#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r1i n ILE 55 N 0.00 0.00 -2.38 -0.61 -0.00 -1.25 -3.58 119.36 111.55 1r1i n ILE 55 Ca 0.00 0.00 -0.39 0.00 -0.00 0.00 0.00 62.75 62.36 1r1i n ILE 55 Cb 0.00 -0.10 -0.03 0.00 -0.00 0.00 0.00 39.64 39.50 1r1i n ILE 55 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1r1i n LYS 57 N 0.69 2.01 -2.54 0.00 5.02 -1.26 -4.17 118.16 117.91 1r1i n LYS 57 Ca 0.01 -3.44 -0.40 0.00 -2.02 0.00 0.00 58.31 52.46 1r1i n LYS 57 Cb 0.45 -1.78 -0.05 0.00 -0.02 0.00 0.00 35.03 33.63 1r1i n LYS 57 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1r1i s SER 58 N -3.15 7.34 0.23 4.39 0.15 -1.26 -4.72 113.70 116.68 1r1i s SER 58 Ca 0.42 2.16 -0.06 0.00 0.70 0.00 0.00 55.95 59.16 1r1i s SER 58 Cb 0.39 -2.62 0.39 0.00 -1.71 0.00 0.00 66.02 62.47 1r1i s SER 58 CO -0.04 -0.11 1.72 -1.28 1.20 0.00 0.00 173.24 174.73 1r1i h SER 59 N 4.26 0.17 0.96 5.45 0.87 -1.96 8.82 113.55 132.12 1r1i h SER 59 Ca -0.46 0.11 0.00 0.00 -1.23 0.00 0.00 61.79 60.21 1r1i h SER 59 Cb 1.21 0.11 0.00 0.00 -0.44 0.00 0.00 62.40 63.28 1r1i h SER 59 CO 0.69 0.07 0.00 0.47 -0.53 0.00 0.00 176.83 177.53 1r1i n ASP 60 N -5.05 0.33 -0.07 6.23 8.00 -1.26 0.11 116.55 124.84 1r1i n ASP 60 Ca 0.12 0.55 -0.11 0.00 0.71 0.00 0.00 54.79 56.06 1r1i n ASP 60 Cb 0.38 -0.63 -0.09 0.00 -0.02 0.00 0.00 41.12 40.76 1r1i n ASP 60 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1r1i h ILE 62 N -1.00 0.81 -0.31 0.00 -0.00 1.94 -0.85 117.51 118.10 1r1i h ILE 62 Ca -0.05 -0.05 -0.12 0.00 -0.00 0.00 0.00 64.86 64.64 1r1i h ILE 62 Cb 0.75 1.03 -0.01 0.00 -0.00 0.00 0.00 36.82 38.60 1r1i h ILE 62 CO -0.03 0.01 -0.26 0.50 -0.00 0.00 0.00 178.15 178.37 1r1i h LYS 63 N 0.00 0.73 0.01 0.16 1.63 0.66 -3.15 116.57 116.60 1r1i h LYS 63 Ca -0.00 -0.37 -0.00 0.00 -0.85 0.00 0.00 60.65 59.43 1r1i h LYS 63 Cb 0.03 0.01 0.00 0.00 -0.60 0.00 0.00 32.23 31.66 1r1i h LYS 63 CO 0.00 0.98 -0.00 0.77 -3.45 0.00 0.00 179.45 177.75 1r1i h SER 64 N 0.48 -0.01 -0.69 4.20 0.02 -1.29 -2.82 113.55 113.45 1r1i h SER 64 Ca 0.05 -0.66 0.07 0.00 -0.84 0.00 0.00 61.79 60.41 1r1i h SER 64 Cb 0.83 0.00 -0.09 0.00 0.14 0.00 0.00 62.40 63.28 1r1i h SER 64 CO 0.07 0.66 -0.38 0.00 -1.14 0.00 0.00 176.83 176.04 1r1i n ALA 65 N -2.45 -0.38 0.24 3.77 0.00 -1.05 -0.68 120.51 119.97 1r1i n ALA 65 Ca -0.09 0.60 0.11 0.00 0.00 0.00 0.00 53.44 54.07 1r1i n ALA 65 Cb 0.33 -0.13 0.53 0.00 0.00 0.00 0.00 19.45 20.17 1r1i n ALA 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1r1i h ALA 66 N 0.45 1.05 -0.12 0.00 0.00 -1.47 -0.97 119.26 118.20 1r1i h ALA 66 Ca 0.13 -0.16 -0.22 0.00 0.00 0.00 0.00 54.91 54.66 1r1i h ALA 66 Cb 0.30 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.08 1r1i h ALA 66 CO -0.65 0.22 -0.78 -0.09 0.00 0.00 0.00 179.25 177.95 1r1i h ARG 67 N 0.00 0.74 0.29 0.00 1.12 -0.66 -3.23 114.38 112.65 1r1i h ARG 67 Ca -0.00 -0.64 -0.01 0.00 -1.11 0.00 0.00 59.98 58.22 1r1i h ARG 67 Cb 0.66 0.14 0.00 0.00 -0.01 0.00 0.00 29.97 30.77 1r1i h ARG 67 CO 0.02 1.24 -0.14 -0.07 -3.11 0.00 0.00 179.97 177.92 1r1i h LEU 68 N 0.46 -0.33 -1.60 3.80 3.38 0.28 -2.82 115.31 118.48 1r1i h LEU 68 Ca -0.06 -0.18 -0.03 0.00 0.09 0.00 0.00 57.88 57.70 1r1i h LEU 68 Cb 1.42 0.08 -0.01 0.00 0.09 0.00 0.00 40.66 42.24 1r1i h LEU 68 CO 0.16 0.03 -0.03 0.40 0.09 0.00 0.00 178.44 179.09 1r1i h ILE 69 N -0.72 1.12 0.00 1.22 5.03 -1.51 -1.52 117.51 121.12 1r1i h ILE 69 Ca -0.04 -0.48 -0.17 0.00 -0.12 0.00 0.00 64.86 64.05 1r1i h ILE 69 Cb 0.49 1.04 -0.02 0.00 -3.03 0.00 0.00 36.82 35.30 1r1i h ILE 69 CO 0.06 0.15 -0.82 -0.61 -0.68 0.00 0.00 178.15 176.26 1r1i h GLN 70 N 0.21 0.00 0.10 2.37 -0.00 -1.55 -2.15 115.11 114.10 1r1i h GLN 70 Ca 0.05 0.00 -0.27 0.00 -0.00 0.00 0.00 58.65 58.43 1r1i h GLN 70 Cb 0.20 0.00 -0.00 0.00 0.00 0.00 0.00 27.48 27.68 1r1i h GLN 70 CO 0.01 0.82 -1.25 -0.91 0.00 0.00 0.00 178.83 177.50 1r1i h ASN 71 N 0.00 0.34 -3.99 -0.69 2.35 -1.22 -3.38 115.58 108.99 1r1i h ASN 71 Ca -0.01 -0.38 -0.45 0.00 -0.55 0.00 0.00 56.30 54.91 1r1i h ASN 71 Cb 1.49 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 39.73 1r1i h ASN 71 CO 0.11 1.30 0.32 0.00 -1.65 0.00 0.00 177.43 177.51 1r1i s MET 72 N -2.66 4.29 -0.23 0.81 0.23 -0.61 -2.06 119.30 119.08 1r1i s MET 72 Ca -0.04 1.12 -0.10 0.00 -1.03 0.00 0.00 55.69 55.65 1r1i s MET 72 Cb 0.07 -2.34 -0.05 0.00 -1.53 0.00 0.00 34.83 30.99 1r1i s MET 72 CO 0.87 0.05 0.13 0.34 -2.03 0.00 0.00 175.02 174.38 1r1i s ASP 73 N -2.06 5.93 0.51 -1.18 2.15 -0.48 -4.26 116.67 117.27 1r1i s ASP 73 Ca 0.59 0.08 0.21 0.00 0.43 0.00 0.00 52.55 53.86 1r1i s ASP 73 Cb -0.11 -2.06 1.30 0.00 -0.30 0.00 0.00 42.92 41.75 1r1i s ASP 73 CO 0.16 0.08 2.03 0.00 -0.17 0.00 0.00 175.17 177.27 1r1i h ALA 74 N 7.40 2.30 -0.45 3.66 0.00 -1.89 -3.29 119.26 126.99 1r1i h ALA 74 Ca -0.38 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.48 1r1i h ALA 74 Cb 1.17 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 1r1i h ALA 74 CO 0.66 -0.41 0.03 0.25 0.00 0.00 0.00 179.25 179.78 1r1i n THR 75 N -4.43 2.58 -4.30 0.00 -2.24 -1.26 -4.88 114.28 99.74 1r1i n THR 75 Ca 0.07 -1.70 -0.26 0.00 -2.27 0.00 0.00 64.05 59.89 1r1i n THR 75 Cb 0.45 -0.28 -0.09 0.00 -2.10 0.00 0.00 70.33 68.30 1r1i n THR 75 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1r1i s THR 76 N -2.85 3.16 -0.43 4.28 2.01 -1.24 -5.09 115.64 115.49 1r1i s THR 76 Ca 0.49 -1.74 -0.27 0.00 0.31 0.00 0.00 61.69 60.48 1r1i s THR 76 Cb 0.39 -2.59 0.02 0.00 0.01 0.00 0.00 72.50 70.33 1r1i s THR 76 CO 0.12 -0.16 1.01 -0.70 -0.69 0.00 0.00 174.62 174.20 1r1i s GLU 77 N -2.97 3.72 0.33 4.92 2.56 -1.26 -4.86 118.70 121.14 1r1i s GLU 77 Ca 0.26 0.48 0.20 0.00 0.00 0.00 0.00 54.97 55.90 1r1i s GLU 77 Cb -0.08 -3.87 1.20 0.00 2.00 0.00 0.00 34.13 33.38 1r1i s GLU 77 CO 0.16 -1.18 1.38 -2.30 -0.56 0.00 0.00 175.26 172.76 1r1i n PRO 78 N 7.26 -0.05 0.00 4.30 -0.02 -1.26 -0.16 135.00 145.07 1r1i n PRO 78 Ca 0.09 1.19 0.14 0.00 -2.02 0.00 0.00 63.50 62.90 1r1i n PRO 78 Cb 0.48 -2.18 0.57 0.00 -0.02 0.00 0.00 33.50 32.36 1r1i n PRO 78 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1r1i n THR 80 N -0.13 1.12 -3.23 0.00 -1.04 0.77 -2.26 114.28 109.51 1r1i n THR 80 Ca 0.19 -0.43 -0.02 0.00 -2.04 0.00 0.00 64.05 61.75 1r1i n THR 80 Cb 0.32 -1.20 -0.02 0.00 -1.82 0.00 0.00 70.33 67.61 1r1i n THR 80 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1r1i s ASP 81 N -5.91 -0.97 0.35 8.00 -1.08 -1.06 -4.58 116.67 111.43 1r1i s ASP 81 Ca -0.26 -0.77 0.15 0.00 -0.52 0.00 0.00 52.55 51.15 1r1i s ASP 81 Cb 0.07 1.68 0.61 0.00 -1.46 0.00 0.00 42.92 43.81 1r1i s ASP 81 CO 0.45 -0.21 1.72 0.15 0.52 0.00 0.00 175.17 177.80 1r1i h PHE 82 N 7.21 0.00 -0.06 -5.34 3.57 -1.81 -0.70 116.94 119.81 1r1i h PHE 82 Ca 0.03 0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.57 1r1i h PHE 82 Cb 1.16 0.00 -0.06 0.00 2.79 0.00 0.00 35.95 39.84 1r1i h PHE 82 CO 0.20 0.45 -0.35 0.35 -2.23 0.00 0.00 178.31 176.73 1r1i h PHE 83 N 0.00 -0.97 -0.86 0.41 -0.00 -1.90 0.24 116.94 113.86 1r1i h PHE 83 Ca -0.00 0.04 -0.02 0.00 -0.00 0.00 0.00 57.97 57.98 1r1i h PHE 83 Cb 0.91 0.44 -0.04 0.00 -0.00 0.00 0.00 35.95 37.25 1r1i h PHE 83 CO 0.00 -0.43 0.47 -0.22 -0.00 0.00 0.00 178.31 178.13 1r1i h LYS 84 N -0.47 1.20 -0.14 1.11 3.64 -1.69 0.23 116.57 120.47 1r1i h LYS 84 Ca 0.07 -0.14 0.02 0.00 -1.27 0.00 0.00 60.65 59.33 1r1i h LYS 84 Cb 0.58 -0.23 -0.05 0.00 -0.41 0.00 0.00 32.23 32.12 1r1i h LYS 84 CO -0.32 0.89 -0.40 -0.92 -2.27 0.00 0.00 179.45 176.43 1r1i h TYR 85 N 1.20 -1.19 0.00 1.91 3.20 -0.82 0.38 116.97 121.65 1r1i h TYR 85 Ca 0.30 0.05 0.00 0.00 3.14 0.00 0.00 58.73 62.22 1r1i h TYR 85 Cb 0.04 0.54 0.00 0.00 1.54 0.00 0.00 36.73 38.84 1r1i h TYR 85 CO 0.01 -0.39 -0.01 0.00 -1.64 0.00 0.00 178.16 176.13 1r1i h ALA 86 N -0.57 0.99 0.00 1.82 0.00 0.13 -1.28 119.26 120.35 1r1i h ALA 86 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1r1i h ALA 86 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1r1i h ALA 86 CO -0.34 0.00 0.00 0.00 0.00 0.00 0.00 179.25 178.91 1r1i h GLY 88 N 0.00 1.07 0.17 0.00 0.00 -0.80 -0.54 103.07 102.97 1r1i h GLY 88 Ca 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 47.33 46.99 1r1i h GLY 88 CO 0.00 0.26 -0.44 0.61 0.00 0.00 0.00 176.54 176.96 1r1i n GLY 89 N -1.43 -0.70 0.15 4.60 0.00 -0.87 -2.63 105.19 104.31 1r1i n GLY 89 Ca 0.11 -0.46 -0.14 0.00 0.00 0.00 0.00 46.02 45.54 1r1i n GLY 89 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 1r1i h TRP 90 N 0.99 0.54 0.10 1.61 7.01 -0.83 -3.27 115.95 122.10 1r1i h TRP 90 Ca 0.00 -0.18 0.01 0.00 2.11 0.00 0.00 58.89 60.83 1r1i h TRP 90 Cb 0.55 -0.10 -0.02 0.00 -2.10 0.00 0.00 29.16 27.49 1r1i h TRP 90 CO 0.00 0.86 -0.16 -0.07 -2.79 0.00 0.00 178.44 176.29 1r1i h LEU 91 N 0.06 -0.43 -0.57 0.65 4.07 -1.29 -3.12 115.31 114.67 1r1i h LEU 91 Ca 0.01 0.05 0.12 0.00 0.08 0.00 0.00 57.88 58.14 1r1i h LEU 91 Cb 0.81 0.16 -0.10 0.00 1.08 0.00 0.00 40.66 42.61 1r1i h LEU 91 CO 0.05 -0.23 -0.02 0.50 -1.08 0.00 0.00 178.44 177.66 1r1i h LYS 92 N -0.31 0.09 0.00 1.13 3.11 -1.59 -2.71 116.57 116.29 1r1i h LYS 92 Ca 0.02 -0.01 0.00 0.00 -2.81 0.00 0.00 60.65 57.85 1r1i h LYS 92 Cb 0.32 -0.02 0.00 0.00 -1.00 0.00 0.00 32.23 31.53 1r1i h LYS 92 CO -0.08 0.06 -0.52 0.00 -2.81 0.00 0.00 179.45 176.10 1r1i h ARG 93 N 0.10 0.00 -6.29 1.90 3.08 -1.60 -3.46 114.38 108.10 1r1i h ARG 93 Ca 0.29 0.00 -0.62 0.00 0.07 0.00 0.00 59.98 59.72 1r1i h ARG 93 Cb 0.46 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 30.41 1r1i h ARG 93 CO -0.51 0.00 -0.63 -0.80 -1.07 0.00 0.00 179.97 176.96 1r1i s ASN 94 N -4.92 5.12 -0.01 7.04 0.01 -1.02 -5.12 114.94 116.05 1r1i s ASN 94 Ca 0.05 -0.21 -0.00 0.00 -0.71 0.00 0.00 52.86 51.99 1r1i s ASN 94 Cb 0.11 -1.23 0.00 0.00 0.41 0.00 0.00 41.25 40.53 1r1i s ASN 94 CO 0.71 0.13 0.01 -0.69 -1.51 0.00 0.00 177.10 175.75 1r1i s VAL 95 N -1.53 -0.00 0.10 1.60 1.01 -1.26 -4.94 120.40 115.38 1r1i s VAL 95 Ca 0.28 0.00 -0.35 0.00 0.00 0.00 0.00 61.98 61.91 1r1i s VAL 95 Cb -0.11 -0.03 -0.15 0.00 0.00 0.00 0.00 36.38 36.10 1r1i s VAL 95 CO 0.20 0.00 1.54 -0.38 0.00 0.00 0.00 175.10 176.47 1r1i n ILE 96 N 3.09 0.07 -1.21 2.22 5.41 -1.26 -4.94 119.36 122.75 1r1i n ILE 96 Ca -0.12 -0.01 -0.32 0.00 1.00 0.00 0.00 62.75 63.30 1r1i n ILE 96 Cb 0.60 -1.34 0.10 0.00 -0.71 0.00 0.00 39.64 38.29 1r1i n ILE 96 CO 0.00 0.00 0.00 -2.84 0.00 0.00 0.00 176.55 173.71 1r1i s PRO 97 N 1.21 1.99 0.00 0.38 0.02 -1.26 -4.94 135.00 132.40 1r1i s PRO 97 Ca 0.83 1.38 0.25 0.00 0.02 0.00 0.00 61.00 63.47 1r1i s PRO 97 Cb -0.78 -1.85 1.11 0.00 0.02 0.00 0.00 34.50 33.00 1r1i s PRO 97 CO 0.43 -1.87 1.80 0.39 -0.33 0.00 0.00 177.00 177.42 1r1i n GLU 98 N -3.45 0.11 0.00 5.54 -0.58 -1.26 -2.03 120.64 118.97 1r1i n GLU 98 Ca 0.11 0.07 0.07 0.00 -0.42 0.00 0.00 57.16 56.98 1r1i n GLU 98 Cb 0.52 -1.50 -0.05 0.00 -0.57 0.00 0.00 31.44 29.84 1r1i n GLU 98 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 1r1i n THR 99 N -1.44 0.00 -3.24 2.62 -2.24 -1.26 -1.89 114.28 106.83 1r1i n THR 99 Ca 0.08 -0.22 -0.33 0.00 -2.27 0.00 0.00 64.05 61.31 1r1i n THR 99 Cb 0.26 1.06 -0.06 0.00 -2.10 0.00 0.00 70.33 69.49 1r1i n THR 99 