0.23 1.87 0.00 -1.61 -1.00 119.26 122.05 2qtc h ALA 245 Ca 0.20 -0.12 -0.32 0.00 0.00 0.00 0.00 54.91 54.67 2qtc h ALA 245 Cb -0.08 -0.02 0.03 0.00 0.00 0.00 0.00 17.79 17.72 2qtc h ALA 245 CO -0.04 0.16 -1.47 1.15 0.00 0.00 0.00 179.25 179.05 2qtc h THR 246 N 0.00 1.22 -0.76 0.00 2.02 -1.32 -0.95 112.91 113.12 2qtc h THR 246 Ca -0.00 -2.63 0.05 0.00 0.77 0.00 0.00 66.41 64.60 2qtc h THR 246 Cb 0.25 2.99 -0.05 0.00 -1.74 0.00 0.00 68.15 69.59 2qtc h THR 246 CO 0.02 0.81 0.46 0.03 0.37 0.00 0.00 175.52 177.20 2qtc h ARG 247 N 0.06 0.83 -0.64 6.66 3.08 -0.96 -2.18 114.38 121.23 2qtc h ARG 247 Ca -0.27 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 59.73 2qtc h ARG 247 Cb 2.09 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 31.95 2qtc h ARG 247 CO 0.23 0.55 0.00 0.39 -1.07 0.00 0.00 179.97 180.07 2qtc n GLU 248 N -4.69 2.87 -4.00 0.04 -0.58 -0.42 -4.97 120.64 108.90 2qtc n GLU 248 Ca 0.10 -2.40 -0.31 0.00 -0.42 0.00 0.00 57.16 54.13 2qtc n GLU 248 Cb 0.15 -1.63 -0.02 0.00 -0.57 0.00 0.00 31.44 29.37 2qtc n GLU 248 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2qtc n LYS 249 N 1.22 -1.92 -1.43 3.49 5.02 -0.82 -4.81 118.16 118.90 2qtc n LYS 249 Ca 0.22 0.30 -0.40 0.00 -2.02 0.00 0.00 58.31 56.41 2qtc n LYS 249 Cb 0.65 -3.93 -0.02 0.00 -0.02 0.00 0.00 35.03 31.71 2qtc n LYS 249 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2qtc n LEU 250 N -4.51 6.64 -0.29 -0.35 4.77 -0.40 -4.33 117.00 118.52 2qtc n LEU 250 Ca -0.24 -3.85 0.00 0.00 -0.03 0.00 0.00 56.01 51.89 2qtc n LEU 250 Cb 0.65 -1.48 0.00 0.00 -2.33 0.00 0.00 43.42 40.26 2qtc n LEU 250 CO 0.75 1.03 0.25 -0.90 -1.33 0.00 0.00 177.39 177.19 2qtc n ASP 251 N 5.57 0.42 -0.56 -1.43 5.68 -1.22 -1.94 116.55 123.06 2qtc n ASP 251 Ca 0.57 -1.42 0.08 0.00 -0.50 0.00 0.00 54.79 53.52 2qtc n ASP 251 Cb 0.33 -0.21 0.20 0.00 -1.14 0.00 0.00 41.12 40.30 2qtc n ASP 251 CO 0.00 0.00 0.00 -0.46 -1.33 0.00 0.00 177.20 175.41 2qtc n ASN 252 N -0.12 3.22 -4.15 -1.12 6.94 -1.26 -4.92 115.26 113.85 2qtc n ASN 252 Ca 0.00 -2.93 -0.28 0.00 -0.02 0.00 0.00 54.58 51.36 2qtc n ASN 252 Cb 0.10 -0.46 -0.16 0.00 -2.36 0.00 0.00 39.78 36.90 2qtc n ASN 252 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 2qtc s LEU 253 N -2.64 1.91 -0.09 -4.53 2.96 -0.82 -0.19 118.68 115.29 2qtc s LEU 253 Ca 0.36 -0.40 -0.01 0.00 -0.22 0.00 0.00 54.13 53.85 2qtc s LEU 253 Cb 0.29 -1.08 0.03 0.00 0.50 0.00 0.00 46.19 45.93 2qtc s LEU 253 CO 0.07 0.14 -0.01 -0.69 -1.32 0.00 0.00 176.35 174.54 2qtc s VAL 254 N 0.20 0.53 -0.08 1.68 1.01 0.16 -2.64 120.40 121.25 2qtc s VAL 254 Ca -0.09 -0.02 -0.16 0.00 0.00 0.00 0.00 61.98 61.70 2qtc s VAL 254 Cb -0.14 -0.69 -0.05 0.00 0.00 0.00 0.00 36.38 35.51 2qtc s VAL 254 CO 0.04 0.24 0.43 -0.36 0.00 0.00 0.00 175.10 175.45 2qtc s PHE 255 N 1.91 3.58 -0.30 5.22 0.40 0.17 -1.43 117.98 127.52 2qtc s PHE 255 Ca 0.04 0.89 0.03 0.00 -0.60 0.00 0.00 56.93 57.29 2qtc s PHE 255 Cb -0.13 -2.43 0.08 0.00 0.51 0.00 0.00 43.02 41.05 2qtc s PHE 255 CO -0.06 0.34 -0.02 0.08 0.70 0.00 0.00 175.22 176.27 2qtc s VAL 256 N 0.01 2.14 -0.27 -0.44 1.01 -0.05 0.03 120.40 122.83 2qtc s VAL 256 Ca 0.24 -1.98 -0.11 0.00 0.00 0.00 0.00 61.98 60.13 2qtc s VAL 256 Cb -0.15 -2.44 -0.05 0.00 0.00 0.00 0.00 36.38 33.73 2qtc s VAL 256 CO 0.10 -0.35 0.18 -0.63 0.00 0.00 0.00 175.10 174.40 2qtc s ILE 257 N 1.03 5.32 -0.72 2.22 1.01 -0.02 -0.95 121.20 129.10 2qtc s ILE 257 Ca 0.02 0.17 -0.26 0.00 0.00 0.00 0.00 60.65 60.58 2qtc s ILE 257 Cb -0.19 -3.52 0.04 0.00 0.01 0.00 0.00 42.46 38.79 2qtc s ILE 257 CO -0.07 0.28 1.23 0.21 0.00 0.00 0.00 174.94 176.59 2qtc s ASN 258 N 1.56 6.17 -1.22 3.58 2.47 -0.05 -2.03 114.94 125.42 2qtc s ASN 258 Ca 0.07 -0.51 -0.12 0.00 0.42 0.00 0.00 52.86 52.72 2qtc s ASN 258 Cb -0.15 -2.54 0.18 0.00 -1.45 0.00 0.00 41.25 37.29 2qtc s ASN 258 CO 0.09 -1.77 1.51 0.00 -3.72 0.00 0.00 177.10 173.21 2qtc n ASN 260 N 5.04 1.92 0.00 0.00 0.23 -1.26 -1.81 115.26 119.38 2qtc n ASN 260 Ca 0.37 -1.79 0.00 0.00 -0.53 0.00 0.00 54.58 52.62 2qtc n ASN 260 Cb 0.41 -0.15 0.00 0.00 -2.08 0.00 0.00 39.78 37.96 2qtc n ASN 260 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 2qtc n LEU 261 N 0.50 0.50 -4.33 -4.53 4.77 -1.26 -4.41 117.00 108.24 2qtc n LEU 261 Ca 0.16 0.00 -0.27 0.00 -0.03 0.00 0.00 56.01 55.87 2qtc n LEU 261 Cb 0.36 -0.76 -0.13 0.00 -2.33 0.00 0.00 43.42 40.56 2qtc n LEU 261 CO 0.12 -0.25 -0.55 -1.10 -1.33 0.00 0.00 177.39 174.29 2qtc s GLN 262 N -0.50 1.40 0.00 3.23 -0.21 -1.26 -1.04 119.66 121.28 2qtc s GLN 262 Ca 0.00 -1.19 0.00 0.00 0.02 0.00 0.00 55.36 54.19 2qtc s GLN 262 Cb 0.00 -1.72 0.00 0.00 1.00 0.00 0.00 33.01 32.29 2qtc s GLN 262 CO 0.00 0.42 0.00 2.89 -2.12 0.00 0.00 175.29 176.48 2qtc n ARG 263 N 1.25 3.87 -0.01 2.91 1.85 -0.00 -4.42 116.66 122.12 2qtc n ARG 263 Ca -0.18 0.00 -0.09 0.00 -1.00 0.00 0.00 57.85 56.58 2qtc n ARG 263 Cb 0.53 0.00 -0.07 0.00 -1.05 0.00 0.00 32.46 31.87 2qtc n ARG 263 CO 0.00 0.00 0.00 1.25 -0.01 0.00 0.00 177.63 178.87 2qtc h LEU 264 N 0.00 -0.08 -1.07 2.89 5.85 -2.00 -3.37 115.31 117.52 2qtc h LEU 264 Ca 0.00 -0.46 0.00 0.00 0.84 0.00 0.00 57.88 58.26 2qtc h LEU 264 Cb 0.00 0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.05 2qtc h LEU 264 CO 0.00 0.59 0.00 0.47 -0.34 0.00 0.00 178.44 179.16 2qtc n ASP 265 N -4.79 1.62 0.00 1.25 8.00 -1.26 -5.01 116.55 116.35 2qtc n ASP 265 Ca -0.06 -1.67 0.00 0.00 0.71 0.00 0.00 54.79 53.77 2qtc n ASP 265 Cb 0.26 -0.09 0.00 0.00 -0.02 0.00 0.00 41.12 41.28 2qtc n ASP 265 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2qtc n GLY 266 N 1.14 -1.30 3.78 0.44 0.00 -1.26 -5.15 105.19 102.83 2qtc n GLY 266 Ca 0.17 -1.05 -0.34 0.00 0.00 0.00 0.00 46.02 44.80 2qtc n GLY 266 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2qtc s PRO 267 N -1.18 3.14 0.07 1.61 0.04 -1.26 -0.82 135.00 136.60 2qtc s PRO 267 Ca 0.00 1.47 -0.26 0.00 0.04 0.00 0.00 61.00 62.25 2qtc s PRO 267 Cb 0.00 -1.99 -0.16 0.00 0.04 0.00 0.00 34.50 32.39 2qtc s PRO 267 CO 0.00 -0.99 1.64 0.28 0.04 0.00 0.00 177.00 177.97 2qtc h VAL 268 N 0.66 0.83 -1.89 -0.36 2.07 -1.38 -3.39 116.25 112.79 2qtc h VAL 268 Ca -0.48 -0.11 -0.45 0.00 0.82 0.00 0.00 66.70 66.48 2qtc h VAL 268 Cb 1.25 0.89 -0.31 0.00 -1.52 0.00 0.00 31.29 31.61 2qtc h VAL 268 CO 0.56 0.03 -0.82 0.35 0.02 0.00 0.00 177.57 177.70 2qtc n THR 269 N -5.18 -0.81 -0.24 2.57 -2.24 -1.26 -5.02 114.28 102.09 2qtc n THR 269 Ca -0.09 -2.65 0.13 0.00 -2.27 0.00 0.00 64.05 59.16 2qtc n THR 269 Cb 0.15 -0.78 0.41 0.00 -2.10 0.00 0.00 70.33 68.01 2qtc n THR 269 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2qtc h GLY 270 N 5.36 1.07 -0.52 3.38 0.00 -1.90 -0.50 103.07 109.95 2qtc h GLY 270 Ca 0.19 -0.27 0.00 0.00 0.00 0.00 0.00 47.33 47.25 2qtc h GLY 270 CO 0.26 0.09 0.00 0.70 0.00 0.00 0.00 176.54 177.59 2qtc n ASN 271 N -4.54 1.28 0.00 0.19 4.13 -1.26 -0.35 115.26 114.71 2qtc n ASN 271 Ca 0.16 -1.66 0.00 0.00 1.68 0.00 0.00 54.58 54.76 2qtc n ASN 271 Cb 0.48 -0.09 0.00 0.00 -1.54 0.00 0.00 39.78 38.63 2qtc n ASN 271 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2qtc n GLY 272 N 1.04 6.26 2.62 7.41 0.00 -0.20 -4.91 105.19 117.41 2qtc n GLY 272 Ca 0.15 -1.67 -0.29 0.00 0.00 0.00 0.00 46.02 44.21 2qtc n GLY 272 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qtc s LYS 273 N 1.16 0.70 0.37 1.61 1.02 -1.26 -1.14 119.74 122.20 2qtc s LYS 273 Ca 0.00 -1.24 0.09 0.00 0.02 0.00 0.00 55.97 54.84 2qtc s LYS 273 Cb 0.00 -1.73 0.84 0.00 -0.52 0.00 0.00 37.83 36.42 2qtc s LYS 273 CO 0.00 -1.09 1.91 -0.84 -0.92 0.00 0.00 175.35 174.41 2qtc h ILE 274 N 5.82 0.89 -0.69 2.17 3.07 -1.97 -1.14 117.51 125.66 2qtc h ILE 274 Ca -0.07 -0.22 -0.02 0.00 1.55 0.00 0.00 64.86 66.09 2qtc h ILE 274 Cb 0.98 0.18 -0.03 0.00 -0.27 0.00 0.00 36.82 37.68 2qtc h ILE 274 CO 0.41 0.12 0.34 0.40 -1.05 0.00 0.00 178.15 178.37 2qtc h ILE 275 N 0.66 1.23 -0.37 0.16 2.04 -1.98 0.11 117.51 119.36 2qtc h ILE 275 Ca 0.39 -0.63 -0.12 0.00 1.00 0.00 0.00 64.86 65.50 2qtc h ILE 275 Cb 0.59 0.38 -0.01 0.00 -0.74 0.00 0.00 36.82 37.04 2qtc h ILE 275 CO -0.15 0.26 -0.24 0.78 0.00 0.00 0.00 178.15 178.80 2qtc h ASN 276 N 0.95 0.77 -0.25 1.72 4.21 -1.68 0.13 115.58 121.43 2qtc h ASN 276 Ca 0.24 -0.28 0.00 0.00 1.21 0.00 0.00 56.30 57.47 2qtc h ASN 276 Cb 0.11 -0.21 -0.01 0.00 -1.12 0.00 0.00 38.32 37.09 2qtc h ASN 276 CO -0.03 0.98 0.17 -0.08 -1.29 0.00 0.00 177.43 177.18 2qtc h GLU 277 N 0.65 0.33 -0.43 0.81 4.81 -0.65 0.18 114.58 120.29 2qtc h GLU 277 Ca 0.09 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.29 2qtc h GLU 277 Cb 0.75 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.04 2qtc h GLU 277 CO 0.06 0.22 0.23 -0.07 -0.73 0.00 0.00 179.01 178.72 2qtc h LEU 278 N 0.34 0.54 -0.73 1.64 4.07 -0.42 -1.86 115.31 118.89 2qtc h LEU 278 Ca 0.09 -0.09 -0.02 0.00 0.08 0.00 0.00 57.88 57.94 2qtc h LEU 278 Cb -0.04 -0.14 -0.03 0.00 1.08 0.00 0.00 40.66 41.53 2qtc h LEU 278 CO -0.02 0.48 0.39 -0.08 -1.08 0.00 0.00 178.44 178.12 2qtc h GLU 279 N 0.55 1.02 -0.43 1.13 4.81 -0.42 -1.06 114.58 120.18 2qtc h GLU 279 Ca 0.15 -0.13 0.02 0.00 -0.13 0.00 0.00 59.36 59.27 2qtc h GLU 279 Cb 0.06 -0.20 -0.03 0.00 0.63 0.00 0.00 28.75 29.22 2qtc h GLU 279 CO -0.02 0.77 0.26 0.78 -0.73 0.00 0.00 179.01 180.07 2qtc h GLY 280 N 1.00 0.61 1.38 1.92 0.00 -0.18 -0.49 103.07 107.31 2qtc h GLY 280 Ca 0.25 -0.20 -0.32 0.00 0.00 0.00 0.00 47.33 47.07 2qtc h GLY 280 CO -0.04 0.17 -1.40 1.19 0.00 0.00 0.00 176.54 176.46 2qtc h ILE 281 N 0.52 1.35 -0.49 2.60 2.10 -1.18 -2.20 117.51 120.20 2qtc h ILE 281 Ca 0.17 -2.80 -0.05 0.00 1.08 0.00 0.00 64.86 63.27 2qtc h ILE 281 Cb 0.00 3.00 -0.02 0.00 -1.09 0.00 0.00 36.82 38.71 2qtc h ILE 281 CO -0.08 0.83 0.12 -0.26 -1.08 0.00 0.00 178.15 177.69 2qtc h PHE 282 N 0.13 0.83 -0.42 2.19 -1.00 -1.19 0.43 116.94 117.92 2qtc h PHE 282 Ca -0.22 -0.10 0.01 0.00 2.81 0.00 0.00 57.97 60.47 2qtc h PHE 282 Cb 2.10 -0.23 -0.02 0.00 3.61 0.00 0.00 35.95 41.40 2qtc h PHE 282 CO 0.11 0.74 0.27 1.49 -1.61 0.00 0.00 178.31 179.31 2qtc h GLU 283 N 0.67 0.54 -0.57 1.51 4.57 -1.15 -0.60 114.58 119.55 2qtc h GLU 283 Ca 0.15 -0.03 0.01 0.00 -1.18 0.00 0.00 59.36 58.31 2qtc h GLU 283 Cb 0.33 -0.12 -0.03 0.00 -0.16 0.00 0.00 28.75 28.77 2qtc h GLU 283 CO 0.00 0.36 0.38 0.78 -1.18 0.00 0.00 179.01 179.35 2qtc h GLY 284 N 0.55 0.79 0.98 1.92 0.00 -1.07 0.26 103.07 106.51 2qtc h GLY 284 Ca 0.15 -0.29 0.00 0.00 0.00 0.00 0.00 47.33 47.19 2qtc h GLY 284 CO -0.04 0.28 0.00 0.00 0.00 0.00 0.00 176.54 176.78 2qtc n ALA 285 N -2.45 2.54 -0.71 3.60 0.00 0.11 -4.89 120.51 118.72 2qtc n ALA 285 Ca 0.06 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.32 2qtc n ALA 285 Cb 0.06 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.06 2qtc n ALA 285 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qtc n GLY 286 N 0.75 0.57 3.93 0.00 0.00 0.93 -4.61 105.19 106.76 2qtc n GLY 286 Ca 0.21 -0.77 -0.25 0.00 0.00 0.00 0.00 46.02 45.21 2qtc n GLY 286 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2qtc s TRP 287 N -2.00 3.47 -0.26 1.61 0.52 -0.32 -4.75 118.94 117.21 2qtc s TRP 287 Ca 0.00 0.56 -0.21 0.00 0.02 0.00 0.00 56.10 56.46 2qtc s TRP 287 Cb 0.00 -2.20 -0.01 0.00 -1.15 0.00 0.00 33.47 30.11 2qtc s TRP 287 CO 0.00 -0.19 0.68 1.21 0.02 0.00 0.00 176.95 178.67 2qtc s ASN 288 N -4.11 6.62 -0.18 2.95 2.47 -0.26 -4.40 114.94 118.02 2qtc s ASN 288 Ca 0.45 0.72 -0.06 0.00 0.42 0.00 0.00 52.86 54.40 2qtc s ASN 288 Cb -0.10 -2.36 -0.03 0.00 -1.45 0.00 0.00 41.25 37.31 2qtc s ASN 288 CO 0.41 -0.44 0.01 0.68 -3.72 0.00 0.00 177.10 174.05 2qtc s VAL 289 N 2.62 4.26 -0.21 -5.21 -7.23 -1.26 -1.23 120.40 112.15 2qtc s VAL 289 Ca 0.28 -0.22 0.02 0.00 -1.81 0.00 0.00 61.98 60.25 2qtc s VAL 289 Cb -0.15 -2.91 0.03 0.00 0.56 0.00 0.00 36.38 33.91 2qtc s VAL 289 CO 0.09 0.46 -0.17 -0.63 -0.31 0.00 0.00 175.10 174.55 2qtc s ILE 290 N 0.55 2.12 -0.15 -0.62 1.01 -0.41 -4.99 121.20 118.70 2qtc s ILE 290 Ca 0.00 -1.19 -0.16 0.00 0.00 0.00 0.00 60.65 59.31 2qtc s ILE 290 Cb -0.14 -2.02 -0.04 0.00 0.01 0.00 0.00 42.46 40.27 2qtc s ILE 290 CO 0.02 0.33 0.37 -0.54 0.00 0.00 0.00 174.94 175.12 2qtc s LYS 291 N 1.22 4.27 -0.58 2.79 1.02 -1.26 -0.98 119.74 126.22 2qtc s LYS 291 Ca -0.00 0.23 0.02 0.00 0.02 0.00 0.00 55.97 56.25 2qtc s LYS 291 Cb -0.16 -3.45 0.15 0.00 -0.52 0.00 0.00 37.83 33.85 2qtc s LYS 291 CO -0.10 0.16 0.35 0.08 -0.92 0.00 0.00 175.35 174.92 2qtc s VAL 292 N 0.68 2.95 -0.22 3.17 1.01 0.26 -1.28 120.40 126.97 2qtc s VAL 292 Ca 0.20 -3.41 -0.19 0.00 0.00 0.00 0.00 61.98 58.59 2qtc s VAL 292 Cb -0.14 -2.99 -0.16 0.00 0.00 0.00 0.00 36.38 33.09 2qtc s VAL 292 CO 0.07 -0.86 0.03 0.23 0.00 0.00 0.00 175.10 174.57 2qtc n MET 293 N 2.99 0.56 -4.44 2.72 2.00 -1.26 -1.14 117.12 118.55 2qtc n MET 293 Ca 0.08 0.49 -0.23 0.00 0.00 0.00 0.00 57.70 58.04 2qtc n MET 293 Cb 0.34 -1.67 -0.13 0.00 0.00 0.00 0.00 33.22 31.75 2qtc n MET 293 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 175.97 174.39 2qtc s TRP 294 N -2.40 1.62 1.12 2.03 0.52 -1.26 0.01 118.94 120.57 2qtc s TRP 294 Ca -0.31 -0.39 -0.19 0.00 0.02 0.00 0.00 56.10 55.24 2qtc s TRP 294 Cb 0.08 -0.94 0.26 0.00 -1.15 0.00 0.00 33.47 31.72 2qtc s TRP 294 CO 0.54 0.11 1.22 0.20 0.02 0.00 0.00 176.95 179.04 2qtc s GLY 295 N -1.41 1.69 0.56 0.98 0.00 -0.79 -4.13 107.32 104.21 2qtc s GLY 295 Ca 0.05 -1.16 0.29 0.00 0.00 0.00 0.00 44.72 43.90 2qtc s GLY 295 CO 0.02 -0.28 2.16 1.76 0.00 0.00 0.00 173.10 176.76 2qtc h SER 296 N -2.25 0.00 0.78 1.64 0.02 -1.93 -2.75 113.55 109.05 2qtc h SER 296 Ca -0.44 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.51 2qtc h SER 296 Cb 1.25 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.79 2qtc h SER 296 CO 0.32 0.06 0.00 0.03 -1.14 0.00 0.00 176.83 176.10 2qtc h ARG 297 N 0.00 0.00 0.00 3.45 3.08 -1.93 -2.54 114.38 116.44 2qtc h ARG 297 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2qtc h ARG 297 Cb 0.19 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.24 2qtc h ARG 297 CO 0.01 0.00 -0.08 -1.49 -1.07 0.00 0.00 179.97 177.34 2qtc h TRP 298 N 0.00 0.00 -0.26 3.04 4.06 -1.85 -3.37 115.95 117.57 2qtc h TRP 298 Ca 0.00 0.00 0.05 0.00 2.06 0.00 0.00 58.89 61.00 2qtc h TRP 298 Cb 0.39 0.00 -0.04 0.00 -1.00 0.00 0.00 29.16 28.50 2qtc h TRP 298 CO 0.00 0.00 -0.02 -0.44 -3.56 0.00 0.00 178.44 174.42 2qtc h ASP 299 N 0.00 -0.15 -0.63 -3.49 3.32 -1.60 0.51 116.42 114.37 2qtc h ASP 299 Ca 0.00 0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.12 2qtc h ASP 299 Cb 0.99 0.12 -0.03 0.00 0.22 0.00 0.00 39.33 40.63 2qtc h ASP 299 CO 0.00 -0.05 0.41 1.05 -1.72 0.00 0.00 179.24 178.93 2qtc h GLU 300 N 0.05 0.83 -0.01 3.56 4.11 -1.78 0.13 114.58 121.47 2qtc h GLU 300 Ca 0.12 -0.06 0.03 0.00 0.07 0.00 0.00 59.36 59.52 2qtc h GLU 300 Cb 0.17 -0.18 -0.04 0.00 0.50 0.00 0.00 28.75 29.20 2qtc h GLU 300 CO -0.23 0.56 -0.19 -0.07 0.07 0.00 0.00 179.01 179.16 2qtc h LEU 301 N 0.85 -0.55 -1.18 3.06 4.07 -1.62 -0.11 115.31 119.84 2qtc h LEU 301 Ca 0.23 0.08 -0.04 0.00 0.08 0.00 0.00 57.88 58.23 2qtc h LEU 301 Cb -0.08 0.23 -0.02 0.00 1.08 0.00 0.00 40.66 41.87 2qtc h LEU 301 CO -0.05 -0.25 0.16 -0.07 -1.08 0.00 0.00 178.44 177.16 2qtc h LEU 302 N -0.30 0.68 -0.06 1.67 3.38 -0.49 -2.83 115.31 117.36 2qtc h LEU 302 Ca 0.06 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 2qtc h LEU 302 Cb 0.38 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 2qtc h LEU 302 CO -0.18 0.64 -0.05 -0.09 0.09 0.00 0.00 178.44 178.85 2qtc h ARG 303 N 0.73 0.13 0.00 1.13 2.43 -0.48 -3.24 114.38 115.08 2qtc h ARG 303 Ca 0.17 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 2qtc h ARG 303 Cb 0.20 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.76 2qtc h ARG 303 CO -0.01 0.57 0.00 1.57 -1.51 0.00 0.00 179.97 180.59 2qtc h LYS 304 N -0.30 0.00 -6.04 0.20 2.10 -0.99 -3.40 116.57 108.14 2qtc h LYS 304 Ca 0.01 0.00 -0.62 0.00 -2.00 0.00 0.00 60.65 58.04 2qtc h LYS 304 Cb 0.54 0.00 -0.09 0.00 -0.90 0.00 0.00 32.23 31.77 2qtc h LYS 304 CO 0.01 0.00 1.68 0.34 -2.00 0.00 0.00 179.45 179.48 2qtc s ASP 305 N -5.33 6.57 0.39 7.07 2.15 -1.07 -4.80 116.67 121.66 2qtc s ASP 305 Ca 0.02 -1.71 0.28 0.00 0.43 0.00 0.00 52.55 51.57 2qtc s ASP 305 Cb 0.09 -2.57 1.05 0.00 -0.30 0.00 0.00 42.92 41.18 2qtc s ASP 305 CO 0.51 -1.44 1.82 0.71 -0.17 0.00 0.00 175.17 176.60 2qtc h THR 306 N 6.47 0.00 0.00 1.71 1.35 -1.87 -3.17 112.91 117.40 2qtc h THR 306 Ca 0.27 -0.46 -0.05 0.00 -0.55 0.00 0.00 66.41 65.61 2qtc h THR 306 Cb 0.97 1.37 -0.01 0.00 -1.73 0.00 0.00 68.15 68.75 2qtc h THR 306 CO 1.44 0.00 -0.24 0.77 -0.25 0.00 0.00 175.52 177.23 2qtc h SER 307 N 0.00 0.00 0.00 5.36 4.64 -1.98 -3.47 113.55 118.10 2qtc h SER 307 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2qtc h SER 307 Cb 0.54 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.63 2qtc h SER 307 CO 0.00 0.24 0.00 0.61 -0.87 0.00 0.00 176.83 176.81 2qtc n GLY 308 N 0.52 0.93 0.22 -0.77 0.00 -1.20 -4.91 105.19 99.97 2qtc n GLY 308 Ca 0.01 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.01 2qtc n GLY 308 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qtc h LYS 309 N 2.85 0.34 -0.62 1.61 1.79 -1.91 -2.09 116.57 118.54 2qtc h LYS 309 Ca 0.00 -0.14 -0.02 0.00 -2.18 0.00 0.00 60.65 58.31 2qtc h LYS 309 Cb 0.00 -0.01 -0.03 0.00 -1.58 0.00 0.00 32.23 30.61 2qtc h LYS 309 CO 0.00 0.63 0.31 1.25 -1.08 0.00 0.00 179.45 180.56 2qtc h LEU 310 N 0.29 0.80 -0.22 2.94 5.85 -1.91 0.20 115.31 123.26 2qtc h LEU 310 Ca 0.04 -0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.63 2qtc h LEU 310 Cb 0.72 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.54 2qtc h LEU 310 CO 0.06 0.69 0.09 0.40 -0.34 0.00 0.00 178.44 179.33 2qtc h ILE 311 N 0.84 1.17 -0.54 4.05 2.04 -1.93 0.01 117.51 123.15 2qtc h ILE 311 Ca 0.21 -0.50 0.08 0.00 1.00 0.00 0.00 64.86 65.66 2qtc h ILE 311 Cb 0.09 1.09 -0.07 0.00 -0.74 0.00 0.00 36.82 37.20 2qtc h ILE 311 CO -0.03 0.16 0.18 -0.61 0.00 0.00 0.00 178.15 177.85 2qtc h GLN 312 N 0.20 0.33 -0.65 2.37 4.15 -0.92 0.19 115.11 120.78 2qtc h GLN 312 Ca 0.07 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.48 2qtc h GLN 312 Cb 0.18 -0.07 -0.03 0.00 0.21 0.00 0.00 27.48 27.76 2qtc h GLN 312 CO -0.01 0.22 0.42 1.25 -1.93 0.00 0.00 178.83 178.78 2qtc h LEU 313 N 0.34 0.76 -0.79 -2.39 5.85 -0.31 -0.87 115.31 117.91 2qtc h LEU 313 Ca 0.27 -0.04 -0.11 0.00 0.84 0.00 0.00 57.88 58.85 2qtc h LEU 313 Cb 0.33 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.15 2qtc h LEU 313 CO -0.29 0.57 -0.23 0.24 -0.34 0.00 0.00 178.44 178.39 2qtc h MET 314 N 0.89 0.66 -0.44 1.25 2.86 0.06 -2.54 114.93 117.67 2qtc h MET 314 Ca 0.24 -0.26 -0.05 0.00 -2.06 0.00 0.00 59.70 57.57 2qtc h MET 314 Cb -0.07 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 31.53 2qtc h MET 314 CO -0.05 0.83 0.08 -0.91 1.06 0.00 0.00 176.91 177.93 2qtc h ASN 315 N 0.58 0.69 1.48 1.22 2.35 -0.10 -3.26 115.58 118.54 2qtc h ASN 315 Ca 0.08 -0.25 -0.09 0.00 -0.55 0.00 0.00 56.30 55.49 2qtc h ASN 315 Cb 0.70 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.88 2qtc h ASN 315 CO 0.05 0.76 -0.44 1.05 -1.65 0.00 0.00 177.43 177.21 2qtc h GLU 316 N 0.58 0.00 -6.66 0.81 4.11 -1.14 -3.46 114.58 108.83 2qtc h GLU 316 Ca 0.14 0.00 -0.52 0.00 0.07 0.00 0.00 59.36 59.04 2qtc h GLU 316 Cb 0.36 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.64 2qtc h GLU 316 CO 0.01 0.44 0.67 0.99 0.07 0.00 0.00 179.01 181.19 2qtc s THR 317 N -3.05 3.18 0.46 -1.06 2.01 -0.96 -5.02 115.64 111.20 2qtc s THR 317 Ca 0.04 0.95 -0.01 0.00 0.31 0.00 0.00 61.69 62.98 2qtc s THR 317 Cb 0.08 -3.61 -0.01 0.00 0.01 0.00 0.00 72.50 68.97 2qtc s THR 317 CO 0.73 0.13 0.70 0.68 -0.69 0.00 0.00 174.62 176.17 2qtc s VAL 318 N 0.28 4.20 0.25 3.82 -7.23 -1.26 -4.95 120.40 115.50 2qtc s VAL 318 Ca 0.58 -0.35 -0.04 0.00 -1.81 0.00 0.00 61.98 60.36 2qtc s VAL 318 Cb -0.37 -3.57 0.23 0.00 0.56 0.00 0.00 36.38 33.23 2qtc s VAL 318 CO 0.37 -0.44 1.71 0.44 -0.31 0.00 0.00 175.10 176.88 2qtc h ASP 319 N 0.35 0.19 -0.94 4.85 3.32 -1.16 -1.83 116.42 121.19 2qtc h ASP 319 Ca -0.47 0.12 0.12 0.00 0.02 0.00 0.00 57.03 56.83 2qtc h ASP 319 Cb 1.24 0.13 -0.08 0.00 0.22 0.00 0.00 39.33 40.84 2qtc h ASP 319 CO 0.59 0.05 0.57 1.23 -1.72 0.00 0.00 179.24 179.95 2qtc h GLY 320 N 0.37 1.53 1.07 2.75 0.00 -0.95 -1.03 103.07 106.81 2qtc h GLY 320 Ca 0.42 -0.38 -0.19 0.00 0.00 0.00 0.00 47.33 47.18 2qtc h GLY 320 CO -0.45 0.13 -0.66 -0.55 0.00 0.00 0.00 176.54 175.01 2qtc h ASP 321 N 0.90 0.83 -0.67 0.19 3.32 -1.58 -1.81 116.42 117.60 2qtc h ASP 321 Ca 0.47 -0.63 0.03 0.00 0.02 0.00 0.00 57.03 56.93 2qtc h ASP 321 Cb 0.48 -0.25 -0.04 0.00 0.22 0.00 0.00 39.33 39.75 2qtc h ASP 321 CO -0.27 1.32 0.44 1.88 -1.72 0.00 0.00 179.24 180.89 2qtc h TYR 322 N 0.40 0.77 -0.31 4.55 0.05 -1.09 -0.16 116.97 121.19 2qtc h TYR 322 Ca -0.04 0.02 -0.16 0.00 0.05 0.00 0.00 