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1r1i s SER 100 N -2.16 6.75 -0.06 3.42 0.01 -0.86 -4.69 113.70 116.11 1r1i s SER 100 Ca 0.08 1.16 0.10 0.00 1.31 0.00 0.00 55.95 58.60 1r1i s SER 100 Cb 0.11 -2.32 -0.14 0.00 0.21 0.00 0.00 66.02 63.87 1r1i s SER 100 CO 0.51 -0.13 0.13 -1.54 0.41 0.00 0.00 173.24 172.62 1r1i n SER 101 N -0.15 2.50 -4.07 2.44 3.41 -1.26 -4.52 113.62 111.97 1r1i n SER 101 Ca 0.02 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.49 1r1i n SER 101 Cb 0.53 1.08 -0.11 0.00 -0.26 0.00 0.00 64.21 65.44 1r1i n SER 101 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1r1i s ARG 102 N -2.47 0.55 0.13 4.33 3.52 -1.26 -1.52 118.95 122.23 1r1i s ARG 102 Ca -0.05 -0.78 -0.13 0.00 -0.13 0.00 0.00 55.73 54.64 1r1i s ARG 102 Cb 0.05 -0.31 0.02 0.00 -1.56 0.00 0.00 34.95 33.14 1r1i s ARG 102 CO 0.43 0.05 0.34 -0.47 -0.81 0.00 0.00 175.30 174.85 1r1i s TYR 103 N -1.44 0.02 0.00 5.12 5.04 -1.11 -4.98 117.35 119.99 1r1i s TYR 103 Ca -0.09 -0.38 0.00 0.00 -2.44 0.00 0.00 57.07 54.16 1r1i s TYR 103 Cb -0.10 0.14 0.00 0.00 0.35 0.00 0.00 41.96 42.35 1r1i s TYR 103 CO 0.00 -0.69 0.00 0.41 -1.34 0.00 0.00 175.55 173.93 1r1i n GLY 104 N -0.20 3.34 0.07 8.97 0.00 -1.26 -1.91 105.19 114.20 1r1i n GLY 104 Ca -0.13 -1.77 -0.11 0.00 0.00 0.00 0.00 46.02 44.01 1r1i n GLY 104 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1r1i h ASN 105 N 0.00 0.09 -0.54 1.61 -1.24 -1.69 0.40 115.58 114.21 1r1i h ASN 105 Ca 0.00 -0.03 0.09 0.00 0.71 0.00 0.00 56.30 57.07 1r1i h ASN 105 Cb 0.00 -0.02 -0.10 0.00 0.73 0.00 0.00 38.32 38.92 1r1i h ASN 105 CO 0.00 0.09 -0.39 0.15 -1.29 0.00 0.00 177.43 175.99 1r1i h PHE 106 N 0.08 -1.13 -0.46 0.67 3.57 -1.81 -0.10 116.94 117.77 1r1i h PHE 106 Ca 0.03 0.07 -0.00 0.00 3.53 0.00 0.00 57.97 61.60 1r1i h PHE 106 Cb 0.01 0.57 -0.02 0.00 2.79 0.00 0.00 35.95 39.30 1r1i h PHE 106 CO -0.07 -0.41 0.27 -0.44 -2.23 0.00 0.00 178.31 175.44 1r1i h ASP 107 N -0.23 0.55 -0.68 0.41 3.32 -0.99 -2.37 116.42 116.43 1r1i h ASP 107 Ca 0.19 -0.06 0.03 0.00 0.02 0.00 0.00 57.03 57.21 1r1i h ASP 107 Cb 0.56 -0.14 -0.04 0.00 0.22 0.00 0.00 39.33 39.93 1r1i h ASP 107 CO -0.65 0.45 0.45 0.40 -1.72 0.00 0.00 179.24 178.17 1r1i h ILE 108 N 0.61 1.11 -0.64 0.35 2.04 0.78 0.21 117.51 121.97 1r1i h ILE 108 Ca 0.16 -0.29 0.09 0.00 1.00 0.00 0.00 64.86 65.83 1r1i h ILE 108 Cb 0.00 0.20 -0.07 0.00 -0.74 0.00 0.00 36.82 36.21 1r1i h ILE 108 CO -0.03 0.15 0.27 -0.07 0.00 0.00 0.00 178.15 178.47 1r1i h LEU 109 N 0.83 0.30 -1.19 1.44 3.38 -0.54 -1.07 115.31 118.46 1r1i h LEU 109 Ca 0.27 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.30 1r1i h LEU 109 Cb 0.04 0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 1r1i h LEU 109 CO -0.07 0.17 0.38 0.03 0.09 0.00 0.00 178.44 179.04 1r1i h ARG 110 N 0.46 0.94 -0.19 1.13 3.08 -0.50 -1.23 114.38 118.09 1r1i h ARG 110 Ca 0.32 -0.09 -0.06 0.00 0.07 0.00 0.00 59.98 60.22 1r1i h ARG 110 Cb 0.38 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.23 1r1i h ARG 110 CO -0.30 0.68 -0.14 -0.44 -1.07 0.00 0.00 179.97 178.71 1r1i h ASP 111 N 0.95 0.29 1.63 7.04 3.45 0.40 -2.11 116.42 128.07 1r1i h ASP 111 Ca 0.24 -0.07 -0.03 0.00 0.43 0.00 0.00 57.03 57.61 1r1i h ASP 111 Cb 0.01 -0.08 -0.00 0.00 -0.56 0.00 0.00 39.33 38.70 1r1i h ASP 111 CO -0.04 0.46 -0.38 -0.33 -1.57 0.00 0.00 179.24 177.38 1r1i h GLU 112 N 0.29 0.00 -0.39 3.56 5.08 -0.93 -2.76 114.58 119.42 1r1i h GLU 112 Ca 0.06 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.37 1r1i h GLU 112 Cb 0.43 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.66 1r1i h GLU 112 CO 0.03 0.12 0.04 1.25 -1.00 0.00 0.00 179.01 179.45 1r1i h LEU 113 N 0.00 0.56 -0.88 1.33 5.85 -0.55 -3.25 115.31 118.37 1r1i h LEU 113 Ca -0.01 -0.10 -0.12 0.00 0.84 0.00 0.00 57.88 58.49 1r1i h LEU 113 Cb 1.12 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.99 1r1i h LEU 113 CO 0.02 0.61 -0.54 -0.33 -0.34 0.00 0.00 178.44 177.85 1r1i h GLU 114 N 0.58 0.04 -0.19 1.25 5.08 -1.21 -2.09 114.58 118.04 1r1i h GLU 114 Ca 0.13 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.44 1r1i h GLU 114 Cb 0.31 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 1r1i h GLU 114 CO 0.01 0.57 0.04 0.28 -1.00 0.00 0.00 179.01 178.91 1r1i h VAL 115 N 0.03 1.21 -0.60 3.13 2.07 -1.59 0.13 116.25 120.64 1r1i h VAL 115 Ca -0.00 -0.68 -0.03 0.00 0.82 0.00 0.00 66.70 66.80 1r1i h VAL 115 Cb 0.97 1.30 -0.03 0.00 -1.52 0.00 0.00 31.29 32.02 1r1i h VAL 115 CO 0.07 0.21 0.25 0.58 0.02 0.00 0.00 177.57 178.70 1r1i h VAL 116 N 0.11 1.23 -0.95 2.57 2.07 -1.55 1.11 116.25 120.83 1r1i h VAL 116 Ca 0.06 -0.70 0.06 0.00 0.82 0.00 0.00 66.70 66.94 1r1i h VAL 116 Cb 0.28 0.57 -0.06 0.00 -1.52 0.00 0.00 31.29 30.56 1r1i h VAL 116 CO 0.00 0.27 0.62 -0.07 0.02 0.00 0.00 177.57 178.41 1r1i h LEU 117 N 0.83 0.99 0.01 2.57 3.38 -1.29 -0.95 115.31 120.85 1r1i h LEU 117 Ca 0.20 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.17 1r1i h LEU 117 Cb 0.19 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.73 1r1i h LEU 117 CO -0.02 0.64 -0.00 0.50 0.09 0.00 0.00 178.44 179.65 1r1i h LYS 118 N 1.12 -0.01 -0.43 1.13 3.64 0.23 0.43 116.57 122.68 1r1i h LYS 118 Ca 0.40 0.00 0.13 0.00 -1.27 0.00 0.00 60.65 59.91 1r1i h LYS 118 Cb 0.14 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.95 1r1i h LYS 118 CO -0.15 0.28 0.56 -0.44 -2.27 0.00 0.00 179.45 177.43 1r1i h ASP 119 N -0.30 0.00 0.00 4.20 5.19 0.17 -3.00 116.42 122.68 1r1i h ASP 119 Ca -0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1r1i h ASP 119 Cb 0.29 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.80 1r1i h ASP 119 CO 0.00 0.00 -0.54 1.33 -3.12 0.00 0.00 179.24 176.91 1r1i n VAL 120 N -3.49 0.00 0.11 -1.35 0.24 -0.41 -4.55 118.33 108.88 1r1i n VAL 120 Ca 0.08 -0.24 -0.19 0.00 -2.04 0.00 0.00 64.34 61.95 1r1i n VAL 120 Cb 0.73 0.73 -0.15 0.00 -1.47 0.00 0.00 33.84 33.69 1r1i n VAL 120 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 1r1i h LEU 121 N 0.00 0.57 -0.89 1.34 3.38 -0.05 -3.43 115.31 116.23 1r1i h LEU 121 Ca 0.00 -0.64 0.00 0.00 0.09 0.00 0.00 57.88 57.33 1r1i h LEU 121 Cb 0.02 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.58 1r1i h LEU 121 CO 0.00 1.51 -0.18 0.00 0.09 0.00 0.00 178.44 179.85 1r1i n GLN 122 N -3.59 1.33 -3.84 1.13 10.64 -1.14 -4.64 117.38 117.27 1r1i n GLN 122 Ca -0.13 -0.89 -0.35 0.00 -1.83 0.00 0.00 57.00 53.80 1r1i n GLN 122 Cb 1.06 -1.48 -0.13 0.00 -0.86 0.00 0.00 30.24 28.83 1r1i n GLN 122 CO 0.00 0.00 0.00 -1.21 -1.83 0.00 0.00 177.06 174.02 1r1i s GLU 123 N -2.28 2.06 0.33 2.61 2.02 -1.26 -5.09 118.70 117.09 1r1i s GLU 123 Ca 0.28 -1.66 -0.20 0.00 0.02 0.00 0.00 54.97 53.41 1r1i s GLU 123 Cb 0.20 -3.42 -0.14 0.00 0.10 0.00 0.00 34.13 30.86 1r1i s GLU 123 CO 0.45 -0.92 0.14 -2.30 0.02 0.00 0.00 175.26 172.65 1r1i n PRO 124 N 4.56 0.00 -3.89 0.39 -0.02 -1.26 -5.00 135.00 129.78 1r1i n PRO 124 Ca -0.05 0.00 -0.20 0.00 -2.02 0.00 0.00 63.50 61.24 1r1i n PRO 124 Cb 0.42 -0.90 -0.17 0.00 -0.02 0.00 0.00 33.50 32.83 1r1i n PRO 124 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1r1i s LYS 125 N -0.90 0.42 0.48 -0.52 1.02 -1.26 -5.03 119.74 113.95 1r1i s LYS 125 Ca 0.54 0.10 0.27 0.00 0.02 0.00 0.00 55.97 56.90 1r1i s LYS 125 Cb -0.62 -0.68 0.74 0.00 -0.52 0.00 0.00 37.83 36.75 1r1i s LYS 125 CO 0.55 -0.20 1.75 1.15 -0.92 0.00 0.00 175.35 177.69 1r1i h THR 126 N 6.27 0.00 -0.68 2.17 2.02 -2.05 0.20 112.91 120.84 1r1i h THR 126 Ca -0.31 -0.80 0.00 0.00 0.77 0.00 0.00 66.41 66.06 1r1i h THR 126 Cb 1.13 1.80 0.00 0.00 -1.74 0.00 0.00 68.15 69.34 1r1i h THR 126 CO 0.37 0.00 0.00 -0.62 0.37 0.00 0.00 175.52 175.64 1r1i n GLU 127 N -3.08 2.61 -1.70 6.66 -0.58 -1.26 -4.97 120.64 118.32 1r1i n GLU 127 Ca 0.03 -2.45 -0.43 0.00 -0.42 0.00 0.00 57.16 53.89 1r1i n GLU 127 Cb 0.44 -1.54 -0.01 0.00 -0.57 0.00 0.00 31.44 29.76 1r1i n GLU 127 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1r1i n ASP 128 N 1.47 2.88 -4.91 1.62 8.00 0.69 -5.01 116.55 121.31 1r1i n ASP 128 Ca 0.23 1.20 -0.27 0.00 0.71 0.00 0.00 54.79 56.66 1r1i n ASP 128 Cb 0.58 -1.49 -0.01 0.00 -0.02 0.00 0.00 41.12 40.18 1r1i n ASP 128 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 1r1i s ILE 129 N -0.96 4.94 0.59 0.53 -0.00 -1.26 -4.86 121.20 120.19 1r1i s ILE 129 Ca 0.57 0.11 0.29 0.00 -0.00 0.00 0.00 60.65 61.61 1r1i s ILE 129 Cb -0.57 -3.85 0.39 0.00 -0.00 0.00 0.00 42.46 38.43 1r1i s ILE 129 CO 0.61 -0.76 1.82 0.58 -0.00 0.00 0.00 174.94 177.19 1r1i h VAL 130 N 0.42 0.31 -0.01 8.37 2.07 -1.97 0.27 116.25 125.72 1r1i h VAL 130 Ca -0.47 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.03 1r1i h VAL 130 Cb 1.21 0.53 0.00 0.00 -1.52 0.00 0.00 31.29 31.50 1r1i h VAL 130 CO 0.62 0.00 -0.05 0.00 0.02 0.00 0.00 177.57 178.16 1r1i h ALA 131 N 1.33 0.02 -0.89 1.67 0.00 -1.92 -2.13 119.26 117.35 1r1i h ALA 131 Ca 0.27 -0.37 0.23 0.00 0.00 0.00 0.00 54.91 55.04 1r1i h ALA 131 Cb 1.45 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 19.19 1r1i h ALA 131 CO -0.00 -0.10 0.61 0.28 0.00 0.00 0.00 179.25 180.04 1r1i h VAL 132 N -0.63 0.61 -0.00 0.00 2.07 -1.28 -2.86 116.25 114.16 1r1i h VAL 132 Ca -0.00 -0.07 -0.17 0.00 0.82 0.00 0.00 66.70 67.28 1r1i h VAL 132 Cb 0.75 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.90 1r1i h VAL 132 CO 0.01 0.04 -0.78 1.56 0.02 0.00 0.00 177.57 178.41 1r1i h GLN 133 N 0.20 0.06 -0.06 1.57 4.20 -1.18 -2.58 115.11 117.33 1r1i h GLN 133 Ca 0.45 -0.06 -0.16 0.00 0.06 0.00 0.00 58.65 58.93 1r1i h GLN 133 Cb 1.43 0.02 0.01 0.00 0.30 0.00 0.00 27.48 29.23 1r1i h GLN 133 CO -0.10 0.81 -0.60 0.87 -0.67 0.00 0.00 178.83 179.14 1r1i h LYS 134 N 0.04 0.51 0.02 1.46 1.57 -1.27 -1.20 116.57 117.70 1r1i h LYS 134 Ca -0.02 -0.47 0.01 0.00 -1.87 0.00 0.00 60.65 58.31 1r1i h LYS 134 Cb 1.38 0.12 -0.02 0.00 0.08 0.00 0.00 32.23 33.78 1r1i h LYS 134 CO 0.11 1.11 -0.10 0.00 -0.57 0.00 0.00 179.45 179.99 1r1i h ALA 135 N 0.41 -0.13 -0.32 3.86 0.00 -1.42 0.44 119.26 122.10 1r1i h ALA 135 Ca -0.06 0.00 0.04 0.00 0.00 0.00 0.00 54.91 54.89 1r1i h ALA 135 Cb 1.27 0.17 -0.04 0.00 0.00 0.00 0.00 17.79 19.19 1r1i h ALA 135 CO 0.12 -0.60 0.10 0.87 0.00 0.00 0.00 179.25 179.74 1r1i h LYS 136 N -0.18 0.23 -0.74 0.00 1.57 -1.51 1.49 116.57 117.43 1r1i h LYS 136 Ca 0.03 -0.01 0.17 0.00 -1.87 0.00 0.00 60.65 58.97 1r1i h LYS 136 Cb 0.22 -0.05 -0.12 0.00 0.08 0.00 0.00 32.23 32.35 1r1i h LYS 136 CO -0.09 0.15 0.05 0.00 -0.57 0.00 0.00 179.45 178.99 1r1i h ALA 137 N 1.21 0.82 0.28 3.86 0.00 -0.69 0.47 119.26 125.22 1r1i h ALA 137 Ca 0.15 0.22 -0.01 0.00 0.00 0.00 0.00 54.91 55.26 1r1i h ALA 137 Cb 0.13 0.36 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1r1i h ALA 137 CO -0.16 -0.41 -0.13 1.25 0.00 0.00 0.00 179.25 179.80 1r1i h LEU 138 N 0.14 -0.31 0.28 0.00 5.85 0.61 0.24 115.31 122.11 1r1i h LEU 138 Ca 0.41 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 59.13 1r1i h LEU 138 Cb 0.72 0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.81 1r1i h LEU 138 CO -0.62 -0.21 -0.31 0.22 -0.34 0.00 0.00 178.44 177.19 1r1i h TYR 139 N -0.39 -0.83 -0.59 1.25 3.20 0.23 -0.77 116.97 119.07 1r1i h TYR 139 Ca -0.04 0.01 0.06 0.00 3.14 0.00 0.00 58.73 61.90 1r1i h TYR 139 Cb 0.30 