58.73 58.60 2qtc h TYR 322 Cb 1.30 -0.26 -0.01 0.00 1.01 0.00 0.00 36.73 38.77 2qtc h TYR 322 CO 0.10 0.45 -0.45 1.96 -1.05 0.00 0.00 178.16 179.17 2qtc h GLN 323 N 0.80 0.80 -0.83 4.88 1.08 -1.09 -2.88 115.11 117.87 2qtc h GLN 323 Ca 0.27 -0.45 -0.02 0.00 -1.45 0.00 0.00 58.65 57.00 2qtc h GLN 323 Cb 0.07 0.03 -0.04 0.00 -0.05 0.00 0.00 27.48 27.49 2qtc h GLN 323 CO -0.07 1.08 0.43 1.15 -0.95 0.00 0.00 178.83 180.47 2qtc h THR 324 N 0.64 1.25 -0.19 -0.54 2.02 -0.27 -2.87 112.91 112.95 2qtc h THR 324 Ca 0.04 -0.65 0.02 0.00 0.77 0.00 0.00 66.41 66.59 2qtc h THR 324 Cb 1.03 0.15 -0.02 0.00 -1.74 0.00 0.00 68.15 67.57 2qtc h THR 324 CO 0.10 0.29 0.05 -0.26 0.37 0.00 0.00 175.52 176.06 2qtc h PHE 325 N 1.16 0.09 0.00 3.16 0.04 -0.88 -1.82 116.94 118.68 2qtc h PHE 325 Ca 0.29 0.01 0.00 0.00 2.80 0.00 0.00 57.97 61.07 2qtc h PHE 325 Cb 0.06 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.20 2qtc h PHE 325 CO 0.01 0.04 0.00 0.36 -0.60 0.00 0.00 178.31 178.12 2qtc n LYS 326 N -5.07 0.04 0.00 1.51 -0.00 -1.10 -1.22 118.16 112.33 2qtc n LYS 326 Ca -0.03 0.37 0.11 0.00 -0.00 0.00 0.00 58.31 58.76 2qtc n LYS 326 Cb 0.08 -1.60 0.06 0.00 -0.00 0.00 0.00 35.03 33.57 2qtc n LYS 326 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 2qtc n SER 327 N -1.68 0.71 0.00 -5.58 3.41 -0.71 -4.90 113.62 104.86 2qtc n SER 327 Ca 0.02 -0.54 0.00 0.00 -0.26 0.00 0.00 58.87 58.09 2qtc n SER 327 Cb 0.13 0.67 0.00 0.00 -0.26 0.00 0.00 64.21 64.75 2qtc n SER 327 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2qtc n LYS 328 N -1.59 0.00 -3.03 4.33 4.76 -0.36 -5.11 118.16 117.17 2qtc n LYS 328 Ca 0.04 0.00 -0.09 0.00 -2.87 0.00 0.00 58.31 55.39 2qtc n LYS 328 Cb 0.35 0.00 -0.02 0.00 -1.84 0.00 0.00 35.03 33.53 2qtc n LYS 328 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 2qtc n ASP 329 N 0.00 -0.85 -0.20 4.39 5.68 -1.26 -5.05 116.55 119.26 2qtc n ASP 329 Ca 0.00 -2.15 -0.07 0.00 -0.50 0.00 0.00 54.79 52.07 2qtc n ASP 329 Cb 0.00 1.58 0.03 0.00 -1.14 0.00 0.00 41.12 41.58 2qtc n ASP 329 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 2qtc h GLY 330 N 1.20 0.90 1.00 6.12 0.00 -1.93 -2.31 103.07 108.05 2qtc h GLY 330 Ca -0.17 -0.45 0.01 0.00 0.00 0.00 0.00 47.33 46.72 2qtc h GLY 330 CO 0.23 0.43 0.46 0.00 0.00 0.00 0.00 176.54 177.66 2qtc h ALA 331 N 1.11 0.88 -0.24 3.60 0.00 -1.97 -0.90 119.26 121.74 2qtc h ALA 331 Ca 0.20 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2qtc h ALA 331 Cb 0.13 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 2qtc h ALA 331 CO -0.02 0.30 0.15 -0.92 0.00 0.00 0.00 179.25 178.76 2qtc h TYR 332 N 0.94 0.31 -0.87 0.00 5.03 -1.92 -2.03 116.97 118.42 2qtc h TYR 332 Ca 0.26 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.57 2qtc h TYR 332 Cb -0.10 -0.10 -0.04 0.00 1.55 0.00 0.00 36.73 38.03 2qtc h TYR 332 CO -0.03 0.22 0.56 0.28 -1.32 0.00 0.00 178.16 177.88 2qtc h VAL 333 N 0.31 1.23 -0.84 1.81 2.07 -1.01 0.14 116.25 119.97 2qtc h VAL 333 Ca 0.09 -0.45 -0.02 0.00 0.82 0.00 0.00 66.70 67.14 2qtc h VAL 333 Cb -0.01 -0.04 -0.04 0.00 -1.52 0.00 0.00 31.29 29.68 2qtc h VAL 333 CO -0.02 0.23 0.45 -0.09 0.02 0.00 0.00 177.57 178.16 2qtc h ARG 334 N 1.19 1.18 0.02 1.57 2.43 -0.75 -0.70 114.38 119.32 2qtc h ARG 334 Ca 0.32 -0.15 -0.00 0.00 -0.81 0.00 0.00 59.98 59.34 2qtc h ARG 334 Cb -0.11 -0.23 0.00 0.00 -0.42 0.00 0.00 29.97 29.22 2qtc h ARG 334 CO -0.07 0.87 -0.01 1.49 -1.51 0.00 0.00 179.97 180.75 2qtc h GLU 335 N 1.17 -0.02 0.00 0.20 4.81 -0.71 0.17 114.58 120.21 2qtc h GLU 335 Ca 0.29 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.52 2qtc h GLU 335 Cb 0.05 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.43 2qtc h GLU 335 CO -0.04 0.71 -0.31 0.45 -0.73 0.00 0.00 179.01 179.09 2qtc h HIS 336 N -0.95 0.00 0.00 0.92 3.86 -0.81 -3.14 115.15 115.04 2qtc h HIS 336 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2qtc h HIS 336 Cb 0.74 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.21 2qtc h HIS 336 CO 0.20 0.03 0.00 0.34 0.86 0.00 0.00 177.93 179.36 2qtc n PHE 337 N -2.99 0.00 0.10 2.45 7.35 -0.31 -4.54 117.46 119.51 2qtc n PHE 337 Ca 0.03 0.00 0.04 0.00 -0.76 0.00 0.00 57.45 56.76 2qtc n PHE 337 Cb 0.55 0.00 0.46 0.00 0.35 0.00 0.00 39.48 40.84 2qtc n PHE 337 CO 0.00 0.00 0.00 0.74 -0.76 0.00 0.00 176.76 176.74 2qtc h PHE 338 N 0.00 0.31 0.00 -5.13 0.04 -1.52 -2.02 116.94 108.62 2qtc h PHE 338 Ca 0.00 -0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.76 2qtc h PHE 338 Cb 0.00 -0.10 0.00 0.00 2.20 0.00 0.00 35.95 38.05 2qtc h PHE 338 CO 0.00 0.27 0.00 0.41 -0.60 0.00 0.00 178.31 178.39 2qtc n GLY 339 N -1.27 -0.51 0.20 -1.45 0.00 0.61 -1.77 105.19 100.99 2qtc n GLY 339 Ca 0.00 -0.07 0.03 0.00 0.00 0.00 0.00 46.02 45.99 2qtc n GLY 339 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2qtc h LYS 340 N 0.00 0.00 -3.92 1.61 1.63 -1.51 -3.44 116.57 110.93 2qtc h LYS 340 Ca 0.00 0.00 -0.18 0.00 -0.85 0.00 0.00 60.65 59.62 2qtc h LYS 340 Cb 0.05 0.00 -0.22 0.00 -0.60 0.00 0.00 32.23 31.46 2qtc h LYS 340 CO 0.00 0.32 -0.69 0.71 -3.45 0.00 0.00 179.45 176.34 2qtc s TYR 341 N -4.30 0.22 0.32 1.91 2.02 -1.19 -5.05 117.35 111.28 2qtc s TYR 341 Ca -0.03 -0.44 0.02 0.00 -0.37 0.00 0.00 57.07 56.25 2qtc s TYR 341 Cb 0.15 -0.16 0.55 0.00 -0.40 0.00 0.00 41.96 42.10 2qtc s TYR 341 CO 0.72 -0.17 1.88 -1.35 -1.57 0.00 0.00 175.55 175.05 2qtc h PRO 342 N 4.81 0.65 -0.03 -1.71 0.11 -1.86 0.15 132.00 134.12 2qtc h PRO 342 Ca -0.31 -0.12 -0.18 0.00 0.11 0.00 0.00 66.00 65.50 2qtc h PRO 342 Cb 1.21 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 2qtc h PRO 342 CO 0.42 0.61 -0.78 1.05 -0.21 0.00 0.00 178.00 179.09 2qtc h GLU 343 N 0.63 0.27 -0.06 1.05 9.09 -1.96 -0.84 114.58 122.75 2qtc h GLU 343 Ca 0.14 -0.24 -0.20 0.00 0.05 0.00 0.00 59.36 59.11 2qtc h GLU 343 Cb 0.26 0.06 -0.00 0.00 -1.65 0.00 0.00 28.75 27.42 2qtc h GLU 343 CO -0.00 0.92 -0.81 1.79 0.05 0.00 0.00 179.01 180.96 2qtc h THR 344 N 0.17 1.38 -0.70 -1.06 1.35 -1.69 -2.90 112.91 109.46 2qtc h THR 344 Ca -0.03 -2.24 -0.01 0.00 -0.55 0.00 0.00 66.41 63.58 2qtc h THR 344 Cb 1.37 2.21 -0.03 0.00 -1.73 0.00 0.00 68.15 69.96 2qtc h THR 344 CO 0.12 0.67 0.39 0.00 -0.25 0.00 0.00 175.52 176.46 2qtc h ALA 345 N 0.84 1.37 0.00 6.62 0.00 0.12 -2.41 119.26 125.80 2qtc h ALA 345 Ca -0.05 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.71 2qtc h ALA 345 Cb 1.41 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 2qtc h ALA 345 CO 0.14 0.52 -0.24 0.00 0.00 0.00 0.00 179.25 179.67 2qtc h ALA 346 N 1.46 1.03 0.00 0.00 0.00 -1.00 -2.09 119.26 118.66 2qtc h ALA 346 Ca 0.25 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 2qtc h ALA 346 Cb 0.01 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2qtc h ALA 346 CO -0.04 0.30 -0.18 -0.07 0.00 0.00 0.00 179.25 179.26 2qtc h LEU 347 N 0.00 0.00 -2.30 0.00 3.38 -1.23 -3.09 115.31 112.06 2qtc h LEU 347 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2qtc h LEU 347 Cb 0.75 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.50 2qtc h LEU 347 CO 0.03 0.18 0.00 1.33 0.09 0.00 0.00 178.44 180.07 2qtc n VAL 348 N -3.71 0.67 -0.30 1.22 0.24 -1.17 -4.74 118.33 110.54 2qtc n VAL 348 Ca -0.02 -0.77 0.19 0.00 -2.04 0.00 0.00 64.34 61.70 2qtc n VAL 348 Cb 0.30 0.70 0.46 0.00 -1.47 0.00 0.00 33.84 33.82 2qtc n VAL 348 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2qtc h ALA 349 N 0.00 2.07 -0.38 2.33 0.00 -1.29 0.16 119.26 122.15 2qtc h ALA 349 Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2qtc h ALA 349 Cb 0.45 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2qtc h ALA 349 CO 0.00 -0.42 0.00 -0.40 0.00 0.00 0.00 179.25 178.43 2qtc n ASP 350 N -4.62 2.13 -4.94 0.00 5.75 -1.26 -4.90 116.55 108.71 2qtc n ASP 350 Ca 0.23 -2.03 -0.27 0.00 -0.01 0.00 0.00 54.79 52.70 2qtc n ASP 350 Cb 0.73 -0.28 -0.03 0.00 -1.03 0.00 0.00 41.12 40.51 2qtc n ASP 350 CO 0.00 0.00 0.00 0.26 -0.11 0.00 0.00 177.20 177.35 2qtc s TRP 351 N -1.52 3.49 0.63 2.11 0.52 0.56 -5.11 118.94 119.63 2qtc s TRP 351 Ca 0.26 0.15 -0.06 0.00 0.02 0.00 0.00 56.10 56.47 2qtc s TRP 351 Cb 0.14 -1.69 0.02 0.00 -1.15 0.00 0.00 33.47 30.79 2qtc s TRP 351 CO 0.17 0.52 0.94 0.95 0.02 0.00 0.00 176.95 179.55 2qtc s THR 352 N -1.70 3.22 0.29 2.01 -4.23 -1.26 -4.92 115.64 109.03 2qtc s THR 352 Ca 0.35 -0.07 0.00 0.00 -1.18 0.00 0.00 61.69 60.79 2qtc s THR 352 Cb -0.11 -3.31 0.14 0.00 1.34 0.00 0.00 72.50 70.55 2qtc s THR 352 CO 0.28 -0.33 1.81 0.44 -0.54 0.00 0.00 174.62 176.29 2qtc h ASP 353 N -0.32 0.67 -0.59 3.99 3.32 -1.96 -1.79 116.42 119.74 2qtc h ASP 353 Ca -0.45 -0.14 -0.05 0.00 0.02 0.00 0.00 57.03 56.41 2qtc h ASP 353 Cb 1.27 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 40.62 2qtc h ASP 353 CO 0.61 0.72 0.20 -0.33 -1.72 0.00 0.00 179.24 178.72 2qtc h GLU 354 N 0.67 0.94 -0.08 3.56 3.07 -1.93 0.99 114.58 121.80 2qtc h GLU 354 Ca 0.14 -0.18 -0.12 0.00 -0.50 0.00 0.00 59.36 58.70 2qtc h GLU 354 Cb 0.38 -0.15 -0.01 0.00 -0.84 0.00 0.00 28.75 28.13 2qtc h GLU 354 CO 0.01 0.80 -0.49 1.96 -1.40 0.00 0.00 179.01 179.90 2qtc h GLN 355 N 0.92 0.20 -0.20 2.33 4.20 -1.77 -2.32 115.11 118.47 2qtc h GLN 355 Ca 0.21 -0.11 -0.11 0.00 0.06 0.00 0.00 58.65 58.69 2qtc h GLN 355 Cb 0.25 0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.03 2qtc h GLN 355 CO -0.01 0.65 -0.32 0.82 -0.67 0.00 0.00 178.83 179.30 2qtc h ILE 356 N 0.16 1.33 0.00 2.54 2.04 -0.74 -3.02 117.51 119.82 2qtc h ILE 356 Ca 0.01 -1.54 -0.00 0.00 1.00 0.00 0.00 64.86 64.32 2qtc h ILE 356 Cb 0.93 1.83 -0.00 0.00 -0.74 0.00 0.00 36.82 38.84 2qtc h ILE 356 CO 0.07 0.47 -0.02 -0.25 0.00 0.00 0.00 178.15 178.43 2qtc h TRP 357 N 0.25 0.00 0.00 1.37 -0.00 -0.65 -1.65 115.95 115.27 2qtc h TRP 357 Ca 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.91 2qtc h TRP 357 Cb 0.91 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 30.07 2qtc h TRP 357 CO 0.09 0.02 0.00 0.00 -0.00 0.00 0.00 178.44 178.55 2qtc h ALA 358 N 1.98 1.00 -2.23 2.65 0.00 -1.28 -3.44 119.26 117.93 2qtc h ALA 358 Ca -0.00 0.00 -0.59 0.00 0.00 0.00 0.00 54.91 54.32 2qtc h ALA 358 Cb 0.05 0.00 0.06 0.00 0.00 0.00 0.00 17.79 17.90 2qtc h ALA 358 CO 0.00 0.00 0.71 1.28 0.00 0.00 0.00 179.25 181.24 2qtc n LEU 359 N -3.07 2.96 -4.44 0.00 4.77 -0.62 -4.96 117.00 111.64 2qtc n LEU 359 Ca 0.00 1.10 -0.22 0.00 -0.03 0.00 0.00 56.01 56.87 2qtc n LEU 359 Cb 0.28 -1.41 -0.10 0.00 -2.33 0.00 0.00 43.42 39.86 2qtc n LEU 359 CO 0.26 -0.42 -0.32 0.21 -1.33 0.00 0.00 177.39 175.79 2qtc s ASN 360 N 0.68 2.62 0.45 -1.43 3.84 -1.26 -5.07 114.94 114.77 2qtc s ASN 360 Ca 0.76 -1.28 -0.17 0.00 0.21 0.00 0.00 52.86 52.38 2qtc s ASN 360 Cb -0.69 -0.14 -0.09 0.00 -0.55 0.00 0.00 41.25 39.78 2qtc s ASN 360 CO 0.42 -0.47 0.91 -0.13 -2.79 0.00 0.00 177.10 175.04 2qtc s ARG 361 N -3.80 4.01 0.33 0.43 0.52 -1.26 -1.89 118.95 117.29 2qtc s ARG 361 Ca 0.33 0.89 0.00 0.00 -0.52 0.00 0.00 55.73 56.43 2qtc s ARG 361 Cb 0.06 -2.22 0.55 0.00 0.52 0.00 0.00 34.95 33.86 2qtc s ARG 361 CO 0.13 -0.11 1.98 0.78 0.02 0.00 0.00 175.30 178.11 2qtc h GLY 362 N 1.42 1.04 1.23 -3.53 0.00 -0.49 -2.57 103.07 100.17 2qtc h GLY 362 Ca -0.48 -0.38 0.00 0.00 0.00 0.00 0.00 47.33 46.47 2qtc h GLY 362 CO 0.62 0.36 0.00 0.61 0.00 0.00 0.00 176.54 178.13 2qtc n GLY 363 N -1.42 -0.33 0.75 4.60 0.00 0.53 -1.36 105.19 107.95 2qtc n GLY 363 Ca 0.08 -0.04 0.07 0.00 0.00 0.00 0.00 46.02 46.13 2qtc n GLY 363 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2qtc n HIS 364 N -1.11 0.48 -3.94 1.61 8.25 -0.97 -4.31 115.22 115.22 2qtc n HIS 364 Ca 0.04 -0.42 -0.34 0.00 -0.26 0.00 0.00 57.72 56.75 2qtc n HIS 364 Cb 0.04 -0.02 -0.14 0.00 1.12 0.00 0.00 29.99 30.99 2qtc n HIS 364 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2qtc s ASP 365 N -1.02 4.82 0.38 0.41 -1.08 -0.46 -4.99 116.67 114.72 2qtc s ASP 365 Ca 0.26 -1.48 0.18 0.00 -0.52 0.00 0.00 52.55 50.99 2qtc s ASP 365 Cb 0.14 -1.68 1.09 0.00 -1.46 0.00 0.00 42.92 41.02 2qtc s ASP 365 CO 0.19 -0.29 1.74 -0.65 0.52 0.00 0.00 175.17 176.68 2qtc h PRO 366 N 7.91 0.38 -0.60 4.34 0.11 -1.91 -0.59 132.00 141.64 2qtc h PRO 366 Ca -0.18 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 65.82 2qtc h PRO 366 Cb 1.05 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.05 2qtc h PRO 366 CO 0.53 0.25 0.04 0.87 -0.21 0.00 0.00 178.00 179.49 2qtc h LYS 367 N 0.39 1.01 -0.07 1.05 1.57 -1.94 -0.15 116.57 118.44 2qtc h LYS 367 Ca 0.64 -0.29 -0.23 0.00 -1.87 0.00 0.00 60.65 58.90 2qtc h LYS 367 Cb 1.57 -0.11 0.01 0.00 0.08 0.00 0.00 32.23 33.78 2qtc h LYS 367 CO -0.36 0.97 -0.88 0.87 -0.57 0.00 0.00 179.45 179.47 2qtc h LYS 368 N 0.94 0.65 -0.01 3.15 1.79 -1.44 -2.66 116.57 118.98 2qtc h LYS 368 Ca 0.18 -0.60 -0.00 0.00 -2.18 0.00 0.00 60.65 58.04 2qtc h LYS 368 Cb 0.49 0.15 -0.00 0.00 -1.58 0.00 0.00 32.23 31.29 2qtc h LYS 368 CO 0.02 1.21 0.00 0.82 -1.08 0.00 0.00 179.45 180.43 2qtc h ILE 369 N 0.41 1.12 -0.45 1.86 2.04 -1.14 -2.58 117.51 118.77 2qtc h ILE 369 Ca -0.08 -0.34 0.06 0.00 1.00 0.00 0.00 64.86 65.51 2qtc h ILE 369 Cb 1.51 1.33 -0.06 0.00 -0.74 0.00 0.00 36.82 38.87 2qtc h ILE 369 CO 0.17 0.09 0.13 0.22 0.00 0.00 0.00 178.15 178.76 2qtc h TYR 370 N -0.13 0.22 -0.68 1.37 3.20 -1.05 -1.08 116.97 118.82 2qtc h TYR 370 Ca 0.00 0.02 0.12 0.00 3.14 0.00 0.00 58.73 62.02 2qtc h TYR 370 Cb 0.14 -0.03 -0.08 0.00 1.54 0.00 0.00 36.73 38.30 2qtc h TYR 370 CO -0.03 0.06 0.26 0.00 -1.64 0.00 0.00 178.16 176.81 2qtc h ALA 371 N 1.32 0.92 0.02 1.82 0.00 -1.33 0.13 119.26 122.13 2qtc h ALA 371 Ca 0.21 0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.23 2qtc h ALA 371 Cb 0.24 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2qtc h ALA 371 CO -0.25 -0.20 -0.01 0.00 0.00 0.00 0.00 179.25 178.79 2qtc h ALA 372 N 1.49 -0.02 -0.57 0.00 0.00 -0.83 -1.30 119.26 118.03 2qtc h ALA 372 Ca 0.36 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 55.10 2qtc h ALA 372 Cb 0.50 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 2qtc h ALA 372 CO -0.36 -0.39 0.18 0.74 0.00 0.00 0.00 179.25 179.42 2qtc h PHE 373 N -0.27 0.86 -0.25 0.00 -1.00 -0.79 -0.88 116.94 114.61 2qtc h PHE 373 Ca -0.00 -0.06 -0.04 0.00 2.81 0.00 0.00 57.97 60.67 2qtc h PHE 373 Cb 0.26 -0.26 -0.01 0.00 3.61 0.00 0.00 35.95 39.56 2qtc h PHE 373 CO 0.01 0.69 -0.01 -0.22 -1.61 0.00 0.00 178.31 177.17 2qtc h LYS 374 N 0.82 0.45 -0.79 1.51 1.63 -0.68 -2.21 116.57 117.29 2qtc h LYS 374 Ca 0.19 -0.15 0.04 0.00 -0.85 0.00 0.00 60.65 59.87 2qtc h LYS 374 Cb 0.23 -0.04 -0.05 0.00 -0.60 0.00 0.00 32.23 31.77 2qtc h LYS 374 CO -0.01 0.63 0.50 -0.22 -3.45 0.00 0.00 179.45 176.91 2qtc h LYS 375 N 0.21 0.94 -0.98 1.90 1.63 -0.92 -1.46 116.57 117.89 2qtc h LYS 375 Ca 0.07 -0.06 0.05 0.00 -0.85 0.00 0.00 60.65 59.86 2qtc h LYS 375 Cb 0.44 -0.21 -0.06 0.00 -0.60 0.00 0.00 32.23 31.80 2qtc h LYS 375 CO 0.02 0.62 0.64 0.00 -3.45 0.00 0.00 179.45 177.28 2qtc h ALA 376 N 1.34 1.32 -0.02 5.00 0.00 -0.99 -2.07 119.26 123.85 2qtc h ALA 376 Ca 0.32 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.20 2qtc h ALA 376 Cb 0.03 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.49 2qtc h ALA 376 CO -0.12 0.48 0.02 0.37 0.00 0.00 0.00 179.25 180.00 2qtc h GLN 377 N 1.20 0.00 -0.01 0.00 4.15 -0.64 -2.00 115.11 117.81 2qtc h GLN 377 Ca 0.40 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.82 2qtc h GLN 377 Cb 0.07 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.76 2qtc h GLN 377 CO -0.14 0.00 -0.60 -0.85 -1.93 0.00 0.00 178.83 175.31 2qtc n GLU 378 N -4.30 0.71 -2.61 1.69 0.28 -0.81 -4.92 120.64 110.67 2qtc n GLU 378 Ca -0.03 -0.56 -0.43 0.00 -0.16 0.00 0.00 57.16 55.99 2qtc n GLU 378 Cb 0.11 -1.49 -0.02 0.00 1.43 0.00 0.00 31.44 31.47 2qtc n GLU 378 CO 0.00 0.00 0.00 0.99 -0.16 0.00 0.00 177.13 177.96 2qtc s THR 379 N -2.67 4.60 0.32 3.84 2.01 -0.75 -5.03 115.64 117.95 2qtc s THR 379 Ca 0.16 1.92 0.09 0.00 0.31 0.00 0.00 61.69 64.17 2qtc s THR 379 Cb 0.18 -4.24 -0.05 0.00 0.01 0.00 0.00 72.50 68.40 2qtc s THR 379 CO 0.66 -0.12 -0.02 -0.54 -0.69 0.00 0.00 174.62 173.91 2qtc s LYS 380 N 2.95 2.06 0.00 4.92 -0.14 -1.26 -4.74 119.74 123.52 2qtc s LYS 380 Ca 0.48 -1.70 0.00 0.00 -1.36 0.00 0.00 55.97 53.39 2qtc s LYS 380 Cb -0.17 -1.94 0.00 0.00 -1.68 0.00 0.00 37.83 34.03 2qtc s LYS 380 CO 0.11 0.20 0.00 0.41 -0.76 0.00 0.00 175.35 175.31 2qtc n GLY 381 N -0.90 2.03 3.67 -3.33 0.00 -1.26 -4.96 105.19 100.44 2qtc n GLY 381 Ca -0.05 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.93 2qtc n GLY 381 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2qtc s LYS 382 N -0.12 1.04 0.58 1.61 -2.85 -1.26 -4.41 119.74 114.33 2qtc s LYS 382 Ca 0.00 -0.53 -0.07 0.00 -1.00 0.00 0.00 55.97 54.37 2qtc s LYS 382 Cb 0.00 0.38 -0.00 0.00 -2.06 0.00 0.00 37.83 36.15 2qtc s LYS 382 CO 0.00 -0.47 0.91 0.00 0.10 0.00 0.00 175.35 175.89 2qtc s ALA 383 N -3.18 3.26 0.01 0.59 0.00 -1.22 -3.45 121.76 117.77 2qtc s ALA 383 Ca 0.10 -0.57 0.08 0.00 0.00 0.00 0.00 51.96 51.57 2qtc s ALA 383 Cb -0.01 -2.68 -0.02 0.00 0.00 0.00 0.00 23.12 20.40 2qtc s ALA 383 CO -0.01 -0.74 -0.24 0.99 0.00 0.00 0.00 175.76 175.76 2qtc s THR 384 N -3.00 1.89 -0.10 0.00 2.01 -1.08 -1.10 115.64 114.25 2qtc s THR 384 Ca 0.53 -1.13 0.03 0.00 0.31 0.00 0.00 61.69 61.43 2qtc s THR 384 Cb -0.11 -1.59 0.01 0.00 0.01 0.00 0.00 72.50 70.82 2qtc s THR 384 CO 0.47 0.43 -0.20 0.68 -0.69 0.00 0.00 174.62 175.30 2qtc s VAL 385 N -0.66 1.80 -0.25 3.82 -7.23 -0.36 -0.66 120.40 116.86 2qtc s VAL 385 Ca 0.09 -0.85 -0.08 0.00 -1.81 0.00 0.00 61.98 59.33 2qtc s VAL 385 Cb -0.09 -1.58 -0.03 0.00 0.56 0.00 0.00 36.38 35.23 2qtc s VAL 385 CO 0.00 0.50 0.09 -0.63 -0.31 0.00 0.00 175.10 174.75 2qtc s ILE 386 N 0.59 4.49 -0.50 -0.62 1.01 0.10 -1.29 121.20 124.97 2qtc s ILE 386 Ca -0.14 -0.11 -0.14 0.00 0.00 0.00 0.00 60.65 60.25 2qtc s ILE 386 Cb -0.17 -3.10 0.11 0.00 0.01 0.00 0.00 42.46 39.32 2qtc s ILE 386 CO 0.04 0.34 0.43 -0.76 0.00 0.00 0.00 174.94 174.99 2qtc s LEU 387 N 1.53 5.91 -0.35 2.97 1.43 -0.15 -0.84 118.68 129.18 2qtc s LEU 387 Ca 0.06 -1.68 -0.14 0.00 -1.03 0.00 0.00 54.13 51.34 2qtc s LEU 387 Cb -0.15 -2.16 -0.01 0.00 0.03 0.00 0.00 46.19 43.90 2qtc s LEU 387 CO 0.05 -0.76 0.29 0.00 0.23 0.00 0.00 176.35 176.16 2qtc s ALA 388 N 1.56 3.50 -0.21 4.21 0.00 -0.86 -0.58 121.76 129.37 2qtc s ALA 388 Ca 0.04 -1.36 -0.29 0.00 0.00 0.00 0.00 51.96 50.35 2qtc s ALA 388 Cb -0.28 -2.75 -0.00 0.00 0.00 0.00 0.00 23.12 20.09 2qtc s ALA 388 CO 0.03 -1.07 1.16 -1.58 0.00 0.00 0.00 175.76 174.30 2qtc s HIS 389 N 1.83 3.05 0.36 0.00 2.46 -0.29 0.26 115.29 122.96 2qtc s HIS 389 Ca 0.08 1.19 0.05 0.00 0.47 0.00 0.00 55.06 56.86 2qtc s HIS 389 Cb -0.17 -3.46 -0.03 0.00 -0.13 0.00 0.00 32.58 28.79 2qtc s HIS 389 CO 0.11 -1.15 0.20 0.95 -2.47 0.00 0.00 174.74 172.38 2qtc s THR 390 N 3.47 0.28 -0.25 0.89 -4.23 -0.75 -0.35 115.64 114.69 2qtc s THR 390 Ca 0.50 -2.00 -0.03 0.00 -1.18 0.00 0.00 61.69 58.98 2qtc s THR 390 Cb -0.18 -2.42 0.02 0.00 1.34 0.00 0.00 72.50 71.26 2qtc s THR 390 CO 0.12 0.00 -0.04 -0.63 -0.54 0.00 0.00 174.62 173.53 2qtc s ILE 391 N -3.37 3.10 0.23 2.99 1.01 -1.26 -4.24 121.20 119.65 2qtc s ILE 391 Ca 0.32 -0.92 -0.30 0.00 0.00 0.00 0.00 60.65 59.75 2qtc s ILE 391 Cb 0.03 -2.57 -0.09 0.00 0.01 0.00 0.00 42.46 39.84 2qtc s ILE 391 CO 0.21 0.20 1.36 -0.75 0.00 0.00 0.00 174.94 175.95 2qtc s LYS 392 N 1.37 4.34 -0.56 2.79 2.20 -1.26 -2.01 119.74 126.61 2qtc s LYS 392 Ca 0.01 2.17 0.00 0.00 -0.36 0.00 0.00 55.97 57.79 2qtc s LYS 392 Cb -0.16 -3.15 0.00 0.00 -1.51 0.00 0.00 37.83 33.00 2qtc s LYS 392 CO -0.03 -0.31 0.00 0.41 -0.36 0.00 0.00 175.35 175.05 2qtc n GLY 393 N 2.18 0.39 3.63 5.54 0.00 -0.83 -4.94 105.19 111.17 2qtc n GLY 393 Ca 0.06 -0.69 -0.52 0.00 0.00 0.00 0.00 46.02 44.87 2qtc n GLY 393 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2qtc n TYR 394 N -3.56 1.77 -1.15 1.61 9.36 -0.85 -1.93 117.16 122.41 2qtc n TYR 394 Ca -0.07 0.53 -0.05 0.00 3.32 0.00 0.00 57.90 61.63 2qtc n TYR 394 Cb 0.42 -2.40 -0.02 0.00 -0.63 0.00 0.00 39.34 36.70 2qtc n TYR 394 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2qtc n GLY 395 N 3.06 0.64 0.41 2.98 0.00 -1.26 -4.81 105.19 106.21 2qtc n GLY 395 Ca 0.20 -0.14 0.12 0.00 0.00 0.00 0.00 46.02 46.20 2qtc n GLY 395 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2qtc n MET 396 N -1.19 1.17 0.00 1.61 2.81 -0.81 -4.54 117.12 116.17 2qtc n MET 396 Ca -0.05 -0.82 0.00 0.00 -1.81 0.00 0.00 57.70 55.02 2qtc n MET 396 Cb 0.38 -1.48 0.00 0.00 -0.71 0.00 0.00 33.22 31.40 2qtc n MET 396 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2qtc n GLY 397 N 1.35 -0.62 0.34 3.03 0.00 -1.26 -3.82 105.19 104.21 2qtc n GLY 397 Ca 0.12 -1.13 0.15 0.00 0.00 0.00 0.00 46.02 45.16 2qtc n GLY 397 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2qtc h ASP 398 N 2.89 0.66 -0.99 1.61 3.32 -1.98 -1.99 116.42 119.94 2qtc h ASP 398 Ca 0.00 0.12 