0.33 -0.03 0.00 1.54 0.00 0.00 36.73 38.86 1r1i h TYR 139 CO -0.05 -0.44 0.39 0.00 -1.64 0.00 0.00 178.16 176.42 1r1i h ARG 140 N -0.63 0.54 -0.02 1.82 3.08 0.22 0.19 114.38 119.59 1r1i h ARG 140 Ca -0.01 -0.03 -0.10 0.00 0.07 0.00 0.00 59.98 59.91 1r1i h ARG 140 Cb 0.58 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.50 1r1i h ARG 140 CO -0.08 0.36 -0.46 0.66 -1.07 0.00 0.00 179.97 179.38 1r1i h SER 141 N 0.56 0.04 0.70 7.04 4.64 0.36 -3.10 113.55 123.79 1r1i h SER 141 Ca 0.25 -0.02 -0.26 0.00 -0.47 0.00 0.00 61.79 61.30 1r1i h SER 141 Cb 0.29 -0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 62.35 1r1i h SER 141 CO -0.07 0.49 -1.30 0.00 -0.87 0.00 0.00 176.83 175.08 1r1i n ILE 143 N -3.36 0.00 -2.76 0.00 -5.35 -0.67 -4.70 119.36 102.51 1r1i n ILE 143 Ca -0.09 -0.03 -0.43 0.00 -0.27 0.00 0.00 62.75 61.93 1r1i n ILE 143 Cb 1.00 -0.34 -0.01 0.00 -1.74 0.00 0.00 39.64 38.56 1r1i n ILE 143 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 1r1i s ASN 144 N -2.31 6.87 0.21 7.28 3.84 -1.19 -4.84 114.94 124.80 1r1i s ASN 144 Ca 0.36 -2.52 -0.11 0.00 0.21 0.00 0.00 52.86 50.81 1r1i s ASN 144 Cb 0.21 -2.49 0.15 0.00 -0.55 0.00 0.00 41.25 38.57 1r1i s ASN 144 CO 0.42 -1.03 1.88 -0.33 -2.79 0.00 0.00 177.10 175.26 1r1i h GLU 145 N 7.78 0.95 -0.45 0.43 5.08 -1.90 -1.00 114.58 125.48 1r1i h GLU 145 Ca 0.34 -0.06 0.08 0.00 -1.00 0.00 0.00 59.36 58.72 1r1i h GLU 145 Cb 0.90 -0.22 -0.07 0.00 0.50 0.00 0.00 28.75 29.87 1r1i h GLU 145 CO 1.33 0.63 0.04 1.03 -1.00 0.00 0.00 179.01 181.05 1r1i h SER 146 N 0.98 -0.10 -0.32 1.42 0.87 -1.98 1.65 113.55 116.07 1r1i h SER 146 Ca 0.27 0.09 -0.04 0.00 -1.23 0.00 0.00 61.79 60.88 1r1i h SER 146 Cb -0.11 0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 61.99 1r1i h SER 146 CO -0.06 -0.02 0.05 0.00 -0.53 0.00 0.00 176.83 176.27 1r1i h ALA 147 N 1.37 0.43 -0.57 6.23 0.00 -1.85 0.50 119.26 125.37 1r1i h ALA 147 Ca 0.22 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 1r1i h ALA 147 Cb 0.31 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 1r1i h ALA 147 CO -0.33 0.14 0.04 0.82 0.00 0.00 0.00 179.25 179.91 1r1i h ILE 148 N 0.37 1.26 0.24 0.00 2.04 0.34 -2.87 117.51 118.89 1r1i h ILE 148 Ca 0.10 -1.07 -0.01 0.00 1.00 0.00 0.00 64.86 64.87 1r1i h ILE 148 Cb 0.36 0.83 0.00 0.00 -0.74 0.00 0.00 36.82 37.28 1r1i h ILE 148 CO 0.01 0.39 -0.11 0.44 0.00 0.00 0.00 178.15 178.87 1r1i h ASP 149 N 0.87 -0.27 0.00 1.72 3.45 0.25 -2.68 116.42 119.77 1r1i h ASP 149 Ca 0.17 -0.06 0.00 0.00 0.43 0.00 0.00 57.03 57.57 1r1i h ASP 149 Cb 0.50 0.07 0.00 0.00 -0.56 0.00 0.00 39.33 39.34 1r1i h ASP 149 CO 0.02 -0.12 0.00 -1.20 -1.57 0.00 0.00 179.24 176.38 1r1i n SER 150 N -5.19 0.00 -0.43 6.45 7.64 0.17 0.55 113.62 122.82 1r1i n SER 150 Ca -0.09 0.00 0.13 0.00 1.01 0.00 0.00 58.87 59.92 1r1i n SER 150 Cb 0.18 0.00 0.39 0.00 -1.01 0.00 0.00 64.21 63.77 1r1i n SER 150 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1r1i n ARG 151 N -3.83 1.36 0.00 1.43 1.74 -1.01 -4.95 116.66 111.40 1r1i n ARG 151 Ca 0.00 -0.87 0.00 0.00 -0.77 0.00 0.00 57.85 56.21 1r1i n ARG 151 Cb 0.00 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 29.96 1r1i n ARG 151 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1r1i n GLY 152 N 1.28 3.34 0.01 -0.13 0.00 0.19 -1.34 105.19 108.54 1r1i n GLY 152 Ca 0.15 0.11 0.11 0.00 0.00 0.00 0.00 46.02 46.39 1r1i n GLY 152 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r1i n GLY 153 N 0.00 -1.14 0.43 -0.02 0.00 -1.26 -3.68 105.19 99.52 1r1i n GLY 153 Ca 0.00 -0.46 0.24 0.00 0.00 0.00 0.00 46.02 45.80 1r1i n GLY 153 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1r1i h GLU 154 N 0.00 0.24 -0.17 1.61 -0.00 -1.62 -2.79 114.58 111.85 1r1i h GLU 154 Ca 0.00 -0.01 0.05 0.00 -0.00 0.00 0.00 59.36 59.40 1r1i h GLU 154 Cb 0.57 -0.05 -0.01 0.00 -0.00 0.00 0.00 28.75 29.26 1r1i h GLU 154 CO 0.00 0.16 0.19 -1.35 -0.00 0.00 0.00 179.01 178.01 1r1i h PRO 155 N 0.25 0.00 0.09 1.06 0.11 -1.86 -1.01 132.00 130.63 1r1i h PRO 155 Ca 0.49 0.00 -0.32 0.00 0.11 0.00 0.00 66.00 66.27 1r1i h PRO 155 Cb 1.48 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.57 1r1i h PRO 155 CO -0.13 0.00 -1.76 1.37 -0.21 0.00 0.00 178.00 177.27 1r1i h LEU 156 N 0.00 0.30 -0.95 2.35 -0.00 -1.90 -3.26 115.31 111.85 1r1i h LEU 156 Ca 0.08 -0.82 0.36 0.00 -0.00 0.00 0.00 57.88 57.50 1r1i h LEU 156 Cb 0.47 -0.10 -0.17 0.00 -0.00 0.00 0.00 40.66 40.86 1r1i h LEU 156 CO -0.00 1.75 0.36 0.18 -0.00 0.00 0.00 178.44 180.73 1r1i n LEU 157 N -3.78 0.20 0.29 0.17 4.77 -1.13 0.86 117.00 118.38 1r1i n LEU 157 Ca -0.32 1.59 0.15 0.00 -0.03 0.00 0.00 56.01 57.41 1r1i n LEU 157 Cb 0.94 -0.72 0.90 0.00 -2.33 0.00 0.00 43.42 42.21 1r1i n LEU 157 CO 0.36 -1.73 1.10 0.50 -1.33 0.00 0.00 177.39 176.29 1r1i h LYS 158 N 0.00 0.00 0.01 3.23 1.63 -1.27 -3.29 116.57 116.88 1r1i h LYS 158 Ca 0.74 0.00 -0.39 0.00 -0.85 0.00 0.00 60.65 60.15 1r1i h LYS 158 Cb 1.85 0.00 -0.06 0.00 -0.60 0.00 0.00 32.23 33.42 1r1i h LYS 158 CO -0.78 0.03 -2.15 1.28 -3.45 0.00 0.00 179.45 174.38 1r1i n LEU 159 N -3.72 2.08 -0.41 5.20 4.32 4.99 -4.60 117.00 124.86 1r1i n LEU 159 Ca -0.03 0.30 0.35 0.00 -0.02 0.00 0.00 56.01 56.62 1r1i n LEU 159 Cb 0.12 -0.89 0.63 0.00 -1.62 0.00 0.00 43.42 41.66 1r1i n LEU 159 CO 0.27 0.55 1.17 -0.07 -1.22 0.00 0.00 177.39 178.09 1r1i h LEU 160 N -0.83 0.27 -0.23 2.23 -0.00 0.40 3.27 115.31 120.42 1r1i h LEU 160 Ca -0.58 0.18 0.00 0.00 -0.00 0.00 0.00 57.88 57.49 1r1i h LEU 160 Cb 1.58 0.18 0.00 0.00 -0.00 0.00 0.00 40.66 42.43 1r1i h LEU 160 CO -0.30 -0.28 0.00 -0.65 -0.00 0.00 0.00 178.44 177.21 1r1i h PRO 161 N 0.05 0.00 -0.24 1.13 0.11 -1.81 1.07 132.00 132.31 1r1i h PRO 161 Ca 0.84 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 66.80 1r1i h PRO 161 Cb 2.49 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 33.60 1r1i h PRO 161 CO -0.56 0.00 -0.47 0.22 -0.21 0.00 0.00 178.00 176.99 1r1i h ASP 162 N 0.00 0.68 -0.69 -2.05 -0.00 0.58 -3.19 116.42 111.76 1r1i h ASP 162 Ca 0.00 -0.33 -0.17 0.00 -0.00 0.00 0.00 57.03 56.52 1r1i h ASP 162 Cb 0.80 -0.19 -0.10 0.00 -0.00 0.00 0.00 39.33 39.83 1r1i h ASP 162 CO 0.00 1.05 0.21 2.30 -0.00 0.00 0.00 179.24 182.80 1r1i n ILE 163 N -4.00 2.89 -1.68 2.25 -5.35 -0.31 -4.86 119.36 108.30 1r1i n ILE 163 Ca -0.02 -1.64 -0.19 0.00 -0.27 0.00 0.00 62.75 60.62 1r1i n ILE 163 Cb 0.56 -0.34 -0.07 0.00 -1.74 0.00 0.00 39.64 38.05 1r1i n ILE 163 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 1r1i n TYR 164 N -0.07 -0.14 0.00 4.28 4.02 -0.95 -4.85 117.16 119.45 1r1i n TYR 164 Ca 0.38 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.27 1r1i n TYR 164 Cb 1.34 -3.35 0.00 0.00 -0.02 0.00 0.00 39.34 37.31 1r1i n TYR 164 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1r1i n GLY 165 N -0.65 -0.37 2.97 2.72 0.00 0.35 -4.84 105.19 105.37 1r1i n GLY 165 Ca -0.20 -1.80 -0.30 0.00 0.00 0.00 0.00 46.02 43.72 1r1i n GLY 165 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1r1i s TRP 166 N -1.41 3.35 0.19 1.61 -0.00 -1.26 -4.83 118.94 116.59 1r1i s TRP 166 Ca 0.00 -3.06 -0.21 0.00 -0.00 0.00 0.00 56.10 52.83 1r1i s TRP 166 Cb 0.00 -2.81 0.13 0.00 -0.00 0.00 0.00 33.47 30.78 1r1i s TRP 166 CO 0.00 -0.83 1.58 -1.35 -0.00 0.00 0.00 176.95 176.35 1r1i h PRO 167 N 6.97 -0.14 0.00 5.86 0.11 -1.88 0.41 132.00 143.32 1r1i h PRO 167 Ca -0.06 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.06 1r1i h PRO 167 Cb 0.94 0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.09 1r1i h PRO 167 CO 0.61 -0.10 0.00 1.55 -0.21 0.00 0.00 178.00 179.86 1r1i n VAL 168 N -5.43 1.09 -2.47 3.15 3.14 -1.26 0.11 118.33 116.65 1r1i n VAL 168 Ca 0.05 0.27 -0.19 0.00 -2.96 0.00 0.00 64.34 61.51 1r1i n VAL 168 Cb 0.36 -1.25 0.02 0.00 -1.06 0.00 0.00 33.84 31.91 1r1i n VAL 168 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1r1i n ALA 169 N -1.28 4.37 -3.01 1.55 0.00 0.14 -5.01 120.51 117.27 1r1i n ALA 169 Ca 0.01 -3.74 -0.21 0.00 0.00 0.00 0.00 53.44 49.50 1r1i n ALA 169 Cb 0.01 -0.63 -0.16 0.00 0.00 0.00 0.00 19.45 18.68 1r1i n ALA 169 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1r1i s THR 170 N -4.55 0.87 -0.24 0.00 2.01 0.30 -4.83 115.64 109.19 1r1i s THR 170 Ca 0.41 -0.41 -0.36 0.00 0.31 0.00 0.00 61.69 61.65 1r1i s THR 170 Cb 0.41 -0.77 -0.12 0.00 0.01 0.00 0.00 72.50 72.03 1r1i s THR 170 CO -0.07 0.27 1.99 -1.84 -0.69 0.00 0.00 174.62 174.28 1r1i n GLU 171 N 3.27 1.54 -3.49 4.92 0.28 -1.26 -4.35 120.64 121.54 1r1i n GLU 171 Ca -0.18 0.51 -0.20 0.00 -0.16 0.00 0.00 57.16 57.13 1r1i n GLU 171 Cb 0.54 -2.49 0.06 0.00 1.43 0.00 0.00 31.44 30.98 1r1i n GLU 171 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1r1i n ASN 172 N 7.84 -3.97 0.34 -1.84 3.02 -1.26 -4.82 115.26 114.57 1r1i n ASN 172 Ca 0.31 -0.78 -0.18 0.00 -0.03 0.00 0.00 54.58 53.89 1r1i n ASN 172 Cb 0.24 -4.52 -0.10 0.00 -0.61 0.00 0.00 39.78 34.80 1r1i n ASN 172 CO 0.00 0.00 0.00 -0.25 -2.62 0.00 0.00 177.26 174.39 1r1i h TRP 173 N -1.61 -1.32 -1.09 3.10 7.01 -1.90 -2.13 115.95 118.01 1r1i h TRP 173 Ca -0.62 0.00 0.39 0.00 2.11 0.00 0.00 58.89 60.78 1r1i h TRP 173 Cb 1.34 0.50 -0.13 0.00 -2.10 0.00 0.00 29.16 28.77 1r1i h TRP 173 CO 0.38 -0.67 0.68 0.39 -2.79 0.00 0.00 178.44 176.42 1r1i n GLU 174 N -5.43 -0.04 0.03 2.65 4.71 -1.26 0.14 120.64 121.44 1r1i n GLU 174 Ca -0.13 1.09 0.02 0.00 -0.01 0.00 0.00 57.16 58.14 1r1i n GLU 174 Cb 0.46 -2.10 -0.08 0.00 -1.01 0.00 0.00 31.44 28.71 1r1i n GLU 174 CO 0.00 0.00 0.00 0.94 0.09 0.00 0.00 177.13 178.16 1r1i n GLN 175 N -4.53 0.63 0.06 3.49 7.27 -0.81 -1.16 117.38 122.33 1r1i n GLN 175 Ca 0.34 0.14 -0.16 0.00 0.07 0.00 0.00 57.00 57.38 1r1i n GLN 175 Cb 1.27 -1.76 -0.07 0.00 2.41 0.00 0.00 30.24 32.09 1r1i n GLN 175 CO 0.00 0.00 0.00 0.87 0.07 0.00 0.00 177.06 178.00 1r1i h LYS 176 N 0.00 0.51 0.00 3.69 1.57 -0.16 -3.44 116.57 118.74 1r1i h LYS 176 Ca -0.15 -0.57 0.00 0.00 -1.87 0.00 0.00 60.65 58.06 1r1i h LYS 176 Cb 1.47 0.17 0.00 0.00 0.08 0.00 0.00 32.23 33.94 1r1i h LYS 176 CO 0.03 1.20 -0.58 0.66 -0.57 0.00 0.00 179.45 180.19 1r1i n TYR 177 N -3.77 0.00 0.30 -1.35 4.01 -1.07 -4.89 117.16 110.39 1r1i n TYR 177 Ca -0.09 0.00 0.18 0.00 -0.16 0.00 0.00 57.90 57.84 1r1i n TYR 177 Cb 0.87 0.00 0.84 0.00 -0.31 0.00 0.00 39.34 40.74 1r1i n TYR 177 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1r1i h GLY 178 N 0.00 0.00 0.73 2.72 0.00 -1.26 0.51 103.07 105.76 1r1i h GLY 178 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 1r1i h GLY 178 CO 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 176.54 176.28 1r1i h ALA 179 N 2.03 -0.56 0.23 3.60 0.00 -1.84 -3.35 119.26 119.37 1r1i h ALA 179 Ca 0.00 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1r1i h ALA 179 Cb 0.27 0.37 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1r1i h ALA 179 CO 0.00 -0.84 -0.11 0.77 0.00 0.00 0.00 179.25 179.07 1r1i h SER 180 N -0.57 -0.26 0.00 0.00 0.02 -0.56 -3.47 113.55 108.71 1r1i h SER 180 Ca -0.01 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1r1i h SER 180 Cb 0.52 0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.12 1r1i h SER 180 CO -0.04 0.09 0.00 1.87 -1.14 0.00 0.00 176.83 177.61 1r1i n TRP 181 N -4.36 0.00 -4.00 