0.36 0.00 0.02 0.00 0.00 57.03 57.53 2qtc h ASP 398 Cb 0.00 0.02 -0.18 0.00 0.22 0.00 0.00 39.33 39.39 2qtc h ASP 398 CO 0.00 0.16 0.37 0.00 -1.72 0.00 0.00 179.24 178.04 2qtc h ALA 399 N 1.69 1.81 0.00 3.45 0.00 -1.99 -3.55 119.26 120.67 2qtc h ALA 399 Ca 0.60 0.29 0.00 0.00 0.00 0.00 0.00 54.91 55.80 2qtc h ALA 399 Cb 1.05 0.41 0.00 0.00 0.00 0.00 0.00 17.79 19.25 2qtc h ALA 399 CO -0.44 -0.80 0.00 0.00 0.00 0.00 0.00 179.25 178.01 2qtc n ALA 400 N -2.56 0.00 -1.88 0.00 0.00 -0.75 -5.15 120.51 110.17 2qtc n ALA 400 Ca 0.32 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.38 2qtc n ALA 400 Cb 1.08 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 20.52 2qtc n ALA 400 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 2qtc n MET 414 N -2.00 4.32 -2.32 0.00 1.56 -1.26 -4.71 117.12 112.71 2qtc n MET 414 Ca 0.00 -3.23 -0.05 0.00 -0.27 0.00 0.00 57.70 54.15 2qtc n MET 414 Cb 0.00 -2.60 0.05 0.00 2.15 0.00 0.00 33.22 32.82 2qtc n MET 414 CO 0.00 0.00 0.00 -0.25 -0.73 0.00 0.00 175.97 174.99 2qtc n ASP 415 N 1.84 2.34 0.13 6.12 8.00 -1.26 -4.61 116.55 129.11 2qtc n ASP 415 Ca 0.63 -2.57 0.11 0.00 0.71 0.00 0.00 54.79 53.67 2qtc n ASP 415 Cb 0.28 -0.42 0.03 0.00 -0.02 0.00 0.00 41.12 40.99 2qtc n ASP 415 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 2qtc h GLY 416 N 2.18 0.00 1.93 0.44 0.00 -2.00 -3.04 103.07 102.59 2qtc h GLY 416 Ca -0.02 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.11 2qtc h GLY 416 CO 0.30 0.00 -0.94 -0.39 0.00 0.00 0.00 176.54 175.51 2qtc h VAL 417 N 0.00 1.62 -0.57 4.60 -1.51 -1.96 -2.88 116.25 115.55 2qtc h VAL 417 Ca -0.01 -3.05 -0.02 0.00 -1.23 0.00 0.00 66.70 62.39 2qtc h VAL 417 Cb 1.04 2.69 -0.03 0.00 -2.13 0.00 0.00 31.29 32.86 2qtc h VAL 417 CO 0.00 0.88 0.28 -0.09 -1.23 0.00 0.00 177.57 177.41 2qtc h ARG 418 N 0.03 0.81 -0.30 5.19 2.43 -1.82 0.31 114.38 121.02 2qtc h ARG 418 Ca -0.03 -0.11 0.03 0.00 -0.81 0.00 0.00 59.98 59.06 2qtc h ARG 418 Cb 1.64 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 31.01 2qtc h ARG 418 CO 0.13 0.65 0.11 1.25 -1.51 0.00 0.00 179.97 180.61 2qtc h HIS 419 N 0.77 0.21 -0.64 2.20 2.76 -1.46 -0.21 115.15 118.77 2qtc h HIS 419 Ca 0.20 0.01 -0.07 0.00 -2.20 0.00 0.00 60.37 58.31 2qtc h HIS 419 Cb 0.10 -0.05 -0.03 0.00 1.55 0.00 0.00 27.41 28.98 2qtc h HIS 419 CO -0.00 0.10 0.12 0.82 -1.30 0.00 0.00 177.93 177.66 2qtc h ILE 420 N 0.25 1.26 -0.17 6.26 2.04 -1.18 0.32 117.51 126.29 2qtc h ILE 420 Ca 0.13 -0.98 -0.10 0.00 1.00 0.00 0.00 64.86 64.91 2qtc h ILE 420 Cb 0.09 0.63 -0.01 0.00 -0.74 0.00 0.00 36.82 36.79 2qtc h ILE 420 CO -0.12 0.37 -0.34 0.08 0.00 0.00 0.00 178.15 178.13 2qtc h ARG 421 N 0.98 0.36 -0.07 2.37 -0.00 0.03 -2.16 114.38 115.89 2qtc h ARG 421 Ca 0.20 -0.16 -0.09 0.00 -0.00 0.00 0.00 59.98 59.93 2qtc h ARG 421 Cb 0.40 -0.01 0.00 0.00 -0.00 0.00 0.00 29.97 30.36 2qtc h ARG 421 CO 0.01 0.66 -0.31 -0.44 -0.00 0.00 0.00 179.97 179.90 2qtc h ASP 422 N 0.31 0.39 -0.97 0.08 3.32 -0.61 0.12 116.42 119.06 2qtc h ASP 422 Ca 0.04 -0.64 0.07 0.00 0.02 0.00 0.00 57.03 56.51 2qtc h ASP 422 Cb 0.76 -0.12 -0.07 0.00 0.22 0.00 0.00 39.33 40.12 2qtc h ASP 422 CO 0.06 0.97 0.62 -0.09 -1.72 0.00 0.00 179.24 179.07 2qtc h ARG 423 N -0.16 1.09 -0.35 3.56 1.12 -0.26 -2.68 114.38 116.71 2qtc h ARG 423 Ca -0.02 -0.07 -0.00 0.00 -1.11 0.00 0.00 59.98 58.78 2qtc h ARG 423 Cb 0.95 -0.25 -0.00 0.00 -0.01 0.00 0.00 29.97 30.66 2qtc h ARG 423 CO 0.06 0.72 0.00 1.19 -3.11 0.00 0.00 179.97 178.84 2qtc n PHE 424 N -4.54 1.27 -4.19 2.20 3.72 -0.82 -4.95 117.46 110.15 2qtc n PHE 424 Ca 0.15 -0.85 -0.31 0.00 -0.05 0.00 0.00 57.45 56.38 2qtc n PHE 424 Cb 0.18 -0.38 -0.05 0.00 -0.94 0.00 0.00 39.48 38.30 2qtc n PHE 424 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 2qtc n ASN 425 N -0.22 -0.81 -4.72 4.37 4.13 -0.90 -4.85 115.26 112.26 2qtc n ASN 425 Ca 0.23 -1.11 -0.42 0.00 1.68 0.00 0.00 54.58 54.97 2qtc n ASN 425 Cb 0.98 -2.41 -0.03 0.00 -1.54 0.00 0.00 39.78 36.78 2qtc n ASN 425 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2qtc s VAL 426 N -3.85 3.46 -1.12 2.41 1.01 0.37 -4.91 120.40 117.76 2qtc s VAL 426 Ca 0.26 1.11 -0.13 0.00 0.00 0.00 0.00 61.98 63.23 2qtc s VAL 426 Cb -0.15 -3.71 -0.07 0.00 0.00 0.00 0.00 36.38 32.45 2qtc s VAL 426 CO 0.94 0.12 2.25 -0.81 0.00 0.00 0.00 175.10 177.61 2qtc n PRO 427 N 3.38 2.39 -3.89 2.72 -0.04 -1.26 -4.83 135.00 133.48 2qtc n PRO 427 Ca 0.08 -1.93 -0.24 0.00 -0.04 0.00 0.00 63.50 61.37 2qtc n PRO 427 Cb 0.44 -2.81 -0.17 0.00 -0.04 0.00 0.00 33.50 30.91 2qtc n PRO 427 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2qtc s VAL 428 N 3.56 0.62 0.49 0.52 0.11 -1.26 -5.07 120.40 119.38 2qtc s VAL 428 Ca 0.52 -0.06 -0.23 0.00 -2.93 0.00 0.00 61.98 59.28 2qtc s VAL 428 Cb 0.14 -0.71 -0.07 0.00 -1.53 0.00 0.00 36.38 34.20 2qtc s VAL 428 CO -0.01 0.29 1.25 -0.24 -3.33 0.00 0.00 175.10 173.07 2qtc n SER 429 N 4.90 2.31 0.03 3.54 2.88 -1.26 -4.81 113.62 121.21 2qtc n SER 429 Ca -0.12 1.02 0.05 0.00 -1.33 0.00 0.00 58.87 58.49 2qtc n SER 429 Cb 0.50 -1.51 0.24 0.00 -0.75 0.00 0.00 64.21 62.69 2qtc n SER 429 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 2qtc n ASP 430 N -0.35 0.14 -0.08 -3.46 -0.08 -1.26 -1.18 116.55 110.28 2qtc n ASP 430 Ca 0.09 0.55 -0.14 0.00 -1.51 0.00 0.00 54.79 53.78 2qtc n ASP 430 Cb 0.42 -0.58 -0.10 0.00 2.34 0.00 0.00 41.12 43.20 2qtc n ASP 430 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2qtc h ALA 431 N 2.21 0.06 0.00 -1.67 0.00 -2.05 -3.38 119.26 114.43 2qtc h ALA 431 Ca 0.00 -0.61 -0.02 0.00 0.00 0.00 0.00 54.91 54.28 2qtc h ALA 431 Cb 0.13 0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 2qtc h ALA 431 CO 0.00 0.20 -0.08 -0.44 0.00 0.00 0.00 179.25 178.92 2qtc h ASP 432 N -1.00 0.00 -1.15 0.00 5.19 -1.81 -3.36 116.42 114.29 2qtc h ASP 432 Ca -0.08 0.00 0.33 0.00 -0.62 0.00 0.00 57.03 56.66 2qtc h ASP 432 Cb 0.92 0.00 -0.05 0.00 0.18 0.00 0.00 39.33 40.39 2qtc h ASP 432 CO -0.05 0.08 0.95 -0.29 -3.12 0.00 0.00 179.24 176.81 2qtc h ILE 433 N 0.00 0.26 0.00 0.35 2.10 -1.33 0.87 117.51 119.76 2qtc h ILE 433 Ca -0.00 0.00 -0.04 0.00 1.08 0.00 0.00 64.86 65.90 2qtc h ILE 433 Cb 1.01 0.31 -0.01 0.00 -1.09 0.00 0.00 36.82 37.04 2qtc h ILE 433 CO 0.01 0.00 -0.18 -0.33 -1.08 0.00 0.00 178.15 176.57 2qtc h GLU 434 N 0.00 0.00 -0.03 2.19 3.07 -1.84 -2.62 114.58 115.36 2qtc h GLU 434 Ca 0.55 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.41 2qtc h GLU 434 Cb 2.43 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 30.34 2qtc h GLU 434 CO -0.01 0.18 0.00 1.63 -1.40 0.00 0.00 179.01 179.41 2qtc n LYS 435 N -3.37 1.31 -3.98 2.33 5.02 0.30 -4.93 118.16 114.85 2qtc n LYS 435 Ca -0.00 -0.46 -0.41 0.00 -2.02 0.00 0.00 58.31 55.42 2qtc n LYS 435 Cb 0.39 -1.45 0.02 0.00 -0.02 0.00 0.00 35.03 33.97 2qtc n LYS 435 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2qtc n LEU 436 N -0.42 -1.05 -4.78 -0.35 4.77 -0.99 -4.87 117.00 109.32 2qtc n LEU 436 Ca 0.20 -1.22 -0.36 0.00 -0.03 0.00 0.00 56.01 54.60 2qtc n LEU 436 Cb 0.21 -1.85 -0.05 0.00 -2.33 0.00 0.00 43.42 39.41 2qtc n LEU 436 CO 0.16 0.69 0.71 -2.16 -1.33 0.00 0.00 177.39 175.45 2qtc s PRO 437 N -7.02 4.28 0.37 3.23 0.04 -1.26 -4.99 135.00 129.65 2qtc s PRO 437 Ca 0.44 1.43 -0.13 0.00 0.04 0.00 0.00 61.00 62.79 2qtc s PRO 437 Cb -0.22 -2.58 -0.08 0.00 0.04 0.00 0.00 34.50 31.67 2qtc s PRO 437 CO 0.94 -0.02 0.75 0.71 0.04 0.00 0.00 177.00 179.43 2qtc s TYR 438 N -1.69 3.42 -0.09 0.56 2.02 -1.26 -4.93 117.35 115.38 2qtc s TYR 438 Ca 0.56 1.12 -0.00 0.00 -0.37 0.00 0.00 57.07 58.38 2qtc s TYR 438 Cb -0.20 -2.48 -0.03 0.00 -0.40 0.00 0.00 41.96 38.85 2qtc s TYR 438 CO 0.25 -0.01 -0.06 0.42 -1.57 0.00 0.00 175.55 174.58 2qtc s ILE 439 N -2.19 3.72 0.20 2.71 1.01 -1.26 -5.10 121.20 120.28 2qtc s ILE 439 Ca 0.53 -0.46 0.04 0.00 0.00 0.00 0.00 60.65 60.75 2qtc s ILE 439 Cb -0.10 -2.55 -0.05 0.00 0.01 0.00 0.00 42.46 39.77 2qtc s ILE 439 CO 0.25 0.57 -0.04 0.42 0.00 0.00 0.00 174.94 176.14 2qtc s THR 440 N -0.51 1.06 -0.19 2.92 -4.23 -1.26 -4.92 115.64 108.52 2qtc s THR 440 Ca 0.08 -2.04 -0.02 0.00 -1.18 0.00 0.00 61.69 58.52 2qtc s THR 440 Cb -0.12 -2.15 -0.01 0.00 1.34 0.00 0.00 72.50 71.56 2qtc s THR 440 CO 0.02 -0.49 -0.09 -0.36 -0.54 0.00 0.00 174.62 173.16 2qtc s PHE 441 N -3.40 2.89 0.60 3.99 0.08 -1.26 -5.10 117.98 115.77 2qtc s PHE 441 Ca 0.24 -0.96 -0.17 0.00 0.12 0.00 0.00 56.93 56.16 2qtc s PHE 441 Cb 0.05 -2.00 -0.03 0.00 -0.57 0.00 0.00 43.02 40.46 2qtc s PHE 441 CO 0.05 -0.49 1.11 -1.25 -0.10 0.00 0.00 175.22 174.54 2qtc s PRO 442 N 1.12 3.12 0.29 0.24 0.04 -1.26 -4.74 135.00 133.82 2qtc s PRO 442 Ca 0.01 1.46 -0.29 0.00 0.04 0.00 0.00 61.00 62.21 2qtc s PRO 442 Cb -0.14 -1.99 -0.13 0.00 0.04 0.00 0.00 34.50 32.28 2qtc s PRO 442 CO -0.02 -1.01 1.25 -1.91 0.04 0.00 0.00 177.00 175.35 2qtc n GLU 443 N -1.87 1.87 0.00 4.56 2.13 -1.26 -1.39 120.64 124.68 2qtc n GLU 443 Ca 0.11 0.66 0.00 0.00 0.66 0.00 0.00 57.16 58.59 2qtc n GLU 443 Cb 0.52 -2.21 0.00 0.00 0.27 0.00 0.00 31.44 30.02 2qtc n GLU 443 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2qtc n GLY 444 N 1.35 2.53 3.81 8.31 0.00 -1.26 -5.04 105.19 114.90 2qtc n GLY 444 Ca 0.08 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 2qtc n GLY 444 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2qtc s SER 445 N -2.02 5.52 0.14 1.61 1.04 -0.49 -4.86 113.70 114.65 2qtc s SER 445 Ca 0.00 1.73 -0.24 0.00 0.48 0.00 0.00 55.95 57.92 2qtc s SER 445 Cb 0.00 -2.52 0.00 0.00 0.10 0.00 0.00 66.02 63.61 2qtc s SER 445 CO 0.00 -1.34 1.63 -0.33 0.98 0.00 0.00 173.24 174.17 2qtc h GLU 446 N -0.17 -0.28 -0.01 4.02 5.08 -1.96 -1.30 114.58 119.95 2qtc h GLU 446 Ca -0.45 0.02 0.03 0.00 -1.00 0.00 0.00 59.36 57.96 2qtc h GLU 446 Cb 1.22 0.06 -0.04 0.00 0.50 0.00 0.00 28.75 30.49 2qtc h GLU 446 CO 0.57 -0.19 -0.19 0.93 -1.00 0.00 0.00 179.01 179.13 2qtc h GLU 447 N -0.29 -0.29 -0.17 2.33 3.07 -1.92 -0.62 114.58 116.68 2qtc h GLU 447 Ca 0.12 0.02 0.03 0.00 -0.50 0.00 0.00 59.36 59.03 2qtc h GLU 447 Cb 0.47 0.07 -0.03 0.00 -0.84 0.00 0.00 28.75 28.41 2qtc h GLU 447 CO -0.35 -0.19 -0.04 1.25 -1.40 0.00 0.00 179.01 178.28 2qtc h HIS 448 N -0.30 -0.09 -0.15 4.33 2.76 -1.75 0.01 115.15 119.97 2qtc h HIS 448 Ca 0.06 0.02 0.04 0.00 -2.20 0.00 0.00 60.37 58.28 2qtc h HIS 448 Cb 0.38 0.07 -0.04 0.00 1.55 0.00 0.00 27.41 29.36 2qtc h HIS 448 CO -0.24 -0.07 -0.09 1.15 -1.30 0.00 0.00 177.93 177.37 2qtc h THR 449 N 0.00 0.72 -0.16 6.26 2.02 -1.01 -2.41 112.91 118.32 2qtc h THR 449 Ca 0.08 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.26 2qtc h THR 449 Cb 0.12 0.72 -0.01 0.00 -1.74 0.00 0.00 68.15 67.25 2qtc h THR 449 CO -0.18 0.00 0.08 0.22 0.37 0.00 0.00 175.52 176.01 2qtc h TYR 450 N -0.09 0.23 -0.29 3.16 5.03 -0.93 -0.49 116.97 123.59 2qtc h TYR 450 Ca 0.09 -0.01 0.06 0.00 2.58 0.00 0.00 58.73 61.45 2qtc h TYR 450 Cb 0.22 -0.07 -0.08 0.00 1.55 0.00 0.00 36.73 38.35 2qtc h TYR 450 CO -0.23 0.26 -0.41 1.25 -1.32 0.00 0.00 178.16 177.72 2qtc h LEU 451 N 0.13 -1.33 -0.58 2.82 5.85 -0.78 -1.36 115.31 120.06 2qtc h LEU 451 Ca 0.06 0.20 -0.15 0.00 0.84 0.00 0.00 57.88 58.82 2qtc h LEU 451 Cb 0.12 0.57 -0.01 0.00 0.37 0.00 0.00 40.66 41.71 2qtc h LEU 451 CO -0.01 -0.38 -0.54 0.45 -0.34 0.00 0.00 178.44 177.62 2qtc h HIS 452 N -0.38 0.60 -0.32 1.25 3.86 -1.43 -2.97 115.15 115.75 2qtc h HIS 452 Ca 0.12 -0.21 0.02 0.00 -1.16 0.00 0.00 60.37 59.13 2qtc h HIS 452 Cb 0.59 -0.11 -0.02 0.00 1.06 0.00 0.00 27.41 28.93 2qtc h HIS 452 CO -0.55 0.91 0.18 0.00 0.86 0.00 0.00 177.93 179.33 2qtc h ALA 453 N 1.04 0.40 -0.66 2.45 0.00 -0.61 0.23 119.26 122.11 2qtc h ALA 453 Ca 0.01 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2qtc h ALA 453 Cb 1.07 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.75 2qtc h ALA 453 CO 0.10 -0.19 0.40 1.96 0.00 0.00 0.00 179.25 181.52 2qtc h GLN 454 N 0.37 0.89 -0.35 0.00 1.08 -1.27 -1.60 115.11 114.22 2qtc h GLN 454 Ca 0.13 -0.08 -0.06 0.00 -1.45 0.00 0.00 58.65 57.19 2qtc h GLN 454 Cb 0.02 -0.19 -0.01 0.00 -0.05 0.00 0.00 27.48 27.25 2qtc h GLN 454 CO -0.07 0.63 -0.03 0.00 -0.95 0.00 0.00 178.83 178.41 2qtc h ARG 455 N 0.89 0.64 -0.82 1.46 2.47 -1.27 -2.85 114.38 114.90 2qtc h ARG 455 Ca 0.24 -0.22 0.02 0.00 -1.26 0.00 0.00 59.98 58.75 2qtc h ARG 455 Cb -0.03 -0.05 -0.04 0.00 -1.65 0.00 0.00 29.97 28.19 2qtc h ARG 455 CO -0.05 0.77 0.54 1.96 0.56 0.00 0.00 179.97 183.76 2qtc h GLN 456 N 0.45 1.04 0.00 0.04 1.08 -0.37 0.93 115.11 118.28 2qtc h GLN 456 Ca 0.10 -0.06 -0.00 0.00 -1.45 0.00 0.00 58.65 57.23 2qtc h GLN 456 Cb 0.50 -0.24 -0.00 0.00 -0.05 0.00 0.00 27.48 27.70 2qtc h GLN 456 CO 0.02 0.69 -0.01 0.87 -0.95 0.00 0.00 178.83 179.45 2qtc h LYS 457 N 1.08 0.00 -0.52 1.46 1.57 -1.07 -1.62 116.57 117.47 2qtc h LYS 457 Ca 0.31 0.00 -0.21 0.00 -1.87 0.00 0.00 60.65 58.88 2qtc h LYS 457 Cb -0.07 0.00 -0.12 0.00 0.08 0.00 0.00 32.23 32.11 2qtc h LYS 457 CO -0.08 0.01 0.13 1.28 -0.57 0.00 0.00 179.45 180.23 2qtc n LEU 458 N -3.48 4.90 -0.29 2.94 4.77 0.17 -4.95 117.00 121.05 2qtc n LEU 458 Ca -0.03 -3.48 -0.04 0.00 -0.03 0.00 0.00 56.01 52.43 2qtc n LEU 458 Cb 0.10 -0.67 -0.02 0.00 -2.33 0.00 0.00 43.42 40.50 2qtc n LEU 458 CO 0.25 1.01 -0.04 1.41 -1.33 0.00 0.00 177.39 178.69 2qtc n HIS 459 N -0.82 0.00 0.00 -1.77 8.25 -0.61 -0.48 115.22 119.79 2qtc n HIS 459 Ca 0.37 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.83 2qtc n HIS 459 Cb 1.18 -1.09 0.00 0.00 1.12 0.00 0.00 29.99 31.20 2qtc n HIS 459 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2qtc n GLY 460 N -2.03 0.25 3.72 -1.41 0.00 -0.30 -4.56 105.19 100.87 2qtc n GLY 460 Ca -0.04 -2.07 -0.31 0.00 0.00 0.00 0.00 46.02 43.59 2qtc n GLY 460 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2qtc s TYR 461 N 0.00 3.10 0.02 1.61 1.51 -1.26 -4.58 117.35 117.74 2qtc s TYR 461 Ca 0.00 0.06 -0.14 0.00 -1.01 0.00 0.00 57.07 55.98 2qtc s TYR 461 Cb 0.00 -1.62 0.02 0.00 -0.11 0.00 0.00 41.96 40.25 2qtc s TYR 461 CO 0.00 0.49 0.31 -0.48 -1.11 0.00 0.00 175.55 174.76 2qtc s LEU 462 N -2.02 0.87 0.55 -1.29 2.34 -1.26 -4.38 118.68 113.50 2qtc s LEU 462 Ca 0.24 -0.09 -0.19 0.00 0.06 0.00 0.00 54.13 54.16 2qtc s LEU 462 Cb -0.12 1.32 -0.05 0.00 -0.56 0.00 0.00 46.19 46.78 2qtc s LEU 462 CO 0.16 -0.55 1.10 -2.16 -1.06 0.00 0.00 176.35 173.83 2qtc s PRO 463 N -2.10 3.39 0.00 1.48 0.04 -1.26 -5.00 135.00 131.55 2qtc s PRO 463 Ca -0.08 1.47 -0.11 0.00 0.04 0.00 0.00 61.00 62.32 2qtc s PRO 463 Cb -0.02 -2.02 0.01 0.00 0.04 0.00 0.00 34.50 32.50 2qtc s PRO 463 CO -0.00 -0.79 0.23 0.45 0.04 0.00 0.00 177.00 176.93 2qtc s SER 464 N -2.04 -0.08 -0.00 6.66 0.15 -1.07 -4.80 113.70 112.52 2qtc s SER 464 Ca 0.70 -0.10 0.00 0.00 0.70 0.00 0.00 55.95 57.25 2qtc s SER 464 Cb -0.21 0.27 0.00 0.00 -1.71 0.00 0.00 66.02 64.38 2qtc s SER 464 CO 0.28 -0.44 -0.01 -0.60 1.20 0.00 0.00 173.24 173.67 2qtc s ARG 465 N -1.59 0.11 -0.31 5.44 3.52 -0.46 -4.82 118.95 120.84 2qtc s ARG 465 Ca -0.12 -0.03 -0.12 0.00 -0.13 0.00 0.00 55.73 55.33 2qtc s ARG 465 Cb -0.05 -0.13 -0.02 0.00 -1.56 0.00 0.00 34.95 33.18 2qtc s ARG 465 CO 0.02 0.01 0.20 -1.14 -0.81 0.00 0.00 175.30 173.58 2qtc s GLN 466 N 0.08 3.60 0.40 5.12 0.74 -1.26 -4.33 119.66 124.02 2qtc s GLN 466 Ca -0.01 -0.56 0.21 0.00 0.05 0.00 0.00 55.36 55.05 2qtc s GLN 466 Cb -0.02 -3.70 0.77 0.00 1.10 0.00 0.00 33.01 31.15 2qtc s GLN 466 CO -0.00 -0.36 1.76 -1.35 -0.55 0.00 0.00 175.29 174.79 2qtc h PRO 467 N 8.42 0.00 -5.24 1.67 0.11 -1.92 -3.42 132.00 131.62 2qtc h PRO 467 Ca -0.33 0.00 -0.39 0.00 0.11 0.00 0.00 66.00 65.40 2qtc h PRO 467 Cb 1.17 0.00 -0.20 0.00 0.11 0.00 0.00 31.00 32.08 2qtc h PRO 467 CO 0.61 0.30 -0.76 -0.80 -0.21 0.00 0.00 178.00 177.13 2qtc s ASN 468 N -6.31 1.66 0.45 -2.05 0.01 -1.26 -4.91 114.94 102.53 2qtc s ASN 468 Ca 0.01 -0.70 -0.12 0.00 -0.71 0.00 0.00 52.86 51.34 2qtc s ASN 468 Cb 0.10 -0.04 -0.06 0.00 0.41 0.00 0.00 41.25 41.66 2qtc s ASN 468 CO 0.66 -0.14 0.84 0.72 -1.51 0.00 0.00 177.10 177.68 2qtc s PHE 469 N -1.71 3.49 -0.07 2.20 -0.71 -1.26 -4.91 117.98 115.00 2qtc s PHE 469 Ca 0.02 1.15 -0.01 0.00 -1.04 0.00 0.00 56.93 57.04 2qtc s PHE 469 Cb -0.07 -2.54 -0.26 0.00 -1.21 0.00 0.00 43.02 38.94 2qtc s PHE 469 CO 0.02 -0.23 0.55 1.79 -1.34 0.00 0.00 175.22 176.01 2qtc h THR 470 N 0.87 0.80 -4.23 -4.49 1.35 -1.88 -3.48 112.91 101.85 2qtc h THR 470 Ca -0.47 -2.53 -0.50 0.00 -0.55 0.00 0.00 66.41 62.36 2qtc h THR 470 Cb 1.19 2.55 0.14 0.00 -1.73 0.00 0.00 68.15 70.30 2qtc h THR 470 CO 0.63 0.78 0.29 -1.83 -0.25 0.00 0.00 175.52 175.13 2qtc s GLU 471 N -2.58 1.82 -0.20 4.72 -1.05 -1.26 -5.02 118.70 115.12 2qtc s GLU 471 Ca -0.15 1.10 -0.06 0.00 -0.15 0.00 0.00 54.97 55.70 2qtc s GLU 471 Cb 0.07 -1.85 -0.03 0.00 -0.44 0.00 0.00 34.13 31.87 2qtc s GLU 471 CO 0.80 -1.93 0.04 0.21 0.95 0.00 0.00 175.26 175.34 2qtc s LYS 472 N -4.89 3.76 0.07 -4.83 2.20 -1.26 -5.09 119.74 109.71 2qtc s LYS 472 Ca 0.62 -0.44 -0.12 0.00 -0.36 0.00 0.00 55.97 55.67 2qtc s LYS 472 Cb -0.18 -3.19 -0.06 0.00 -1.51 0.00 0.00 37.83 32.89 2qtc s LYS 472 CO 0.57 0.07 0.43 -0.51 -0.36 0.00 0.00 175.35 175.54 2qtc s LEU 473 N 0.90 4.38 -1.06 5.43 1.43 -1.26 -5.02 118.68 123.49 2qtc s LEU 473 Ca 0.03 0.89 -0.10 0.00 -1.03 0.00 0.00 54.13 53.92 2qtc s LEU 473 Cb -0.14 -2.92 0.27 0.00 0.03 0.00 0.00 46.19 43.43 2qtc s LEU 473 CO 0.02 0.21 1.05 -1.61 0.23 0.00 0.00 176.35 176.25 2qtc s GLU 474 N -1.68 4.09 0.55 1.70 0.41 -1.26 -4.96 118.70 117.56 2qtc s GLU 474 Ca 0.31 -3.09 -0.20 0.00 -0.41 0.00 0.00 54.97 51.58 2qtc s GLU 474 Cb -0.15 -4.53 -0.05 0.00 -1.78 0.00 0.00 34.13 27.62 2qtc s GLU 474 CO 0.17 -1.25 1.18 -0.51 -0.49 0.00 0.00 175.26 174.36 2qtc s LEU 475 N -1.02 3.76 0.54 1.80 1.02 -1.26 -4.56 118.68 118.96 2qtc s LEU 475 Ca 0.28 2.33 -0.21 0.00 0.02 0.00 0.00 54.13 56.55 2qtc s LEU 475 Cb -0.10 -4.51 -0.05 0.00 0.02 0.00 0.00 46.19 41.55 2qtc s LEU 475 CO -0.08 -1.36 1.31 -2.16 0.02 0.00 0.00 176.35 174.08 2qtc s PRO 476 N -3.18 3.20 0.69 1.29 0.04 -1.26 -5.00 135.00 130.77 2qtc s PRO 476 Ca 0.73 2.12 -0.07 0.00 0.04 0.00 0.00 61.00 63.82 2qtc s PRO 476 Cb -0.29 -2.23 0.05 0.00 0.04 0.00 0.00 34.50 32.07 2qtc s PRO 476 CO 0.32 -1.11 1.01 -1.54 0.04 0.00 0.00 177.00 175.72 2qtc s SER 477 N -1.10 4.99 0.31 6.66 1.04 -1.26 -4.95 113.70 119.39 2qtc s SER 477 Ca 0.71 0.57 0.03 0.00 0.48 0.00 0.00 55.95 57.74 2qtc s SER 477 Cb -0.37 -1.29 0.50 0.00 0.10 0.00 0.00 66.02 64.96 2qtc s SER 477 CO 0.44 -1.50 1.82 0.25 0.98 0.00 0.00 173.24 175.23 2qtc h LEU 478 N -0.55 0.54 -2.01 2.42 5.85 -1.96 -2.12 115.31 117.47 2qtc h LEU 478 Ca -0.45 -0.13 0.07 0.00 0.84 0.00 0.00 57.88 58.22 2qtc h LEU 478 Cb 1.30 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 42.18 2qtc h LEU 478 CO 0.61 0.65 0.17 1.56 -0.34 0.00 0.00 178.44 181.10 2qtc h GLN 479 N 0.53 0.00 0.00 1.25 7.50 -2.00 0.16 115.11 122.55 2qtc h GLN 479 Ca 0.11 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.26 2qtc h GLN 479 Cb 0.43 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.96 2qtc h GLN 479 CO 0.02 0.00 0.00 -0.44 -1.50 0.00 0.00 178.83 176.91 2qtc h ASP 480 N 0.00 0.00 -0.71 1.46 3.32 -1.75 0.27 116.42 119.01 2qtc h ASP 480 Ca 0.11 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.16 2qtc h ASP 480 Cb 0.46 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.01 2qtc h ASP 480 CO -0.00 0.00 0.00 0.49 -1.72 0.00 0.00 179.24 178.01 2qtc n PHE 481 N -2.67 1.19 -0.33 4.55 3.01 0.54 -4.69 117.46 119.07 2qtc n PHE 481 Ca -0.01 -0.54 0.22 0.00 1.01 0.00 0.00 57.45 58.12 2qtc n PHE 481 Cb 0.14 -0.10 0.41 0.00 -0.01 0.00 0.00 39.48 39.92 2qtc n PHE 481 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 2qtc h GLY 482 N 4.25 1.68 0.38 1.37 0.00 -0.45 0.01 103.07 110.31 2qtc h GLY 482 Ca 0.00 0.01 0.14 0.00 0.00 0.00 0.00 47.33 47.48 2qtc h GLY 482 CO 0.09 -0.62 0.62 0.00 0.00 0.00 0.00 176.54 176.63 2qtc h ALA 483 N 1.97 1.55 0.00 3.60 0.00 -1.83 -0.68 119.26 123.86 2qtc h ALA 483 Ca 0.70 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.65 2qtc h ALA 483 Cb 1.63 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 19.25 2qtc h ALA 483 CO -0.84 0.15 0.00 -0.07 0.00 0.00 0.00 179.25 178.49 2qtc h LEU 484 N 0.93 0.00 0.00 0.00 -0.00 -1.37 -2.94 115.31 111.93 2qtc h LEU 484 Ca 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.40 2qtc h LEU 484 Cb 0.59 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.25 2qtc h LEU 484 CO -0.30 0.00 -0.63 0.18 -0.00 0.00 0.00 178.44 177.69 2qtc n LEU 485 N -2.38 0.64 -4.92 1.67 4.77 -0.27 -3.11 117.00 113.39 2qtc n LEU 485 Ca 0.03 0.16 -0.26 0.00 -0.03 0.00 0.00 56.01 55.91 2qtc n LEU 485 Cb 0.31 -0.19 0.04 0.00 -2.33 0.00 0.00 43.42 41.24 2qtc n LEU 485 CO 0.24 -0.01 0.55 -1.61 -1.33 0.00 0.00 177.39 175.23 2qtc s GLU 486 N -3.13 2.78 0.42 3.23 2.02 -1.11 -1.15 118.70 121.75 2qtc s GLU 486 Ca 0.07 -0.06 -0.26 0.00 0.02 0.00 0.00 54.97 54.74 2qtc s GLU 486 Cb 0.14 -2.25 -0.09 0.00 0.10 0.00 0.00 34.13 32.03 2qtc s GLU 486 CO 0.72 -0.80 1.44 -2.00 0.02 0.00 0.00 175.26 174.64 2qtc s GLU 487 N -5.04 3.88 0.29 1.61 2.12 -1.26 -4.38 118.70 115.92 2qtc s GLU 487 Ca 0.55 2.46 -0.13 0.00 0.36 0.00 0.00 54.97 58.21 2qtc s GLU 487 Cb -0.11 -2.79 -0.08 0.00 0.26 0.00 0.00 34.13 31.41 2qtc s GLU 487 CO 0.45 -0.67 0.66 -0.65 -0.54 0.00 0.00 175.26 174.50 2qtc s GLN 488 N -2.28 3.91 0.02 4.30 -1.52 0.01 -4.89 119.66 119.21 2qtc s GLN 488 Ca 0.57 0.49 -0.26 0.00 -1.95 0.00 0.00 55.36 54.22 2qtc s GLN 488 Cb -0.44 -2.52 -0.14 0.00 -0.22 0.00 0.00 33.01 29.68 2qtc s GLN 488 CO 0.58 0.22 1.14 0.77 -0.25 0.00 0.00 175.29 177.76 2qtc h SER 489 N 2.35 -0.78 -2.45 5.90 0.02 -1.93 -3.44 113.55 113.22 2qtc h SER 489 Ca -0.47 0.03 -0.46 0.00 -0.84 0.00 0.00 61.79 60.04 2qtc h SER 489 Cb 1.17 0.20 0.01 0.00 0.14 0.00 0.00 62.40 63.92 2qtc h SER 489 CO 0.67 -0.45 -0.27 -0.75 -1.14 0.00 0.00 176.83 174.89 2qtc s LYS 490 N -4.64 3.34 0.08 3.45 2.20 -1.26 -5.04 119.74 117.87 2qtc s LYS 490 Ca -0.13 -0.59 -0.30 0.00 -0.36 0.00 0.00 55.97 54.58 2qtc s LYS 490 Cb 0.01 -2.74 -0.06 0.00 -1.51 0.00 0.00 37.83 33.54 2qtc s LYS 490 CO 0.40 0.15 1.20 -1.21 -0.36 0.00 0.00 175.35 175.53 2qtc s GLU 491 N -4.23 4.45 0.28 4.03 2.02 -1.26 -4.70 118.70 119.28 2qtc s GLU 491 Ca 0.40 1.79 0.06 0.00 0.02 0.00 0.00 54.97 57.24 2qtc s GLU 491 Cb -0.09 -3.33 -0.02 0.00 0.10 0.00 0.00 34.13 30.79 2qtc s GLU 491 CO 0.33 -0.22 0.21 0.44 0.02 0.00 0.00 175.26 176.05 2qtc n ILE 492 N 3.66 0.00 -4.14 -1.63 -5.35 -1.07 -4.61 119.36 106.22 2qtc n ILE 492 Ca 0.08 -1.98 -0.25 0.00 -0.27 0.00 0.00 62.75 60.33 2qtc n ILE 492 Cb 0.46 0.94 -0.07 0.00 -1.74 0.00 0.00 39.64 39.23 2qtc n ILE 492 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 2qtc s SER 493 N -2.93 4.42 0.43 7.28 1.04 -1.26 -1.13 113.70 121.55 2qtc s SER 493 Ca 0.30 -1.10 0.29 0.00 0.48 0.00 0.00 55.95 55.92 2qtc s SER 493 Cb 0.01 -0.42 1.11 0.00 0.10 0.00 0.00 66.02 66.82 2qtc s SER 493 CO 0.21 -0.57 1.85 0.71 0.98 0.00 0.00 173.24 176.42 2qtc h THR 494 N 1.40 0.00 -0.04 2.02 1.35 -1.79 -1.18 112.91 114.67 2qtc h THR 494 Ca -0.43 -0.47 -0.25 0.00 -0.55 0.00 0.00 66.41 64.72 2qtc h THR 494 Cb 1.26 1.39 0.01 0.00 -1.73 0.00 0.00 68.15 69.08 2qtc h THR 494 CO 0.70 0.00 -0.95 0.74 -0.25 0.00 0.00 175.52 175.75 2qtc h THR 495 N 0.00 1.30 -0.67 6.82 2.02 -1.86 -0.57 112.91 119.95 2qtc h THR 495 Ca 0.00 -2.21 -0.06 0.00 0.77 0.00 0.00 66.41 64.91 2qtc h THR 495 Cb 0.53 2.28 -0.03 0.00 -1.74 0.00 0.00 68.15 69.19 2qtc h THR 495 CO 0.00 0.68 0.18 0.40 0.37 0.00 0.00 175.52 177.16 2qtc h ILE 496 N 0.40 1.25 -0.62 3.11 2.04 -1.72 -1.31 117.51 120.65 2qtc h ILE 496 Ca -0.10 -0.91 0.01 0.00 1.00 0.00 0.00 64.86 64.87 2qtc h ILE 496 Cb 1.60 0.54 -0.03 0.00 -0.74 0.00 0.00 36.82 38.18 2qtc h ILE 496 CO 0.18 0.35 0.40 0.00 0.00 0.00 0.00 178.15 179.09 2qtc h ALA 497 N 1.19 0.80 -0.32 1.87 0.00 -1.05 -0.89 119.26 120.85 2qtc h ALA 497 Ca 0.22 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.14 2qtc h ALA 497 Cb 0.33 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 2qtc h ALA 497 CO -0.00 0.19 0.07 0.35 0.00 0.00 0.00 179.25 179.85 2qtc h PHE 498 N 0.81 0.12 -0.30 0.00 3.57 -0.37 0.17 116.94 120.93 2qtc h PHE 498 Ca 0.24 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.71 2qtc h PHE 498 Cb -0.05 -0.01 -0.02 0.00 2.79 0.00 0.00 35.95 38.67 2qtc h PHE 498 CO -0.04 0.03 -0.03 0.28 -2.23 0.00 0.00 178.31 176.32 2qtc h VAL 499 N 0.19 1.19 -0.47 1.41 2.07 -0.88 -0.27 116.25 119.49 2qtc h VAL 499 Ca 0.15 -0.79 -0.13 0.00 0.82 0.00 0.00 66.70 66.75 2qtc h VAL 499 Cb 0.16 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.91 2qtc h VAL 499 CO -0.19 0.27 -0.23 0.03 0.02 0.00 0.00 177.57 177.47 2qtc h ARG 500 N 0.45 0.97 -0.67 1.57 3.08 -0.38 -1.45 114.38 117.95 2qtc h ARG 500 Ca 0.10 -0.42 -0.02 0.00 0.07 0.00 0.00 59.98 59.71 2qtc h ARG 500 Cb 0.34 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.33 2qtc h ARG 500 CO 0.01 1.08 0.35 0.00 -1.07 0.00 0.00 179.97 180.34 2qtc h ALA 501 N 0.90 0.87 -0.92 0.04 0.00 0.13 -1.96 119.26 118.32 2qtc h ALA 501 Ca 0.11 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2qtc h ALA 501 Cb 0.80 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 18.28 2qtc h ALA 501 CO 0.07 0.41 0.52 1.25 0.00 0.00 0.00 179.25 181.49 2qtc h LEU 502 N 0.93 1.13 -1.37 0.00 6.46 -0.85 -1.85 115.31 119.76 2qtc h LEU 502 Ca 0.23 -0.09 -0.02 0.00 -0.12 0.00 0.00 57.88 57.88 2qtc h LEU 502 Cb 0.08 -0.29 -0.02 0.00 -0.73 0.00 0.00 40.66 39.70 2qtc h LEU 502 CO -0.03 0.90 0.15 -1.13 -0.62 0.00 0.00 178.44 177.71 2qtc h ASN 503 N 1.28 0.52 -0.37 1.25 -1.24 -0.58 0.10 115.58 116.54 2qtc h ASN 503 Ca 0.32 -0.06 -0.05 0.00 0.71 0.00 0.00 56.30 57.23 2qtc h ASN 503 Cb 0.00 -0.13 -0.01 0.00 0.73 0.00 0.00 38.32 38.90 2qtc h ASN 503 CO -0.05 0.48 0.04 0.58 -1.29 0.00 0.00 177.43 177.19 2qtc h VAL 504 N 0.58 1.24 -0.49 2.57 2.07 -0.65 -2.84 116.25 118.74 2qtc h VAL 504 Ca 0.14 -0.88 -0.04 0.00 0.82 0.00 0.00 66.70 66.74 2qtc h VAL 504 Cb 0.13 1.10 -0.02 0.00 -1.52 0.00 0.00 31.29 30.98 2qtc h VAL 504 CO -0.01 0.30 0.14 0.24 0.02 0.00 0.00 177.57 178.25 2qtc h MET 505 N 0.46 0.72 0.00 1.57 2.86 -0.63 -2.08 114.93 117.83 2qtc h MET 505 Ca 0.11 -0.13 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 2qtc h MET 505 Cb 0.39 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 31.93 2qtc h MET 505 CO 0.01 0.64 0.00 1.28 1.06 0.00 0.00 176.91 179.90 2qtc n LEU 506 N -4.31 0.00 0.00 1.22 4.77 0.26 -1.42 117.00 117.52 2qtc n LEU 506 Ca 0.03 0.36 0.11 0.00 -0.03 0.00 0.00 56.01 56.48 2qtc n LEU 506 Cb 0.20 -0.36 -0.09 0.00 -2.33 0.00 0.00 43.42 40.84 2qtc n LEU 506 CO 0.39 -0.20 -0.20 0.29 -1.33 0.00 0.00 177.39 176.33 2qtc n LYS 507 N -1.36 0.23 -2.50 3.23 5.02 -0.79 -4.78 118.16 117.22 2qtc n LYS 507 Ca 0.05 -0.05 -0.43 0.00 -2.02 0.00 0.00 58.31 55.86 2qtc n LYS 507 Cb 0.12 -1.53 -0.02 0.00 -0.02 0.00 0.00 35.03 33.58 2qtc n LYS 507 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 2qtc s ASN 508 N -3.59 7.04 0.20 4.39 3.84 -0.51 -4.94 114.94 121.37 2qtc s ASN 508 Ca 0.03 1.67 -0.11 0.00 0.21 0.00 0.00 52.86 54.66 2qtc s ASN 508 Cb 0.15 -2.55 0.22 0.00 -0.55 0.00 0.00 41.25 38.52 2qtc s ASN 508 CO 0.86 -0.65 1.76 0.11 -2.79 0.00 0.00 177.10 176.39 2qtc h LYS 509 N 7.70 0.44 -0.54 0.43 1.79 -1.90 0.41 116.57 124.90 2qtc h LYS 509 Ca -0.28 -0.03 -0.11 0.00 -2.18 0.00 0.00 60.65 58.05 2qtc h LYS 509 Cb 1.12 -0.10 -0.02 0.00 -1.58 0.00 0.00 32.23 31.65 2qtc h LYS 509 CO 0.93 0.29 -0.08 1.03 -1.08 0.00 0.00 179.45 180.54 2qtc h SER 510 N 0.45 0.99 -0.00 0.86 0.87 -1.92 -3.37 113.55 111.42 2qtc h SER 510 Ca 0.27 -0.31 0.00 0.00 -1.23 0.00 0.00 61.79 60.52 2qtc h SER 510 Cb 0.27 -0.27 0.00 0.00 -0.44 0.00 0.00 62.40 61.97 2qtc h SER 510 CO -0.24 1.09 -0.16 2.30 -0.53 0.00 0.00 176.83 179.28 2qtc n ILE 511 N -4.15 0.00 -0.30 2.23 -5.35 -1.16 -4.78 119.36 105.84 2qtc n ILE 511 Ca 0.02 -0.42 0.14 0.00 -0.27 0.00 0.00 62.75 62.22 2qtc n ILE 511 Cb 0.38 1.02 0.30 0.00 -1.74 0.00 0.00 39.64 39.60 2qtc n ILE 511 CO 0.00 0.00 0.00 0.07 -1.76 0.00 0.00 176.55 174.86 2qtc h LYS 512 N 0.15 0.21 -0.01 6.28 2.10 -1.03 0.37 116.57 124.63 2qtc h LYS 512 Ca 0.00 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 2qtc h LYS 512 Cb 0.11 -0.05 0.00 0.00 -0.90 0.00 0.00 32.23 31.39 2qtc h LYS 512 CO 0.00 0.14 -0.02 -0.25 -2.00 0.00 0.00 179.45 177.32 2qtc n ASP 513 N -5.21 1.37 0.02 7.07 8.00 -1.26 -3.39 116.55 123.15 2qtc n ASP 513 Ca 0.22 -1.42 0.12 0.00 0.71 0.00 0.00 54.79 54.41 2qtc n ASP 513 Cb 0.70 0.01 0.12 0.00 -0.02 0.00 0.00 41.12 41.93 2qtc n ASP 513 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2qtc n ARG 514 N 0.04 0.18 -2.20 -1.24 5.12 0.12 -4.89 116.66 113.80 2qtc n ARG 514 Ca 0.19 0.02 -0.41 0.00 -1.93 0.00 0.00 57.85 55.72 2qtc n ARG 514 Cb 0.34 -1.58 -0.03 0.00 -1.16 0.00 0.00 32.46 30.03 2qtc n ARG 514 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2qtc s LEU 515 N -3.65 4.43 -0.51 0.55 1.43 -0.93 -0.83 118.68 119.16 2qtc s LEU 515 Ca 0.07 2.48 0.03 0.00 -1.03 0.00 0.00 54.13 55.69 2qtc s LEU 515 Cb 0.15 -3.62 0.15 0.00 0.03 0.00 0.00 46.19 42.90 2qtc s LEU 515 CO 0.76 -0.50 0.32 -0.69 0.23 0.00 0.00 176.35 176.46 2qtc s VAL 516 N -0.37 1.86 0.14 -1.59 1.01 -0.51 -4.87 120.40 116.07 2qtc s VAL 516 Ca 0.53 -3.13 -0.30 0.00 0.00 0.00 0.00 61.98 59.08 2qtc s VAL 516 Cb -0.37 -2.27 -0.08 0.00 0.00 0.00 0.00 36.38 33.66 2qtc s VAL 516 CO 0.43 -0.94 1.28 -2.84 0.00 0.00 0.00 175.10 173.03 2qtc s PRO 517 N -0.24 4.40 -0.03 2.72 0.02 -1.26 -1.76 135.00 138.85 2qtc s PRO 517 Ca 0.21 1.95 0.04 0.00 0.02 0.00 0.00 61.00 63.22 2qtc s PRO 517 Cb -0.17 -3.26 -0.00 0.00 0.02 0.00 0.00 34.50 31.10 2qtc s PRO 517 CO -0.06 -0.27 -0.14 0.42 -0.33 0.00 0.00 177.00 176.62 2qtc s ILE 518 N 0.59 1.12 0.04 2.83 1.01 0.09 -1.17 121.20 125.72 2qtc s ILE 518 Ca 0.59 -0.56 0.01 0.00 0.00 0.00 0.00 60.65 60.68 2qtc s ILE 518 Cb -0.34 -0.96 -0.02 0.00 0.01 0.00 0.00 42.46 41.14 2qtc s ILE 518 CO 0.33 0.33 -0.05 0.27 0.00 0.00 0.00 174.94 175.82 2qtc s ILE 519 N -0.02 0.36 -0.83 2.92 -4.36 -0.45 -1.89 121.20 116.94 2qtc s ILE 519 Ca -0.01 -1.13 -0.03 0.00 -0.26 0.00 0.00 60.65 59.22 2qtc s ILE 519 Cb -0.09 -0.62 0.21 0.00 1.25 0.00 0.00 42.46 43.21 2qtc s ILE 519 CO 0.01 -0.51 0.71 0.00 0.24 0.00 0.00 174.94 175.38 2qtc s ALA 520 N -1.77 4.09 0.00 2.27 0.00 -1.26 -1.54 121.76 123.55 2qtc s ALA 520 Ca -0.09 -3.66 0.00 0.00 0.00 0.00 0.00 51.96 48.21 2qtc s ALA 520 Cb -0.08 -2.87 0.00 0.00 0.00 0.00 0.00 23.12 20.18 2qtc s ALA 520 CO -0.01 -2.15 0.00 -3.47 0.00 0.00 0.00 175.76 170.13 2qtc n ASP 521 N 2.75 0.00 -4.53 0.00 2.03 -0.76 -4.57 116.55 111.47 2qtc n ASP 521 Ca 0.18 0.00 -0.49 0.00 0.52 0.00 0.00 54.79 55.00 2qtc n ASP 521 Cb 0.38 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 40.72 2qtc n ASP 521 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2qtc n GLU 522 N 0.00 1.49 0.00 -0.67 4.71 -1.26 -4.70 120.64 120.21 2qtc n GLU 522 Ca 0.00 0.45 0.00 0.00 -0.01 0.00 0.00 57.16 57.60 2qtc n GLU 522 Cb 0.00 -2.67 0.00 0.00 -1.01 0.00 0.00 31.44 27.76 2qtc n GLU 522 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2qtc n ALA 523 N 9.55 2.46 -0.32 0.62 0.00 -1.26 -4.74 120.51 126.82 2qtc n ALA 523 Ca 0.35 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.77 2qtc n ALA 523 Cb 0.29 0.19 0.15 0.00 0.00 0.00 0.00 19.45 20.08 2qtc n ALA 523 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qtc h ARG 524 N 0.00 1.20 -0.06 0.00 3.08 -1.93 0.46 114.38 117.13 2qtc h ARG 524 Ca 0.00 -0.08 0.02 0.00 0.07 0.00 0.00 59.98 59.99 2qtc h ARG 524 Cb 0.38 -0.27 -0.00 0.00 0.08 0.00 0.00 29.97 30.16 2qtc h ARG 524 CO 0.00 0.81 0.05 1.15 -1.07 0.00 0.00 179.97 180.91 2qtc h THR 525 N 1.23 0.78 -0.55 2.04 2.02 -1.95 -1.62 112.91 114.86 2qtc h THR 525 Ca 0.33 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.51 2qtc h THR 525 Cb -0.12 0.96 0.00 0.00 -1.74 0.00 0.00 68.15 67.25 2qtc h THR 525 CO -0.07 0.00 0.00 0.49 0.37 0.00 0.00 175.52 176.31 2qtc n PHE 526 N -4.24 1.01 -3.24 3.16 3.72 0.01 -4.94 117.46 112.95 2qtc n PHE 526 Ca -0.02 -0.58 -0.23 0.00 -0.05 0.00 0.00 57.45 56.57 2qtc n PHE 526 Cb 0.15 -0.12 0.03 0.00 -0.94 0.00 0.00 39.48 38.60 2qtc n PHE 526 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2qtc n GLY 527 N 0.95 -0.52 0.03 1.37 0.00 -0.61 -4.84 105.19 101.58 2qtc n GLY 527 Ca 0.21 0.14 0.11 0.00 0.00 0.00 0.00 46.02 46.48 2qtc n GLY 527 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2qtc n MET 528 N -4.11 0.47 0.21 1.61 2.81 -0.38 -4.30 117.12 113.43 2qtc n MET 528 Ca -0.06 -0.07 0.09 0.00 -1.81 0.00 0.00 57.70 55.85 2qtc n MET 528 Cb 0.59 -1.59 0.47 0.00 -0.71 0.00 0.00 33.22 31.98 2qtc n MET 528 CO 0.00 0.00 0.00 1.49 1.51 0.00 0.00 175.97 178.97 2qtc h GLU 529 N 0.00 0.00 0.00 0.03 4.81 -1.88 0.31 114.58 117.85 2qtc h GLU 529 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2qtc h GLU 529 Cb 0.87 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.25 2qtc h GLU 529 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 179.01 178.69 2qtc n GLY 530 N -1.27 -0.87 0.00 1.92 0.00 -1.26 -2.81 105.19 100.90 2qtc n GLY 530 Ca -0.01 -0.13 0.08 0.00 0.00 0.00 0.00 46.02 45.96 2qtc n GLY 530 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2qtc n LEU 531 N -1.13 0.28 0.18 0.99 4.77 0.11 -4.02 117.00 118.18 2qtc n LEU 531 Ca 0.15 -0.19 0.18 0.00 -0.03 0.00 0.00 56.01 56.12 2qtc n LEU 531 Cb 0.13 0.00 0.81 0.00 -2.33 0.00 0.00 43.42 42.03 2qtc n LEU 531 CO 0.15 0.07 1.16 -0.26 -1.33 0.00 0.00 177.39 177.18 2qtc h PHE 532 N 0.00 0.00 0.02 -1.77 0.04 -1.65 -2.19 116.94 111.39 2qtc h PHE 532 Ca 0.00 0.00 -0.25 0.00 2.80 0.00 0.00 57.97 60.52 2qtc h PHE 532 Cb 0.60 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.71 2qtc h PHE 532 CO 0.00 0.00 -1.37 0.00 -0.60 0.00 0.00 178.31 176.34 2qtc h ARG 533 N 0.00 0.04 0.06 1.51 3.08 -1.77 -3.10 114.38 114.20 2qtc h ARG 533 Ca 0.11 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 60.10 2qtc h ARG 533 Cb 0.72 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.79 2qtc h ARG 533 CO -0.00 1.03 -0.03 0.37 -1.07 0.00 0.00 179.97 180.27 2qtc h GLN 534 N -0.86 -0.08 -0.00 0.04 4.15 -1.61 -3.37 115.11 113.37 2qtc h GLN 534 Ca -0.36 0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.06 2qtc h GLN 534 Cb 1.40 0.02 0.00 0.00 0.21 0.00 0.00 27.48 29.11 2qtc h GLN 534 CO -0.17 0.11 -0.16 0.44 -1.93 0.00 0.00 178.83 177.11 2qtc n ILE 535 N -5.05 0.00 -0.45 2.39 -5.35 -0.85 -5.11 119.36 104.94 2qtc n ILE 535 Ca -0.08 -0.42 0.06 0.00 -0.27 0.00 0.00 62.75 62.04 2qtc n ILE 535 Cb 0.13 1.00 -0.03 0.00 -1.74 0.00 0.00 39.64 39.01 2qtc n ILE 535 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2qtc n GLY 536 N 1.08 -2.46 3.69 3.28 0.00 -1.02 -1.71 105.19 108.04 2qtc n GLY 536 Ca 0.01 -1.35 -0.35 0.00 0.00 0.00 0.00 46.02 44.32 2qtc n GLY 536 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2qtc s ILE 537 N -2.82 4.58 0.13 -0.61 2.07 -1.26 -0.87 121.20 122.42 2qtc s ILE 537 Ca 0.00 -0.13 -0.31 0.00 -1.41 0.00 0.00 60.65 58.80 2qtc s ILE 537 Cb 0.00 -2.98 -0.08 0.00 0.13 0.00 0.00 42.46 39.53 2qtc s ILE 537 CO 0.00 0.57 1.41 -0.47 -1.91 0.00 0.00 174.94 174.53 2qtc s TYR 538 N -0.51 3.22 -0.39 3.50 5.04 0.43 -2.72 117.35 125.91 2qtc s TYR 538 Ca 0.10 0.93 0.06 0.00 -2.44 0.00 0.00 57.07 55.71 2qtc s TYR 538 Cb -0.12 -3.71 0.18 0.00 0.35 0.00 0.00 41.96 38.66 2qtc s TYR 538 CO 0.02 -2.49 0.67 0.45 -1.34 0.00 0.00 175.55 172.86 2qtc s SER 539 N 1.04 -1.41 0.00 4.32 0.15 -0.14 -4.76 113.70 112.89 2qtc s SER 539 Ca 0.65 -0.62 0.00 0.00 0.70 0.00 0.00 55.95 56.68 2qtc s SER 539 Cb -0.38 1.81 0.00 0.00 -1.71 0.00 0.00 66.02 65.75 2qtc s SER 539 CO 0.31 -0.17 0.43 -0.81 1.20 0.00 0.00 173.24 174.20 2qtc n PRO 540 N 4.45 0.00 0.00 5.44 -0.04 -1.26 -2.06 135.00 141.54 2qtc n PRO 540 Ca 0.10 -0.06 0.00 0.00 -0.04 0.00 0.00 63.50 63.50 2qtc n PRO 540 Cb 0.57 -1.32 0.00 0.00 -0.04 0.00 0.00 33.50 32.71 2qtc n PRO 540 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2qtc n GLU 558 N 2.89 0.00 -1.94 0.54 2.13 -1.25 -4.85 120.64 118.16 2qtc n GLU 558 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 2qtc n GLU 558 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 2qtc n GLU 558 CO 0.00 0.00 0.00 -0.40 -0.41 0.00 0.00 177.13 176.32 2qtc n ASP 559 N 0.00 0.41 0.00 4.31 5.68 -1.10 -4.96 116.55 120.89 2qtc n ASP 559 Ca 0.00 -0.97 0.10 0.00 -0.50 0.00 0.00 54.79 53.42 2qtc n ASP 559 Cb 0.00 0.00 0.48 0.00 -1.14 0.00 0.00 41.12 40.46 2qtc n ASP 559 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 2qtc n GLU 560 N 0.00 0.16 0.00 0.11 0.00 -0.87 -0.97 120.64 119.07 2qtc n GLU 560 Ca 0.00 0.12 0.11 0.00 0.00 0.00 0.00 57.16 57.39 2qtc n GLU 560 Cb 0.00 -1.50 0.06 0.00 0.00 0.00 0.00 31.44 30.00 2qtc n GLU 560 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 2qtc n LYS 561 N -1.38 0.49 -1.62 3.44 4.76 -1.26 -4.06 118.16 118.53 2qtc n LYS 561 Ca 0.08 -0.38 -0.43 0.00 -2.87 0.00 0.00 58.31 54.71 2qtc n LYS 561 Cb 0.20 -1.49 -0.01 0.00 -1.84 0.00 0.00 35.03 31.89 2qtc n LYS 561 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2qtc n GLY 562 N 1.45 -0.07 0.10 0.72 0.00 -0.77 -4.89 105.19 101.73 2qtc n GLY 562 Ca 0.07 0.27 -0.12 0.00 0.00 0.00 0.00 46.02 46.24 2qtc n GLY 562 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2qtc n GLN 563 N 0.53 0.67 -2.72 1.61 7.27 -0.69 -3.66 117.38 120.39 2qtc n GLN 563 Ca 0.08 0.19 -0.41 0.00 0.07 0.00 0.00 57.00 56.94 2qtc n GLN 563 Cb 0.35 -1.68 -0.05 0.00 2.41 0.00 0.00 30.24 31.27 2qtc n GLN 563 CO 0.00 0.00 0.00 0.42 0.07 0.00 0.00 177.06 177.55 2qtc s ILE 564 N -2.55 4.27 -0.34 1.69 1.01 -0.05 -4.46 121.20 120.77 2qtc s ILE 564 Ca -0.12 2.04 -0.14 0.00 0.00 0.00 0.00 60.65 62.43 2qtc s ILE 564 Cb 0.07 -4.30 -0.02 0.00 0.01 0.00 0.00 42.46 38.23 2qtc s ILE 564 CO 0.80 0.39 0.30 -0.76 0.00 0.00 0.00 174.94 175.66 2qtc s LEU 565 N -0.52 4.45 -0.44 2.97 1.43 -0.31 -0.43 118.68 125.83 2qtc s LEU 565 Ca 0.45 -0.30 -0.09 0.00 -1.03 0.00 0.00 54.13 53.15 2qtc s LEU 565 Cb -0.25 -2.23 0.10 0.00 0.03 0.00 0.00 46.19 43.83 2qtc s LEU 565 CO 0.31 -0.27 0.30 -1.58 0.23 0.00 0.00 176.35 175.34 2qtc s GLN 566 N 1.86 2.57 0.00 1.70 2.00 -1.26 -1.34 119.66 125.20 2qtc s GLN 566 Ca 0.09 -1.58 0.24 0.00 -2.00 0.00 0.00 55.36 52.11 2qtc s GLN 566 Cb -0.17 -3.86 0.67 0.00 0.80 0.00 0.00 33.01 30.45 2qtc s GLN 566 CO 0.11 -1.06 1.53 0.39 -0.50 0.00 0.00 175.29 175.76 2qtc n GLU 567 N 4.93 1.97 0.00 1.67 -0.58 -0.59 -4.94 120.64 123.10 2qtc n GLU 567 Ca -0.09 -1.43 0.00 0.00 -0.42 0.00 0.00 57.16 55.22 2qtc n GLU 567 Cb 0.42 -1.46 0.00 0.00 -0.57 0.00 0.00 31.44 29.83 2qtc n GLU 567 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2qtc n GLY 568 N 1.26 -0.79 3.51 0.62 0.00 -1.26 -4.24 105.19 104.29 2qtc n GLY 568 Ca 0.17 -1.16 -0.43 0.00 0.00 0.00 0.00 46.02 44.59 2qtc n GLY 568 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qtc s ILE 569 N 0.00 4.58 -0.47 -0.61 1.01 -1.26 -1.83 121.20 122.61 2qtc s ILE 569 Ca 0.00 -2.06 0.05 0.00 0.00 0.00 0.00 60.65 58.64 2qtc s ILE 569 Cb 0.00 -5.00 0.19 0.00 0.01 0.00 0.00 42.46 37.66 2qtc s ILE 569 CO 0.00 -1.77 0.78 0.21 0.00 0.00 0.00 174.94 174.16 2qtc s ASN 570 N 3.62 -1.25 0.24 3.58 3.84 -1.26 -5.02 114.94 118.69 2qtc s ASN 570 Ca 0.45 -1.33 -0.05 0.00 0.21 0.00 0.00 52.86 52.14 2qtc s ASN 570 Cb -0.01 1.63 0.26 0.00 -0.55 0.00 0.00 41.25 42.58 2qtc s ASN 570 CO 0.00 -0.06 1.79 -0.33 -2.79 0.00 0.00 177.10 175.71 2qtc h GLU 571 N 5.19 1.03 -0.50 0.43 3.07 -1.92 -1.11 114.58 120.77 2qtc h GLU 571 Ca 0.05 -0.21 -0.08 0.00 -0.50 0.00 0.00 59.36 58.61 2qtc h GLU 571 Cb 1.13 -0.16 -0.02 0.00 -0.84 0.00 0.00 28.75 28.87 2qtc h GLU 571 CO 0.00 0.88 -0.02 1.25 -1.40 0.00 0.00 179.01 179.72 2qtc h LEU 572 N 1.00 0.89 -0.70 1.33 5.85 -1.93 0.83 115.31 122.58 2qtc h LEU 572 Ca 0.22 -0.32 -0.04 0.00 0.84 0.00 0.00 57.88 58.59 2qtc h LEU 572 Cb 0.28 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.04 2qtc h LEU 572 CO -0.01 0.99 0.30 1.23 -0.34 0.00 0.00 178.44 180.60 2qtc h GLY 573 N 0.76 1.11 1.08 3.75 0.00 -1.89 -0.36 103.07 107.53 2qtc h GLY 573 Ca 0.14 -0.59 -0.09 0.00 0.00 0.00 0.00 47.33 46.79 2qtc h GLY 573 CO 0.03 0.56 0.05 0.00 0.00 0.00 0.00 176.54 177.18 2qtc h ALA 574 N 1.14 0.86 -0.41 3.60 0.00 -0.95 -1.12 119.26 122.37 2qtc h ALA 574 Ca 0.24 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 2qtc h ALA 574 Cb 0.19 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 2qtc h ALA 574 CO -0.02 0.66 0.05 0.78 0.00 0.00 0.00 179.25 180.72 2qtc h GLY 575 N 1.01 0.69 1.83 0.00 0.00 -0.48 0.92 103.07 107.04 2qtc h GLY 575 Ca 0.19 -0.40 -0.12 0.00 0.00 0.00 0.00 47.33 47.00 2qtc h GLY 575 CO 0.02 0.37 -0.51 0.00 0.00 0.00 0.00 176.54 176.43 2qtc h SER 577 N 0.15 0.43 -0.60 0.00 0.02 -0.69 -1.61 113.55 111.25 2qtc h SER 577 Ca 0.00 -0.51 0.07 0.00 -0.84 0.00 0.00 61.79 60.51 2qtc h SER 577 Cb 0.95 -0.12 -0.06 0.00 0.14 0.00 0.00 62.40 63.31 2qtc h SER 577 CO 0.08 0.86 0.29 -0.25 -1.14 0.00 0.00 176.83 176.67 2qtc h TRP 578 N 0.02 0.53 -0.35 3.45 7.01 -0.60 -0.37 115.95 125.63 2qtc h TRP 578 Ca 0.02 0.03 -0.04 0.00 2.11 0.00 0.00 58.89 61.00 2qtc h TRP 578 Cb 0.76 -0.15 -0.01 0.00 -2.10 0.00 0.00 29.16 27.66 2qtc h TRP 578 CO 0.09 0.22 0.06 1.25 -2.79 0.00 0.00 178.44 177.27 2qtc h LEU 579 N 0.54 0.55 -0.64 0.65 5.85 -0.60 0.28 115.31 121.94 2qtc h LEU 579 Ca 0.28 -0.26 -0.00 0.00 0.84 0.00 0.00 57.88 58.74 2qtc h LEU 579 Cb 0.24 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.09 2qtc h LEU 579 CO -0.22 0.67 0.39 0.00 -0.34 0.00 0.00 178.44 178.94 2qtc h ALA 580 N 0.90 0.82 -0.30 1.25 0.00 -0.89 -1.42 119.26 119.62 2qtc h ALA 580 Ca 0.11 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 