3.45 -0.00 0.11 -4.98 117.44 107.66 1r1i n TRP 181 Ca -0.04 0.00 -0.15 0.00 -0.00 0.00 0.00 57.50 57.31 1r1i n TRP 181 Cb 0.12 0.00 -0.15 0.00 -0.00 0.00 0.00 31.31 31.28 1r1i n TRP 181 CO 0.00 0.00 0.00 -0.08 -0.00 0.00 0.00 177.69 177.61 1r1i s THR 182 N 0.00 0.21 0.00 5.87 -1.32 -1.26 -4.99 115.64 114.15 1r1i s THR 182 Ca 0.00 -0.06 0.00 0.00 -1.21 0.00 0.00 61.69 60.42 1r1i s THR 182 Cb 0.00 -0.21 0.00 0.00 -1.51 0.00 0.00 72.50 70.78 1r1i s THR 182 CO 0.00 0.09 0.00 0.00 -2.21 0.00 0.00 174.62 172.50 1r1i n ALA 183 N 3.33 0.00 -0.05 11.08 0.00 -1.26 0.15 120.51 133.76 1r1i n ALA 183 Ca -0.17 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.12 1r1i n ALA 183 Cb 0.56 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.95 1r1i n ALA 183 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 1r1i h GLU 184 N 0.00 0.75 0.07 0.00 9.09 -1.95 0.14 114.58 122.68 1r1i h GLU 184 Ca 0.00 -0.53 -0.10 0.00 0.05 0.00 0.00 59.36 58.77 1r1i h GLU 184 Cb 0.00 0.09 0.01 0.00 -1.65 0.00 0.00 28.75 27.20 1r1i h GLU 184 CO 0.00 1.16 -0.45 1.57 0.05 0.00 0.00 179.01 181.34 1r1i h LYS 185 N 0.48 0.17 0.00 1.06 2.10 -1.40 0.44 116.57 119.43 1r1i h LYS 185 Ca -0.01 -0.28 0.00 0.00 -2.00 0.00 0.00 60.65 58.35 1r1i h LYS 185 Cb 1.19 0.10 0.00 0.00 -0.90 0.00 0.00 32.23 32.63 1r1i h LYS 185 CO 0.12 1.12 0.00 0.00 -2.00 0.00 0.00 179.45 178.69 1r1i n ALA 186 N -2.63 -0.25 -0.29 0.07 0.00 0.39 0.36 120.51 118.16 1r1i n ALA 186 Ca -0.12 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.43 1r1i n ALA 186 Cb 0.66 0.14 0.26 0.00 0.00 0.00 0.00 19.45 20.51 1r1i n ALA 186 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1r1i h ILE 187 N 0.00 0.35 -0.18 0.00 2.04 -0.88 -0.01 117.51 118.83 1r1i h ILE 187 Ca 0.00 -0.07 -0.07 0.00 1.00 0.00 0.00 64.86 65.72 1r1i h ILE 187 Cb 0.00 0.11 -0.01 0.00 -0.74 0.00 0.00 36.82 36.18 1r1i h ILE 187 CO 0.00 0.04 -0.20 0.00 0.00 0.00 0.00 178.15 177.99 1r1i h ALA 188 N 1.75 1.34 0.29 1.87 0.00 0.11 -2.12 119.26 122.50 1r1i h ALA 188 Ca 0.52 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 1r1i h ALA 188 Cb 1.02 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.72 1r1i h ALA 188 CO -0.63 0.45 -0.14 1.96 0.00 0.00 0.00 179.25 180.89 1r1i h GLN 189 N 0.28 -0.37 -0.91 0.00 1.08 0.85 -0.57 115.11 115.46 1r1i h GLN 189 Ca 0.05 0.03 0.08 0.00 -1.45 0.00 0.00 58.65 57.36 1r1i h GLN 189 Cb 0.52 0.08 -0.11 0.00 -0.05 0.00 0.00 27.48 27.92 1r1i h GLN 189 CO 0.03 -0.04 -0.54 1.28 -0.95 0.00 0.00 178.83 178.61 1r1i n LEU 190 N -5.11 -0.97 -0.04 1.46 4.77 -1.00 -1.02 117.00 115.09 1r1i n LEU 190 Ca -0.09 1.63 -0.08 0.00 -0.03 0.00 0.00 56.01 57.44 1r1i n LEU 190 Cb 0.26 -0.21 -0.02 0.00 -2.33 0.00 0.00 43.42 41.12 1r1i n LEU 190 CO 0.30 -1.33 0.73 -1.13 -1.33 0.00 0.00 177.39 174.64 1r1i h ASN 191 N 0.00 -0.61 0.14 -1.43 -0.73 -0.66 1.56 115.58 113.85 1r1i h ASN 191 Ca 0.15 0.12 -0.19 0.00 1.87 0.00 0.00 56.30 58.25 1r1i h ASN 191 Cb 0.37 0.30 0.02 0.00 0.27 0.00 0.00 38.32 39.29 1r1i h ASN 191 CO -0.86 -0.23 -0.81 -1.28 -0.37 0.00 0.00 177.43 173.88 1r1i h SER 192 N -0.20 0.47 0.13 1.15 0.87 0.16 0.35 113.55 116.49 1r1i h SER 192 Ca 0.13 -0.95 -0.18 0.00 -1.23 0.00 0.00 61.79 59.56 1r1i h SER 192 Cb 0.39 -0.15 0.02 0.00 -0.44 0.00 0.00 62.40 62.22 1r1i h SER 192 CO -0.34 1.39 -0.78 0.50 -0.53 0.00 0.00 176.83 177.07 1r1i h LYS 193 N -0.37 0.27 0.00 2.24 3.64 -1.22 -3.41 116.57 117.72 1r1i h LYS 193 Ca -0.14 -0.47 0.00 0.00 -1.27 0.00 0.00 60.65 58.77 1r1i h LYS 193 Cb 1.64 0.17 0.00 0.00 -0.41 0.00 0.00 32.23 33.63 1r1i h LYS 193 CO 0.15 1.22 -0.23 0.66 -2.27 0.00 0.00 179.45 178.99 1r1i n TYR 194 N -4.15 0.00 -1.76 1.91 4.01 -1.03 -2.85 117.16 113.29 1r1i n TYR 194 Ca -0.14 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.41 1r1i n TYR 194 Cb 0.80 -0.01 -0.07 0.00 -0.31 0.00 0.00 39.34 39.76 1r1i n TYR 194 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1r1i n GLY 195 N 1.27 1.30 3.73 2.72 0.00 0.53 -4.89 105.19 109.85 1r1i n GLY 195 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1r1i n GLY 195 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1r1i s LYS 196 N -3.97 4.58 -0.20 1.61 2.47 -0.95 -4.89 119.74 118.40 1r1i s LYS 196 Ca 0.00 1.28 -0.02 0.00 -1.56 0.00 0.00 55.97 55.68 1r1i s LYS 196 Cb 0.00 -3.41 0.00 0.00 -1.46 0.00 0.00 37.83 32.97 1r1i s LYS 196 CO 0.00 0.14 -0.11 0.15 0.16 0.00 0.00 175.35 175.69 1r1i s LYS 197 N 0.37 3.22 0.06 4.03 1.02 -1.26 -1.90 119.74 125.28 1r1i s LYS 197 Ca 0.45 -0.71 0.02 0.00 0.02 0.00 0.00 55.97 55.76 1r1i s LYS 197 Cb -0.21 -2.82 -0.03 0.00 -0.52 0.00 0.00 37.83 34.24 1r1i s LYS 197 CO 0.26 -0.19 -0.08 0.14 -0.92 0.00 0.00 175.35 174.56 1r1i s VAL 198 N 1.38 0.62 0.00 3.17 -7.23 -1.26 -4.67 120.40 112.41 1r1i s VAL 198 Ca 0.05 -1.28 0.00 0.00 -1.81 0.00 0.00 61.98 58.94 1r1i s VAL 198 Cb -0.14 -0.87 0.00 0.00 0.56 0.00 0.00 36.38 35.93 1r1i s VAL 198 CO -0.07 -0.47 0.00 0.18 -0.31 0.00 0.00 175.10 174.43 1r1i n LEU 199 N 1.12 0.00 -3.84 1.32 7.99 -1.26 -4.54 117.00 117.80 1r1i n LEU 199 Ca -0.20 0.00 -0.29 0.00 -0.01 0.00 0.00 56.01 55.50 1r1i n LEU 199 Cb 0.56 0.00 -0.16 0.00 -0.11 0.00 0.00 43.42 43.71 1r1i n LEU 199 CO 0.23 0.00 -0.38 -0.63 -1.51 0.00 0.00 177.39 175.10 1r1i s ILE 200 N 0.00 1.12 -0.37 -0.08 1.09 -1.26 -4.23 121.20 117.46 1r1i s ILE 200 Ca 0.00 -1.11 -0.26 0.00 -1.10 0.00 0.00 60.65 58.17 1r1i s ILE 200 Cb 0.00 -1.58 0.02 0.00 -1.06 0.00 0.00 42.46 39.84 1r1i s ILE 200 CO 0.00 -0.29 0.96 0.21 -0.10 0.00 0.00 174.94 175.72 1r1i s ASN 201 N 1.56 6.70 -0.13 3.58 2.47 -0.57 -4.93 114.94 123.62 1r1i s ASN 201 Ca -0.00 0.61 0.01 0.00 0.42 0.00 0.00 52.86 53.90 1r1i s ASN 201 Cb -0.18 -2.48 0.02 0.00 -1.45 0.00 0.00 41.25 37.16 1r1i s ASN 201 CO -0.11 -0.89 -0.15 -0.22 -3.72 0.00 0.00 177.10 172.01 1r1i s LEU 202 N 3.57 1.74 0.00 3.21 1.98 -1.26 0.57 118.68 128.49 1r1i s LEU 202 Ca 0.40 -0.48 0.04 0.00 -2.89 0.00 0.00 54.13 51.19 1r1i s LEU 202 Cb -0.12 -1.17 -0.01 0.00 0.66 0.00 0.00 46.19 45.55 1r1i s LEU 202 CO 0.19 -0.02 0.13 2.22 -1.89 0.00 0.00 176.35 176.99 1r1i n PHE 203 N 4.52 0.07 -5.12 5.38 1.16 0.07 -4.97 117.46 118.58 1r1i n PHE 203 Ca -0.18 -2.26 -0.31 0.00 -1.87 0.00 0.00 57.45 52.83 1r1i n PHE 203 Cb 0.51 0.01 -0.17 0.00 -1.61 0.00 0.00 39.48 38.22 1r1i n PHE 203 CO 0.00 0.00 0.00 0.08 -1.87 0.00 0.00 176.76 174.97 1r1i s VAL 204 N -2.88 1.90 0.16 1.97 1.01 -1.26 -1.56 120.40 119.72 1r1i s VAL 204 Ca 0.19 -0.94 -0.03 0.00 0.00 0.00 0.00 61.98 61.20 1r1i s VAL 204 Cb 0.01 -1.64 -0.03 0.00 0.00 0.00 0.00 36.38 34.72 1r1i s VAL 204 CO 0.13 0.53 0.13 -0.83 0.00 0.00 0.00 175.10 175.06 1r1i s GLY 205 N 0.28 0.97 0.19 4.51 0.00 -0.11 -4.95 107.32 108.21 1r1i s GLY 205 Ca -0.15 -1.39 -0.33 0.00 0.00 0.00 0.00 44.72 42.86 1r1i s GLY 205 CO 0.07 -1.24 1.59 2.41 0.00 0.00 0.00 173.10 175.93 1r1i n THR 206 N -0.16 0.20 -2.47 0.90 -1.04 -1.26 -1.08 114.28 109.36 1r1i n THR 206 Ca -0.04 -0.05 -0.42 0.00 -2.04 0.00 0.00 64.05 61.50 1r1i n THR 206 Cb 0.64 -1.67 -0.03 0.00 -1.82 0.00 0.00 70.33 67.45 1r1i n THR 206 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1r1i s ASP 207 N 0.86 7.16 0.44 8.00 3.68 0.17 -4.80 116.67 132.19 1r1i s ASP 207 Ca 0.75 2.04 0.25 0.00 2.13 0.00 0.00 52.55 57.72 1r1i s ASP 207 Cb -0.62 -2.59 0.75 0.00 -1.45 0.00 0.00 42.92 39.01 1r1i s ASP 207 CO 0.39 -0.36 1.75 0.44 0.13 0.00 0.00 175.17 177.52 1r1i h ASP 208 N 6.06 0.00 0.90 -0.34 3.45 -1.90 -2.52 116.42 122.07 1r1i h ASP 208 Ca -0.43 0.00 -0.19 0.00 0.43 0.00 0.00 57.03 56.84 1r1i h ASP 208 Cb 1.21 0.00 -0.03 0.00 -0.56 0.00 0.00 39.33 39.95 1r1i h ASP 208 CO 0.77 0.16 -1.18 0.11 -1.57 0.00 0.00 179.24 177.53 1r1i h LYS 209 N 0.00 0.00 -2.52 3.56 6.56 -1.89 0.43 116.57 122.71 1r1i h LYS 209 Ca -0.00 0.00 -0.45 0.00 -1.06 0.00 0.00 60.65 59.14 1r1i h LYS 209 Cb 0.86 0.00 -0.37 0.00 -0.57 0.00 0.00 32.23 32.14 1r1i h LYS 209 CO 0.02 0.55 -0.72 1.21 -2.06 0.00 0.00 179.45 178.45 1r1i s ASN 210 N -6.22 2.77 -0.35 0.86 3.84 -0.95 -4.59 114.94 110.29 1r1i s ASN 210 Ca -0.01 -1.09 0.07 0.00 0.21 0.00 0.00 52.86 52.04 1r1i s ASN 210 Cb 0.09 0.00 0.67 0.00 -0.55 0.00 0.00 41.25 41.46 1r1i s ASN 210 CO 0.80 -0.42 1.79 -1.54 -2.79 0.00 0.00 177.10 174.95 1r1i n SER 211 N 5.26 4.28 0.00 -4.21 3.41 -1.23 0.03 113.62 121.15 1r1i n SER 211 Ca -0.04 -3.29 0.11 0.00 -0.26 0.00 0.00 58.87 55.38 1r1i n SER 211 Cb 0.44 -0.77 -0.13 0.00 -0.26 0.00 0.00 64.21 63.49 1r1i n SER 211 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 1r1i n VAL 212 N -0.50 0.04 -4.54 -3.33 0.24 -1.26 -4.84 118.33 104.14 1r1i n VAL 212 Ca 0.46 -0.31 -0.34 0.00 -2.04 0.00 0.00 64.34 62.11 1r1i n VAL 212 Cb 1.45 0.33 -0.11 0.00 -1.47 0.00 0.00 33.84 34.04 1r1i n VAL 212 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 1r1i s ASN 213 N -3.99 4.78 0.25 -1.34 0.01 0.10 -0.97 114.94 113.78 1r1i s ASN 213 Ca -0.01 -0.01 -0.07 0.00 -0.71 0.00 0.00 52.86 52.06 1r1i s ASN 213 Cb 0.15 -1.35 -0.06 0.00 0.41 0.00 0.00 41.25 40.40 1r1i s ASN 213 CO 0.88 0.33 0.53 -1.00 -1.51 0.00 0.00 177.10 176.33 1r1i s HIS 214 N -0.59 3.46 0.33 2.20 3.76 -1.25 0.46 115.29 123.65 1r1i s HIS 214 Ca 0.09 0.72 -0.09 0.00 -0.15 0.00 0.00 55.06 55.63 1r1i s HIS 214 Cb -0.12 -2.15 0.01 0.00 1.11 0.00 0.00 32.58 31.44 1r1i s HIS 214 CO 0.02 0.24 0.56 0.08 -0.85 0.00 0.00 174.74 174.79 1r1i s VAL 215 N -1.94 0.00 -0.11 -0.90 1.01 -0.24 -4.73 120.40 113.48 1r1i s VAL 215 Ca 0.45 -1.38 -0.16 0.00 0.00 0.00 0.00 61.98 60.89 1r1i s VAL 215 Cb -0.11 -2.58 -0.05 0.00 0.00 0.00 0.00 36.38 33.65 1r1i s VAL 215 CO 0.26 0.00 0.38 -0.63 0.00 0.00 0.00 175.10 175.12 1r1i s ILE 216 N -3.12 5.21 0.06 2.22 1.01 -1.26 -0.93 121.20 124.38 1r1i s ILE 216 Ca 0.24 0.76 0.05 0.00 0.00 0.00 0.00 60.65 61.70 1r1i s ILE 216 Cb -0.02 -3.72 -0.04 0.00 0.01 0.00 0.00 42.46 38.70 1r1i s ILE 216 CO 0.15 0.41 -0.06 -1.00 0.00 0.00 0.00 174.94 174.43 1r1i s HIS 217 N 0.17 2.85 -0.07 3.97 3.76 -0.60 -2.04 115.29 123.33 1r1i s HIS 217 Ca 0.22 -0.08 0.03 0.00 -0.15 0.00 0.00 55.06 55.07 1r1i s HIS 217 Cb -0.15 -1.52 -0.02 0.00 1.11 0.00 0.00 32.58 32.00 1r1i s HIS 217 CO 0.08 0.42 -0.15 0.42 -0.85 0.00 0.00 174.74 174.66 1r1i s ILE 218 N -1.16 2.94 0.20 0.60 -1.09 -0.81 -0.75 121.20 121.12 1r1i s ILE 218 Ca 0.21 -0.75 -0.04 0.00 -2.23 0.00 0.00 60.65 57.84 1r1i s ILE 218 Cb -0.11 -2.16 -0.03 0.00 -1.58 0.00 0.00 42.46 38.58 1r1i s ILE 218 CO 0.13 0.57 0.21 -0.62 -1.23 0.00 0.00 174.94 173.99 1r1i s ASP 219 N -0.38 0.11 0.76 3.58 -1.08 0.19 -1.15 116.67 118.71 1r1i s ASP 219 Ca 0.04 -1.21 -0.12 0.00 -0.52 0.00 0.00 52.55 50.73 1r1i s ASP 219 Cb -0.12 0.42 0.05 0.00 -1.46 0.00 0.00 42.92 41.81 1r1i s ASP 219 CO 0.02 -0.89 1.12 0.00 0.52 0.00 0.00 175.17 175.94 1r1i s GLN 220 N -4.09 2.17 0.31 4.34 -2.07 -1.26 -1.51 119.66 117.55 1r1i s GLN 220 Ca 0.31 1.39 -0.28 0.00 -1.82 0.00 0.00 55.36 54.95 1r1i s GLN 220 Cb 0.05 -1.87 -0.10 0.00 -1.09 0.00 0.00 33.01 30.00 1r1i s GLN 220 CO 0.09 -1.74 1.15 -1.25 -1.32 0.00 0.00 175.29 172.22 1r1i s PRO 221 N -4.48 4.47 1.12 9.60 0.04 -1.26 -4.51 135.00 139.99 1r1i s PRO 221 Ca 0.66 1.88 -0.16 0.00 0.04 0.00 0.00 61.00 63.42 1r1i s PRO 221 Cb -0.21 -3.06 0.16 0.00 0.04 