2qtc h ALA 580 Cb 0.35 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2qtc h ALA 580 CO 0.01 0.29 0.03 0.00 0.00 0.00 0.00 179.25 179.58 2qtc h ALA 581 N 1.20 0.40 0.00 0.00 0.00 -0.83 -2.57 119.26 117.47 2qtc h ALA 581 Ca 0.23 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2qtc h ALA 581 Cb -0.03 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.64 2qtc h ALA 581 CO -0.04 0.11 0.00 0.00 0.00 0.00 0.00 179.25 179.32 2qtc n ALA 582 N -2.34 1.55 -0.14 0.00 0.00 0.96 -2.46 120.51 118.08 2qtc n ALA 582 Ca -0.02 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.37 2qtc n ALA 582 Cb 0.23 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.50 2qtc n ALA 582 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2qtc n THR 583 N -1.44 0.80 0.24 0.00 -2.24 -0.58 -1.47 114.28 109.58 2qtc n THR 583 Ca 0.03 -0.83 0.09 0.00 -2.27 0.00 0.00 64.05 61.07 2qtc n THR 583 Cb 0.12 0.61 0.62 0.00 -2.10 0.00 0.00 70.33 69.58 2qtc n THR 583 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 2qtc h SER 584 N 0.00 0.00 0.03 3.42 0.87 -1.13 -0.71 113.55 116.03 2qtc h SER 584 Ca 0.00 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.55 2qtc h SER 584 Cb 0.54 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.49 2qtc h SER 584 CO 0.00 0.15 -0.05 0.10 -0.53 0.00 0.00 176.83 176.50 2qtc h TYR 585 N 0.00 0.04 0.00 2.24 -0.00 -1.78 -1.29 116.97 116.19 2qtc h TYR 585 Ca -0.00 -0.00 -0.33 0.00 0.00 0.00 0.00 58.73 58.40 2qtc h TYR 585 Cb 0.30 -0.01 -0.05 0.00 0.00 0.00 0.00 36.73 36.97 2qtc h TYR 585 CO 0.00 0.10 -1.83 0.45 -0.00 0.00 0.00 178.16 176.88 2qtc n SER 586 N -4.45 1.91 0.15 0.10 2.88 -0.40 -3.02 113.62 110.79 2qtc n SER 586 Ca -0.02 0.39 0.01 0.00 -1.33 0.00 0.00 58.87 57.91 2qtc n SER 586 Cb 0.15 -0.89 0.22 0.00 -0.75 0.00 0.00 64.21 62.94 2qtc n SER 586 CO 0.00 0.00 0.00 0.71 -1.23 0.00 0.00 175.04 174.52 2qtc h THR 587 N -1.00 1.27 -0.02 2.46 1.35 -1.21 -3.29 112.91 112.47 2qtc h THR 587 Ca -0.49 -1.94 0.00 0.00 -0.55 0.00 0.00 66.41 63.43 2qtc h THR 587 Cb 1.41 2.08 0.00 0.00 -1.73 0.00 0.00 68.15 69.91 2qtc h THR 587 CO -0.30 0.53 0.00 0.59 -0.25 0.00 0.00 175.52 176.09 2qtc n ASN 588 N -3.72 1.47 -3.30 5.36 3.02 -0.53 -3.80 115.26 113.75 2qtc n ASN 588 Ca -0.01 -1.34 -0.23 0.00 -0.03 0.00 0.00 54.58 52.97 2qtc n ASN 588 Cb 0.58 -0.01 0.00 0.00 -0.61 0.00 0.00 39.78 39.74 2qtc n ASN 588 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 2qtc n ASN 589 N 0.03 -4.06 -3.70 6.41 5.15 -1.01 -4.74 115.26 113.34 2qtc n ASN 589 Ca 0.02 -0.37 -0.30 0.00 -0.60 0.00 0.00 54.58 53.33 2qtc n ASN 589 Cb 0.12 -3.34 -0.13 0.00 -0.53 0.00 0.00 39.78 35.90 2qtc n ASN 589 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 2qtc s LEU 590 N -6.51 2.58 0.22 1.20 2.96 -0.93 -4.75 118.68 113.45 2qtc s LEU 590 Ca 0.38 -2.55 -0.31 0.00 -0.22 0.00 0.00 54.13 51.43 2qtc s LEU 590 Cb -0.20 -0.99 -0.11 0.00 0.50 0.00 0.00 46.19 45.39 2qtc s LEU 590 CO 0.47 -0.28 1.60 -2.16 -1.32 0.00 0.00 176.35 174.66 2qtc s PRO 591 N 0.46 4.17 0.04 0.98 0.04 -1.26 -3.20 135.00 136.23 2qtc s PRO 591 Ca 0.17 2.48 0.06 0.00 0.04 0.00 0.00 61.00 63.75 2qtc s PRO 591 Cb -0.24 -3.09 -0.02 0.00 0.04 0.00 0.00 34.50 31.19 2qtc s PRO 591 CO -0.00 -0.62 -0.17 -1.64 0.04 0.00 0.00 177.00 174.60 2qtc s MET 592 N 0.48 1.15 -0.45 4.56 -1.94 -1.26 -4.89 119.30 116.96 2qtc s MET 592 Ca 0.68 -0.83 0.04 0.00 -1.71 0.00 0.00 55.69 53.87 2qtc s MET 592 Cb -0.46 -1.21 0.12 0.00 2.01 0.00 0.00 34.83 35.28 2qtc s MET 592 CO 0.38 0.31 0.18 0.42 -0.01 0.00 0.00 175.02 176.29 2qtc s ILE 593 N -0.80 2.44 0.25 2.53 1.01 -0.01 -4.47 121.20 122.15 2qtc s ILE 593 Ca 0.05 -2.92 -0.18 0.00 0.00 0.00 0.00 60.65 57.59 2qtc s ILE 593 Cb -0.08 -2.74 -0.08 0.00 0.01 0.00 0.00 42.46 39.56 2qtc s ILE 593 CO 0.01 -0.72 0.72 -2.16 0.00 0.00 0.00 174.94 172.80 2qtc s PRO 594 N 0.19 4.16 -0.26 2.79 0.04 -1.26 -1.43 135.00 139.23 2qtc s PRO 594 Ca 0.15 0.79 -0.00 0.00 0.04 0.00 0.00 61.00 61.98 2qtc s PRO 594 Cb -0.23 -2.74 0.08 0.00 0.04 0.00 0.00 34.50 31.65 2qtc s PRO 594 CO -0.03 0.32 0.03 -0.06 0.04 0.00 0.00 177.00 177.30 2qtc s PHE 595 N -1.67 1.99 -0.33 0.56 0.40 -0.72 -1.35 117.98 116.86 2qtc s PHE 595 Ca 0.46 -1.68 -0.11 0.00 -0.60 0.00 0.00 56.93 55.00 2qtc s PHE 595 Cb -0.15 -1.65 -0.01 0.00 0.51 0.00 0.00 43.02 41.73 2qtc s PHE 595 CO 0.20 -0.79 0.20 -0.47 0.70 0.00 0.00 175.22 175.06 2qtc s TYR 596 N 1.52 3.21 -0.09 0.36 5.04 -0.76 -0.73 117.35 125.90 2qtc s TYR 596 Ca 0.03 -0.44 0.01 0.00 -2.44 0.00 0.00 57.07 54.23 2qtc s TYR 596 Cb -0.18 -2.43 -0.02 0.00 0.35 0.00 0.00 41.96 39.68 2qtc s TYR 596 CO -0.14 -0.43 -0.10 -1.50 -1.34 0.00 0.00 175.55 172.05 2qtc s ILE 597 N 1.66 3.42 0.36 3.14 2.07 -0.79 -0.66 121.20 130.40 2qtc s ILE 597 Ca 0.05 -0.56 -0.14 0.00 -1.41 0.00 0.00 60.65 58.58 2qtc s ILE 597 Cb -0.17 -2.41 0.04 0.00 0.13 0.00 0.00 42.46 40.05 2qtc s ILE 597 CO 0.08 0.56 0.73 -0.72 -1.91 0.00 0.00 174.94 173.68 2qtc s TYR 598 N -0.32 0.22 -0.05 3.50 -0.85 -0.95 -4.21 117.35 114.69 2qtc s TYR 598 Ca 0.04 -0.80 -0.30 0.00 -0.52 0.00 0.00 57.07 55.49 2qtc s TYR 598 Cb -0.13 0.67 -0.05 0.00 0.38 0.00 0.00 41.96 42.84 2qtc s TYR 598 CO 0.02 -1.45 1.44 0.71 -1.52 0.00 0.00 175.55 174.75 2qtc s TYR 599 N -2.66 2.59 0.46 -3.49 2.02 -1.26 -0.20 117.35 114.80 2qtc s TYR 599 Ca 0.17 0.68 0.21 0.00 -0.37 0.00 0.00 57.07 57.76 2qtc s TYR 599 Cb -0.04 -3.70 1.21 0.00 -0.40 0.00 0.00 41.96 39.02 2qtc s TYR 599 CO 0.12 -2.69 1.90 0.66 -1.57 0.00 0.00 175.55 173.97 2qtc h SER 600 N 8.42 0.26 -0.97 2.29 4.64 -1.11 -0.24 113.55 126.84 2qtc h SER 600 Ca -0.36 0.02 0.11 0.00 -0.47 0.00 0.00 61.79 61.10 2qtc h SER 600 Cb 1.16 -0.03 -0.08 0.00 -0.31 0.00 0.00 62.40 63.15 2qtc h SER 600 CO 0.93 0.11 0.62 -0.03 -0.87 0.00 0.00 176.83 177.59 2qtc h MET 601 N 0.26 0.94 -0.99 4.77 -1.53 -1.84 -1.58 114.93 114.96 2qtc h MET 601 Ca 0.40 -0.06 -0.30 0.00 -3.44 0.00 0.00 59.70 56.30 2qtc h MET 601 Cb 1.18 -0.21 -0.18 0.00 -0.55 0.00 0.00 31.60 31.84 2qtc h MET 601 CO -0.10 0.62 0.39 1.19 0.14 0.00 0.00 176.91 179.14 2qtc n PHE 602 N -4.57 1.85 0.00 1.39 3.72 -0.10 -4.19 117.46 115.55 2qtc n PHE 602 Ca 0.17 -1.29 0.00 0.00 -0.05 0.00 0.00 57.45 56.29 2qtc n PHE 602 Cb 0.33 -0.66 0.00 0.00 -0.94 0.00 0.00 39.48 38.21 2qtc n PHE 602 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2qtc n GLY 603 N -0.47 0.62 0.41 1.37 0.00 -0.60 -4.44 105.19 102.09 2qtc n GLY 603 Ca 0.36 0.00 0.21 0.00 0.00 0.00 0.00 46.02 46.59 2qtc n GLY 603 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2qtc h PHE 604 N 0.00 0.36 -0.68 1.61 -1.00 -1.84 0.08 116.94 115.47 2qtc h PHE 604 Ca 0.00 0.01 -0.06 0.00 2.81 0.00 0.00 57.97 60.73 2qtc h PHE 604 Cb 0.00 -0.11 -0.03 0.00 3.61 0.00 0.00 35.95 39.42 2qtc h PHE 604 CO 0.00 0.10 0.20 0.37 -1.61 0.00 0.00 178.31 177.37 2qtc h GLN 605 N 0.27 1.05 0.00 1.51 4.15 -1.87 -0.40 115.11 119.83 2qtc h GLN 605 Ca 0.44 -0.22 -0.30 0.00 0.77 0.00 0.00 58.65 59.33 2qtc h GLN 605 Cb 1.28 -0.15 -0.05 0.00 0.21 0.00 0.00 27.48 28.76 2qtc h GLN 605 CO -0.12 0.91 -1.96 -2.13 -1.93 0.00 0.00 178.83 173.60 2qtc n ARG 606 N -4.26 0.65 -0.85 1.69 3.00 -0.51 -4.50 116.66 111.88 2qtc n ARG 606 Ca 0.05 0.16 0.05 0.00 -0.00 0.00 0.00 57.85 58.11 2qtc n ARG 606 Cb 0.23 -1.68 0.11 0.00 0.00 0.00 0.00 32.46 31.12 2qtc n ARG 606 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.63 178.07 2qtc n ILE 607 N -2.89 1.18 -0.13 5.15 -5.35 -0.10 -4.87 119.36 112.35 2qtc n ILE 607 Ca -0.22 -2.03 0.19 0.00 -0.27 0.00 0.00 62.75 60.41 2qtc n ILE 607 Cb 1.06 0.27 0.58 0.00 -1.74 0.00 0.00 39.64 39.81 2qtc n ILE 607 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 2qtc h GLY 608 N 0.79 0.45 2.00 3.28 0.00 -1.21 0.35 103.07 108.74 2qtc h GLY 608 Ca -0.08 -0.11 -0.09 0.00 0.00 0.00 0.00 47.33 47.05 2qtc h GLY 608 CO 0.04 0.03 -0.42 -1.80 0.00 0.00 0.00 176.54 174.38 2qtc h ASP 609 N 0.25 0.00 0.34 0.19 3.58 -1.89 -1.70 116.42 117.19 2qtc h ASP 609 Ca 0.35 0.00 -0.25 0.00 0.42 0.00 0.00 57.03 57.56 2qtc h ASP 609 Cb 1.03 0.00 0.01 0.00 1.72 0.00 0.00 39.33 42.08 2qtc h ASP 609 CO -0.08 0.42 -1.05 0.25 -2.88 0.00 0.00 179.24 175.91 2qtc h LEU 610 N 0.00 0.59 -1.16 2.28 7.12 -1.36 -2.27 115.31 120.50 2qtc h LEU 610 Ca -0.00 -0.51 -0.06 0.00 0.13 0.00 0.00 57.88 57.44 2qtc h LEU 610 Cb 0.89 -0.18 -0.02 0.00 -0.53 0.00 0.00 40.66 40.82 2qtc h LEU 610 CO 0.05 1.32 -0.01 0.00 -0.13 0.00 0.00 178.44 179.67 2qtc h TRP 612 N 0.54 0.15 -0.62 0.00 2.91 -1.29 -2.71 115.95 114.92 2qtc h TRP 612 Ca 0.11 -0.05 0.03 0.00 1.13 0.00 0.00 58.89 60.12 2qtc h TRP 612 Cb 0.36 -0.03 -0.03 0.00 -0.51 0.00 0.00 29.16 28.95 2qtc h TRP 612 CO 0.01 0.60 0.41 0.00 -1.03 0.00 0.00 178.44 178.43 2qtc h ALA 613 N 0.53 1.68 -0.59 2.65 0.00 -1.12 -1.20 119.26 121.21 2qtc h ALA 613 Ca 0.01 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 2qtc h ALA 613 Cb 0.58 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 2qtc h ALA 613 CO 0.01 0.26 0.06 0.00 0.00 0.00 0.00 179.25 179.58 2qtc h ALA 614 N 1.64 1.00 -0.72 0.00 0.00 -0.39 0.21 119.26 121.00 2qtc h ALA 614 Ca 0.25 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 2qtc h ALA 614 Cb 0.09 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 2qtc h ALA 614 CO -0.07 0.63 0.35 0.78 0.00 0.00 0.00 179.25 180.94 2qtc h GLY 615 N 1.02 1.11 1.00 0.00 0.00 -0.93 -1.30 103.07 103.97 2qtc h GLY 615 Ca 0.18 -0.55 0.00 0.00 0.00 0.00 0.00 47.33 46.96 2qtc h GLY 615 CO 0.02 0.52 0.37 -1.80 0.00 0.00 0.00 176.54 175.65 2qtc h ASP 616 N 1.01 0.69 0.00 0.19 3.58 -0.81 -2.23 116.42 118.85 2qtc h ASP 616 Ca 0.25 -0.04 0.00 0.00 0.42 0.00 0.00 57.03 57.66 2qtc h ASP 616 Cb 0.12 -0.17 0.00 0.00 1.72 0.00 0.00 39.33 41.00 2qtc h ASP 616 CO -0.03 0.52 0.00 1.67 -2.88 0.00 0.00 179.24 178.52 2qtc n GLN 617 N -4.65 0.92 -3.20 0.28 7.27 0.68 -1.01 117.38 117.67 2qtc n GLN 617 Ca 0.04 0.00 -0.21 0.00 0.07 0.00 0.00 57.00 56.90 2qtc n GLN 617 Cb 0.04 -1.31 0.05 0.00 2.41 0.00 0.00 30.24 31.43 2qtc n GLN 617 CO 0.00 0.00 0.00 1.04 0.07 0.00 0.00 177.06 178.17 2qtc n GLN 618 N -0.81 -5.75 -1.76 3.69 1.13 -0.58 -4.93 117.38 108.36 2qtc n GLN 618 Ca 0.14 0.80 -0.40 0.00 -1.94 0.00 0.00 57.00 55.60 2qtc n GLN 618 Cb 0.06 -5.55 0.02 0.00 0.11 0.00 0.00 30.24 24.88 2qtc n GLN 618 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2qtc n ALA 619 N -4.03 2.00 -3.86 -1.58 0.00 -0.66 -4.83 120.51 107.54 2qtc n ALA 619 Ca -0.05 0.24 -0.30 0.00 0.00 0.00 0.00 53.44 53.32 2qtc n ALA 619 Cb 0.59 -2.39 -0.15 0.00 0.00 0.00 0.00 19.45 17.49 2qtc n ALA 619 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2qtc s ARG 620 N -2.49 1.16 0.06 0.00 0.52 -0.54 -3.71 118.95 113.95 2qtc s ARG 620 Ca 0.62 -1.16 -0.09 0.00 -0.52 0.00 0.00 55.73 54.58 2qtc s ARG 620 Cb -0.45 -2.45 0.03 0.00 0.52 0.00 0.00 34.95 32.60 2qtc s ARG 620 CO 0.57 -0.82 0.42 0.41 0.02 0.00 0.00 175.30 175.90 2qtc n GLY 621 N 4.68 0.94 3.21 -3.53 0.00 -1.26 -4.53 105.19 104.69 2qtc n GLY 621 Ca -0.05 -1.00 -0.31 0.00 0.00 0.00 0.00 46.02 44.67 2qtc n GLY 621 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2qtc s PHE 622 N -4.18 2.41 -0.23 1.61 0.40 -0.46 -1.38 117.98 116.16 2qtc s PHE 622 Ca 0.09 -0.92 -0.05 0.00 -0.60 0.00 0.00 56.93 55.46 2qtc s PHE 622 Cb -0.01 -1.61 -0.01 0.00 0.51 0.00 0.00 43.02 41.89 2qtc s PHE 622 CO 0.02 -0.36 -0.02 -0.51 0.70 0.00 0.00 175.22 175.05 2qtc s LEU 623 N 0.25 3.03 -0.35 -0.37 1.43 -0.36 -1.83 118.68 120.48 2qtc s LEU 623 Ca -0.15 -0.34 -0.08 0.00 -1.03 0.00 0.00 54.13 52.53 2qtc s LEU 623 Cb -0.17 -1.78 0.03 0.00 0.03 0.00 0.00 46.19 44.30 2qtc s LEU 623 CO 0.07 -0.02 0.14 -0.63 0.23 0.00 0.00 176.35 176.14 2qtc s ILE 624 N 1.49 4.07 -0.71 -0.59 -1.09 0.17 -1.30 121.20 123.24 2qtc s ILE 624 Ca 0.06 -1.01 -0.21 0.00 -2.23 0.00 0.00 60.65 57.26 2qtc s ILE 624 Cb -0.14 -3.28 0.09 0.00 -1.58 0.00 0.00 42.46 37.55 2qtc s ILE 624 CO -0.01 -0.18 0.95 -0.83 -1.23 0.00 0.00 174.94 173.64 2qtc s GLY 625 N 1.46 1.56 0.88 6.18 0.00 -0.22 -2.23 107.32 114.95 2qtc s GLY 625 Ca -0.00 -2.11 -0.13 0.00 0.00 0.00 0.00 44.72 42.48 2qtc s GLY 625 CO 0.04 1.97 1.23 -0.32 0.00 0.00 0.00 173.10 176.02 2qtc s GLY 626 N 3.66 1.71 -1.40 0.20 0.00 0.71 -0.54 107.32 111.66 2qtc s GLY 626 Ca 0.22 -1.01 -0.07 0.00 0.00 0.00 0.00 44.72 43.86 2qtc s GLY 626 CO 0.05 -0.38 0.17 -1.30 0.00 0.00 0.00 173.10 171.65 2qtc n THR 627 N -3.50 -0.56 -2.28 0.90 -2.24 -1.19 -0.63 114.28 104.78 2qtc n THR 627 Ca 0.12 -0.28 -0.25 0.00 -2.27 0.00 0.00 64.05 61.37 2qtc n THR 627 Cb 0.60 -0.70 0.09 0.00 -2.10 0.00 0.00 70.33 68.22 2qtc n THR 627 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2qtc s SER 628 N -3.74 4.52 0.00 3.42 1.04 -0.87 -4.55 113.70 113.53 2qtc s SER 628 Ca 0.24 0.22 0.00 0.00 0.48 0.00 0.00 55.95 56.89 2qtc s SER 628 Cb -0.14 -0.75 0.00 0.00 0.10 0.00 0.00 66.02 65.23 2qtc s SER 628 CO 0.85 -1.77 0.00 0.61 0.98 0.00 0.00 173.24 173.91 2qtc n GLY 629 N -2.97 -0.73 0.19 7.32 0.00 -0.77 -4.32 105.19 103.91 2qtc n GLY 629 Ca 0.10 -1.26 -0.14 0.00 0.00 0.00 0.00 46.02 44.73 2qtc n GLY 629 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2qtc h ARG 630 N 0.00 -0.36 -0.00 1.61 9.65 -0.41 -3.17 114.38 121.71 2qtc h ARG 630 Ca 0.00 0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.90 2qtc h ARG 630 Cb 0.00 0.08 0.00 0.00 -1.39 0.00 0.00 29.97 28.66 2qtc h ARG 630 CO 0.00 -0.24 -0.22 0.25 2.80 0.00 0.00 179.97 182.55 2qtc n THR 631 N -5.27 0.00 0.02 0.20 -2.24 -1.26 -4.21 114.28 101.52 2qtc n THR 631 Ca -0.09 -0.01 -0.12 0.00 -2.27 0.00 0.00 64.05 61.56 2qtc n THR 631 Cb 0.18 -0.14 -0.14 0.00 -2.10 0.00 0.00 70.33 68.14 2qtc n THR 631 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 2qtc h THR 632 N 0.06 1.05 -2.11 4.28 2.02 -1.78 -3.30 112.91 113.13 2qtc h THR 632 Ca 0.00 -2.81 -0.78 0.00 0.77 0.00 0.00 66.41 63.58 2qtc h THR 632 Cb 0.49 2.59 -0.22 0.00 -1.74 0.00 0.00 68.15 69.27 2qtc h THR 632 CO 0.00 0.70 1.43 -0.11 0.37 0.00 0.00 175.52 177.92 2qtc n LEU 633 N -3.25 6.75 -0.33 2.58 7.94 -1.23 -4.83 117.00 124.63 2qtc n LEU 633 Ca -0.15 -4.98 -0.04 0.00 -1.11 0.00 0.00 56.01 49.73 2qtc n LEU 633 Cb 1.03 -1.35 0.09 0.00 0.53 0.00 0.00 43.42 43.72 2qtc n LEU 633 CO 0.46 1.64 1.22 -0.55 -1.11 0.00 0.00 177.39 179.05 2qtc h ASN 634 N 5.37 1.04 1.58 1.96 -1.07 -1.81 -3.19 115.58 119.46 2qtc h ASN 634 Ca 0.35 -0.05 0.00 0.00 0.07 0.00 0.00 56.30 56.66 2qtc h ASN 634 Cb 0.57 -0.26 0.00 0.00 -2.07 0.00 0.00 38.32 36.55 2qtc h ASN 634 CO 1.45 0.79 -0.24 1.23 0.07 0.00 0.00 177.43 180.73 2qtc h GLY 635 N 1.21 0.00 2.00 9.14 0.00 -1.88 -2.07 103.07 111.46 2qtc h GLY 635 Ca 0.32 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.54 2qtc h GLY 635 CO -0.06 0.00 -0.51 0.83 0.00 0.00 0.00 176.54 176.80 2qtc h GLU 636 N 0.00 0.00 0.00 4.80 4.39 -1.87 -3.42 114.58 118.48 2qtc h GLU 636 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2qtc h GLU 636 Cb 0.91 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.56 2qtc h GLU 636 CO 0.00 0.51 0.00 0.41 -1.16 0.00 0.00 179.01 178.77 2qtc n GLY 637 N -0.03 -1.72 0.24 -3.84 0.00 -1.26 -4.57 105.19 94.01 2qtc n GLY 637 Ca -0.01 -1.62 0.01 0.00 0.00 0.00 0.00 46.02 44.39 2qtc n GLY 637 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2qtc h LEU 638 N 0.00 -0.42 -1.29 0.99 7.12 -1.84 -0.29 115.31 119.58 2qtc h LEU 638 Ca 0.00 0.17 0.00 0.00 0.13 0.00 0.00 57.88 58.18 2qtc h LEU 638 Cb 0.00 0.33 0.00 0.00 -0.53 0.00 0.00 40.66 40.46 2qtc h LEU 638 CO 0.00 -0.17 0.00 0.00 -0.13 0.00 0.00 178.44 178.14 2qtc n GLN 639 N -5.36 1.84 -0.01 1.25 6.02 -1.26 -4.29 117.38 115.58 2qtc n GLN 639 Ca 0.09 -1.27 -0.01 0.00 -0.01 0.00 0.00 57.00 55.80 2qtc n GLN 639 Cb 0.36 -1.41 -0.01 0.00 1.02 0.00 0.00 30.24 30.21 2qtc n GLN 639 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 2qtc n HIS 640 N 0.50 0.00 -2.06 1.08 8.25 -0.88 -4.93 115.22 117.17 2qtc n HIS 640 Ca 0.16 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.22 2qtc n HIS 640 Cb 0.37 -0.05 -0.03 0.00 1.12 0.00 0.00 29.99 31.40 2qtc n HIS 640 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 2qtc s GLU 641 N -2.03 2.89 -0.40 -0.41 2.02 -0.17 -4.50 118.70 116.10 2qtc s GLU 641 Ca -0.01 0.82 -0.20 0.00 0.02 0.00 0.00 54.97 55.60 2qtc s GLU 641 Cb 0.00 -4.31 0.01 0.00 0.10 0.00 0.00 34.13 29.94 2qtc s GLU 641 CO 0.04 -2.41 0.63 0.34 0.02 0.00 0.00 175.26 173.87 2qtc s ASP 642 N 7.20 6.35 -0.13 -0.19 2.15 -1.25 -4.71 116.67 126.09 2qtc s ASP 642 Ca 0.69 -0.15 0.15 0.00 0.43 0.00 0.00 52.55 53.67 2qtc s ASP 642 Cb -0.15 -2.32 0.36 0.00 -0.30 0.00 0.00 42.92 40.51 2qtc s ASP 642 CO 0.25 -0.69 1.18 0.61 -0.17 0.00 0.00 175.17 176.34 2qtc n GLY 643 N 4.90 3.84 0.00 2.66 0.00 -1.26 -1.18 105.19 114.14 2qtc n GLY 643 Ca -0.02 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 44.93 2qtc n GLY 643 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2qtc n HIS 644 N -0.76 0.00 0.28 1.61 1.44 -1.26 -0.65 115.22 115.89 2qtc n HIS 644 Ca 0.14 0.00 0.13 0.00 -2.01 0.00 0.00 57.72 55.98 2qtc n HIS 644 Cb 0.78 0.02 0.83 0.00 0.12 0.00 0.00 29.99 31.74 2qtc n HIS 644 CO 0.00 0.00 0.00 0.66 -2.81 0.00 0.00 176.34 174.19 2qtc h SER 645 N 0.00 0.00 1.04 4.39 4.64 -1.91 0.10 113.55 121.81 2qtc h SER 645 Ca 0.00 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 2qtc h SER 645 Cb 0.44 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.53 2qtc h SER 645 CO 0.00 0.02 -0.20 0.45 -0.87 0.00 0.00 176.83 176.23 2qtc h HIS 646 N 0.00 0.00 0.01 4.77 3.86 -1.97 0.36 115.15 122.18 2qtc h HIS 646 Ca -0.00 0.00 -0.23 0.00 -1.16 0.00 0.00 60.37 58.98 2qtc h HIS 646 Cb 0.06 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.53 2qtc h HIS 646 CO 0.00 0.20 -0.97 0.82 0.86 0.00 0.00 177.93 178.84 2qtc h ILE 647 N 0.00 1.40 -0.17 2.45 1.08 -1.16 -2.49 117.51 118.62 2qtc h ILE 647 Ca -0.00 -2.48 -0.10 0.00 -0.39 0.00 0.00 64.86 61.89 2qtc h ILE 647 Cb 0.78 2.46 -0.00 0.00 -3.07 0.00 0.00 36.82 36.99 2qtc h ILE 647 CO 0.03 0.74 -0.28 1.56 -0.69 0.00 0.00 178.15 179.50 2qtc h GLN 648 N 0.23 0.49 0.00 2.37 4.20 -1.16 -3.29 115.11 117.94 2qtc h GLN 648 Ca -0.09 -0.30 -0.06 0.00 0.06 0.00 0.00 58.65 58.26 2qtc h GLN 648 Cb 1.62 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 29.42 2qtc h GLN 648 CO 0.17 0.90 -0.28 0.66 -0.67 0.00 0.00 178.83 179.62 2qtc h SER 649 N 0.13 0.00 0.47 1.46 4.64 -0.97 -2.39 113.55 116.89 2qtc h SER 649 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 2qtc h SER 649 Cb 0.87 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.96 2qtc h SER 649 CO 0.06 0.28 0.00 0.00 -0.87 0.00 0.00 176.83 176.30 2qtc n LEU 650 N -4.08 0.00 -0.01 5.97 -0.00 -0.94 -2.15 117.00 115.79 2qtc n LEU 650 Ca -0.02 0.36 0.13 0.00 -0.00 0.00 0.00 56.01 56.49 2qtc n LEU 650 Cb 0.33 -0.36 0.47 0.00 -0.00 0.00 0.00 43.42 43.87 2qtc n LEU 650 CO 0.37 -0.13 0.75 0.35 -0.00 0.00 0.00 177.39 178.73 2qtc n THR 651 N -1.36 0.00 -3.36 1.47 -2.24 -0.90 -4.69 114.28 103.21 2qtc n THR 651 Ca 0.08 -0.01 -0.42 0.00 -2.27 0.00 0.00 64.05 61.43 2qtc n THR 651 Cb 0.18 -0.16 -0.09 0.00 -2.10 0.00 0.00 70.33 68.16 2qtc n THR 651 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2qtc s ILE 652 N -2.94 5.13 0.28 2.28 1.01 -0.91 -4.99 121.20 121.06 2qtc s ILE 652 Ca 0.14 -0.29 0.02 0.00 0.00 0.00 0.00 60.65 60.53 2qtc s ILE 652 Cb 0.19 -3.97 0.27 0.00 0.01 0.00 0.00 42.46 38.95 2qtc s ILE 652 CO 0.59 -0.33 1.73 -0.65 0.00 0.00 0.00 174.94 176.28 2qtc h PRO 653 N 8.65 0.50 -0.77 2.79 0.11 -1.87 -2.04 132.00 139.37 2qtc h PRO 653 Ca -0.27 -0.03 -0.24 0.00 0.11 0.00 0.00 66.00 65.57 2qtc h PRO 653 Cb 1.12 -0.11 -0.14 0.00 0.11 0.00 0.00 31.00 31.97 2qtc h PRO 653 CO 0.76 0.33 0.31 0.27 -0.21 0.00 0.00 178.00 179.46 2qtc n ASN 654 N -4.95 4.83 -4.59 -2.05 6.94 -1.26 -4.86 115.26 109.31 2qtc n ASN 654 Ca 0.20 -3.25 -0.35 0.00 -0.02 0.00 0.00 54.58 51.16 2qtc n ASN 654 Cb 0.56 -0.76 -0.10 0.00 -2.36 0.00 0.00 39.78 37.12 2qtc n ASN 654 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2qtc s ILE 656 N 0.70 4.80 -0.09 0.00 -1.09 0.23 -4.91 121.20 120.84 2qtc s ILE 656 Ca 0.03 -0.01 0.02 0.00 -2.23 0.00 0.00 60.65 58.46 2qtc s ILE 656 Cb -0.13 -3.26 -0.02 0.00 -1.58 0.00 0.00 42.46 37.47 2qtc s ILE 656 CO 0.02 0.31 -0.13 -0.44 -1.23 0.00 0.00 174.94 173.47 2qtc s SER 657 N 1.56 4.09 0.03 3.58 0.01 -1.26 -0.43 113.70 121.29 2qtc s SER 657 Ca 0.06 -0.23 0.04 0.00 1.31 0.00 0.00 55.95 57.13 2qtc s SER 657 Cb -0.15 -1.20 -0.02 0.00 0.21 0.00 0.00 66.02 64.86 2qtc s SER 657 CO 0.06 0.27 -0.11 -0.31 0.41 0.00 0.00 173.24 173.57 2qtc s TYR 658 N -0.29 0.97 -0.55 2.43 2.02 -0.00 -4.61 117.35 117.32 2qtc s TYR 658 Ca 0.02 -0.35 0.06 0.00 -0.37 0.00 0.00 57.07 56.44 2qtc s TYR 658 Cb -0.13 -0.58 0.22 0.00 -0.40 0.00 0.00 41.96 41.07 2qtc s TYR 658 CO 0.03 -0.00 0.56 -3.47 -1.57 0.00 0.00 175.55 171.10 2qtc n ASP 659 N 1.96 1.93 -4.77 2.29 2.03 0.62 -1.92 116.55 118.69 2qtc n ASP 659 Ca -0.18 -3.01 -0.39 0.00 0.52 0.00 0.00 54.79 51.72 2qtc n ASP 659 Cb 0.55 -0.66 -0.02 0.00 -0.72 0.00 0.00 41.12 40.27 2qtc n ASP 659 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2qtc s PRO 660 N -1.49 4.11 -0.11 -0.67 0.04 -1.26 -1.46 135.00 134.16 2qtc s PRO 660 Ca 0.34 1.99 0.14 0.00 0.04 0.00 0.00 61.00 63.51 2qtc s PRO 660 Cb 0.09 -2.79 -0.24 0.00 0.04 0.00 0.00 34.50 31.60 2qtc s PRO 660 CO -0.10 -0.32 0.41 0.00 0.04 0.00 0.00 177.00 177.03 2qtc n ALA 661 N 0.27 1.48 -2.51 8.56 0.00 -1.26 -4.04 120.51 123.01 2qtc n ALA 661 Ca 0.03 -0.98 -0.25 0.00 0.00 0.00 0.00 53.44 52.24 2qtc n ALA 661 Cb 0.45 -0.58 -0.10 0.00 0.00 0.00 0.00 19.45 19.22 2qtc n ALA 661 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2qtc s TYR 662 N -2.55 2.37 0.21 0.00 2.02 -1.26 -4.81 117.35 113.33 2qtc s TYR 662 Ca -0.08 -0.39 -0.09 0.00 -0.37 0.00 0.00 57.07 56.14 2qtc s TYR 662 Cb 0.07 -1.17 0.17 0.00 -0.40 0.00 0.00 41.96 40.63 2qtc s TYR 662 CO 0.82 0.65 1.83 0.00 -1.57 0.00 0.00 175.55 177.29 2qtc h ALA 663 N 2.13 1.04 0.00 3.71 0.00 -1.90 -2.15 119.26 122.09 2qtc h ALA 663 Ca -0.41 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.33 2qtc h ALA 663 Cb 1.26 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 2qtc h ALA 663 CO 0.64 0.55 -0.22 0.10 0.00 0.00 0.00 179.25 180.32 2qtc h TYR 664 N 1.13 0.00 -0.23 0.00 -0.00 -1.83 -2.24 116.97 113.80 2qtc h TYR 664 Ca 0.28 0.00 -0.08 0.00 0.00 0.00 0.00 58.73 58.94 2qtc h TYR 664 Cb 0.03 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 36.76 2qtc h TYR 664 CO 0.00 0.22 -0.16 0.93 -0.00 0.00 0.00 178.16 179.15 2qtc h GLU 665 N 0.00 0.51 -0.53 0.10 5.08 -1.73 -1.79 114.58 116.23 2qtc h GLU 665 Ca -0.00 -0.25 0.08 0.00 -1.00 0.00 0.00 59.36 58.19 2qtc h GLU 665 Cb 0.41 -0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.60 2qtc h GLU 665 CO 0.03 0.81 0.18 0.28 -1.00 0.00 0.00 179.01 179.31 2qtc h VAL 666 N 0.21 0.80 -0.42 3.13 2.07 -1.11 0.63 116.25 121.57 2qtc h VAL 666 Ca 0.04 -0.12 -0.05 0.00 0.82 0.00 0.00 66.70 67.40 2qtc h VAL 666 Cb 0.69 0.41 -0.02 0.00 -1.52 0.00 0.00 31.29 30.85 2qtc h VAL 666 CO 0.04 0.07 0.08 0.00 0.02 0.00 0.00 177.57 177.78 2qtc h ALA 667 N 1.36 0.55 -0.70 1.67 0.00 -1.26 -1.11 119.26 119.78 2qtc h ALA 667 Ca 0.26 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 2qtc h ALA 667 Cb 0.29 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 2qtc h ALA 667 CO -0.27 0.26 0.30 0.28 0.00 0.00 0.00 179.25 179.81 2qtc h VAL 668 N 0.54 1.24 -0.09 0.00 2.07 -0.91 -0.81 116.25 118.29 2qtc h VAL 668 Ca 0.13 -0.73 -0.01 0.00 0.82 0.00 0.00 66.70 66.91 2qtc h VAL 668 Cb 0.35 0.42 -0.00 0.00 -1.52 0.00 0.00 31.29 30.54 2qtc h VAL 668 CO 0.01 0.30 0.02 0.40 0.02 0.00 0.00 177.57 178.31 2qtc h ILE 669 N 0.99 1.20 -0.63 4.57 2.04 -0.76 0.17 117.51 125.09 2qtc h ILE 669 Ca 0.24 -0.62 -0.00 0.00 1.00 0.00 0.00 64.86 65.47 2qtc h ILE 669 Cb 0.18 1.45 -0.03 0.00 -0.74 0.00 0.00 36.82 37.68 2qtc h ILE 669 CO -0.02 0.18 0.37 0.24 0.00 0.00 0.00 178.15 178.92 2qtc h MET 670 N -0.08 0.86 -0.35 2.37 2.86 -1.12 -0.18 114.93 119.30 2qtc h MET 670 Ca 0.03 -0.08 -0.01 0.00 -2.06 0.00 0.00 59.70 57.58 2qtc h MET 670 Cb 0.26 -0.18 -0.02 0.00 0.06 0.00 0.00 31.60 31.73 2qtc h MET 670 CO 0.00 0.62 0.18 1.25 1.06 0.00 0.00 176.91 180.03 2qtc h HIS 671 N 0.85 0.48 -0.47 -0.22 -0.00 -1.03 -1.29 115.15 113.48 2qtc h HIS 671 Ca 0.23 -0.02 -0.01 0.00 -0.00 0.00 0.00 60.37 60.57 2qtc h HIS 671 Cb -0.01 -0.15 -0.02 0.00 -0.00 0.00 0.00 27.41 27.22 2qtc h HIS 671 CO -0.02 0.39 0.26 0.22 -0.00 0.00 0.00 177.93 178.79 2qtc h ASP 672 N 0.43 0.58 -0.69 3.26 3.58 -0.65 -1.61 116.42 121.32 2qtc h ASP 672 Ca 0.12 -0.08 0.01 0.00 0.42 0.00 0.00 57.03 57.50 2qtc h ASP 672 Cb 0.08 -0.15 -0.03 0.00 1.72 0.00 0.00 39.33 40.94 2qtc h ASP 672 CO -0.02 0.49 0.45 1.23 -2.88 0.00 0.00 179.24 178.52 2qtc h GLY 673 N 0.61 0.97 0.90 -0.78 0.00 -0.86 0.17 103.07 104.08 2qtc h GLY 673 Ca 0.16 -0.36 0.02 0.00 0.00 0.00 0.00 47.33 47.15 2qtc h GLY 673 CO -0.03 0.35 0.24 -2.00 0.00 0.00 0.00 176.54 175.10 2qtc h LEU 674 N 0.93 0.39 -0.27 3.11 5.85 -0.98 -0.92 115.31 123.42 2qtc h LEU 674 Ca 0.25 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.95 2qtc h LEU 674 Cb -0.10 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 40.84 2qtc h LEU 674 CO -0.06 0.28 0.08 -0.08 -0.34 0.00 0.00 178.44 178.32 2qtc h GLU 675 N 0.49 0.43 -0.11 1.25 4.57 -0.69 0.77 114.58 121.28 2qtc h GLU 675 Ca 0.16 -0.09 -0.01 0.00 -1.18 0.00 0.00 59.36 58.24 2qtc h GLU 675 Cb 0.01 -0.06 -0.00 0.00 -0.16 0.00 0.00 28.75 28.54 2qtc h GLU 675 CO -0.08 0.50 0.03 0.00 -1.18 0.00 0.00 179.01 178.27 2qtc h ARG 676 N 0.28 0.18 0.06 1.92 3.08 -0.78 0.14 114.38 119.25 2qtc h ARG 676 Ca 0.09 -0.04 -0.17 0.00 0.07 0.00 0.00 59.98 59.93 2qtc h ARG 676 Cb 0.25 -0.02 0.02 0.00 0.08 0.00 0.00 29.97 30.29 2qtc h ARG 676 CO -0.00 0.36 -0.69 0.52 -1.07 0.00 0.00 179.97 179.08 2qtc h MET 677 N -0.03 0.36 -0.25 0.04 2.86 -1.20 0.22 114.93 116.92 2qtc h MET 677 Ca 0.03 -0.47 0.00 0.00 -2.06 0.00 0.00 59.70 57.20 2qtc h MET 677 Cb 0.26 0.15 0.00 0.00 0.06 0.00 0.00 31.60 32.07 2qtc h MET 677 CO 0.00 1.16 0.00 0.66 1.06 0.00 0.00 176.91 179.79 2qtc n TYR 678 N -4.18 0.34 -2.37 -0.22 4.01 0.25 -4.12 117.16 110.86 2qtc n TYR 678 Ca -0.12 -0.43 0.00 0.00 -0.16 0.00 0.00 57.90 57.19 2qtc n TYR 678 Cb 0.74 -0.03 0.00 0.00 -0.31 0.00 0.00 39.34 39.74 2qtc n TYR 678 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2qtc n GLY 679 N 0.37 1.19 0.28 2.72 0.00 0.04 -4.59 105.19 105.20 2qtc n GLY 679 Ca 0.09 -2.01 0.12 0.00 0.00 0.00 0.00 46.02 44.23 2qtc n GLY 679 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2qtc h GLU 680 N 0.00 0.00 -0.96 1.61 5.08 -1.91 -2.62 114.58 115.78 2qtc h GLU 680 Ca 0.00 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.38 2qtc h GLU 680 Cb 0.00 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.20 2qtc h GLU 680 CO 0.00 0.00 0.63 -0.22 -1.00 0.00 0.00 179.01 178.42 2qtc h LYS 681 N 0.00 1.21 -6.51 2.33 3.64 -1.79 -3.47 116.57 111.99 2qtc h LYS 681 Ca 0.00 -0.07 -0.50 0.00 -1.27 0.00 0.00 60.65 58.81 2qtc h LYS 681 Cb 0.01 -0.27 0.04 0.00 -0.41 0.00 0.00 32.23 31.59 2qtc h LYS 681 CO -0.00 0.80 -0.97 1.04 -2.27 0.00 0.00 179.45 178.06 2qtc n GLN 682 N -4.42 -0.95 -2.62 1.90 6.02 -0.99 -4.91 117.38 111.43 2qtc n GLN 682 Ca 0.12 0.31 -0.41 0.00 -0.01 0.00 0.00 57.00 57.00 2qtc n GLN 682 Cb 0.06 -3.54 -0.04 0.00 1.02 0.00 0.00 30.24 27.74 2qtc n GLN 682 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 2qtc s GLU 683 N -6.57 4.61 -1.20 -1.09 2.12 0.75 -4.96 118.70 112.37 2qtc s GLU 683 Ca 0.46 1.57 -0.16 0.00 0.36 0.00 0.00 54.97 57.20 2qtc s GLU 683 Cb -0.20 -3.35 0.13 0.00 0.26 0.00 0.00 34.13 30.97 2qtc s GLU 683 CO 0.91 0.07 1.50 -0.80 -0.54 0.00 0.00 175.26 176.39 2qtc s ASN 684 N 0.25 6.92 0.09 -1.70 0.01 -1.26 -4.41 114.94 114.84 2qtc s ASN 684 Ca 0.50 -2.65 -0.08 0.00 -0.71 0.00 0.00 52.86 49.92 2qtc s ASN 684 Cb -0.26 -2.46 -0.00 0.00 0.41 0.00 0.00 41.25 38.94 2qtc s ASN 684 CO 0.31 -0.95 0.18 0.54 -1.51 0.00 0.00 177.10 175.67 2qtc s VAL 685 N 2.68 0.15 0.21 1.60 0.11 -1.26 -4.88 120.40 119.01 2qtc s VAL 685 Ca 0.45 -1.21 0.08 0.00 -2.93 0.00 0.00 61.98 58.37 2qtc s VAL 685 Cb -0.01 -1.34 -0.05 0.00 -1.53 0.00 0.00 36.38 33.46 2qtc s VAL 685 CO 0.01 -0.67 -0.15 -0.72 -3.33 0.00 0.00 175.10 170.25 2qtc s TYR 686 N -3.83 1.72 0.11 1.54 -0.85 -0.53 -4.28 117.35 111.22 2qtc s TYR 686 Ca 0.05 -0.57 0.04 0.00 -0.52 0.00 0.00 57.07 56.07 2qtc s TYR 686 Cb 0.05 -0.80 -0.04 0.00 0.38 0.00 0.00 41.96 41.55 2qtc s TYR 686 CO -0.11 0.36 0.09 0.71 -1.52 0.00 0.00 175.55 175.08 2qtc s TYR 687 N -2.96 3.14 -0.13 -3.49 1.51 -0.48 -0.60 117.35 114.35 2qtc s TYR 687 Ca 0.22 0.03 -0.01 0.00 -1.01 0.00 0.00 57.07 56.30 2qtc s TYR 687 Cb -0.01 -1.57 0.04 0.00 -0.11 0.00 0.00 41.96 40.31 2qtc s TYR 687 CO 0.07 0.52 -0.03 -0.47 -1.11 0.00 0.00 175.55 174.53 2qtc s TYR 688 N -1.51 1.24 -0.12 2.71 5.04 0.43 -1.23 117.35 123.91 2qtc s TYR 688 Ca 0.29 -0.70 0.02 0.00 -2.44 0.00 0.00 57.07 54.23 2qtc s TYR 688 Cb -0.11 -1.10 0.02 0.00 0.35 0.00 0.00 41.96 41.11 2qtc s TYR 688 CO 0.22 -0.51 -0.16 0.42 -1.34 0.00 0.00 175.55 174.18 2qtc s ILE 689 N 1.79 1.61 0.04 3.14 1.01 -0.42 -0.82 121.20 127.54 2qtc s ILE 689 Ca 0.03 -0.70 -0.20 0.00 0.00 0.00 0.00 60.65 59.78 2qtc s ILE 689 Cb -0.14 -1.47 -0.06 0.00 0.01 0.00 0.00 42.46 40.80 2qtc s ILE 689 CO -0.07 0.46 0.58 0.42 0.00 0.00 0.00 174.94 176.33 2qtc s THR 690 N 1.06 4.81 0.29 2.92 -4.23 -0.81 -1.06 115.64 118.62 2qtc s THR 690 Ca -0.04 1.23 0.05 0.00 -1.18 0.00 0.00 61.69 61.75 2qtc s THR 690 Cb -0.15 -3.91 -0.06 0.00 1.34 0.00 0.00 72.50 69.72 2qtc s THR 690 CO -0.03 0.50 0.00 0.42 -0.54 0.00 0.00 174.62 174.96 2qtc s THR 691 N -0.72 1.37 0.25 3.99 -4.23 0.29 -4.30 115.64 112.29 2qtc s THR 691 Ca 0.30 -2.05 0.11 0.00 -1.18 0.00 0.00 61.69 58.87 2qtc s THR 691 Cb -0.19 -2.59 -0.05 0.00 1.34 0.00 0.00 72.50 71.02 2qtc s THR 691 CO 0.18 -0.18 -0.20 -0.76 -0.54 0.00 0.00 174.62 173.13 2qtc s LEU 692 N -3.44 2.56 -0.03 4.79 1.43 -1.26 -2.05 118.68 120.66 2qtc s LEU 692 Ca 0.32 -1.00 0.17 0.00 -1.03 0.00 0.00 54.13 52.59 2qtc s LEU 692 Cb 0.06 -1.03 0.53 0.00 0.03 0.00 0.00 46.19 45.79 2qtc s LEU 692 CO 0.13 0.01 1.45 -0.46 0.23 0.00 0.00 176.35 177.71 2qtc n ASN 693 N -0.43 3.75 -4.56 2.29 6.94 -1.26 -2.84 115.26 119.15 2qtc n ASN 693 Ca -0.07 -2.16 -0.35 0.00 -0.02 0.00 0.00 54.58 51.99 2qtc n ASN 693 Cb 0.59 -0.42 -0.11 0.00 -2.36 0.00 0.00 39.78 37.49 2qtc n ASN 693 CO 0.00 0.00 0.00 -0.70 -1.03 0.00 0.00 177.26 175.53 2qtc s GLU 694 N -1.29 3.83 0.03 -3.83 2.12 -1.26 -4.99 118.70 113.30 2qtc s GLU 694 Ca 0.40 -0.42 -0.19 0.00 0.36 0.00 0.00 54.97 55.12 2qtc s GLU 694 Cb 0.23 -3.14 -0.06 0.00 0.26 0.00 0.00 34.13 31.42 2qtc s GLU 694 CO 0.24 0.19 0.55 -0.80 -0.54 0.00 0.00 175.26 174.90 2qtc s ASN 695 N 0.57 6.98 0.31 -1.70 0.01 -1.26 -4.06 114.94 115.80 2qtc s ASN 695 Ca 0.01 1.17 -0.16 0.00 -0.71 0.00 0.00 52.86 53.17 2qtc s ASN 695 Cb -0.13 -2.34 0.02 0.00 0.41 0.00 0.00 41.25 39.20 2qtc s ASN 695 CO 0.02 0.21 0.66 -0.72 -1.51 0.00 0.00 177.10 175.75 2qtc s TYR 696 N -0.70 0.16 0.23 2.20 -0.85 -0.29 -4.79 117.35 113.31 2qtc s TYR 696 Ca 0.29 -0.63 -0.31 0.00 -0.52 0.00 0.00 57.07 55.90 2qtc s TYR 696 Cb -0.18 0.54 -0.12 0.00 0.38 0.00 0.00 41.96 42.58 2qtc s TYR 696 CO 0.17 -1.26 1.69 1.58 -1.52 0.00 0.00 175.55 176.21 2qtc n HIS 697 N -0.47 2.78 -3.74 -3.49 -0.00 -1.26 -2.61 115.22 106.44 2qtc n HIS 697 Ca -0.04 0.10 -0.37 0.00 -0.00 0.00 0.00 57.72 57.41 2qtc n HIS 697 Cb 0.60 -2.65 -0.11 0.00 -0.00 0.00 0.00 29.99 27.83 2qtc n HIS 697 CO 0.00 0.00 0.00 -1.64 -0.00 0.00 0.00 176.34 174.70 2qtc s MET 698 N 0.66 2.08 0.94 1.57 1.00 -1.26 -4.97 119.30 119.32 2qtc s MET 698 Ca 0.72 -1.81 -0.12 0.00 0.00 0.00 0.00 55.69 54.48 2qtc s MET 698 Cb -0.50 -3.64 0.15 0.00 0.00 0.00 0.00 34.83 30.84 2qtc s MET 698 CO 0.37 -1.09 1.11 -1.25 0.00 0.00 0.00 175.02 174.16 2qtc s PRO 699 N 1.18 0.90 0.57 2.03 0.04 -1.26 -0.81 135.00 137.65 2qtc s PRO 699 Ca 0.08 0.49 -0.16 0.00 0.04 0.00 0.00 61.00 61.45 2qtc s PRO 699 Cb -0.23 -1.79 -0.05 0.00 0.04 0.00 0.00 34.50 32.46 2qtc s PRO 699 CO -0.04 -2.40 1.04 0.00 0.04 0.00 0.00 177.00 175.64 2qtc s ALA 700 N -3.08 2.83 0.23 8.56 0.00 -1.26 -4.38 121.76 124.66 2qtc s ALA 700 Ca 0.64 0.36 -0.30 0.00 0.00 0.00 0.00 51.96 52.66 2qtc s ALA 700 Cb -0.17 -3.21 -0.09 0.00 0.00 0.00 0.00 23.12 19.65 2qtc s ALA 700 CO 0.56 -0.64 1.31 1.41 0.00 0.00 0.00 175.76 178.40 2qtc s MET 701 N -4.02 4.39 0.46 0.00 1.75 -0.30 -4.89 119.30 116.69 2qtc s MET 701 Ca 0.63 2.08 -0.24 0.00 -1.25 0.00 0.00 55.69 56.91 2qtc s MET 701 Cb -0.15 -3.17 -0.07 0.00 2.84 0.00 0.00 34.83 34.28 2qtc s MET 701 CO 0.34 -0.23 1.26 -2.14 -0.65 0.00 0.00 175.02 173.60 2qtc s PRO 702 N -0.46 3.70 0.30 4.11 0.02 -1.26 -4.90 135.00 136.51 2qtc s PRO 702 Ca 0.55 2.02 -0.30 0.00 0.02 0.00 0.00 61.00 63.29 2qtc s PRO 702 Cb -0.37 -2.51 -0.11 0.00 0.02 0.00 0.00 34.50 31.52 2qtc s PRO 702 CO 0.41 -0.67 1.59 -2.00 -0.33 0.00 0.00 177.00 176.00 2qtc s GLU 703 N -2.56 4.11 0.00 5.54 2.12 -1.26 -1.97 118.70 124.68 2qtc s GLU 703 Ca 0.63 2.59 0.00 0.00 0.36 0.00 0.00 54.97 58.55 2qtc s GLU 703 Cb -0.35 -3.02 0.00 0.00 0.26 0.00 0.00 34.13 31.03 2qtc s GLU 703 CO 0.43 -0.63 0.00 0.41 -0.54 0.00 0.00 175.26 174.93 2qtc n GLY 704 N 2.03 0.54 0.02 -1.50 0.00 -1.26 -4.90 105.19 100.12 2qtc n GLY 704 Ca 0.08 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.24 2qtc n GLY 704 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qtc n ALA 705 N 1.00 2.55 -0.07 4.61 0.00 -0.83 -4.35 120.51 123.42 2qtc n ALA 705 Ca 0.00 -0.17 -0.12 0.00 0.00 0.00 0.00 53.44 53.15 2qtc n ALA 705 Cb 0.07 -1.47 -0.07 0.00 0.00 0.00 0.00 19.45 17.98 2qtc n ALA 705 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2qtc h GLU 706 N 0.09 -0.43 -0.81 0.00 3.07 -1.91 -1.57 114.58 113.03 2qtc h GLU 706 Ca 0.00 0.03 -0.02 0.00 -0.50 0.00 0.00 59.36 58.87 2qtc h GLU 706 Cb 0.27 0.10 -0.04 0.00 -0.84 0.00 0.00 28.75 28.24 2qtc h GLU 706 CO 0.00 -0.29 0.41 1.49 -1.40 0.00 0.00 179.01 179.23 2qtc h GLU 707 N -0.45 1.14 -0.57 2.33 4.57 -2.00 -2.06 114.58 117.54 2qtc h GLU 707 Ca 0.09 -0.15 -0.03 0.00 -1.18 0.00 0.00 59.36 58.09 2qtc h GLU 707 Cb 0.62 -0.22 -0.03 0.00 -0.16 0.00 0.00 28.75 28.97 2qtc h GLU 707 CO -0.50 0.86 0.24 0.78 -1.18 0.00 0.00 179.01 179.22 2qtc h GLY 708 N 1.17 0.88 1.10 1.92 0.00 -1.69 0.81 103.07 107.25 2qtc h GLY 708 Ca 0.28 -0.43 -0.03 0.00 0.00 0.00 0.00 47.33 47.15 2qtc h GLY 708 CO -0.04 0.41 0.37 -2.22 0.00 0.00 0.00 176.54 175.06 2qtc h ILE 709 N 0.81 1.25 -0.32 2.60 2.04 -0.64 -0.36 117.51 122.90 2qtc h ILE 709 Ca 0.20 -0.73 -0.18 0.00 1.00 0.00 0.00 64.86 65.15 2qtc h ILE 709 Cb 0.13 0.24 -0.00 0.00 -0.74 0.00 0.00 36.82 36.45 2qtc h ILE 709 CO -0.02 0.31 -0.50 0.03 0.00 0.00 0.00 178.15 177.96 2qtc h ARG 710 N 1.15 0.89 0.00 2.37 3.08 -0.72 -3.22 114.38 117.94 2qtc h ARG 710 Ca 0.27 -0.54 -0.09 0.00 0.07 0.00 0.00 59.98 59.69 2qtc h ARG 710 Cb 0.14 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.23 2qtc h ARG 710 CO -0.03 1.18 -0.45 0.87 -1.07 0.00 0.00 179.97 180.47 2qtc h LYS 711 N 0.70 0.00 0.00 0.04 1.79 -0.51 -3.48 116.57 115.11 2qtc h LYS 711 Ca 0.03 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.50 2qtc h LYS 711 Cb 1.11 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.76 2qtc h LYS 711 CO 0.11 0.45 0.00 0.41 -1.08 0.00 0.00 179.45 179.34 2qtc n GLY 712 N 0.25 1.40 3.52 3.86 0.00 -0.23 -4.31 105.19 109.68 2qtc n GLY 712 Ca -0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 2qtc n GLY 712 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2qtc s ILE 713 N -1.16 0.00 0.02 -0.61 2.07 -0.72 -0.44 121.20 120.37 2qtc s ILE 713 Ca 0.00 0.00 -0.28 0.00 -1.41 0.00 0.00 60.65 58.96 2qtc s ILE 713 Cb 0.00 -1.00 0.07 0.00 0.13 0.00 0.00 42.46 41.66 2qtc s ILE 713 CO 0.00 0.00 0.67 -0.72 -1.91 0.00 0.00 174.94 172.98 2qtc s TYR 714 N -1.49 -0.60 -0.21 3.50 1.13 -1.06 -4.48 117.35 114.14 2qtc s TYR 714 Ca -0.08 0.82 -0.26 0.00 -1.41 0.00 0.00 57.07 56.14 2qtc s TYR 714 Cb -0.00 0.47 -0.00 0.00 -1.10 0.00 0.00 41.96 41.32 2qtc s TYR 714 CO 0.06 -0.68 0.89 0.21 -2.51 0.00 0.00 175.55 173.52 2qtc s LYS 715 N -2.09 4.25 -0.10 -3.49 2.20 -1.26 -1.75 119.74 117.50 2qtc s LYS 715 Ca -0.06 1.10 -0.27 0.00 -0.36 0.00 0.00 55.97 56.38 2qtc s LYS 715 Cb -0.00 -3.61 -0.25 0.00 -1.51 0.00 0.00 37.83 32.45 2qtc s LYS 715 CO 0.01 -0.47 0.90 -0.07 -0.36 0.00 0.00 175.35 175.36 2qtc h LEU 716 N 8.90 0.10 -7.51 5.43 3.38 -0.89 -3.48 115.31 121.24 2qtc h LEU 716 Ca -0.25 -0.88 0.22 0.00 0.09 0.00 0.00 57.88 57.06 2qtc h LEU 716 Cb 1.10 -0.03 -0.10 0.00 0.09 0.00 0.00 40.66 41.72 2qtc h LEU 716 CO 0.89 0.97 0.58 -1.83 0.09 0.00 0.00 178.44 179.14 2qtc s GLU 717 N -2.69 0.95 -0.06 1.13 -1.05 -1.17 -5.03 118.70 110.79 2qtc s GLU 717 Ca -0.17 -0.52 0.02 0.00 -0.15 0.00 0.00 54.97 54.15 2qtc s GLU 717 Cb -0.01 0.33 0.01 0.00 -0.44 0.00 0.00 34.13 34.02 2qtc s GLU 717 CO 0.71 -0.43 -0.10 0.95 0.95 0.00 0.00 175.26 177.34 2qtc s THR 718 N -3.03 0.96 -0.13 1.83 -4.23 -1.26 -0.43 115.64 109.34 2qtc s THR 718 Ca 0.12 -0.38 -0.04 0.00 -1.18 0.00 0.00 61.69 60.21 2qtc s THR 718 Cb 0.00 -0.89 -0.04 0.00 1.34 0.00 0.00 72.50 72.91 2qtc s THR 718 CO 0.00 0.31 0.02 -0.63 -0.54 0.00 0.00 174.62 173.79 2qtc s ILE 719 N 0.69 4.48 0.60 2.99 1.01 0.15 -4.94 121.20 126.18 2qtc s ILE 719 Ca -0.13 -0.16 -0.14 0.00 0.00 0.00 0.00 60.65 60.22 2qtc s ILE 719 Cb -0.15 -2.95 -0.04 0.00 0.01 0.00 0.00 42.46 39.33 2qtc s ILE 719 CO 0.03 0.54 1.03 -1.61 0.00 0.00 0.00 174.94 174.93 2qtc s GLU 720 N -0.25 3.48 0.00 2.79 0.41 -1.26 -0.62 118.70 123.25 2qtc s GLU 720 Ca 0.07 0.98 0.00 0.00 -0.41 0.00 0.00 54.97 55.61 2qtc s GLU 720 Cb -0.12 -2.06 0.00 0.00 -1.78 0.00 0.00 34.13 30.16 2qtc s GLU 720 CO 0.02 -0.66 0.00 0.41 -0.49 0.00 0.00 175.26 174.54 2qtc n GLY 721 N -1.75 0.94 0.42 -1.39 0.00 -1.26 -4.26 105.19 97.89 2qtc n GLY 721 Ca 0.07 0.43 0.14 0.00 0.00 0.00 0.00 46.02 46.66 2qtc n GLY 721 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2qtc n SER 722 N 0.00 1.32 0.02 1.61 3.41 -0.97 -3.70 113.62 115.30 2qtc n SER 722 Ca 0.00 -1.44 0.11 0.00 -0.26 0.00 0.00 58.87 57.28 2qtc n SER 722 Cb 0.00 -0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 2qtc n SER 722 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2qtc n LYS 723 N 0.03 0.31 0.00 4.33 4.76 0.59 -5.04 118.16 123.14 2qtc n LYS 723 Ca 0.20 -0.03 0.00 0.00 -2.87 0.00 0.00 58.31 55.61 2qtc n LYS 723 Cb 0.32 -1.57 0.00 0.00 -1.84 0.00 0.00 35.03 31.94 2qtc n LYS 723 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2qtc n GLY 724 N 1.37 0.64 2.98 0.72 0.00 -1.24 -4.90 105.19 104.75 2qtc n GLY 724 Ca 0.01 -0.97 -0.13 0.00 0.00 0.00 0.00 46.02 44.94 2qtc n GLY 724 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2qtc s LYS 725 N -2.00 0.13 0.31 1.61 2.20 -1.26 -0.92 119.74 119.81 2qtc s LYS 725 Ca 0.00 0.20 0.03 0.00 -0.36 0.00 0.00 55.97 55.84 2qtc s LYS 725 Cb 0.00 0.02 -0.04 0.00 -1.51 0.00 0.00 37.83 36.30 2qtc s LYS 725 CO 0.00 -0.05 0.14 0.14 -0.36 0.00 0.00 175.35 175.22 2qtc s VAL 726 N 0.29 0.45 -0.04 4.02 -7.23 -0.75 -4.31 120.40 112.82 2qtc s VAL 726 Ca -0.02 -2.00 0.07 0.00 -1.81 0.00 0.00 61.98 58.22 2qtc s VAL 726 Cb -0.03 -2.53 -0.02 0.00 0.56 0.00 0.00 36.38 34.36 2qtc s VAL 726 CO -0.01 0.00 -0.25 -1.10 -0.31 0.00 0.00 175.10 173.43 2qtc s GLN 727 N -3.84 2.29 -0.07 4.82 -0.21 0.56 -1.56 119.66 121.64 2qtc s GLN 727 Ca 0.35 -0.91 0.00 0.00 0.02 0.00 0.00 55.36 54.83 2qtc s GLN 727 Cb 0.05 -2.07 0.02 0.00 1.00 0.00 0.00 33.01 32.02 2qtc s GLN 727 CO 0.16 0.47 -0.06 -0.51 -2.12 0.00 0.00 175.29 173.23 2qtc s LEU 728 N -0.39 1.19 -0.01 2.90 1.43 0.00 -1.11 118.68 122.70 2qtc s LEU 728 Ca 0.03 -0.20 0.08 0.00 -1.03 0.00 0.00 54.13 53.01 2qtc s LEU 728 Cb -0.12 -0.64 -0.02 0.00 0.03 0.00 0.00 46.19 45.44 2qtc s LEU 728 CO 0.01 -0.09 -0.25 -0.76 0.23 0.00 0.00 176.35 175.50 2qtc s LEU 729 N 1.33 2.07 0.12 1.79 1.02 0.07 -0.79 118.68 124.28 2qtc s LEU 729 Ca -0.04 -0.48 -0.08 0.00 0.02 0.00 0.00 54.13 53.56 2qtc s LEU 729 Cb -0.14 -1.28 -0.01 0.00 0.02 0.00 0.00 46.19 44.79 2qtc s LEU 729 CO -0.03 0.30 0.22 -0.83 0.02 0.00 0.00 176.35 176.02 2qtc s GLY 730 N -0.71 0.28 0.14 -3.19 0.00 -0.99 -1.57 107.32 101.29 2qtc s GLY 730 Ca 0.10 -0.77 -0.08 0.00 0.00 0.00 0.00 44.72 43.98 2qtc s GLY 730 CO -0.00 -0.85 0.23 -1.35 0.00 0.00 0.00 173.10 171.13 2qtc s SER 731 N -2.91 0.10 0.64 1.64 1.04 -1.23 -0.78 113.70 112.20 2qtc s SER 731 Ca 0.10 -0.87 0.00 0.00 0.48 0.00 0.00 55.95 55.66 2qtc s SER 731 Cb 0.04 0.39 0.00 0.00 0.10 0.00 0.00 66.02 66.56 2qtc s SER 731 CO -0.06 -0.83 0.00 0.61 0.98 0.00 0.00 173.24 173.93 2qtc n GLY 732 N -0.16 1.64 0.17 7.32 0.00 -0.54 -2.54 105.19 111.07 2qtc n GLY 732 Ca -0.09 -0.47 0.13 0.00 0.00 0.00 0.00 46.02 45.59 2qtc n GLY 732 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2qtc h SER 733 N 6.08 0.00 1.39 1.61 4.64 -1.89 -2.98 113.55 122.40 2qtc h SER 733 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2qtc h SER 733 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2qtc h SER 733 CO 0.00 0.00 -0.47 0.40 -0.87 0.00 0.00 176.83 175.89 2qtc h ILE 734 N 0.00 0.00 -0.68 0.95 1.08 -1.82 -3.35 117.51 113.69 2qtc h ILE 734 Ca 0.00 -0.86 0.09 0.00 -0.39 0.00 0.00 64.86 63.70 2qtc h ILE 734 Cb 0.30 1.61 -0.07 0.00 -3.07 0.00 0.00 36.82 35.59 2qtc h ILE 734 CO 0.00 0.00 0.32 0.25 -0.69 0.00 0.00 178.15 178.03 2qtc h LEU 735 N 0.00 0.41 -2.20 1.44 5.85 -1.39 0.23 115.31 119.65 2qtc h LEU 735 Ca 0.00 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 2qtc h LEU 735 Cb 0.93 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.95 2qtc h