0.00 0.00 34.50 31.44 1r1i s PRO 221 CO 0.51 0.03 0.39 0.54 0.04 0.00 0.00 177.00 178.51 1r1i n ARG 222 N 0.88 -1.77 -4.37 4.56 5.12 -1.26 -5.03 116.66 114.78 1r1i n ARG 222 Ca 0.00 -0.49 -0.19 0.00 -1.93 0.00 0.00 57.85 55.24 1r1i n ARG 222 Cb 0.45 -1.88 -0.10 0.00 -1.16 0.00 0.00 32.46 29.76 1r1i n ARG 222 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1r1i s LEU 223 N -3.32 1.93 0.07 0.55 1.43 -1.26 -4.93 118.68 113.15 1r1i s LEU 223 Ca 0.60 -1.36 -0.20 0.00 -1.03 0.00 0.00 54.13 52.15 1r1i s LEU 223 Cb -0.17 -0.18 -0.10 0.00 0.03 0.00 0.00 46.19 45.77 1r1i s LEU 223 CO 0.66 -0.65 1.51 1.23 0.23 0.00 0.00 176.35 179.33 1r1i h GLY 224 N 2.29 0.39 -0.92 -3.19 0.00 -1.97 -3.43 103.07 96.23 1r1i h GLY 224 Ca -0.39 -0.28 -0.46 0.00 0.00 0.00 0.00 47.33 46.20 1r1i h GLY 224 CO 0.65 0.26 0.32 1.08 0.00 0.00 0.00 176.54 178.85 1r1i s LEU 225 N -9.51 2.71 0.15 3.11 1.43 -1.26 -5.00 118.68 110.31 1r1i s LEU 225 Ca -0.14 0.43 -0.16 0.00 -1.03 0.00 0.00 54.13 53.23 1r1i s LEU 225 Cb 0.07 -2.83 0.02 0.00 0.03 0.00 0.00 46.19 43.47 1r1i s LEU 225 CO 0.73 -2.02 1.77 -0.65 0.23 0.00 0.00 176.35 176.41 1r1i h PRO 226 N -1.01 0.59 -4.18 1.29 0.11 -2.00 -3.46 132.00 123.33 1r1i h PRO 226 Ca -0.44 -0.06 -0.21 0.00 0.11 0.00 0.00 66.00 65.39 1r1i h PRO 226 Cb 1.29 -0.12 -0.11 0.00 0.11 0.00 0.00 31.00 32.18 1r1i h PRO 226 CO 0.54 0.45 -0.32 -1.54 -0.21 0.00 0.00 178.00 176.92 1r1i s SER 227 N -5.69 0.44 0.55 -2.05 1.04 -1.26 -4.94 113.70 101.79 1r1i s SER 227 Ca -0.13 -1.31 0.26 0.00 0.48 0.00 0.00 55.95 55.25 1r1i s SER 227 Cb 0.11 0.55 1.56 0.00 0.10 0.00 0.00 66.02 68.33 1r1i s SER 227 CO 0.74 -1.10 2.16 0.08 0.98 0.00 0.00 173.24 176.10 1r1i h ARG 228 N 2.31 0.00 -0.95 4.02 0.11 -1.92 -2.14 114.38 115.80 1r1i h ARG 228 Ca -0.29 0.00 0.16 0.00 0.10 0.00 0.00 59.98 59.95 1r1i h ARG 228 Cb 1.25 0.00 -0.08 0.00 1.11 0.00 0.00 29.97 32.24 1r1i h ARG 228 CO 0.42 0.06 0.60 -0.44 0.10 0.00 0.00 179.97 180.71 1r1i h ASP 229 N 0.00 0.71 -0.99 0.08 5.19 -1.96 -2.46 116.42 116.99 1r1i h ASP 229 Ca -0.00 0.06 0.11 0.00 -0.62 0.00 0.00 57.03 56.58 1r1i h ASP 229 Cb 0.14 -0.08 -0.08 0.00 0.18 0.00 0.00 39.33 39.50 1r1i h ASP 229 CO 0.01 0.32 0.63 1.88 -3.12 0.00 0.00 179.24 178.96 1r1i h TYR 230 N 0.73 1.13 0.00 4.55 -1.99 -1.80 -1.69 116.97 117.90 1r1i h TYR 230 Ca 0.50 0.03 0.00 0.00 2.00 0.00 0.00 58.73 61.26 1r1i h TYR 230 Cb 0.80 -0.36 0.00 0.00 2.00 0.00 0.00 36.73 39.17 1r1i h TYR 230 CO -0.00 0.47 0.00 0.66 -0.00 0.00 0.00 178.16 179.29 1r1i n TYR 231 N -4.59 0.00 0.11 4.88 4.02 -0.92 0.17 117.16 120.82 1r1i n TYR 231 Ca 0.18 0.00 -0.16 0.00 -0.01 0.00 0.00 57.90 57.91 1r1i n TYR 231 Cb 0.33 0.00 -0.10 0.00 -0.02 0.00 0.00 39.34 39.55 1r1i n TYR 231 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 176.86 176.78 1r1i h GLU 232 N 0.00 -0.72 -0.30 -0.72 5.08 -1.46 -3.47 114.58 112.98 1r1i h GLU 232 Ca 0.00 0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.40 1r1i h GLU 232 Cb 0.00 0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.41 1r1i h GLU 232 CO 0.00 -0.48 -0.01 0.00 -1.00 0.00 0.00 179.01 177.52 1r1i s THR 234 N -2.27 0.11 0.00 0.00 -4.23 -1.26 -4.46 115.64 103.52 1r1i s THR 234 Ca 0.00 -1.41 0.00 0.00 -1.18 0.00 0.00 61.69 59.10 1r1i s THR 234 Cb -0.00 -1.67 0.00 0.00 1.34 0.00 0.00 72.50 72.17 1r1i s THR 234 CO 0.00 -0.49 0.00 0.61 -0.54 0.00 0.00 174.62 174.20 1r1i n GLY 235 N -0.12 3.24 0.00 3.99 0.00 -1.26 -3.11 105.19 107.92 1r1i n GLY 235 Ca -0.10 -0.18 0.04 0.00 0.00 0.00 0.00 46.02 45.78 1r1i n GLY 235 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1r1i n ILE 236 N 0.00 0.00 -0.06 -0.61 -5.35 -1.26 0.55 119.36 112.63 1r1i n ILE 236 Ca 0.00 0.00 0.04 0.00 -0.27 0.00 0.00 62.75 62.52 1r1i n ILE 236 Cb 0.00 -0.65 0.09 0.00 -1.74 0.00 0.00 39.64 37.34 1r1i n ILE 236 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 1r1i n TYR 237 N -0.85 0.26 0.27 4.28 4.01 -1.18 -4.81 117.16 119.14 1r1i n TYR 237 Ca 0.06 -0.43 -0.13 0.00 -0.16 0.00 0.00 57.90 57.24 1r1i n TYR 237 Cb 0.03 -0.03 -0.07 0.00 -0.31 0.00 0.00 39.34 38.96 1r1i n TYR 237 CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 1r1i h LYS 238 N 1.31 -0.75 -0.35 -0.72 3.64 -0.07 -2.23 116.57 117.39 1r1i h LYS 238 Ca 0.00 0.05 0.04 0.00 -1.27 0.00 0.00 60.65 59.47 1r1i h LYS 238 Cb 0.60 0.17 -0.06 0.00 -0.41 0.00 0.00 32.23 32.53 1r1i h LYS 238 CO 0.00 -0.50 -0.35 1.49 -2.27 0.00 0.00 179.45 177.82 1r1i h GLU 239 N -0.78 -0.17 -1.01 1.90 4.57 -1.87 0.11 114.58 117.33 1r1i h GLU 239 Ca -0.06 0.01 0.24 0.00 -1.18 0.00 0.00 59.36 58.37 1r1i h GLU 239 Cb 0.64 0.04 -0.12 0.00 -0.16 0.00 0.00 28.75 29.14 1r1i h GLU 239 CO 0.04 -0.11 0.60 0.00 -1.18 0.00 0.00 179.01 178.36 1r1i h ALA 240 N -0.40 1.80 -0.27 2.92 0.00 -1.82 1.40 119.26 122.90 1r1i h ALA 240 Ca 0.06 0.12 -0.17 0.00 0.00 0.00 0.00 54.91 54.92 1r1i h ALA 240 Cb 0.33 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 1r1i h ALA 240 CO -0.43 -0.27 -0.52 0.00 0.00 0.00 0.00 179.25 178.03 1r1i h THR 242 N 0.61 1.27 0.00 0.00 2.02 0.34 -2.88 112.91 114.26 1r1i h THR 242 Ca 0.02 -1.10 -0.05 0.00 0.77 0.00 0.00 66.41 66.06 1r1i h THR 242 Cb 1.10 1.20 -0.01 0.00 -1.74 0.00 0.00 68.15 68.71 1r1i h THR 242 CO 0.11 0.37 -0.23 0.00 0.37 0.00 0.00 175.52 176.13 1r1i h ALA 243 N 0.85 1.10 -0.13 6.16 0.00 -0.31 -1.57 119.26 125.36 1r1i h ALA 243 Ca 0.10 -0.21 -0.18 0.00 0.00 0.00 0.00 54.91 54.62 1r1i h ALA 243 Cb 0.55 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.31 1r1i h ALA 243 CO 0.03 0.29 -0.62 -0.92 0.00 0.00 0.00 179.25 178.04 1r1i h TYR 244 N 0.00 0.88 0.00 0.00 -0.00 -0.99 -1.27 116.97 115.59 1r1i h TYR 244 Ca -0.00 -0.38 -0.04 0.00 -0.00 0.00 0.00 58.73 58.30 1r1i h TYR 244 Cb 0.66 -0.14 -0.01 0.00 -0.00 0.00 0.00 36.73 37.25 1r1i h TYR 244 CO 0.00 1.19 -0.50 0.28 -0.00 0.00 0.00 178.16 179.12 1r1i h VAL 245 N 0.32 0.27 -0.26 1.81 2.07 -1.52 -1.33 116.25 117.61 1r1i h VAL 245 Ca -0.04 -1.41 -0.10 0.00 0.82 0.00 0.00 66.70 65.97 1r1i h VAL 245 Cb 1.25 2.00 -0.01 0.00 -1.52 0.00 0.00 31.29 33.01 1r1i h VAL 245 CO 0.13 0.15 -0.26 0.44 0.02 0.00 0.00 177.57 178.05 1r1i h ASP 246 N 0.00 0.51 0.27 0.57 5.19 -1.21 -1.30 116.42 120.45 1r1i h ASP 246 Ca -0.02 -0.18 -0.01 0.00 -0.62 0.00 0.00 57.03 56.20 1r1i h ASP 246 Cb 1.16 -0.14 0.00 0.00 0.18 0.00 0.00 39.33 40.53 1r1i h ASP 246 CO 0.02 0.76 -0.13 0.15 -3.12 0.00 0.00 179.24 176.92 1r1i h PHE 247 N 0.44 -0.34 -1.07 4.55 -0.00 -1.08 0.30 116.94 119.75 1r1i h PHE 247 Ca 0.06 -0.01 0.39 0.00 -0.00 0.00 0.00 57.97 58.41 1r1i h PHE 247 Cb 0.69 0.11 -0.16 0.00 -0.00 0.00 0.00 35.95 36.59 1r1i h PHE 247 CO 0.02 0.03 0.62 0.52 -0.00 0.00 0.00 178.31 179.50 1r1i h MET 248 N -0.82 0.13 0.10 1.11 2.86 -1.12 -0.98 114.93 116.21 1r1i h MET 248 Ca -0.04 -0.01 -0.00 0.00 -2.06 0.00 0.00 59.70 57.59 1r1i h MET 248 Cb 0.51 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.14 1r1i h MET 248 CO 0.06 0.08 -0.05 0.82 1.06 0.00 0.00 176.91 178.89 1r1i h ILE 249 N 0.13 0.00 -0.59 -1.22 2.04 -0.37 -1.14 117.51 116.36 1r1i h ILE 249 Ca 0.80 -0.19 0.19 0.00 1.00 0.00 0.00 64.86 66.67 1r1i h ILE 249 Cb 2.12 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 38.10 1r1i h ILE 249 CO -0.64 0.00 0.12 -1.20 0.00 0.00 0.00 178.15 176.43 1r1i n SER 250 N -2.89 0.03 0.02 1.72 7.64 0.99 -0.61 113.62 120.52 1r1i n SER 250 Ca -0.02 1.00 -0.18 0.00 1.01 0.00 0.00 58.87 60.68 1r1i n SER 250 Cb 0.05 -0.41 -0.13 0.00 -1.01 0.00 0.00 64.21 62.72 1r1i n SER 250 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 1r1i h VAL 251 N 0.00 1.49 -0.10 0.44 2.07 -1.11 -2.44 116.25 116.60 1r1i h VAL 251 Ca 0.41 -2.29 0.03 0.00 0.82 0.00 0.00 66.70 65.66 1r1i h VAL 251 Cb 0.95 2.92 -0.00 0.00 -1.52 0.00 0.00 31.29 33.63 1r1i h VAL 251 CO -0.52 0.65 0.22 0.00 0.02 0.00 0.00 177.57 177.95 1r1i h ALA 252 N 0.20 1.49 0.00 1.67 0.00 0.46 -2.40 119.26 120.68 1r1i h ALA 252 Ca -0.10 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 1r1i h ALA 252 Cb 1.44 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.23 1r1i h ALA 252 CO 0.13 -0.27 -0.34 -0.09 0.00 0.00 0.00 179.25 178.67 1r1i h ARG 253 N 0.00 0.00 -0.60 0.00 2.43 -0.73 -3.14 114.38 112.34 1r1i h ARG 253 Ca 0.05 0.00 0.12 0.00 -0.81 0.00 0.00 59.98 59.34 1r1i h ARG 253 Cb 0.49 0.00 -0.11 0.00 -0.42 0.00 0.00 29.97 29.93 1r1i h ARG 253 CO -0.00 0.61 -0.14 -0.07 -1.51 0.00 0.00 179.97 178.86 1r1i h LEU 254 N -1.00 -0.54 -0.66 3.80 3.38 -1.44 -1.01 115.31 117.83 1r1i h LEU 254 Ca -0.08 0.18 0.14 0.00 0.09 0.00 0.00 57.88 58.21 1r1i h LEU 254 Cb 0.74 0.37 -0.11 0.00 0.09 0.00 0.00 40.66 41.74 1r1i h LEU 254 CO -0.05 -0.19 -0.01 0.40 0.09 0.00 0.00 178.44 178.68 1r1i h ILE 255 N 0.00 0.43 0.28 1.22 2.04 -1.51 0.19 117.51 120.17 1r1i h ILE 255 Ca 0.29 -0.04 -0.01 0.00 1.00 0.00 0.00 64.86 66.10 1r1i h ILE 255 Cb 0.44 0.32 0.00 0.00 -0.74 0.00 0.00 36.82 36.84 1r1i h ILE 255 CO -0.61 0.02 -0.13 0.03 0.00 0.00 0.00 178.15 177.45 1r1i h ARG 256 N 0.10 -0.36 -0.46 2.37 3.08 -1.28 -2.08 114.38 115.75 1r1i h ARG 256 Ca 0.35 0.02 0.07 0.00 0.07 0.00 0.00 59.98 60.49 1r1i h ARG 256 Cb 0.58 0.08 -0.07 0.00 0.08 0.00 0.00 29.97 30.64 1r1i h ARG 256 CO -0.58 -0.04 -0.19 1.04 -1.07 0.00 0.00 179.97 179.13 1r1i n GLN 257 N -5.03 -0.11 0.24 0.04 6.02 -0.47 0.55 117.38 118.61 1r1i n GLN 257 Ca -0.08 0.71 0.07 0.00 -0.01 0.00 0.00 57.00 57.69 1r1i n GLN 257 Cb 0.25 -1.05 0.57 0.00 1.02 0.00 0.00 30.24 31.03 1r1i n GLN 257 CO 0.00 0.00 0.00 1.49 -1.01 0.00 0.00 177.06 177.54 1r1i h GLU 258 N 0.00 0.00 -0.00 -1.09 4.81 -0.21 0.23 114.58 118.32 1r1i h GLU 258 Ca 0.16 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.39 1r1i h GLU 258 Cb 0.27 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.65 1r1i h GLU 258 CO -0.46 0.12 -0.02 0.39 -0.73 0.00 0.00 179.01 178.31 1r1i n GLU 259 N -4.31 1.02 -3.88 1.92 -0.58 2.19 -4.88 120.64 112.11 1r1i n GLU 259 Ca -0.03 -0.26 -0.36 0.00 -0.42 0.00 0.00 57.16 56.10 1r1i n GLU 259 Cb 0.20 -1.49 0.02 0.00 -0.57 0.00 0.00 31.44 29.59 1r1i n GLU 259 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1r1i n ARG 260 N -0.77 -1.19 -4.26 3.49 3.00 0.79 -5.00 116.66 112.73 1r1i n ARG 260 Ca 0.20 0.30 -0.25 0.00 -0.01 0.00 0.00 57.85 58.10 1r1i n ARG 260 Cb 0.21 -3.63 -0.08 0.00 0.00 0.00 0.00 32.46 28.96 1r1i n ARG 260 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1r1i s LEU 261 N -6.92 3.06 0.20 0.55 1.43 -1.04 -5.01 118.68 110.95 1r1i s LEU 261 Ca 0.39 -1.02 -0.29 0.00 -1.03 0.00 0.00 54.13 52.18 1r1i s LEU 261 Cb -0.17 -1.40 -0.08 0.00 0.03 0.00 0.00 46.19 44.57 1r1i s LEU 261 CO 0.91 -0.37 0.91 -2.16 0.23 0.00 0.00 176.35 175.87 1r1i s PRO 262 N -3.80 4.77 -0.28 1.29 0.04 -1.26 -4.35 135.00 131.42 1r1i s PRO 262 Ca 0.37 1.41 -0.11 0.00 0.04 0.00 0.00 61.00 62.71 1r1i s PRO 262 Cb 0.02 -3.29 -0.05 0.00 0.04 0.00 0.00 34.50 31.22 1r1i s PRO 262 CO 0.21 0.48 0.20 0.42 0.04 0.00 0.00 177.00 178.35 1r1i s ILE 263 N -0.99 5.31 -0.70 0.56 1.09 -1.26 -5.01 121.20 120.20 1r1i s ILE 263 Ca 0.41 0.18 -0.04 0.00 -1.10 0.00 0.00 60.65 60.09 1r1i s ILE 263 Cb -0.25 -3.54 0.18 0.00 -1.06 0.00 0.00 42.46 37.79 1r1i s ILE 263 CO 0.30 0.24 0.54 -0.62 -0.10 0.00 0.00 174.94 175.31 1r1i s ASP 264 N 1.76 5.57 0.45 3.58 -1.08 -1.26 -4.94 116.67 120.75 1r1i s ASP 264 Ca 0.07 -2.98 0.16 0.00 -0.52 0.00 0.00 52.55 49.28 1r1i s ASP 264 Cb -0.16 -1.92 1.03 0.00 -1.46 0.00 0.00 42.92 40.41 1r1i s ASP 264 CO 0.11 -0.37 1.99 -0.33 0.52 0.00 0.00 175.17 177.09 1r1i h GLU 265 N 6.97 0.00 -0.13 4.34 4.39 -1.99 -0.46 114.58 127.71 1r1i h GLU 265 Ca 0.03 0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.60 1r1i h GLU 265 Cb 0.94 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.58 1r1i h GLU 265 CO 0.74 0.19 -0.49 -0.97 -1.16 0.00 0.00 179.01 177.32 1r1i h ASN 266 N 0.00 0.35 1.67 1.42 -0.73 -1.98 0.76 115.58 117.07 1r1i h ASN 266 Ca -0.00 -0.17 -0.03 0.00 1.87 0.00 0.00 56.30 57.97 1r1i h ASN 266 Cb 0.35 -0.10 -0.00 0.00 0.27 0.00 0.00 38.32 38.83 1r1i h ASN 266 CO 0.02 0.78 -0.33 -0.61 -0.37 0.00 0.00 177.43 176.93 1r1i h GLN 267 N 0.26 0.00 0.28 6.67 5.75 -1.56 -2.88 115.11 123.63 1r1i h GLN 267 Ca 0.01 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.50 1r1i h GLN 267 Cb 0.95 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.50 1r1i h GLN 267 CO 0.08 0.12 -0.13 -0.07 -2.65 0.00 0.00 178.83 176.18 1r1i h LEU 268 N 0.00 -0.32 -0.62 -2.39 3.38 -0.98 0.16 115.31 114.55 1r1i h LEU 268 Ca -0.01 0.01 0.18 0.00 0.09 0.00 0.00 57.88 58.15 1r1i h LEU 268 Cb 1.11 0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.92 1r1i h LEU 268 CO 0.02 -0.02 0.61 0.00 0.09 0.00 0.00 178.44 179.13 1r1i n ALA 269 N -2.50 0.60 -0.08 1.53 0.00 0.24 -0.76 120.51 119.54 1r1i n ALA 269 Ca -0.05 0.20 -0.06 0.00 0.00 0.00 0.00 53.44 53.54 1r1i n ALA 269 Cb 0.15 -0.36 -0.02 0.00 0.00 0.00 0.00 19.45 19.22 1r1i n ALA 269 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1r1i n LEU 270 N -2.41 1.81 -0.16 0.00 0.00 -1.08 -3.42 117.00 111.75 1r1i n LEU 270 Ca 0.14 0.50 -0.03 0.00 0.00 0.00 0.00 56.01 56.62 1r1i n LEU 270 Cb 0.79 -0.81 0.06 0.00 0.00 0.00 0.00 43.42 43.46 1r1i n LEU 270 CO 0.14 -0.39 0.96 -0.08 0.00 0.00 0.00 177.39 178.01 1r1i h GLU 271 N -0.97 0.33 0.00 1.96 4.81 0.93 -2.44 114.58 119.20 1r1i h GLU 271 Ca 0.00 -0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 59.13 1r1i h GLU 271 Cb 0.69 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.99 1r1i h GLU 271 CO 0.00 0.22 -0.37 0.52 -0.73 0.00 0.00 179.01 178.65 1r1i h MET 272 N 0.34 0.00 0.00 1.92 2.86 -1.12 -2.00 114.93 116.93 1r1i h MET 272 Ca 0.24 0.00 -0.19 0.00 -2.06 0.00 0.00 59.70 57.69 1r1i h MET 272 Cb 0.25 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.88 1r1i h MET 272 CO -0.24 0.37 -0.94 -0.91 1.06 0.00 0.00 176.91 176.25 1r1i h ASN 273 N 0.00 0.00 0.09 1.22 2.35 -1.48 -2.78 115.58 114.98 1r1i h ASN 273 Ca -0.00 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.74 1r1i h ASN 273 Cb 0.90 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.27 1r1i h ASN 273 CO 0.05 0.88 -0.04 0.11 -1.65 0.00 0.00 177.43 176.77 1r1i h LYS 274 N 0.00 -0.11 -0.74 0.81 6.56 -0.93 -1.86 116.57 120.30 1r1i h LYS 274 Ca -0.03 0.01 0.16 0.00 -1.06 0.00 0.00 60.65 59.73 1r1i h LYS 274 Cb 1.69 0.03 -0.11 0.00 -0.57 0.00 0.00 32.23 33.27 1r1i h LYS 274 CO 0.11 -0.07 0.17 -0.24 -2.06 0.00 0.00 179.45 177.36 1r1i h VAL 275 N -0.12 0.50 -0.21 0.50 3.04 -1.30 0.17 116.25 118.84 1r1i h VAL 275 Ca -0.01 -0.09 0.05 0.00 -1.01 0.00 0.00 66.70 65.63 1r1i h VAL 275 Cb 0.09 0.22 -0.04 0.00 -2.01 0.00 0.00 31.29 29.55 1r1i h VAL 275 CO 0.02 0.05 -0.08 -0.03 -1.01 0.00 0.00 177.57 176.52 1r1i h MET 276 N 0.26 -0.04 -0.93 4.17 1.85 -1.33 -1.86 114.93 117.05 1r1i h MET 276 Ca 0.42 0.00 0.09 0.00 -0.61 0.00 0.00 59.70 59.60 1r1i h MET 276 Cb 0.72 0.01 -0.07 0.00 0.43 0.00 0.00 31.60 32.69 1r1i h MET 276 CO -0.52 -0.03 0.60 0.93 -0.40 0.00 0.00 176.91 177.49 1r1i h GLU 277 N -0.04 0.95 -0.15 0.39 4.39 0.10 0.35 114.58 120.57 1r1i h GLU 277 Ca 0.11 -0.06 0.04 0.00 0.34 0.00 0.00 59.36 59.79 1r1i h GLU 277 Cb 0.20 -0.22 -0.04 0.00 -0.10 0.00 0.00 28.75 28.60 1r1i h GLU 277 CO -0.24 0.63 -0.08 1.25 -1.16 0.00 0.00 179.01 179.41 1r1i h LEU 278 N 0.98 -0.27 -0.26 1.33 6.46 -0.51 -1.96 115.31 121.08 1r1i h LEU 278 Ca 0.42 0.06 -0.21 0.00 -0.12 0.00 0.00 57.88 58.04 1r1i h LEU 278 Cb 0.33 0.15 0.00 0.00 -0.73 0.00 0.00 40.66 40.41 1r1i h LEU 278 CO -0.18 -0.11 -0.82 -0.08 -0.62 0.00 0.00 178.44 176.63 1r1i h GLU 279 N -0.08 0.53 -0.27 1.25 4.81 -0.50 -1.06 114.58 119.27 1r1i h GLU 279 Ca 0.09 -0.47 0.04 0.00 -0.13 0.00 0.00 59.36 58.88 1r1i h GLU 279 Cb 0.20 0.11 -0.07 0.00 0.63 0.00 0.00 28.75 29.63 1r1i h GLU 279 CO -0.20 1.10 -0.51 0.87 -0.73 0.00 0.00 179.01 179.55 1r1i h LYS 280 N 0.34 -0.42 -0.77 1.92 1.57 -0.26 1.88 116.57 120.83 1r1i h LYS 280 Ca -0.06 0.03 0.09 0.00 -1.87 0.00 0.00 60.65 58.84 1r1i h LYS 280 Cb 1.43 0.10 -0.07 0.00 0.08 0.00 0.00 32.23 33.77 1r1i h LYS 280 CO 0.15 -0.28 0.43 0.93 -0.57 0.00 0.00 179.45 180.11 1r1i h GLU 281 N -0.44 0.71 -0.55 3.15 5.08 -1.16 0.99 114.58 122.36 1r1i h GLU 281 Ca 0.05 -0.04 -0.08 0.00 -1.00 0.00 0.00 59.36 58.29 1r1i h GLU 281 Cb 0.58 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.65 1r1i h GLU 281 CO -0.48 0.47 0.03 0.82 -1.00 0.00 0.00 179.01 178.84 1r1i h ILE 282 N 0.73 1.25 -0.17 3.13 2.04 -0.01 -2.07 117.51 122.41 1r1i h ILE 282 Ca 0.37 -1.04 0.03 0.00 1.00 0.00 0.00 64.86 65.22 1r1i h ILE 282 Cb 0.34 0.80 -0.03 0.00 -0.74 0.00 0.00 36.82 37.19 1r1i h ILE 282 CO -0.24 0.38 -0.01 0.00 0.00 0.00 0.00 178.15 178.28 1r1i h ALA 283 N 1.16 0.14 0.00 1.87 0.00 0.53 -2.53 119.26 120.43 1r1i h ALA 283 Ca 0.17 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.09 1r1i h ALA 283 Cb 0.47 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 1r1i h ALA 283 CO 0.02 -0.45 -0.15 -0.97 0.00 0.00 0.00 179.25 177.70 1r1i h ASN 284 N 0.05 0.00 1.82 0.00 -0.00 -0.68 -1.03 115.58 115.74 1r1i h ASN 284 Ca 0.08 0.00 -0.02 0.00 -0.00 0.00 0.00 56.30 56.36 1r1i h ASN 284 Cb 0.10 0.00 -0.00 0.00 -0.00 0.00 0.00 38.32 38.42 1r1i h ASN 284 CO -0.14 0.15 -0.10 0.00 -0.00 0.00 0.00 177.43 177.34 1r1i h ALA 285 N 1.85 0.94 -2.58 1.57 0.00 -0.98 -3.45 119.26 116.61 1r1i h ALA 285 Ca -0.00 -0.09 -0.49 0.00 0.00 0.00 0.00 54.91 54.33 1r1i h ALA 285 Cb 0.43 -0.02 0.04 0.00 0.00 0.00 0.00 17.79 18.24 1r1i h ALA 285 CO 0.02 0.12 0.44 0.95 0.00 0.00 0.00 179.25 180.79 1r1i s THR 286 N -3.20 3.41 0.18 0.00 -4.23 -0.39 -4.45 115.64 106.96 1r1i s THR 286 Ca 0.06 1.03 -0.30 0.00 -1.18 0.00 0.00 61.69 61.30 1r1i s THR 286 Cb 0.06 -3.51 -0.07 0.00 1.34 0.00 0.00 72.50 70.31 1r1i s THR 286 CO 0.68 -0.04 0.98 0.00 -0.54 0.00 0.00 174.62 175.70 1r1i s ALA 287 N -1.65 3.31 1.02 3.99 0.00 -1.26 -5.03 121.76 122.14 1r1i s ALA 287 Ca 0.62 0.65 -0.13 0.00 0.00 0.00 0.00 51.96 53.10 1r1i s ALA 287 Cb -0.24 -3.27 0.14 0.00 0.00 0.00 0.00 23.12 19.75 1r1i s ALA 287 CO 0.30 0.03 0.70 1.63 0.00 0.00 0.00 175.76 178.42 1r1i n LYS 288 N 2.14 -1.09 0.22 0.00 5.02 -1.26 -4.88 118.16 118.31 1r1i n LYS 288 Ca 0.01 -0.28 0.10 0.00 -2.02 0.00 0.00 58.31 56.12 1r1i n LYS 288 Cb 0.48 -2.06 0.48 0.00 -0.02 0.00 0.00 35.03 33.91 1r1i n LYS 288 CO 0.00 0.00 0.00 -1.35 -0.52 0.00 0.00 177.40 175.53 1r1i h PRO 289 N -2.02 0.00 -0.68 1.97 0.11 -1.98 -3.23 132.00 126.16 1r1i h PRO 289 Ca -0.49 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.59 1r1i h PRO 289 Cb 1.30 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.38 1r1i h PRO 289 CO 0.40 0.24 0.30 0.93 -0.21 0.00 0.00 178.00 179.66 1r1i h GLU 290 N 0.00 0.99 -0.45 1.05 3.07 -1.96 -2.93 114.58 114.35 1r1i h GLU 290 Ca -0.00 -0.16 0.00 0.00 -0.50 0.00 0.00 59.36 58.70 1r1i h GLU 290 Cb 0.70 -0.17 0.00 0.00 -0.84 0.00 0.00 28.75 28.44 1r1i h GLU 290 CO 0.03 0.81 0.00 -0.25 -1.40 0.00 0.00 179.01 178.20 1r1i n ASP 291 N -4.43 2.34 -0.65 1.42 8.00 -1.22 -3.89 116.55 118.12 1r1i n ASP 291 Ca 0.05 -2.07 0.06 0.00 0.71 0.00 0.00 54.79 53.54 1r1i n ASP 291 Cb 0.15 -0.31 0.13 0.00 -0.02 0.00 0.00 41.12 41.07 1r1i n ASP 291 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1r1i n ARG 292 N 0.62 2.13 -0.11 -1.24 1.74 -1.10 -4.73 116.66 113.97 1r1i n ARG 292 Ca 0.14 -1.83 0.05 0.00 -0.77 0.00 0.00 57.85 55.44 1r1i n ARG 292 Cb 0.40 -1.29 0.11 0.00 -1.02 0.00 0.00 32.46 30.66 1r1i n ARG 292 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 1r1i n ASN 293 N 0.68 2.56 -4.14 0.55 6.94 -1.25 -4.65 115.26 115.95 1r1i n ASN 293 Ca 0.11 -1.81 -0.33 0.00 -0.02 0.00 0.00 54.58 52.53 1r1i n ASN 293 Cb 0.41 -0.15 -0.15 0.00 -2.36 0.00 0.00 39.78 37.53 1r1i n ASN 293 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 1r1i s ASP 294 N -0.97 4.20 0.00 0.53 2.15 -1.26 -4.76 116.67 116.57 1r1i s ASP 294 Ca 0.19 -1.06 0.00 0.00 0.43 0.00 0.00 52.55 52.11 1r1i s ASP 294 Cb 0.11 -1.59 0.00 0.00 -0.30 0.00 0.00 42.92 41.13 1r1i s ASP 294 CO 0.15 -0.14 0.68 -0.81 -0.17 0.00 0.00 175.17 174.87 1r1i n PRO 295 N 4.57 0.72 -0.04 4.34 -0.04 -1.26 -1.65 135.00 141.64 1r1i n PRO 295 Ca -0.16 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.17 1r1i n PRO 295 Cb 0.45 -1.04 -0.14 0.00 -0.04 0.00 0.00 33.50 32.73 1r1i n PRO 295 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 1r1i n MET 296 N -0.42 0.67 0.18 0.54 2.81 -1.26 -3.73 117.12 115.91 1r1i n MET 296 Ca 0.00 0.21 0.07 0.00 -1.81 0.00 0.00 57.70 56.17 1r1i n MET 296 Cb 0.02 -1.69 0.11 0.00 -0.71 0.00 0.00 33.22 30.95 1r1i n MET 296 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 1r1i h LEU 297 N 0.02 0.00 0.08 4.03 3.38 -1.73 -3.30 115.31 117.79 1r1i h LEU 297 Ca -0.40 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.35 1r1i h LEU 297 Cb 2.06 0.00 0.02 0.00 0.09 0.00 0.00 40.66 42.83 1r1i h LEU 297 CO 0.05 0.29 -0.88 0.25 0.09 0.00 0.00 178.44 178.24 1r1i h LEU 298 N 0.00 0.64 -8.24 1.67 6.46 -1.66 -3.42 115.31 110.76 1r1i h LEU 298 Ca -0.00 -0.84 -0.58 0.00 -0.12 0.00 0.00 57.88 56.34 1r1i h LEU 298 Cb 1.20 -0.20 -0.10 0.00 -0.73 0.00 0.00 40.66 40.83 1r1i h LEU 298 CO 0.04 1.41 1.19 -0.47 -0.62 0.00 0.00 178.44 179.99 1r1i s TYR 299 N -2.91 2.44 -0.29 1.25 6.14 -1.24 -4.32 117.35 118.41 1r1i s TYR 299 Ca -0.12 -0.45 0.03 0.00 0.64 0.00 0.00 57.07 57.16 1r1i s TYR 299 Cb 0.03 -4.62 0.07 0.00 0.42 0.00 0.00 41.96 37.86 1r1i s TYR 299 CO 0.86 -1.97 -0.05 -0.80 0.64 0.00 0.00 175.55 174.23 1r1i s ASN 300 N 4.23 4.59 0.04 4.32 0.02 -1.21 -4.95 114.94 121.97 1r1i s ASN 300 Ca 0.38 -1.61 -0.17 0.00 -1.02 0.00 0.00 52.86 50.45 1r1i s ASN 300 Cb -0.05 -1.59 -0.06 0.00 0.02 0.00 0.00 41.25 39.56 1r1i s ASN 300 CO 0.04 -0.26 0.49 -0.75 0.02 0.00 0.00 177.10 176.64 1r1i s LYS 301 N 1.06 4.07 0.05 -0.60 2.20 -1.26 -0.96 119.74 124.30 1r1i s LYS 301 Ca -0.03 0.58 -0.18 0.00 -0.36 0.00 0.00 55.97 55.98 1r1i s LYS 301 Cb -0.20 -3.23 0.04 0.00 -1.51 0.00 0.00 37.83 32.92 1r1i s LYS 301 CO -0.05 0.66 0.41 -1.64 -0.36 0.00 0.00 175.35 174.36 1r1i s MET 302 N -1.07 0.92 0.06 4.03 -1.94 0.35 -4.89 119.30 116.77 1r1i s MET 302 Ca 0.26 -0.39 -0.19 0.00 -1.71 0.00 0.00 55.69 53.67 1r1i s MET 302 Cb -0.18 0.41 -0.07 0.00 2.01 0.00 0.00 34.83 37.00 1r1i s MET 302 CO 0.16 -0.32 0.55 0.95 -0.01 0.00 0.00 175.02 176.35 1r1i s THR 303 N -2.55 4.78 0.31 2.05 -4.23 -1.22 0.52 115.64 115.30 1r1i s THR 303 Ca -0.05 1.17 0.19 0.00 -1.18 0.00 0.00 61.69 61.81 1r1i s THR 