LEU 735 CO 0.00 0.24 -0.06 0.08 -0.34 0.00 0.00 178.44 178.36 2qtc h ARG 736 N 0.56 0.00 0.04 1.25 0.11 -1.80 0.68 114.38 115.23 2qtc h ARG 736 Ca 0.33 0.00 -0.23 0.00 0.10 0.00 0.00 59.98 60.18 2qtc h ARG 736 Cb 0.35 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.41 2qtc h ARG 736 CO -0.27 0.06 -1.11 0.45 0.10 0.00 0.00 179.97 179.21 2qtc h HIS 737 N 0.00 0.15 -0.35 4.08 3.86 -1.22 -2.20 115.15 119.47 2qtc h HIS 737 Ca -0.00 -0.11 -0.13 0.00 -1.16 0.00 0.00 60.37 58.96 2qtc h HIS 737 Cb 0.19 -0.01 -0.01 0.00 1.06 0.00 0.00 27.41 28.64 2qtc h HIS 737 CO 0.00 1.09 -0.32 0.28 0.86 0.00 0.00 177.93 179.85 2qtc h VAL 738 N 0.02 1.28 -0.40 2.45 2.07 0.23 -1.35 116.25 120.56 2qtc h VAL 738 Ca -0.06 -1.47 -0.08 0.00 0.82 0.00 0.00 66.70 65.92 2qtc h VAL 738 Cb 1.84 1.34 -0.02 0.00 -1.52 0.00 0.00 31.29 32.94 2qtc h VAL 738 CO 0.15 0.48 -0.08 0.03 0.02 0.00 0.00 177.57 178.18 2qtc h ARG 739 N 0.66 0.69 -0.79 1.57 3.08 -0.90 -1.23 114.38 117.46 2qtc h ARG 739 Ca 0.07 -0.20 -0.03 0.00 0.07 0.00 0.00 59.98 59.89 2qtc h ARG 739 Cb 0.85 -0.07 -0.04 0.00 0.08 0.00 0.00 29.97 30.79 2qtc h ARG 739 CO 0.07 0.75 0.39 1.49 -1.07 0.00 0.00 179.97 181.61 2qtc h GLU 740 N 0.63 1.13 -0.76 0.04 4.81 -1.06 -1.98 114.58 117.40 2qtc h GLU 740 Ca 0.12 -0.16 -0.03 0.00 -0.13 0.00 0.00 59.36 59.16 2qtc h GLU 740 Cb 0.51 -0.21 -0.04 0.00 0.63 0.00 0.00 28.75 29.64 2qtc h GLU 740 CO 0.03 0.87 0.37 0.00 -0.73 0.00 0.00 179.01 179.55 2qtc h ALA 741 N 1.20 1.22 -0.57 2.92 0.00 -0.51 -1.73 119.26 121.80 2qtc h ALA 741 Ca 0.27 -0.15 0.01 0.00 0.00 0.00 0.00 54.91 55.05 2qtc h ALA 741 Cb 0.11 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 2qtc h ALA 741 CO -0.04 0.60 0.37 0.00 0.00 0.00 0.00 179.25 180.18 2qtc h ALA 742 N 1.33 0.73 -0.48 0.00 0.00 -0.51 0.17 119.26 120.48 2qtc h ALA 742 Ca 0.26 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.09 2qtc h ALA 742 Cb 0.10 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 2qtc h ALA 742 CO -0.03 0.13 0.10 0.93 0.00 0.00 0.00 179.25 180.37 2qtc h GLU 743 N 0.74 0.79 -0.06 0.00 4.39 -1.11 -1.41 114.58 117.92 2qtc h GLU 743 Ca 0.22 -0.20 -0.00 0.00 0.34 0.00 0.00 59.36 59.71 2qtc h GLU 743 Cb -0.05 -0.10 -0.00 0.00 -0.10 0.00 0.00 28.75 28.50 2qtc h GLU 743 CO -0.07 0.78 0.04 0.82 -1.16 0.00 0.00 179.01 179.42 2qtc h ILE 744 N 0.67 1.06 -0.99 3.13 2.04 -0.82 -0.41 117.51 122.19 2qtc h ILE 744 Ca 0.15 -0.15 0.08 0.00 1.00 0.00 0.00 64.86 65.94 2qtc h ILE 744 Cb 0.37 1.05 -0.07 0.00 -0.74 0.00 0.00 36.82 37.42 2qtc h ILE 744 CO 0.01 0.05 0.64 -0.07 0.00 0.00 0.00 178.15 178.77 2qtc h LEU 745 N 0.04 0.99 0.02 1.44 3.38 -0.52 0.82 115.31 121.48 2qtc h LEU 745 Ca 0.02 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 2qtc h LEU 745 Cb 0.05 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.61 2qtc h LEU 745 CO -0.00 0.60 -0.01 0.00 0.09 0.00 0.00 178.44 179.12 2qtc h ALA 746 N 1.49 -0.03 0.02 1.53 0.00 -0.93 -0.72 119.26 120.63 2qtc h ALA 746 Ca 0.45 -0.27 -0.21 0.00 0.00 0.00 0.00 54.91 54.88 2qtc h ALA 746 Cb 0.27 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 2qtc h ALA 746 CO -0.19 -0.24 -0.97 0.87 0.00 0.00 0.00 179.25 178.71 2qtc h LYS 747 N -0.59 0.08 0.00 0.00 1.79 -0.95 -1.93 116.57 114.99 2qtc h LYS 747 Ca -0.00 -0.12 -0.23 0.00 -2.18 0.00 0.00 60.65 58.12 2qtc h LYS 747 Cb 0.55 0.04 -0.04 0.00 -1.58 0.00 0.00 32.23 31.20 2qtc h LYS 747 CO 0.01 0.98 -1.96 -0.25 -1.08 0.00 0.00 179.45 177.15 2qtc n ASP 748 N -3.49 0.33 0.00 0.86 9.92 0.27 -4.62 116.55 119.82 2qtc n ASP 748 Ca -0.02 0.15 0.00 0.00 -0.53 0.00 0.00 54.79 54.39 2qtc n ASP 748 Cb 0.89 0.86 0.00 0.00 -0.64 0.00 0.00 41.12 42.23 2qtc n ASP 748 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 2qtc n TYR 749 N -2.72 0.00 -1.29 1.24 4.02 -0.92 -5.01 117.16 112.49 2qtc n TYR 749 Ca -0.19 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.61 2qtc n TYR 749 Cb 0.94 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 40.22 2qtc n TYR 749 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2qtc n GLY 750 N 0.33 1.09 3.59 2.72 0.00 -0.72 -4.74 105.19 107.46 2qtc n GLY 750 Ca 0.00 -0.60 -0.39 0.00 0.00 0.00 0.00 46.02 45.03 2qtc n GLY 750 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qtc s VAL 751 N -2.35 5.25 0.79 1.61 1.01 -0.35 -0.30 120.40 126.06 2qtc s VAL 751 Ca 0.00 0.29 -0.09 0.00 0.00 0.00 0.00 61.98 62.17 2qtc s VAL 751 Cb 0.00 -3.62 0.11 0.00 0.00 0.00 0.00 36.38 32.87 2qtc s VAL 751 CO 0.00 0.18 1.12 -0.83 0.00 0.00 0.00 175.10 175.57 2qtc s GLY 752 N 1.71 1.70 0.11 4.51 0.00 -0.10 -2.47 107.32 112.79 2qtc s GLY 752 Ca 0.10 -1.02 -0.25 0.00 0.00 0.00 0.00 44.72 43.56 2qtc s GLY 752 CO 0.11 -0.49 0.69 -1.35 0.00 0.00 0.00 173.10 172.06 2qtc s SER 753 N -4.65 -0.50 -0.18 1.64 1.04 0.21 -1.81 113.70 109.45 2qtc s SER 753 Ca 0.65 -0.01 -0.05 0.00 0.48 0.00 0.00 55.95 57.01 2qtc s SER 753 Cb -0.09 0.53 -0.03 0.00 0.10 0.00 0.00 66.02 66.54 2qtc s SER 753 CO 0.48 -0.87 -0.00 -1.81 0.98 0.00 0.00 173.24 172.02 2qtc s ASP 754 N -2.67 4.97 -0.17 7.02 1.01 -0.60 0.31 116.67 126.55 2qtc s ASP 754 Ca 0.02 -0.12 -0.02 0.00 0.71 0.00 0.00 52.55 53.14 2qtc s ASP 754 Cb -0.01 -1.84 -0.01 0.00 1.01 0.00 0.00 42.92 42.07 2qtc s ASP 754 CO -0.11 0.12 -0.09 -0.69 0.21 0.00 0.00 175.17 174.61 2qtc s VAL 755 N 0.64 3.27 0.02 -1.27 1.01 0.42 -0.82 120.40 123.68 2qtc s VAL 755 Ca -0.00 -0.56 0.08 0.00 0.00 0.00 0.00 61.98 61.49 2qtc s VAL 755 Cb -0.14 -2.43 -0.03 0.00 0.00 0.00 0.00 36.38 33.79 2qtc s VAL 755 CO 0.02 0.48 -0.22 -0.31 0.00 0.00 0.00 175.10 175.07 2qtc s TYR 756 N 0.79 2.45 -0.22 5.22 1.51 0.03 -0.15 117.35 126.98 2qtc s TYR 756 Ca -0.03 -0.34 -0.11 0.00 -1.01 0.00 0.00 57.07 55.59 2qtc s TYR 756 Cb -0.15 -1.46 -0.05 0.00 -0.11 0.00 0.00 41.96 40.19 2qtc s TYR 756 CO 0.01 0.15 0.16 0.45 -1.11 0.00 0.00 175.55 175.21 2qtc s SER 757 N -1.15 6.19 -0.42 2.29 0.15 -0.72 -2.34 113.70 117.70 2qtc s SER 757 Ca 0.12 0.20 -0.08 0.00 0.70 0.00 0.00 55.95 56.89 2qtc s SER 757 Cb -0.10 -2.11 0.08 0.00 -1.71 0.00 0.00 66.02 62.19 2qtc s SER 757 CO 0.02 0.12 0.25 -0.69 1.20 0.00 0.00 173.24 174.14 2qtc s VAL 758 N 0.69 4.06 -0.15 4.45 1.01 0.04 -2.56 120.40 127.95 2qtc s VAL 758 Ca 0.09 -1.51 0.20 0.00 0.00 0.00 0.00 61.98 60.75 2qtc s VAL 758 Cb -0.12 -3.53 0.18 0.00 0.00 0.00 0.00 36.38 32.91 2qtc s VAL 758 CO 0.01 -0.53 1.59 0.71 0.00 0.00 0.00 175.10 176.88 2qtc h THR 759 N 6.13 0.56 -1.26 3.92 1.35 -1.03 -3.40 112.91 119.19 2qtc h THR 759 Ca -0.22 -1.62 -0.12 0.00 -0.55 0.00 0.00 66.41 63.90 2qtc h THR 759 Cb 1.08 2.14 -0.23 0.00 -1.73 0.00 0.00 68.15 69.41 2qtc h THR 759 CO 0.75 0.30 -0.49 -0.55 -0.25 0.00 0.00 175.52 175.28 2qtc s SER 760 N -6.32 -0.84 0.38 5.36 0.15 -0.90 -0.28 113.70 111.26 2qtc s SER 760 Ca 0.04 -0.72 0.06 0.00 0.70 0.00 0.00 55.95 56.02 2qtc s SER 760 Cb 0.08 1.62 0.77 0.00 -1.71 0.00 0.00 66.02 66.78 2qtc s SER 760 CO 0.70 -0.23 2.02 -0.26 1.20 0.00 0.00 173.24 176.67 2qtc h PHE 761 N 7.31 0.65 -0.48 3.44 0.04 -1.82 -2.31 116.94 123.77 2qtc h PHE 761 Ca 0.03 0.02 -0.13 0.00 2.80 0.00 0.00 57.97 60.68 2qtc h PHE 761 Cb 1.15 -0.22 -0.01 0.00 2.20 0.00 0.00 35.95 39.07 2qtc h PHE 761 CO 0.22 0.39 -0.20 1.15 -0.60 0.00 0.00 178.31 179.27 2qtc h THR 762 N 0.68 1.27 -0.06 -1.55 2.02 -1.84 -0.15 112.91 113.28 2qtc h THR 762 Ca 0.21 -1.36 -0.12 0.00 0.77 0.00 0.00 66.41 65.91 2qtc h THR 762 Cb 0.01 1.13 -0.01 0.00 -1.74 0.00 0.00 68.15 67.54 2qtc h THR 762 CO -0.05 0.47 -0.52 -0.33 0.37 0.00 0.00 175.52 175.46 2qtc h GLU 763 N 0.83 0.16 -0.46 6.66 4.39 -1.77 -0.10 114.58 124.29 2qtc h GLU 763 Ca 0.11 -0.09 -0.13 0.00 0.34 0.00 0.00 59.36 59.59 2qtc h GLU 763 Cb 0.78 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.42 2qtc h GLU 763 CO 0.06 0.64 -0.22 -0.07 -1.16 0.00 0.00 179.01 178.27 2qtc h LEU 764 N 0.13 0.99 -0.31 1.33 3.38 -1.08 -1.13 115.31 118.61 2qtc h LEU 764 Ca 0.00 -0.40 -0.01 0.00 0.09 0.00 0.00 57.88 57.56 2qtc h LEU 764 Cb 0.96 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 2qtc h LEU 764 CO 0.08 1.17 0.14 0.00 0.09 0.00 0.00 178.44 179.92 2qtc h ALA 765 N 0.85 0.41 -0.65 1.53 0.00 -0.56 -0.40 119.26 120.45 2qtc h ALA 765 Ca 0.10 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.91 2qtc h ALA 765 Cb 0.79 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.43 2qtc h ALA 765 CO 0.07 -0.02 0.42 0.00 0.00 0.00 0.00 179.25 179.72 2qtc h ARG 766 N 0.37 0.85 -0.43 0.00 3.08 -0.91 0.26 114.38 117.60 2qtc h ARG 766 Ca 0.11 -0.05 0.01 0.00 0.07 0.00 0.00 59.98 60.11 2qtc h ARG 766 Cb 0.15 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 29.98 2qtc h ARG 766 CO -0.01 0.57 0.28 0.22 -1.07 0.00 0.00 179.97 179.96 2qtc h ASP 767 N 0.88 0.49 -0.45 7.04 3.58 -0.87 0.32 116.42 127.41 2qtc h ASP 767 Ca 0.24 -0.01 -0.00 0.00 0.42 0.00 0.00 57.03 57.67 2qtc h ASP 767 Cb -0.09 -0.12 -0.02 0.00 1.72 0.00 0.00 39.33 40.82 2qtc h ASP 767 CO -0.05 0.35 0.26 1.23 -2.88 0.00 0.00 179.24 178.16 2qtc h GLY 768 N 0.58 0.66 0.96 -0.78 0.00 -0.63 -0.71 103.07 103.15 2qtc h GLY 768 Ca 0.16 -0.28 0.02 0.00 0.00 0.00 0.00 47.33 47.23 2qtc h GLY 768 CO -0.04 0.27 0.58 1.46 0.00 0.00 0.00 176.54 178.82 2qtc h GLN 769 N 0.59 1.14 -0.27 4.80 4.20 0.01 -1.86 115.11 123.72 2qtc h GLN 769 Ca 0.16 -0.07 -0.11 0.00 0.06 0.00 0.00 58.65 58.69 2qtc h GLN 769 Cb 0.01 -0.26 -0.01 0.00 0.30 0.00 0.00 27.48 27.52 2qtc h GLN 769 CO -0.03 0.75 -0.28 -0.44 -0.67 0.00 0.00 178.83 178.16 2qtc h ASP 770 N 1.17 0.55 -0.38 1.46 3.32 -0.56 -0.84 116.42 121.14 2qtc h ASP 770 Ca 0.34 -0.20 -0.06 0.00 0.02 0.00 0.00 57.03 57.13 2qtc h ASP 770 Cb -0.08 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.30 2qtc h ASP 770 CO -0.09 0.82 0.02 0.00 -1.72 0.00 0.00 179.24 178.27 2qtc h GLU 772 N 0.49 0.00 0.08 0.00 4.39 -1.20 0.38 114.58 118.71 2qtc h GLU 772 Ca 0.11 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.81 2qtc h GLU 772 Cb 0.44 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.09 2qtc h GLU 772 CO 0.02 0.70 -0.04 -0.09 -1.16 0.00 0.00 179.01 178.44 2qtc h ARG 773 N 0.00 -0.10 -0.83 2.33 2.43 -1.12 -0.36 114.38 116.73 2qtc h ARG 773 Ca -0.01 0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.20 2qtc h ARG 773 Cb 1.30 0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 30.83 2qtc h ARG 773 CO 0.09 0.16 0.54 2.35 -1.51 0.00 0.00 179.97 181.60 2qtc h TRP 774 N -0.35 1.01 -0.73 2.20 7.01 -1.15 -1.53 115.95 122.41 2qtc h TRP 774 Ca -0.01 0.03 -0.05 0.00 2.11 0.00 0.00 58.89 60.96 2qtc h TRP 774 Cb 0.30 -0.34 -0.03 0.00 -2.10 0.00 0.00 29.16 26.99 2qtc h TRP 774 CO 0.01 0.60 0.25 -0.91 -2.79 0.00 0.00 178.44 175.60 2qtc h ASN 775 N 1.06 1.03 -0.67 2.65 2.35 -0.75 -0.83 115.58 120.43 2qtc h ASN 775 Ca 0.33 -0.19 -0.00 0.00 -0.55 0.00 0.00 56.30 55.88 2qtc h ASN 775 Cb -0.03 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.04 2qtc h ASN 775 CO -0.10 0.95 0.40 -0.03 -1.65 0.00 0.00 177.43 177.00 2qtc h MET 776 N 1.06 0.92 0.00 0.81 1.85 -0.48 -2.84 114.93 116.26 2qtc h MET 776 Ca 0.24 -0.08 0.00 0.00 -0.61 0.00 0.00 59.70 59.25 2qtc h MET 776 Cb 0.27 -0.19 0.00 0.00 0.43 0.00 0.00 31.60 32.10 2qtc h MET 776 CO -0.01 0.65 -0.27 1.28 -0.40 0.00 0.00 176.91 178.16 2qtc n LEU 777 N -4.39 0.28 -3.15 3.39 4.77 -0.63 -4.21 117.00 113.05 2qtc n LEU 777 Ca 0.07 0.23 -0.22 0.00 -0.03 0.00 0.00 56.01 56.06 2qtc n LEU 777 Cb 0.07 -0.36 -0.04 0.00 -2.33 0.00 0.00 43.42 40.76 2qtc n LEU 777 CO 0.37 0.06 -0.13 1.41 -1.33 0.00 0.00 177.39 177.77 2qtc n HIS 778 N -1.51 1.25 0.26 -1.77 8.25 -0.37 -4.96 115.22 116.36 2qtc n HIS 778 Ca 0.06 -3.84 0.14 0.00 -0.26 0.00 0.00 57.72 53.82 2qtc n HIS 778 Cb 0.34 -0.43 0.75 0.00 1.12 0.00 0.00 29.99 31.77 2qtc n HIS 778 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2qtc h PRO 779 N 3.30 0.00 0.00 -0.41 0.13 -1.72 -1.84 132.00 131.46 2qtc h PRO 779 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 2qtc h PRO 779 Cb 0.82 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.95 2qtc h PRO 779 CO 0.59 0.00 -0.81 1.28 -0.23 0.00 0.00 178.00 178.83 2qtc n LEU 780 N -2.59 0.73 -5.01 1.56 4.32 -1.26 -4.99 117.00 109.76 2qtc n LEU 780 Ca -0.02 -0.22 -0.18 0.00 -0.02 0.00 0.00 56.01 55.57 2qtc n LEU 780 Cb 0.21 -0.12 0.03 0.00 -1.62 0.00 0.00 43.42 41.93 2qtc n LEU 780 CO 0.12 0.17 0.24 -1.61 -1.22 0.00 0.00 177.39 175.09 2qtc s GLU 781 N -3.03 2.61 -0.14 3.23 2.02 -0.69 -5.02 118.70 117.67 2qtc s GLU 781 Ca 0.08 -1.33 -0.29 0.00 0.02 0.00 0.00 54.97 53.46 2qtc s GLU 781 Cb 0.16 -2.69 -0.07 0.00 0.10 0.00 0.00 34.13 31.64 2qtc s GLU 781 CO 0.79 -0.53 2.14 2.41 0.02 0.00 0.00 175.26 180.09 2qtc n THR 782 N -2.04 0.48 -2.02 3.63 -1.04 -1.26 -4.92 114.28 107.10 2qtc n THR 782 Ca 0.11 -0.35 -0.40 0.00 -2.04 0.00 0.00 64.05 61.37 2qtc n THR 782 Cb 0.60 -2.44 -0.00 0.00 -1.82 0.00 0.00 70.33 66.66 2qtc n THR 782 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 2qtc s PRO 783 N 5.73 3.94 0.24 -2.82 0.02 -1.26 -5.00 135.00 135.85 2qtc s PRO 783 Ca 0.97 2.20 -0.24 0.00 0.02 0.00 0.00 61.00 63.95 2qtc s PRO 783 Cb -0.39 -2.75 -0.09 0.00 0.02 0.00 0.00 34.50 31.29 2qtc s PRO 783 CO 0.38 -0.53 0.83 1.03 -0.33 0.00 0.00 177.00 178.38 2qtc s ARG 784 N -2.26 4.50 -0.21 5.54 0.52 -1.26 -5.05 118.95 120.73 2qtc s ARG 784 Ca 0.57 1.15 -0.08 0.00 -0.52 0.00 0.00 55.73 56.85 2qtc s ARG 784 Cb -0.39 -2.99 -0.04 0.00 0.52 0.00 0.00 34.95 32.05 2qtc s ARG 784 CO 0.50 0.42 0.08 0.08 0.02 0.00 0.00 175.30 176.40 2qtc s VAL 785 N -1.42 4.70 0.32 3.52 1.01 -1.26 -4.79 120.40 122.48 2qtc s VAL 785 Ca 0.43 -0.05 -0.29 0.00 0.00 0.00 0.00 61.98 62.06 2qtc s VAL 785 Cb -0.20 -3.15 -0.12 0.00 0.00 0.00 0.00 36.38 32.91 2qtc s VAL 785 CO 0.24 0.41 1.46 -2.65 0.00 0.00 0.00 175.10 174.56 2qtc n PRO 786 N 4.06 2.43 -0.26 2.72 -0.02 -1.26 -4.86 135.00 137.81 2qtc n PRO 786 Ca -0.16 0.86 0.06 0.00 -2.02 0.00 0.00 63.50 62.24 2qtc n PRO 786 Cb 0.52 -2.55 0.19 0.00 -0.02 0.00 0.00 33.50 31.64 2qtc n PRO 786 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 2qtc h TYR 787 N 3.66 0.28 -0.17 6.00 3.20 -1.89 0.14 116.97 128.18 2qtc h TYR 787 Ca -0.47 0.04 0.05 0.00 3.14 0.00 0.00 58.73 61.49 2qtc h TYR 787 Cb 1.25 -0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.51 2qtc h TYR 787 CO 0.55 -0.10 0.12 0.97 -1.64 0.00 0.00 178.16 178.06 2qtc h ILE 788 N 0.26 0.91 0.00 1.81 2.10 -1.89 0.18 117.51 120.88 2qtc h ILE 788 Ca 0.43 0.00 0.00 0.00 1.08 0.00 0.00 64.86 66.37 2qtc h ILE 788 Cb 0.76 0.91 0.00 0.00 -1.09 0.00 0.00 36.82 37.40 2qtc h ILE 788 CO -0.53 0.00 0.00 0.00 -1.08 0.00 0.00 178.15 176.54 2qtc n ALA 789 N -2.57 2.22 1.20 0.18 0.00 0.45 -0.89 120.51 121.10 2qtc n ALA 789 Ca 0.01 -0.05 0.13 0.00 0.00 0.00 0.00 53.44 53.53 2qtc n ALA 789 Cb 0.26 -1.45 0.28 0.00 0.00 0.00 0.00 19.45 18.54 2qtc n ALA 789 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2qtc n GLN 790 N -1.90 1.13 -0.05 0.00 6.02 0.03 -4.28 117.38 118.34 2qtc n GLN 790 Ca 0.06 -0.77 -0.08 0.00 -0.01 0.00 0.00 57.00 56.20 2qtc n GLN 790 Cb 0.36 -1.48 -0.04 0.00 1.02 0.00 0.00 30.24 30.10 2qtc n GLN 790 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 2qtc n VAL 791 N -0.26 0.58 -2.58 5.09 0.31 -1.01 -5.05 118.33 115.41 2qtc n VAL 791 Ca 0.12 -0.20 -0.27 0.00 -0.01 0.00 0.00 64.34 63.99 2qtc n VAL 791 Cb 0.39 -1.11 0.01 0.00 -0.91 0.00 0.00 33.84 32.23 2qtc n VAL 791 CO 0.00 0.00 0.00 -0.04 -1.32 0.00 0.00 176.83 175.47 2qtc s MET 792 N -2.20 3.23 0.00 5.55 -1.94 -0.06 -4.94 119.30 118.94 2qtc s MET 792 Ca -0.14 0.04 0.00 0.00 -1.71 0.00 0.00 55.69 53.88 2qtc s MET 792 Cb 0.04 -2.35 0.00 0.00 2.01 0.00 0.00 34.83 34.53 2qtc s MET 792 CO 0.22 -0.41 0.00 0.27 -0.01 0.00 0.00 175.02 175.09 2qtc n ASN 793 N -2.37 1.56 -1.16 3.03 0.23 -1.26 -4.79 115.26 110.50 2qtc n ASN 793 Ca 0.02 0.00 0.12 0.00 -0.53 0.00 0.00 54.58 54.19 2qtc n ASN 793 Cb 0.56 0.00 0.22 0.00 -2.08 0.00 0.00 39.78 38.49 2qtc n ASN 793 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 2qtc n ASP 794 N 0.00 3.45 -4.78 0.53 5.75 -1.26 -4.03 116.55 116.22 2qtc n ASP 794 Ca 0.00 -1.99 -0.34 0.00 -0.01 0.00 0.00 54.79 52.45 2qtc n ASP 794 Cb 0.00 -0.25 0.02 0.00 -1.03 0.00 0.00 41.12 39.86 2qtc n ASP 794 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2qtc s ALA 795 N -1.49 2.62 0.21 2.12 0.00 -1.26 -4.28 121.76 119.67 2qtc s ALA 795 Ca 0.39 0.59 -0.32 0.00 0.00 0.00 0.00 51.96 52.62 2qtc s ALA 795 Cb 0.23 -3.30 -0.14 0.00 0.00 0.00 0.00 23.12 19.90 2qtc s ALA 795 CO 0.32 -0.97 1.30 -0.35 0.00 0.00 0.00 175.76 176.06 2qtc n PRO 796 N -1.94 1.64 -4.59 0.00 -0.04 -1.26 -4.49 135.00 124.32 2qtc n PRO 796 Ca 0.10 0.58 -0.29 0.00 -0.04 0.00 0.00 63.50 63.86 2qtc n PRO 796 Cb 0.52 -2.17 -0.14 0.00 -0.04 0.00 0.00 33.50 31.67 2qtc n PRO 796 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2qtc s ALA 797 N -0.09 2.23 -0.02 0.55 0.00 -0.34 -0.32 121.76 123.77 2qtc s ALA 797 Ca 0.71 -1.34 0.04 0.00 0.00 0.00 0.00 51.96 51.36 2qtc s ALA 797 Cb -0.74 -0.40 -0.01 0.00 0.00 0.00 0.00 23.12 21.97 2qtc s ALA 797 CO 0.50 0.51 -0.13 0.08 0.00 0.00 0.00 175.76 176.72 2qtc s VAL 798 N -0.96 1.09 0.06 0.00 1.01 -0.27 -0.67 120.40 120.67 2qtc s VAL 798 Ca 0.12 -0.56 0.07 0.00 0.00 0.00 0.00 61.98 61.61 2qtc s VAL 798 Cb -0.10 -0.93 -0.03 0.00 0.00 0.00 0.00 36.38 35.33 2qtc s VAL 798 CO 0.04 0.32 -0.18 0.00 0.00 0.00 0.00 175.10 175.28 2qtc s ALA 799 N -0.11 1.53 -0.05 5.51 0.00 0.29 -0.75 121.76 128.18 2qtc s ALA 799 Ca 0.01 -1.04 -0.04 0.00 0.00 0.00 0.00 51.96 50.90 2qtc s ALA 799 Cb -0.08 -0.24 0.02 0.00 0.00 0.00 0.00 23.12 22.83 2qtc s ALA 799 CO 0.00 0.31 0.12 0.45 0.00 0.00 0.00 175.76 176.64 2qtc s SER 800 N -1.45 -0.11 0.31 0.00 0.15 -0.61 -0.87 113.70 111.12 2qtc s SER 800 Ca 0.04 0.25 0.01 0.00 0.70 0.00 0.00 55.95 56.95 2qtc s SER 800 Cb -0.09 0.22 -0.02 0.00 -1.71 0.00 0.00 66.02 64.42 2qtc s SER 800 CO 0.02 -0.08 0.34 0.42 1.20 0.00 0.00 173.24 175.15 2qtc s THR 801 N 0.43 0.00 -1.55 6.45 -4.23 -1.23 -3.58 115.64 111.93 2qtc s THR 801 Ca -0.03 -1.80 0.12 0.00 -1.18 0.00 0.00 61.69 58.80 2qtc s THR 801 Cb -0.04 -2.53 0.41 0.00 1.34 0.00 0.00 72.50 71.68 2qtc s THR 801 CO -0.02 0.00 1.29 -0.67 -0.54 0.00 0.00 174.62 174.68 2qtc n ASP 802 N -1.18 2.77 -4.63 3.99 2.03 -1.26 -4.29 116.55 113.97 2qtc n ASP 802 Ca 0.03 -2.17 -0.24 0.00 0.52 0.00 0.00 54.79 52.93 2qtc n ASP 802 Cb 0.63 -0.39 -0.08 0.00 -0.72 0.00 0.00 41.12 40.55 2qtc n ASP 802 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 2qtc s TYR 803 N -1.61 2.55 0.85 -0.67 1.51 -1.26 -1.87 117.35 116.85 2qtc s TYR 803 Ca 0.30 -0.43 -0.14 0.00 -1.01 0.00 0.00 57.07 55.79 2qtc s TYR 803 Cb 0.18 -1.48 0.02 0.00 -0.11 0.00 0.00 41.96 40.57 2qtc s TYR 803 CO 0.16 0.48 0.59 0.00 -1.11 0.00 0.00 175.55 175.67 2qtc n MET 804 N -0.96 -0.03 -0.28 -0.62 0.00 0.18 -0.97 117.12 114.44 2qtc n MET 804 Ca -0.04 0.04 0.15 0.00 0.00 0.00 0.00 57.70 57.86 2qtc n MET 804 Cb 0.62 -1.95 0.42 0.00 0.00 0.00 0.00 33.22 32.31 2qtc n MET 804 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 175.97 176.84 2qtc h LYS 805 N -1.08 0.58 -0.32 3.17 1.57 -1.83 -1.44 116.57 117.22 2qtc h LYS 805 Ca -0.44 -0.03 0.09 0.00 -1.87 0.00 0.00 60.65 58.39 2qtc h LYS 805 Cb 1.31 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 33.47 2qtc h LYS 805 CO 0.39 0.38 0.29 1.25 -0.57 0.00 0.00 179.45 181.19 2qtc h LEU 806 N 0.60 0.00 -0.65 2.94 5.85 -1.95 0.25 115.31 122.35 2qtc h LEU 806 Ca 0.50 0.00 0.01 0.00 0.84 0.00 0.00 57.88 59.22 2qtc h LEU 806 Cb 0.97 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.96 2qtc h LEU 806 CO -0.24 0.00 0.43 0.15 -0.34 0.00 0.00 178.44 178.44 2qtc h PHE 807 N 0.00 0.81 0.00 1.25 3.57 -1.57 -1.24 116.94 119.77 2qtc h PHE 807 Ca 0.15 0.02 -0.28 0.00 3.53 0.00 0.00 57.97 61.39 2qtc h PHE 807 Cb 0.73 -0.28 -0.05 0.00 2.79 0.00 0.00 35.95 39.15 2qtc h PHE 807 CO 0.00 0.51 -1.70 0.00 -2.23 0.00 0.00 178.31 174.89 2qtc n ALA 808 N -2.28 1.53 0.27 2.41 0.00 -0.65 -4.07 120.51 117.72 2qtc n ALA 808 Ca 0.05 -0.76 0.15 0.00 0.00 0.00 0.00 53.44 52.88 2qtc n ALA 808 Cb 0.02 -0.84 0.77 0.00 0.00 0.00 0.00 19.45 19.39 2qtc n ALA 808 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2qtc h GLU 809 N 0.00 0.00 -0.06 0.00 5.08 -0.32 -3.14 114.58 116.14 2qtc h GLU 809 Ca -0.28 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.10 2qtc h GLU 809 Cb 1.98 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 31.23 2qtc h GLU 809 CO 0.07 0.09 0.21 -0.56 -1.00 0.00 0.00 179.01 177.82 2qtc h GLN 810 N 0.00 0.00 -0.50 2.33 3.07 -1.37 -0.18 115.11 118.46 2qtc h GLN 810 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 2qtc h GLN 810 Cb 0.37 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.93 2qtc h GLN 810 CO 0.01 0.00 0.00 1.33 0.09 0.00 0.00 178.83 180.26 2qtc n VAL 811 N -3.19 0.65 -0.25 1.86 0.24 -1.19 -4.63 118.33 111.83 2qtc n VAL 811 Ca -0.01 -0.76 0.04 0.00 -2.04 0.00 0.00 64.34 61.57 2qtc n VAL 811 Cb 0.29 0.63 0.14 0.00 -1.47 0.00 0.00 33.84 33.43 2qtc n VAL 811 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 2qtc h ARG 812 N 3.85 0.09 -0.72 7.34 9.65 -1.24 -0.32 114.38 133.04 2qtc h ARG 812 Ca 0.00 -0.01 0.12 0.00 -1.10 0.00 0.00 59.98 58.99 2qtc h ARG 812 Cb 0.87 -0.02 -0.05 0.00 -1.39 0.00 0.00 29.97 29.38 2qtc h ARG 812 CO 0.00 0.06 0.48 1.15 2.80 0.00 0.00 179.97 184.46 2qtc h THR 813 N 0.09 0.87 0.00 0.20 2.02 -1.83 -2.43 112.91 111.83 2qtc h THR 813 Ca 0.40 -0.17 0.00 0.00 0.77 0.00 0.00 66.41 67.40 2qtc h THR 813 Cb 0.69 0.32 0.00 0.00 -1.74 0.00 0.00 68.15 67.42 2qtc h THR 813 CO -0.66 0.09 -0.72 -1.22 0.37 0.00 0.00 175.52 173.38 2qtc n TYR 814 N -4.49 0.23 -2.40 3.16 4.01 -0.17 -4.85 117.16 112.65 2qtc n TYR 814 Ca 0.13 0.07 -0.43 0.00 -0.16 0.00 0.00 57.90 57.51 2qtc n TYR 814 Cb 0.42 -0.41 -0.02 0.00 -0.31 0.00 0.00 39.34 39.02 2qtc n TYR 814 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 2qtc s VAL 815 N -3.11 4.23 -0.05 -0.72 1.01 -0.92 -4.23 120.40 116.61 2qtc s VAL 815 Ca 0.07 1.49 0.00 0.00 0.00 0.00 0.00 61.98 63.54 2qtc s VAL 815 Cb 0.15 -3.96 0.00 0.00 0.00 0.00 0.00 36.38 32.57 2qtc s VAL 815 CO 0.75 -0.12 0.90 -0.81 0.00 0.00 0.00 175.10 175.81 2qtc n PRO 816 N 6.51 0.92 -4.60 2.72 -0.04 -1.26 -4.80 135.00 134.45 2qtc n PRO 816 Ca 0.14 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.31 2qtc n PRO 816 Cb 0.45 -1.06 -0.14 0.00 -0.04 0.00 0.00 33.50 32.71 2qtc n PRO 816 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2qtc s ALA 817 N 0.03 2.27 0.19 0.55 0.00 -1.26 -4.04 121.76 119.50 2qtc s ALA 817 Ca 0.00 -1.36 0.25 0.00 0.00 0.00 0.00 51.96 50.84 2qtc s ALA 817 Cb 0.00 -0.41 1.02 0.00 0.00 0.00 0.00 23.12 23.73 2qtc s ALA 817 CO 0.00 0.52 1.87 -0.44 0.00 0.00 0.00 175.76 177.71 2qtc h ASP 818 N 4.29 0.00 -3.26 0.00 5.19 -1.87 -3.41 116.42 117.36 2qtc h ASP 818 Ca -0.49 0.00 -0.66 0.00 -0.62 0.00 0.00 57.03 55.26 2qtc h ASP 818 Cb 1.16 0.00 -0.31 0.00 0.18 0.00 0.00 39.33 40.36 2qtc h ASP 818 CO 0.41 0.21 -0.80 -1.81 -3.12 0.00 0.00 179.24 174.13 2qtc s ASP 819 N -6.18 3.69 -0.29 6.45 1.11 -1.26 -5.07 116.67 115.13 2qtc s ASP 819 Ca -0.00 -0.48 -0.03 0.00 0.18 0.00 0.00 52.55 52.21 2qtc s ASP 819 Cb 0.11 -1.58 0.11 0.00 1.07 0.00 0.00 42.92 42.62 2qtc s ASP 819 CO 0.63 0.05 0.16 -0.47 1.18 0.00 0.00 175.17 176.71 2qtc s TYR 820 N 1.03 0.17 -0.09 4.23 5.04 -1.25 -1.20 117.35 125.28 2qtc s TYR 820 Ca -0.01 -0.74 -0.11 0.00 -2.44 0.00 0.00 57.07 53.78 2qtc s TYR 820 Cb -0.15 -0.81 -0.05 0.00 0.35 0.00 0.00 41.96 41.30 2qtc s TYR 820 CO -0.03 -0.84 0.25 1.03 -1.34 0.00 0.00 175.55 174.62 2qtc s ARG 821 N 2.15 3.76 -0.12 4.97 0.52 0.16 -4.99 118.95 125.40 2qtc s ARG 821 Ca 0.09 0.08 0.01 0.00 -0.52 0.00 0.00 55.73 55.39 2qtc s ARG 821 Cb -0.16 -3.25 0.02 0.00 0.52 0.00 0.00 34.95 32.08 2qtc s ARG 821 CO -0.36 0.64 -0.14 0.08 0.02 0.00 0.00 175.30 175.54 2qtc s VAL 822 N -0.75 1.48 0.07 3.52 1.01 -1.26 -0.55 120.40 123.93 2qtc s VAL 822 Ca 0.18 -0.61 -0.01 0.00 0.00 0.00 0.00 61.98 61.53 2qtc s VAL 822 Cb -0.14 -1.37 -0.04 0.00 0.00 0.00 0.00 36.38 34.83 2qtc s VAL 822 CO 0.07 0.44 0.25 -0.76 0.00 0.00 0.00 175.10 175.09 2qtc s LEU 823 N 1.18 4.34 0.18 3.92 1.43 -0.05 -4.93 118.68 124.75 2qtc s LEU 823 Ca -0.03 0.35 -0.23 0.00 -1.03 0.00 0.00 54.13 53.19 2qtc s LEU 823 Cb -0.14 -3.02 0.07 0.00 0.03 0.00 0.00 46.19 43.13 2qtc s LEU 823 CO -0.05 0.15 1.00 -0.83 0.23 0.00 0.00 176.35 176.86 2qtc s GLY 824 N -2.46 -0.01 -0.57 -3.19 0.00 -1.26 -3.49 107.32 96.34 2qtc s GLY 824 Ca 0.36 -0.16 0.01 0.00 0.00 0.00 0.00 44.72 44.92 2qtc s GLY 824 CO 0.27 1.30 1.96 -1.30 0.00 0.00 0.00 173.10 175.33 2qtc n THR 825 N -0.60 3.42 -1.62 0.90 -2.24 -0.14 -4.68 114.28 109.32 2qtc n THR 825 Ca -0.05 -2.60 -0.42 0.00 -2.27 0.00 0.00 64.05 58.71 2qtc n THR 825 Cb 0.60 -0.89 0.01 0.00 -2.10 0.00 0.00 70.33 67.95 2qtc n THR 825 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2qtc n ASP 826 N -1.00 1.41 0.00 3.42 9.92 -1.26 -4.59 116.55 124.45 2qtc n ASP 826 Ca 0.61 1.07 0.00 0.00 -0.53 0.00 0.00 54.79 55.93 2qtc n ASP 826 Cb 1.04 -1.36 0.00 0.00 -0.64 0.00 0.00 41.12 40.16 2qtc n ASP 826 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2qtc n GLY 827 N 1.15 2.95 3.78 0.44 0.00 -1.26 -3.34 105.19 108.90 2qtc n GLY 827 Ca 0.09 -1.98 -0.37 0.00 0.00 0.00 0.00 46.02 43.76 2qtc n GLY 827 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2qtc s PHE 828 N -2.88 3.33 1.05 1.61 0.08 -1.26 -4.95 117.98 114.95 2qtc s PHE 828 Ca 0.00 1.66 -0.15 0.00 0.12 0.00 0.00 56.93 58.56 2qtc s PHE 828 Cb 0.00 -3.12 0.21 0.00 -0.57 0.00 0.00 43.02 39.54 2qtc s PHE 828 CO 0.00 -0.56 1.12 0.20 -0.10 0.00 0.00 175.22 175.88 2qtc s GLY 829 N -1.51 1.58 0.07 4.36 0.00 -1.26 -4.97 107.32 105.58 2qtc s GLY 829 Ca 0.56 -0.64 -0.27 0.00 0.00 0.00 0.00 44.72 44.38 2qtc s GLY 829 CO 0.28 0.06 0.85 1.09 0.00 0.00 0.00 173.10 175.38 2qtc s ARG 830 N -5.22 1.02 -0.05 2.90 1.70 -1.26 -3.32 118.95 114.71 2qtc s ARG 830 Ca 0.67 -0.43 -0.24 0.00 -0.47 0.00 0.00 55.73 55.26 2qtc s ARG 830 Cb -0.14 0.43 -0.04 0.00 -0.57 0.00 0.00 34.95 34.63 2qtc s ARG 830 CO 0.56 -0.45 0.72 -1.12 -1.08 0.00 0.00 175.30 173.93 2qtc s SER 831 N -2.64 7.03 -0.00 -2.89 0.01 -1.26 -4.23 113.70 109.72 2qtc s SER 831 Ca 0.06 1.24 -0.07 0.00 1.31 0.00 0.00 55.95 58.49 2qtc s SER 831 Cb -0.01 -2.43 0.02 0.00 0.21 0.00 0.00 66.02 63.81 2qtc s SER 831 CO -0.07 -0.11 0.32 -0.67 0.41 0.00 0.00 173.24 173.12 2qtc n ASP 832 N 3.71 -0.32 -4.87 2.44 -0.08 -0.78 -4.99 116.55 111.67 2qtc n ASP 832 Ca -0.01 -1.08 -0.31 0.00 -1.51 0.00 0.00 54.79 51.89 2qtc n ASP 832 Cb 0.51 0.49 0.02 0.00 2.34 0.00 0.00 41.12 44.49 2qtc n ASP 832 CO 0.00 0.00 0.00 -0.94 0.12 0.00 0.00 177.20 176.38 2qtc s SER 833 N -1.71 5.92 0.17 1.67 1.04 -1.26 -3.76 113.70 115.77 2qtc s SER 833 Ca 0.07 1.36 -0.14 0.00 0.48 0.00 0.00 55.95 57.72 2qtc s SER 833 Cb -0.00 -2.32 0.09 0.00 0.10 0.00 0.00 66.02 63.88 2qtc s SER 833 CO -0.00 -1.06 1.81 0.03 0.98 0.00 0.00 173.24 175.00 2qtc h ARG 834 N -0.46 0.58 -0.14 4.02 3.08 -1.92 -1.03 114.38 118.51 2qtc h ARG 834 Ca -0.44 -0.03 0.04 0.00 0.07 0.00 0.00 59.98 59.61 2qtc h ARG 834 Cb 1.21 -0.13 -0.04 0.00 0.08 0.00 0.00 29.97 31.09 2qtc h ARG 834 CO 0.62 0.38 -0.12 1.49 -1.07 0.00 0.00 179.97 181.27 2qtc h GLU 835 N 0.59 -0.13 -0.62 0.04 4.81 -1.92 0.45 114.58 117.80 2qtc h GLU 835 Ca 0.20 0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.41 2qtc h GLU 835 Cb 0.01 0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.39 2qtc h GLU 835 CO -0.09 -0.09 0.27 -0.91 -0.73 0.00 0.00 179.01 177.47 2qtc h ASN 836 N -0.13 0.81 0.14 1.04 2.35 -1.86 -2.13 115.58 115.79 2qtc h ASN 836 Ca 0.09 -0.10 -0.17 0.00 -0.55 0.00 0.00 56.30 55.58 2qtc h ASN 836 Cb 0.27 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.42 2qtc h ASN 836 CO -0.22 0.71 -0.62 -0.07 -1.65 0.00 0.00 177.43 175.57 2qtc h LEU 837 N 0.89 0.54 -1.15 1.61 3.38 -0.69 0.74 115.31 120.62 2qtc h LEU 837 Ca 0.21 -0.31 -0.05 0.00 0.09 0.00 0.00 57.88 57.82 2qtc h LEU 837 Cb 0.13 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 2qtc h LEU 837 CO -0.02 1.03 -0.24 0.03 0.09 0.00 0.00 178.44 179.33 2qtc h ARG 838 N 0.35 0.00 0.07 1.13 3.08 -0.76 0.39 114.38 118.64 2qtc h ARG 838 Ca -0.01 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 59.89 2qtc h ARG 838 Cb 1.17 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.22 2qtc h ARG 838 CO 0.11 0.24 -0.73 1.25 -1.07 0.00 0.00 179.97 179.76 2qtc h HIS 839 N 0.00 0.28 -0.67 3.04 2.76 -1.18 -2.14 115.15 117.24 2qtc h HIS 839 Ca -0.00 -0.20 0.11 0.00 -2.20 0.00 0.00 60.37 58.08 2qtc h HIS 839 Cb 0.73 -0.01 -0.08 0.00 1.55 0.00 0.00 27.41 29.60 2qtc h HIS 839 CO 0.00 1.28 0.26 1.25 -1.30 0.00 0.00 177.93 179.42 2qtc h HIS 840 N -0.64 0.44 -0.06 5.26 -0.00 -0.67 -1.14 115.15 118.34 2qtc h HIS 840 Ca -0.16 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.25 2qtc h HIS 840 Cb 1.42 -0.10 0.00 0.00 -0.00 0.00 0.00 27.41 28.73 2qtc h HIS 840 CO 0.20 0.09 0.00 1.19 -0.00 0.00 0.00 177.93 179.41 2qtc n PHE 841 N -5.00 0.07 -3.75 5.26 3.72 0.11 -4.70 117.46 113.18 2qtc n PHE 841 Ca 0.11 -0.04 -0.23 0.00 -0.05 0.00 0.00 57.45 57.24 2qtc n PHE 841 Cb 0.33 0.00 0.03 0.00 -0.94 0.00 0.00 39.48 38.89 2qtc n PHE 841 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 2qtc n GLU 842 N -0.34 -4.89 0.00 -1.08 1.02 -0.43 -4.51 120.64 110.41 2qtc n GLU 842 Ca 0.16 0.60 0.00 0.00 -0.02 0.00 0.00 57.16 57.90 2qtc n GLU 842 Cb 0.19 -5.18 0.00 0.00 -0.02 0.00 0.00 31.44 26.43 2qtc n GLU 842 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2qtc n VAL 843 N -4.34 0.00 -1.62 2.62 0.31 -0.84 -4.49 118.33 109.96 2qtc n VAL 843 Ca -0.25 -0.34 -0.27 0.00 -0.01 0.00 0.00 64.34 63.47 2qtc n VAL 843 Cb 0.66 1.21 0.20 0.00 -0.91 0.00 0.00 33.84 34.99 2qtc n VAL 843 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 2qtc n ASP 844 N -0.24 -0.48 -0.30 4.52 5.68 -0.96 -4.76 116.55 120.01 2qtc n ASP 844 Ca 0.00 -1.35 0.05 0.00 -0.50 0.00 0.00 54.79 52.99 2qtc n ASP 844 Cb 0.05 -0.93 0.26 0.00 -1.14 0.00 0.00 41.12 39.36 2qtc n ASP 844 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2qtc h ALA 845 N -2.05 1.55 -0.35 2.12 0.00 -1.93 -1.78 119.26 116.83 2qtc h ALA 845 Ca -0.39 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 54.55 2qtc h ALA 845 Cb 1.10 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.60 2qtc h ALA 845 CO 0.27 0.29 0.08 0.77 0.00 0.00 0.00 179.25 180.66 2qtc h SER 846 N 0.98 0.03 0.57 0.00 0.02 -1.91 -0.80 113.55 112.44 2qtc h SER 846 Ca 0.40 0.05 -0.09 0.00 -0.84 0.00 0.00 61.79 61.32 2qtc h SER 846 Cb 0.28 0.07 -0.01 0.00 0.14 0.00 0.00 62.40 62.87 2qtc h SER 846 CO -0.16 0.05 -0.43 1.88 -1.14 0.00 0.00 176.83 177.04 2qtc h TYR 847 N 0.20 0.00 -0.25 3.45 -1.99 -1.68 -1.44 116.97 115.26 2qtc h TYR 847 Ca 0.16 0.00 -0.19 0.00 2.00 0.00 0.00 58.73 60.71 2qtc h TYR 847 Cb 0.18 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.91 2qtc h TYR 847 CO -0.18 0.43 -0.59 0.28 -0.00 0.00 0.00 178.16 178.10 2qtc h VAL 848 N 0.00 1.28 -0.16 -2.88 2.07 -0.80 -0.99 116.25 114.78 2qtc h VAL 848 Ca -0.00 -1.79 -0.02 0.00 0.82 0.00 0.00 66.70 65.71 2qtc h VAL 848 Cb 0.83 1.72 -0.01 0.00 -1.52 0.00 0.00 31.29 32.31 2qtc h VAL 848 CO 0.06 0.58 0.04 0.58 0.02 0.00 0.00 177.57 178.84 2qtc h VAL 849 N 0.60 1.21 -0.54 2.57 2.07 -0.88 -0.92 116.25 120.37 2qtc h VAL 849 Ca 0.00 -0.65 -0.03 0.00 0.82 0.00 0.00 66.70 66.84 2qtc h VAL 849 Cb 1.19 1.33 -0.03 0.00 -1.52 0.00 0.00 31.29 32.27 2qtc h VAL 849 CO 0.13 0.20 0.21 0.58 0.02 0.00 0.00 177.57 178.70 2qtc h VAL 850 N 0.06 1.20 -0.44 2.57 2.07 -1.25 0.83 116.25 121.29 2qtc h VAL 850 Ca 0.05 -0.62 -0.10 0.00 0.82 0.00 0.00 66.70 66.85 2qtc h VAL 850 Cb 0.27 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 30.59 2qtc h VAL 850 CO 0.00 0.24 -0.11 0.00 0.02 0.00 0.00 177.57 177.73 2qtc h ALA 851 N 1.47 0.60 -0.11 1.67 0.00 -0.97 -1.48 119.26 120.44 2qtc h ALA 851 Ca 0.18 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 2qtc h ALA 851 Cb 0.16 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 2qtc h ALA 851 CO -0.02 0.49 -0.02 0.00 0.00 0.00 0.00 179.25 179.70 2qtc h ALA 852 N 0.86 0.15 -0.89 0.00 0.00 -0.70 -2.78 119.26 115.90 2qtc h ALA 852 Ca 0.11 -0.22 0.01 0.00 0.00 0.00 0.00 54.91 54.82 2qtc h ALA 852 Cb 0.65 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.35 2qtc h ALA 852 CO 0.04 -0.12 0.59 -0.07 0.00 0.00 0.00 179.25 179.69 2qtc h LEU 853 N -0.10 1.01 -1.28 0.00 3.38 -0.85 -2.25 115.31 115.21 2qtc h LEU 853 Ca 0.03 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 57.98 2qtc h LEU 853 Cb 0.43 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.90 2qtc h LEU 853 CO 0.01 0.72 0.48 1.23 0.09 0.00 0.00 178.44 180.97 2qtc h GLY 854 N 1.19 1.02 1.25 0.83 0.00 -1.21 0.37 103.07 106.52 2qtc h GLY 854 Ca 0.33 -0.38 -0.11 0.00 0.00 0.00 0.00 47.33 47.17 2qtc h GLY 854 CO -0.08 0.38 -0.13 0.83 0.00 0.00 0.00 176.54 177.54 2qtc h GLU 855 N 0.99 0.88 -0.45 4.80 5.08 -1.13 -1.57 114.58 123.17 2qtc h GLU 855 Ca 0.27 -0.32 -0.12 0.00 -1.00 0.00 0.00 59.36 58.19 2qtc h GLU 855 Cb -0.11 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.06 2qtc h GLU 855 CO -0.06 0.95 -0.20 -0.07 -1.00 0.00 0.00 179.01 178.64 2qtc h LEU 856 N 0.78 0.91 -1.53 1.33 3.38 -0.84 -2.63 115.31 116.70 2qtc h LEU 856 Ca 0.12 -0.33 -0.05 0.00 0.09 0.00 0.00 57.88 57.72 2qtc h LEU 856 Cb 0.65 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 2qtc h LEU 856 CO 0.05 1.08 -0.24 0.00 0.09 0.00 0.00 178.44 179.42 2qtc h ALA 857 N 0.99 1.57 0.00 1.53 0.00 -0.73 -1.17 119.26 121.45 2qtc h ALA 857 Ca 0.11 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 2qtc h ALA 857 Cb 0.74 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.49 2qtc h ALA 857 CO 0.06 0.30 -0.01 0.87 0.00 0.00 0.00 179.25 180.47 2qtc h LYS 858 N 0.00 0.00 -0.32 0.00 1.57 -0.92 -2.72 116.57 114.18 2qtc h LYS 858 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2qtc h LYS 858 Cb 0.43 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.74 2qtc h LYS 858 CO 0.03 0.01 0.00 0.54 -0.57 0.00 0.00 179.45 179.46 2qtc n ARG 859 N -3.10 2.09 -2.56 3.15 1.74 -0.53 -4.92 116.66 112.52 2qtc n ARG 859 Ca 0.03 -1.66 -0.16 0.00 -0.77 0.00 0.00 57.85 55.29 2qtc n ARG 859 Cb 0.44 -1.43 0.01 0.00 -1.02 0.00 0.00 32.46 30.46 2qtc n ARG 859 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2qtc n GLY 860 N 1.29 -0.22 0.01 -0.13 0.00 -1.02 -4.91 105.19 100.21 2qtc n GLY 860 Ca 0.17 -0.18 0.11 0.00 0.00 0.00 0.00 46.02 46.12 2qtc n GLY 860 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2qtc n GLU 861 N -2.80 0.44 -3.82 1.61 1.02 -0.66 -4.95 120.64 111.48 2qtc n GLU 861 Ca -0.13 -0.13 -0.10 0.00 -0.02 0.00 0.00 57.16 56.78 2qtc n GLU 861 Cb 0.61 -1.51 -0.08 0.00 -0.02 0.00 0.00 31.44 30.44 2qtc n GLU 861 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 2qtc s ILE 862 N -3.35 0.11 0.21 -3.67 -4.36 -1.25 -4.97 121.20 103.92 2qtc s ILE 862 Ca -0.03 -0.94 -0.30 0.00 -0.26 0.00 0.00 60.65 59.12 2qtc s ILE 862 Cb 0.15 -1.09 -0.08 0.00 1.25 0.00 0.00 42.46 42.69 2qtc s ILE 862 CO 0.90 -0.52 1.16 -0.62 0.24 0.00 0.00 174.94 176.10 2qtc s ASP 863 N -2.40 7.15 0.63 4.36 -1.08 -1.26 -4.36 116.67 119.70 2qtc s ASP 863 Ca -0.01 2.23 0.31 0.00 -0.52 0.00 0.00 52.55 54.56 2qtc s ASP 863 Cb 0.01 -2.61 1.68 0.00 -1.46 0.00 0.00 42.92 40.54 2qtc s ASP 863 CO -0.07 -0.30 2.01 0.11 0.52 0.00 0.00 175.17 177.44 2qtc h LYS 864 N 4.83 0.00 0.00 4.34 1.57 -1.97 0.28 116.57 125.62 2qtc h LYS 864 Ca -0.45 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.27 2qtc h LYS 864 Cb 1.21 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.51 2qtc h LYS 864 CO 0.72 0.00 -0.28 0.87 -0.57 0.00 0.00 179.45 180.19 2qtc h LYS 865 N 0.00 0.00 -0.76 3.15 1.57 -1.99 -1.96 116.57 116.58 2qtc h LYS 865 Ca 0.07 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.80 2qtc h LYS 865 Cb 0.67 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.95 2qtc h LYS 865 CO -0.00 0.28 0.28 0.28 -0.57 0.00 0.00 179.45 179.72 2qtc h VAL 866 N 0.00 1.26 -0.36 0.50 2.07 -0.81 0.22 116.25 119.12 2qtc h VAL 866 Ca -0.00 -0.84 -0.12 0.00 0.82 0.00 0.00 66.70 66.55 2qtc h VAL 866 Cb 0.52 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 30.66 2qtc h VAL 866 CO 0.04 0.34 -0.25 0.58 0.02 0.00 0.00 177.57 178.30 2qtc h VAL 867 N 1.12 1.29 -0.67 2.57 2.07 -1.52 -1.21 116.25 119.90 2qtc h VAL 867 Ca 0.25 -1.40 -0.05 0.00 0.82 0.00 0.00 66.70 66.33 2qtc h VAL 867 Cb 0.24 1.40 -0.03 0.00 -1.52 0.00 0.00 31.29 31.38 2qtc h VAL 867 CO -0.02 0.46 0.23 0.00 0.02 0.00 0.00 177.57 178.26 2qtc h ALA 868 N 0.77 1.14 0.00 1.67 0.00 -0.87 -2.19 119.26 119.79 2qtc h ALA 868 Ca 0.07 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.68 2qtc h ALA 868 Cb 0.81 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2qtc h ALA 868 CO 0.07 0.60 -0.49 -0.44 0.00 0.00 0.00 179.25 178.99 2qtc h ASP 869 N 0.98 0.00 0.04 0.00 3.32 -0.34 -2.79 116.42 117.62 2qtc h ASP 869 Ca 0.22 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.27 2qtc h ASP 869 Cb 0.25 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.80 2qtc h ASP 869 CO -0.01 0.49 -0.02 0.00 -1.72 0.00 0.00 179.24 177.98 2qtc h ALA 870 N 1.51 -0.05 -0.74 3.45 0.00 -0.79 -0.74 119.26 121.90 2qtc h ALA 870 Ca -0.00 -0.19 0.17 0.00 0.00 0.00 0.00 54.91 54.88 2qtc h ALA 870 Cb 0.93 0.02 -0.13 0.00 0.00 0.00 0.00 17.79 18.61 2qtc h ALA 870 CO 0.06 -0.34 0.04 0.82 0.00 0.00 0.00 179.25 179.84 2qtc h ILE 871 N -0.43 0.38 -0.22 0.00 2.04 -1.29 0.17 117.51 118.15 2qtc h ILE 871 Ca -0.01 -0.04 -0.18 0.00 1.00 0.00 0.00 64.86 65.63 2qtc h ILE 871 Cb 0.40 0.23 0.00 0.00 -0.74 0.00 0.00 36.82 36.72 2qtc h ILE 871 CO 0.01 0.02 -0.57 0.00 0.00 0.00 0.00 178.15 177.61 2qtc h ALA 872 N 1.68 0.36 -0.80 1.87 0.00 -1.38 -1.14 119.26 119.86 2qtc h ALA 872 Ca 0.41 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2qtc h ALA 872 Cb 0.73 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.43 2qtc h ALA 872 CO -0.63 0.59 0.52 -0.22 0.00 0.00 0.00 179.25 179.51 2qtc h LYS 873 N 0.51 1.07 -0.15 0.00 3.64 -0.20 -2.45 116.57 118.99 2qtc h LYS 873 Ca -0.01 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 2qtc h LYS 873 Cb 1.19 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 32.77 2qtc h LYS 873 CO 0.12 0.72 0.00 1.19 -2.27 0.00 0.00 179.45 179.21 2qtc n PHE 874 N -4.40 0.19 -3.38 1.91 3.72 -0.04 -4.91 117.46 110.55 2qtc n PHE 874 Ca 0.09 -0.09 -0.23 0.00 -0.05 0.00 0.00 57.45 57.17 2qtc n PHE 874 Cb 0.04 0.00 0.06 0.00 -0.94 0.00 0.00 39.48 38.64 2qtc n PHE 874 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 2qtc n ASN 875 N 0.01 -6.16 -4.72 4.37 3.02 -0.92 -4.97 115.26 105.88 2qtc n ASN 875 Ca 0.13 -0.44 -0.39 0.00 -0.03 0.00 0.00 54.58 53.85 2qtc n ASN 875 Cb 0.23 -4.85 -0.05 0.00 -0.61 0.00 0.00 39.78 34.50 2qtc n ASN 875 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2qtc s ILE 876 N -3.26 5.10 -0.66 2.41 1.01 -0.44 -5.02 121.20 120.33 2qtc s ILE 876 Ca 0.48 1.22 -0.18 0.00 0.00 0.00 0.00 60.65 62.17 2qtc s ILE 876 Cb -0.21 -3.94 0.12 0.00 0.01 0.00 0.00 42.46 38.44 2qtc s ILE 876 CO 0.60 0.30 0.77 -0.62 0.00 0.00 0.00 174.94 175.98 2qtc s ASP 877 N 0.65 6.30 0.58 3.58 -1.08 -1.26 -4.70 116.67 120.74 2qtc s ASP 877 Ca 0.32 -1.64 0.39 0.00 -0.52 0.00 0.00 52.55 51.10 2qtc s ASP 877 Cb -0.17 -2.31 2.05 0.00 -1.46 0.00 0.00 42.92 41.04 2qtc s ASP 877 CO 0.15 -1.06 2.18 0.00 0.52 0.00 0.00 175.17 176.96 2qtc h ALA 878 N 9.00 1.00 -0.29 3.66 0.00 -1.95 -2.89 119.26 127.80 2qtc h ALA 878 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2qtc h ALA 878 Cb 1.07 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.86 2qtc h ALA 878 CO 1.07 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 180.07 2qtc n ASP 879 N -2.89 2.91 -4.76 0.00 8.00 -1.26 -5.00 116.55 113.56 2qtc n ASP 879 Ca -0.02 -2.14 -0.33 0.00 0.71 0.00 0.00 54.79 53.00 2qtc n ASP 879 Cb 0.09 -0.24 0.06 0.00 -0.02 0.00 0.00 41.12 41.01 2qtc n ASP 879 CO 0.00 0.00 0.00 -1.59 -0.39 0.00 0.00 177.20 175.22 2qtc s LYS 880 N -1.25 2.58 0.59 -1.24 -2.85 -1.09 -4.94 119.74 111.53 2qtc s LYS 880 Ca 0.23 1.48 -0.20 0.00 -1.00 0.00 0.00 55.97 56.48 2qtc s LYS 880 Cb 0.13 -1.91 -0.03 0.00 -2.06 0.00 0.00 37.83 33.96 2qtc s LYS 880 CO 0.13 -1.44 1.30 0.54 0.10 0.00 0.00 175.35 175.97 2qtc s VAL 881 N -2.27 2.22 0.14 1.79 0.11 -1.26 -4.88 120.40 116.24 2qtc s VAL 881 Ca 0.69 0.15 -0.34 0.00 -2.93 0.00 0.00 61.98 59.55 2qtc s VAL 881 Cb -0.23 -3.07 -0.13 0.00 -1.53 0.00 0.00 36.38 31.42 2qtc s VAL 881 CO 0.43 -0.02 1.63 -3.20 -3.33 0.00 0.00 175.10 170.62 2qtc n ASN 882 N -1.41 3.24 -0.09 3.54 2.85 -1.26 -4.80 115.26 117.33 2qtc n ASN 882 Ca 0.13 1.06 0.26 0.00 -0.11 0.00 0.00 54.58 55.92 2qtc n ASN 882 Cb 0.47 -1.44 0.72 0.00 1.24 0.00 0.00 39.78 40.77 2qtc n ASN 882 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 2qtc h PRO 883 N 6.47 0.00 -0.35 1.20 0.11 -1.84 0.11 132.00 137.70 2qtc h PRO 883 Ca -0.45 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.65 2qtc h PRO 883 Cb 1.25 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.34 2qtc h PRO 883 CO 0.90 0.00 0.17 -0.09 -0.21 0.00 0.00 178.00 178.77 2qtc h ARG 884 N 0.00 0.48 -0.01 1.05 2.43 -1.88 -2.40 114.38 114.05 2qtc h ARG 884 Ca 0.35 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.47 2qtc h ARG 884 Cb 1.50 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.95 2qtc h ARG 884 CO -0.00 0.38 -0.46 1.28 -1.51 0.00 0.00 179.97 179.65 2qtc n LEU 885 N -4.42 1.31 0.00 3.80 4.77 0.34 -4.50 117.00 118.29 2qtc n LEU 885 Ca 0.02 -0.43 0.07 0.00 -0.03 0.00 0.00 56.01 55.64 2qtc n LEU 885 Cb 0.12 -0.08 0.41 0.00 -2.33 0.00 0.00 43.42 41.53 2qtc n LEU 885 CO 0.36 0.26 0.62 0.00 -1.33 0.00 0.00 177.39 177.29