303 Cb -0.01 -3.87 0.27 0.00 1.34 0.00 0.00 72.50 70.23 1r1i s THR 303 CO -0.03 0.56 0.74 0.18 -0.54 0.00 0.00 174.62 175.52 1r1i n LEU 304 N 1.75 0.00 0.00 4.79 4.77 -0.80 -0.90 117.00 126.60 1r1i n LEU 304 Ca -0.11 0.45 0.00 0.00 -0.03 0.00 0.00 56.01 56.32 1r1i n LEU 304 Cb 0.51 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.42 1r1i n LEU 304 CO 0.41 -0.45 0.15 0.00 -1.33 0.00 0.00 177.39 176.17 1r1i n ALA 305 N -2.04 0.00 0.15 -1.18 0.00 -1.13 0.15 120.51 116.46 1r1i n ALA 305 Ca 0.16 0.00 0.18 0.00 0.00 0.00 0.00 53.44 53.79 1r1i n ALA 305 Cb 0.91 0.05 0.78 0.00 0.00 0.00 0.00 19.45 21.19 1r1i n ALA 305 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1r1i h GLN 306 N 0.00 0.00 0.38 0.00 4.20 -1.34 0.25 115.11 118.60 1r1i h GLN 306 Ca 0.00 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.69 1r1i h GLN 306 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 1r1i h GLN 306 CO 0.00 0.00 -0.18 0.82 -0.67 0.00 0.00 178.83 178.80 1r1i h ILE 307 N 0.00 0.61 -0.57 2.54 2.04 -0.84 1.20 117.51 122.49 1r1i h ILE 307 Ca 0.14 -0.34 0.17 0.00 1.00 0.00 0.00 64.86 65.82 1r1i h ILE 307 Cb 0.73 0.78 -0.02 0.00 -0.74 0.00 0.00 36.82 37.57 1r1i h ILE 307 CO -0.00 0.06 0.48 -0.61 0.00 0.00 0.00 178.15 178.09 1r1i h GLN 308 N -0.71 0.00 0.17 2.37 5.75 0.48 -0.49 115.11 122.67 1r1i h GLN 308 Ca -0.05 0.00 -0.32 0.00 -0.15 0.00 0.00 58.65 58.13 1r1i h GLN 308 Cb 0.50 0.00 0.01 0.00 1.07 0.00 0.00 27.48 29.06 1r1i h GLN 308 CO 0.09 0.00 -1.56 -0.97 -2.65 0.00 0.00 178.83 173.73 1r1i h ASN 309 N 0.00 0.55 0.14 -0.69 -1.24 0.46 -3.38 115.58 111.42 1r1i h ASN 309 Ca 0.27 -0.91 -0.17 0.00 0.71 0.00 0.00 56.30 56.21 1r1i h ASN 309 Cb 1.24 -0.18 -0.03 0.00 0.73 0.00 0.00 38.32 40.08 1r1i h ASN 309 CO -0.00 1.71 -2.02 0.59 -1.29 0.00 0.00 177.43 176.41 1r1i n ASN 310 N -3.75 0.16 -3.26 1.15 3.02 0.38 -4.49 115.26 108.47 1r1i n ASN 310 Ca -0.24 0.07 -0.25 0.00 -0.03 0.00 0.00 54.58 54.13 1r1i n ASN 310 Cb 1.00 1.29 -0.07 0.00 -0.61 0.00 0.00 39.78 41.39 1r1i n ASN 310 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1r1i n PHE 311 N -2.55 1.55 -2.71 3.10 3.72 -0.27 -4.95 117.46 115.34 1r1i n PHE 311 Ca -0.16 -3.84 -0.31 0.00 -0.05 0.00 0.00 57.45 53.09 1r1i n PHE 311 Cb 0.83 -0.45 -0.03 0.00 -0.94 0.00 0.00 39.48 38.89 1r1i n PHE 311 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1r1i s SER 312 N -1.95 6.55 -0.07 4.37 1.04 -1.26 -4.76 113.70 117.61 1r1i s SER 312 Ca 0.38 1.26 -0.04 0.00 0.48 0.00 0.00 55.95 58.04 1r1i s SER 312 Cb 0.19 -2.38 0.04 0.00 0.10 0.00 0.00 66.02 63.96 1r1i s SER 312 CO -0.07 -0.46 0.17 -0.76 0.98 0.00 0.00 173.24 173.10 1r1i s LEU 313 N -3.93 0.76 -0.70 2.42 2.01 -1.26 -4.79 118.68 113.20 1r1i s LEU 313 Ca 0.53 0.35 -0.04 0.00 0.01 0.00 0.00 54.13 54.99 1r1i s LEU 313 Cb -0.10 0.48 0.18 0.00 0.01 0.00 0.00 46.19 46.76 1r1i s LEU 313 CO 0.32 -0.14 0.54 -0.70 1.01 0.00 0.00 176.35 177.38 1r1i s GLU 314 N 1.01 2.83 -0.26 1.70 2.56 -1.26 0.24 118.70 125.51 1r1i s GLU 314 Ca -0.08 -2.66 -0.09 0.00 0.00 0.00 0.00 54.97 52.14 1r1i s GLU 314 Cb -0.09 -3.86 -0.04 0.00 2.00 0.00 0.00 34.13 32.13 1r1i s GLU 314 CO -0.05 -1.21 0.13 0.42 -0.56 0.00 0.00 175.26 173.99 1r1i s ILE 315 N -0.28 4.82 0.00 -3.70 1.09 -1.26 -4.02 121.20 117.85 1r1i s ILE 315 Ca 0.19 0.00 0.00 0.00 -1.10 0.00 0.00 60.65 59.74 1r1i s ILE 315 Cb -0.17 -3.27 0.00 0.00 -1.06 0.00 0.00 42.46 37.96 1r1i s ILE 315 CO -0.05 0.30 0.00 -3.20 -0.10 0.00 0.00 174.94 171.89 1r1i n ASN 316 N 4.92 -1.84 -3.10 3.58 4.05 -1.26 -0.72 115.26 120.89 1r1i n ASN 316 Ca -0.15 0.00 -0.19 0.00 0.45 0.00 0.00 54.58 54.69 1r1i n ASN 316 Cb 0.52 -0.42 0.02 0.00 1.23 0.00 0.00 39.78 41.13 1r1i n ASN 316 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1r1i n GLY 317 N -2.48 -0.86 0.00 8.20 0.00 -1.26 -4.94 105.19 103.85 1r1i n GLY 317 Ca 0.00 1.16 0.00 0.00 0.00 0.00 0.00 46.02 47.18 1r1i n GLY 317 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1r1i n LYS 318 N -0.16 0.00 -1.97 1.61 4.76 0.10 -5.08 118.16 117.42 1r1i n LYS 318 Ca 0.03 0.00 -0.08 0.00 -2.87 0.00 0.00 58.31 55.40 1r1i n LYS 318 Cb 0.52 0.00 0.01 0.00 -1.84 0.00 0.00 35.03 33.73 1r1i n LYS 318 CO 0.00 0.00 0.00 -0.35 -1.37 0.00 0.00 177.40 175.68 1r1i n PRO 319 N 0.00 1.04 -3.20 1.97 -0.04 -1.26 -4.91 135.00 128.59 1r1i n PRO 319 Ca 0.00 -1.11 -0.37 0.00 -0.04 0.00 0.00 63.50 61.98 1r1i n PRO 319 Cb 0.00 0.02 -0.06 0.00 -0.04 0.00 0.00 33.50 33.42 1r1i n PRO 319 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 1r1i s PHE 320 N -0.56 3.72 -0.29 0.54 2.19 0.65 -4.85 117.98 119.38 1r1i s PHE 320 Ca 0.16 1.30 0.03 0.00 0.33 0.00 0.00 56.93 58.75 1r1i s PHE 320 Cb -0.01 -2.54 0.07 0.00 -1.31 0.00 0.00 43.02 39.23 1r1i s PHE 320 CO 0.10 0.46 -0.06 0.45 1.83 0.00 0.00 175.22 178.01 1r1i s SER 321 N -1.43 4.56 0.51 6.13 0.15 -1.26 -4.59 113.70 117.77 1r1i s SER 321 Ca 0.36 -1.63 0.28 0.00 0.70 0.00 0.00 55.95 55.66 1r1i s SER 321 Cb -0.18 -1.58 1.37 0.00 -1.71 0.00 0.00 66.02 63.92 1r1i s SER 321 CO 0.21 -0.25 2.02 -0.50 1.20 0.00 0.00 173.24 175.92 1r1i h TRP 322 N 7.73 0.00 0.11 3.44 4.06 -1.96 -1.95 115.95 127.37 1r1i h TRP 322 Ca -0.14 0.00 -0.28 0.00 2.06 0.00 0.00 58.89 60.53 1r1i h TRP 322 Cb 1.03 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.19 1r1i h TRP 322 CO 0.58 0.13 -1.32 1.25 -3.56 0.00 0.00 178.44 175.52 1r1i h LEU 323 N 0.00 0.37 -0.01 -4.49 7.12 -1.93 -0.91 115.31 115.46 1r1i h LEU 323 Ca -0.00 -0.43 0.00 0.00 0.13 0.00 0.00 57.88 57.58 1r1i h LEU 323 Cb 0.43 -0.12 -0.01 0.00 -0.53 0.00 0.00 40.66 40.42 1r1i h LEU 323 CO 0.02 1.35 -0.10 -1.13 -0.13 0.00 0.00 178.44 178.45 1r1i h ASN 324 N 0.06 -0.31 0.55 1.25 -0.00 -1.80 -2.19 115.58 113.14 1r1i h ASN 324 Ca -0.16 0.04 -0.14 0.00 -0.00 0.00 0.00 56.30 56.04 1r1i h ASN 324 Cb 1.97 0.12 -0.02 0.00 -0.00 0.00 0.00 38.32 40.39 1r1i h ASN 324 CO 0.18 -0.09 -0.63 0.15 -0.00 0.00 0.00 177.43 177.04 1r1i h PHE 325 N -0.12 0.10 -0.13 0.67 3.04 -1.40 1.18 116.94 120.28 1r1i h PHE 325 Ca 0.00 -0.04 -0.08 0.00 3.98 0.00 0.00 57.97 61.84 1r1i h PHE 325 Cb 0.13 -0.02 -0.01 0.00 2.56 0.00 0.00 35.95 38.61 1r1i h PHE 325 CO -0.42 0.68 -0.27 1.15 -2.02 0.00 0.00 178.31 177.43 1r1i h THR 326 N 0.05 1.24 0.21 4.41 2.02 -1.26 -1.76 112.91 117.82 1r1i h THR 326 Ca -0.01 -1.15 -0.31 0.00 0.77 0.00 0.00 66.41 65.71 1r1i h THR 326 Cb 1.12 1.45 0.02 0.00 -1.74 0.00 0.00 68.15 69.00 1r1i h THR 326 CO 0.09 0.35 -1.44 0.78 0.37 0.00 0.00 175.52 175.66 1r1i h ASN 327 N 0.21 0.69 0.16 4.18 2.35 -0.34 -2.17 115.58 120.66 1r1i h ASN 327 Ca 0.03 -0.92 0.00 0.00 -0.55 0.00 0.00 56.30 54.86 1r1i h ASN 327 Cb 0.59 -0.22 0.00 0.00 0.05 0.00 0.00 38.32 38.74 1r1i h ASN 327 CO 0.04 1.68 0.00 -0.62 -1.65 0.00 0.00 177.43 176.88 1r1i n GLU 328 N -3.77 0.02 -0.09 0.81 -0.58 0.39 -1.41 120.64 116.00 1r1i n GLU 328 Ca -0.19 0.36 -0.12 0.00 -0.42 0.00 0.00 57.16 56.78 1r1i n GLU 328 Cb 1.03 -1.50 -0.05 0.00 -0.57 0.00 0.00 31.44 30.36 1r1i n GLU 328 CO 0.00 0.00 0.00 -0.89 -0.48 0.00 0.00 177.13 175.76 1r1i n ILE 329 N -1.44 1.48 0.24 -3.67 5.41 -0.67 -4.77 119.36 115.94 1r1i n ILE 329 Ca 0.02 0.07 0.12 0.00 1.00 0.00 0.00 62.75 63.96 1r1i n ILE 329 Cb 0.06 -2.25 0.51 0.00 -0.71 0.00 0.00 39.64 37.25 1r1i n ILE 329 CO 0.00 0.00 0.00 0.24 0.00 0.00 0.00 176.55 176.79 1r1i h MET 330 N -1.00 0.00 -1.97 0.38 2.86 -1.03 -1.62 114.93 112.56 1r1i h MET 330 Ca -0.16 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.48 1r1i h MET 330 Cb 0.95 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.61 1r1i h MET 330 CO -0.10 0.14 0.00 -1.13 1.06 0.00 0.00 176.91 176.89 1r1i n SER 331 N -3.27 3.15 -0.06 1.22 3.41 -0.50 -1.24 113.62 116.33 1r1i n SER 331 Ca 0.01 -1.81 0.03 0.00 -0.26 0.00 0.00 58.87 56.83 1r1i n SER 331 Cb 0.40 -0.66 -0.02 0.00 -0.26 0.00 0.00 64.21 63.67 1r1i n SER 331 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1r1i n THR 332 N 1.64 0.00 -2.47 6.66 -1.04 -0.61 -3.81 114.28 114.66 1r1i n THR 332 Ca 0.00 -0.38 -0.24 0.00 -2.04 0.00 0.00 64.05 61.39 1r1i n THR 332 Cb 0.30 1.03 0.01 0.00 -1.82 0.00 0.00 70.33 69.85 1r1i n THR 332 CO 0.00 0.00 0.00 0.55 -0.64 0.00 0.00 175.07 174.98 1r1i n VAL 333 N -0.82 2.21 -3.32 12.58 3.14 -0.37 -5.01 118.33 126.74 1r1i n VAL 333 Ca 0.02 -4.63 -0.13 0.00 -2.96 0.00 0.00 64.34 56.65 1r1i n VAL 333 Cb 0.12 -1.00 -0.03 0.00 -1.06 0.00 0.00 33.84 31.88 1r1i n VAL 333 CO 0.00 0.00 0.00 -3.20 -6.46 0.00 0.00 176.83 167.17 1r1i n ASN 334 N -0.45 -0.05 -4.94 6.55 2.85 -1.19 -4.88 115.26 113.15 1r1i n ASN 334 Ca 0.35 -0.47 -0.26 0.00 -0.11 0.00 0.00 54.58 54.09 1r1i n ASN 334 Cb 0.71 -0.58 -0.03 0.00 1.24 0.00 0.00 39.78 41.12 1r1i n ASN 334 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 1r1i s ILE 335 N -3.72 5.26 -0.09 -1.44 1.01 -1.13 -4.92 121.20 116.17 1r1i s ILE 335 Ca 0.04 -0.57 0.04 0.00 0.00 0.00 0.00 60.65 60.16 1r1i s ILE 335 Cb -0.02 -3.75 -0.00 0.00 0.01 0.00 0.00 42.46 38.69 1r1i s ILE 335 CO 0.36 -0.17 -0.24 -0.44 0.00 0.00 0.00 174.94 174.46 1r1i s SER 336 N -3.31 3.08 -0.19 3.58 0.01 -1.26 -3.45 113.70 112.16 1r1i s SER 336 Ca 0.36 -0.55 -0.05 0.00 1.31 0.00 0.00 55.95 57.03 1r1i s SER 336 Cb -0.11 -1.33 0.07 0.00 0.21 0.00 0.00 66.02 64.87 1r1i s SER 336 CO 0.29 0.17 0.14 -0.63 0.41 0.00 0.00 173.24 173.62 1r1i s ILE 337 N 0.27 -0.17 0.31 1.44 -1.09 -1.26 -5.11 121.20 115.59 1r1i s ILE 337 Ca -0.17 -0.18 0.08 0.00 -2.23 0.00 0.00 60.65 58.16 1r1i s ILE 337 Cb -0.17 -0.63 -0.04 0.00 -1.58 0.00 0.00 42.46 40.04 1r1i s ILE 337 CO 0.08 -0.28 0.13 0.42 -1.23 0.00 0.00 174.94 174.06 1r1i s THR 338 N 2.20 3.31 -1.39 2.92 -4.23 -1.26 -4.79 115.64 112.40 1r1i s THR 338 Ca 0.04 -1.69 0.00 0.00 -1.18 0.00 0.00 61.69 58.86 1r1i s THR 338 Cb -0.16 -3.01 0.00 0.00 1.34 0.00 0.00 72.50 70.67 1r1i s THR 338 CO -0.11 -0.24 0.24 -3.20 -0.54 0.00 0.00 174.62 170.76 1r1i n ASN 339 N -1.11 0.21 -0.17 3.99 4.05 -1.26 -0.01 115.26 120.96 1r1i n ASN 339 Ca -0.04 -0.69 0.05 0.00 0.45 0.00 0.00 54.58 54.34 1r1i n ASN 339 Cb 0.60 -0.11 0.07 0.00 1.23 0.00 0.00 39.78 41.58 1r1i n ASN 339 CO 0.00 0.00 0.00 -1.84 -3.05 0.00 0.00 177.26 172.37 1r1i n GLU 340 N 0.00 1.09 -1.62 1.20 -0.00 -1.26 -2.82 120.64 117.24 1r1i n GLU 340 Ca 0.00 -1.81 -0.54 0.00 -0.00 0.00 0.00 57.16 54.81 1r1i n GLU 340 Cb 0.05 -1.07 -0.06 0.00 -0.00 0.00 0.00 31.44 30.36 1r1i n GLU 340 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 1r1i n GLU 341 N -0.79 1.05 -2.58 3.44 4.07 0.99 -4.89 120.64 121.93 1r1i n GLU 341 Ca 0.08 0.38 -0.35 0.00 -0.06 0.00 0.00 57.16 57.20 1r1i n GLU 341 Cb 0.58 -2.02 -0.04 0.00 -0.06 0.00 0.00 31.44 29.90 1r1i n GLU 341 CO 0.00 0.00 0.00 -0.51 -0.06 0.00 0.00 177.13 176.56 1r1i s ASP 342 N 1.30 6.66 -0.19 4.31 1.01 -1.26 -1.91 116.67 126.60 1r1i s ASP 342 Ca 0.89 1.96 -0.08 0.00 0.71 0.00 0.00 52.55 56.03 1r1i s ASP 342 Cb -1.02 -2.57 0.08 0.00 1.01 0.00 0.00 42.92 40.42 1r1i s ASP 342 CO 0.53 -0.56 0.42 -0.69 0.21 0.00 0.00 175.17 175.09 1r1i s VAL 343 N -1.81 -0.34 -0.24 -1.27 1.01 2.01 -4.64 120.40 115.12 1r1i s VAL 343 Ca 0.61 0.13 -0.25 0.00 0.00 0.00 0.00 61.98 62.47 1r1i s VAL 343 Cb -0.19 -0.65 -0.01 0.00 0.00 0.00 0.00 36.38 35.54 1r1i s VAL 343 CO 0.23 0.05 0.83 -0.69 0.00 0.00 0.00 175.10 175.53 1r1i s VAL 344 N 2.01 4.84 -0.25 2.92 1.01 -0.87 0.13 120.40 130.20 1r1i s VAL 344 Ca -0.06 1.57 -0.09 0.00 0.00 0.00 0.00 61.98 63.40 1r1i s VAL 344 Cb -0.10 -4.12 -0.04 0.00 0.00 0.00 0.00 36.38 32.12 1r1i s VAL 344 CO -0.13 -0.07 0.12 -0.69 0.00 0.00 0.00 175.10 174.33 1r1i s VAL 345 N 2.81 4.81 -0.56 2.92 1.01 -0.13 -1.93 120.40 129.33 1r1i s VAL 345 Ca 0.35 -0.01 0.22 0.00 0.00 0.00 0.00 61.98 62.55 1r1i s VAL 345 Cb -0.15 -3.25 -0.17 0.00 0.00 0.00 0.00 36.38 32.81 1r1i s VAL 345 CO 0.07 0.32 0.92 -1.22 0.00 0.00 0.00 175.10 175.19 1r1i n TYR 346 N 4.76 0.20 -2.64 5.22 4.01 -0.30 -3.32 117.16 125.10 1r1i n TYR 346 Ca -0.15 0.06 -0.11 0.00 -0.16 0.00 0.00 57.90 57.53 1r1i n TYR 346 Cb 0.52 -0.40 0.03 0.00 -0.31 0.00 0.00 39.34 39.18 1r1i n TYR 346 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1r1i n ALA 347 N -1.86 3.65 -0.01 -0.72 0.00 -1.25 -4.91 120.51 115.41 1r1i n ALA 347 Ca 0.01 -3.30 -0.00 0.00 0.00 0.00 0.00 53.44 50.15 1r1i n ALA 347 Cb 0.45 -0.87 -0.00 0.00 0.00 0.00 0.00 19.45 19.02 1r1i n ALA 347 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1r1i n PRO 348 N -0.15 -0.01 0.05 0.00 -0.02 -1.26 -0.30 135.00 133.31 1r1i n PRO 348 Ca 0.14 0.38 0.06 0.00 -2.02 0.00 0.00 63.50 62.06 1r1i n PRO 348 Cb 0.80 -0.57 0.48 0.00 -0.02 0.00 0.00 33.50 34.19 1r1i n PRO 348 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 1r1i h GLU 349 N 0.00 0.40 -0.55 -0.52 4.11 -1.96 -0.89 114.58 115.17 1r1i h GLU 349 Ca 0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.36 59.41 1r1i h GLU 349 Cb 0.01 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.14 1r1i h GLU 349 CO -0.02 0.27 0.35 -0.92 0.07 0.00 0.00 179.01 178.76 1r1i h TYR 350 N 0.41 0.70 0.00 2.06 5.03 -0.87 -1.38 116.97 122.92 1r1i h TYR 350 Ca 0.13 0.01 -0.25 0.00 2.58 0.00 0.00 58.73 61.21 1r1i h TYR 350 Cb 0.04 -0.23 -0.04 0.00 1.55 0.00 0.00 36.73 38.04 1r1i h TYR 350 CO -0.00 0.45 -1.37 -0.07 -1.32 0.00 0.00 178.16 175.85 1r1i h LEU 351 N 0.75 0.00 -1.61 2.82 3.38 -0.64 -2.35 115.31 117.66 1r1i h LEU 351 Ca 0.20 0.00 0.20 0.00 0.09 0.00 0.00 57.88 58.37 1r1i h LEU 351 Cb -0.06 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.63 1r1i h LEU 351 CO -0.04 0.98 0.57 0.74 0.09 0.00 0.00 178.44 180.78 1r1i h THR 352 N 0.00 0.69 0.00 0.22 2.02 -0.68 -3.11 112.91 112.05 1r1i h THR 352 Ca -0.16 -0.12 -0.02 0.00 0.77 0.00 0.00 66.41 66.88 1r1i h THR 352 Cb 1.89 0.32 -0.00 0.00 -1.74 0.00 0.00 68.15 68.61 1r1i h THR 352 CO 0.10 0.06 -1.67 1.17 0.37 0.00 0.00 175.52 175.56 1r1i n LYS 353 N -4.47 0.64 0.13 6.66 3.00 -0.57 -3.92 118.16 119.63 1r1i n LYS 353 Ca 0.18 -0.07 -0.23 0.00 -0.00 0.00 0.00 58.31 58.19 1r1i n LYS 353 Cb 0.69 -1.63 -0.15 0.00 0.00 0.00 0.00 35.03 33.93 1r1i n LYS 353 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.40 178.65 1r1i h LEU 354 N 0.00 0.73 -0.82 3.14 5.85 -1.36 -3.33 115.31 119.52 1r1i h LEU 354 Ca -0.03 -0.81 0.12 0.00 0.84 0.00 0.00 57.88 58.00 1r1i h LEU 354 Cb 1.08 -0.24 -0.13 0.00 0.37 0.00 0.00 40.66 41.74 1r1i h LEU 354 CO 0.00 1.64 -0.41 0.50 -0.34 0.00 0.00 178.44 179.84 1r1i h LYS 355 N 0.13 -0.08 -0.53 1.25 3.64 -1.68 1.45 116.57 120.74 1r1i h LYS 355 Ca -0.24 0.01 0.11 0.00 -1.27 0.00 0.00 60.65 59.25 1r1i h LYS 355 Cb 2.12 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 33.93 1r1i h LYS 355 CO 0.25 -0.05 0.36 -1.00 -2.27 0.00 0.00 179.45 176.74 1r1i h PRO 356 N -0.08 0.24 0.01 1.90 0.13 -1.79 0.14 132.00 132.56 1r1i h PRO 356 Ca 0.27 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 65.38 1r1i h PRO 356 Cb 0.56 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 31.64 1r1i h PRO 356 CO -0.85 0.16 -0.01 0.82 -0.23 0.00 0.00 178.00 177.89 1r1i h ILE 357 N 0.25 0.00 0.00 -3.56 2.04 0.14 -3.36 117.51 113.02 1r1i h ILE 357 Ca 0.25 -0.81 -0.00 0.00 1.00 0.00 0.00 64.86 65.30 1r1i h ILE 357 Cb 0.65 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.73 1r1i h ILE 357 CO -0.05 0.00 -0.00 -0.07 0.00 0.00 0.00 178.15 178.03 1r1i h LEU 358 N -0.82 0.00 -1.08 1.44 4.07 0.82 -0.38 115.31 119.35 1r1i h LEU 358 Ca -0.00 0.00 0.16 0.00 0.08 0.00 0.00 57.88 58.12 1r1i h LEU 358 Cb 0.01 0.00 -0.09 0.00 1.08 0.00 0.00 40.66 41.66 1r1i h LEU 358 CO 0.00 0.00 0.62 0.71 -1.08 0.00 0.00 178.44 178.69 1r1i h THR 359 N 0.00 0.80 -0.69 0.22 1.35 -0.86 -2.82 112.91 110.91 1r1i h THR 359 Ca -0.00 -0.28 0.00 0.00 -0.55 0.00 0.00 66.41 65.58 1r1i h THR 359 Cb 0.12 -0.09 0.00 0.00 -1.73 0.00 0.00 68.15 66.45 1r1i h THR 359 CO 0.00 0.15 0.00 2.29 -0.25 0.00 0.00 175.52 177.71 1r1i n LYS 360 N -4.66 3.29 -4.91 4.72 2.85 -0.15 -4.91 118.16 114.38 1r1i n LYS 360 Ca 0.21 -2.80 -0.31 0.00 -1.05 0.00 0.00 58.31 54.36 1r1i n LYS 360 Cb 0.49 -1.75 -0.14 0.00 -0.65 0.00 0.00 35.03 32.98 1r1i n LYS 360 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 1r1i s TYR 361 N -1.46 2.42 0.72 5.58 2.02 -1.06 -5.12 117.35 120.45 1r1i s TYR 361 Ca 0.51 -0.36 -0.13 0.00 -0.37 0.00 0.00 57.07 56.72 1r1i s TYR 361 Cb 0.30 -1.45 0.03 0.00 -0.40 0.00 0.00 41.96 40.44 1r1i s TYR 361 CO 0.29 0.14 1.13 -1.54 -1.57 0.00 0.00 175.55 173.99 1r1i s SER 362 N -1.15 4.60 0.41 2.29 1.04 -1.26 -4.45 113.70 115.18 1r1i s SER 362 Ca 0.12 2.04 0.21 0.00 0.48 0.00 0.00 55.95 58.80 1r1i s SER 362 Cb -0.10 -2.55 1.16 0.00 0.10 0.00 0.00 66.02 64.63 1r1i s SER 362 CO 0.02 -1.97 1.76 0.00 0.98 0.00 0.00 173.24 174.03 1r1i h ALA 363 N -0.47 2.33 0.16 5.32 0.00 -1.96 -2.46 119.26 122.17 1r1i h ALA 363 Ca -0.46 0.06 -0.25 0.00 0.00 0.00 0.00 54.91 54.27 1r1i h ALA 363 Cb 1.25 0.05 0.03 0.00 0.00 0.00 0.00 17.79 19.12 1r1i h ALA 363 CO 0.51 -0.75 -1.06 -0.09 0.00 0.00 0.00 179.25 177.86 1r1i h ARG 364 N 0.34 0.43 -0.96 0.00 2.43 -2.00 -3.14 114.38 111.48 1r1i h ARG 364 Ca 0.61 -0.68 0.25 0.00 -0.81 0.00 0.00 59.98 59.36 1r1i h ARG 364 Cb 1.65 0.25 -0.18 0.00 -0.42 0.00 0.00 29.97 31.26 1r1i h ARG 364 CO -0.29 1.31 -0.02 -0.25 -1.51 0.00 0.00 179.97 179.21 1r1i n ASP 365 N -3.97 -0.15 0.04 -3.80 8.00 -0.95 -2.54 116.55 113.19 1r1i n ASP 365 Ca -0.14 1.64 -0.13 0.00 0.71 0.00 0.00 54.79 56.86 1r1i n ASP 365 Cb 0.92 -0.58 -0.14 0.00 -0.02 0.00 0.00 41.12 41.30 1r1i n ASP 365 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1r1i h LEU 366 N 0.00 0.23 -0.50 0.64 3.38 -1.51 -3.31 115.31 114.25 1r1i h LEU 366 Ca 0.56 -0.35 -0.04 0.00 0.09 0.00 0.00 57.88 58.14 1r1i h LEU 366 Cb 1.13 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.79 1r1i h LEU 366 CO -0.92 1.30 -0.20 -0.61 0.09 0.00 0.00 178.44 178.10 1r1i h GLN 367 N 0.04 0.00 -0.60 1.13 5.75 -1.45 0.57 115.11 120.55 1r1i h GLN 367 Ca -0.23 0.00 -0.09 0.00 -0.15 0.00 0.00 58.65 58.19 1r1i h GLN 367 Cb 1.98 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 30.50 1r1i h GLN 367 CO 0.13 0.20 0.03 -0.91 -2.65 0.00 0.00 178.83 175.63 1r1i h ASN 368 N 0.00 1.02 0.47 -0.69 -0.26 -1.58 0.21 115.58 114.75 1r1i h ASN 368 Ca -0.00 -0.29 -0.02 0.00 -0.56 0.00 0.00 56.30 55.42 1r1i h ASN 368 Cb 0.97 -0.27 0.00 0.00 -1.06 0.00 0.00 38.32 37.96 1r1i h ASN 368 CO 0.03 1.06 -0.23 0.25 -1.06 0.00 0.00 177.43 177.48 1r1i h LEU 369 N 0.94 -0.53 -0.42 1.61 7.12 -1.57 -2.27 115.31 120.19 1r1i h LEU 369 Ca 0.17 -0.08 -0.13 0.00 0.13 0.00 0.00 57.88 57.98 1r1i h LEU 369 Cb 0.52 0.14 -0.01 0.00 -0.53 0.00 0.00 40.66 40.78 1r1i h LEU 369 CO 0.03 -0.21 -0.23 0.24 -0.13 0.00 0.00 178.44 178.14 1r1i h MET 370 N -0.88 0.89 -0.24 1.25 0.00 -0.80 -1.22 114.93 113.93 1r1i h MET 370 Ca -0.06 -0.40 -0.11 0.00 0.00 0.00 0.00 59.70 59.12 1r1i h MET 370 Cb 0.58 -0.02 -0.01 0.00 0.00 0.00 0.00 31.60 32.15 1r1i h MET 370 CO 0.11 1.05 -0.32 1.03 0.00 0.00 0.00 176.91 178.78 1r1i h SER 371 N 0.71 0.50 0.36 1.22 0.87 -0.72 -2.64 113.55 113.85 1r1i h SER 371 Ca 0.09 -0.19 0.00 0.00 -1.23 0.00 0.00 61.79 60.46 1r1i h SER 371 Cb 0.81 -0.14 0.00 0.00 -0.44 0.00 0.00 62.40 62.63 1r1i h SER 371 CO 0.07 0.79 0.00 1.87 -0.53 0.00 0.00 176.83 179.03 1r1i n TRP 372 N -4.08 0.00 -0.05 2.24 -0.00 -0.81 -1.91 117.44 112.83 1r1i n TRP 372 Ca -0.01 0.00 -0.05 0.00 -0.00 0.00 0.00 57.50 57.44 1r1i n TRP 372 Cb 0.45 -0.20 -0.14 0.00 -0.00 0.00 0.00 31.31 31.42 1r1i n TRP 372 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 177.69 178.23 1r1i n ARG 373 N -1.20 0.66 -0.17 5.87 5.12 -0.53 -3.05 116.66 123.37 1r1i n ARG 373 Ca 0.16 0.05 -0.11 0.00 -1.93 0.00 0.00 57.85 56.02 1r1i n ARG 373 Cb 0.18 -1.62 0.01 0.00 -1.16 0.00 0.00 32.46 29.87 1r1i n ARG 373 CO 0.00 0.00 0.00 0.35 -1.93 0.00 0.00 177.63 176.05 1r1i h PHE 374 N 0.00 1.16 0.05 -1.55 3.57 -1.38 -3.37 116.94 115.40 1r1i h PHE 374 Ca -0.36 -0.27 -0.24 0.00 3.53 0.00 0.00 57.97 60.64 1r1i h PHE 374 Cb 1.91 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 40.35 1r1i h PHE 374 CO 0.00 1.10 -1.13 0.82 -2.23 0.00 0.00 178.31 176.87 1r1i h ILE 375 N 0.89 1.59 0.00 1.41 2.04 -1.49 -2.90 117.51 119.04 1r1i h ILE 375 Ca 0.12 -3.25 0.00 0.00 1.00 0.00 0.00 64.86 62.73 1r1i h ILE 375 Cb 0.76 2.86 0.00 0.00 -0.74 0.00 0.00 36.82 39.69 1r1i h ILE 375 CO 0.06 0.92 0.00 0.80 0.00 0.00 0.00 178.15 179.93 1r1i n MET 376 N -3.40 0.00 -0.07 2.37 1.56 -1.17 -2.01 117.12 114.40 1r1i n MET 376 Ca -0.04 0.60 -0.02 0.00 -0.27 0.00 0.00 57.70 57.97 1r1i n MET 376 Cb 0.98 -0.91 0.23 0.00 2.15 0.00 0.00 33.22 35.67 1r1i n MET 376 CO 0.00 0.00 0.00 -0.44 -0.73 0.00 0.00 175.97 174.80 1r1i h ASP 377 N 0.00 0.65 0.50 6.12 3.45 -1.69 -2.47 116.42 122.97 1r1i h ASP 377 Ca 0.00 -0.12 -0.04 0.00 0.43 0.00 0.00 57.03 57.30 1r1i h ASP 377 Cb 0.00 -0.17 -0.01 0.00 -0.56 0.00 0.00 39.33 38.59 1r1i h ASP 377 CO 0.00 0.68 -0.17 -0.07 -1.57 0.00 0.00 179.24 178.12 1r1i h LEU 378 N 0.67 0.00 -1.75 1.55 3.38 -1.32 -3.25 115.31 114.59 1r1i h LEU 378 Ca 0.14 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.15 1r1i h LEU 378 Cb 0.33 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 1r1i h LEU 378 CO 0.01 0.17 0.23 1.62 0.09 0.00 0.00 178.44 180.55 1r1i h VAL 379 N 0.00 1.01 0.00 1.22 3.04 -0.91 0.46 116.25 121.07 1r1i h VAL 379 Ca -0.00 -0.11 0.00 0.00 -1.01 0.00 0.00 66.70 65.58 1r1i h VAL 379 Cb 0.46 0.65 0.00 0.00 -2.01 0.00 0.00 31.29 30.39 1r1i h VAL 379 CO 0.02 0.06 0.00 -1.54 -1.01 0.00 0.00 177.57 175.10 1r1i n SER 380 N -4.49 0.00 -1.05 3.17 3.41 -1.23 -2.72 113.62 110.72 1r1i n SER 380 Ca 0.03 -0.48 0.05 0.00 -0.26 0.00 0.00 58.87 58.21 1r1i n SER 380 Cb 0.17 -0.17 0.21 0.00 -0.26 0.00 0.00 64.21 64.16 1r1i n SER 380 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1r1i n SER 381 N -1.17 3.00 0.00 4.04 7.64 0.16 -4.92 113.62 122.37 1r1i n SER 381 Ca 0.18 -2.27 0.00 0.00 1.01 0.00 0.00 58.87 57.79 1r1i n SER 381 Cb 0.19 -0.45 0.00 0.00 -1.01 0.00 0.00 64.21 62.94 1r1i n SER 381 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1r1i n LEU 382 N 0.55 0.00 -4.76 -3.43 4.77 -1.10 -4.60 117.00 108.42 1r1i n LEU 382 Ca 0.15 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.83 1r1i n LEU 382 Cb 0.58 0.00 0.10 0.00 -2.33 0.00 0.00 43.42 41.77 1r1i n LEU 382 CO 0.14 0.00 0.69 -0.94 -1.33 0.00 0.00 177.39 175.95 1r1i s SER 383 N 1.00 4.20 0.25 -1.43 1.04 -1.24 -4.69 113.70 112.83 1r1i s SER 383 Ca 0.00 1.56 -0.11 0.00 0.48 0.00 0.00 55.95 57.88 1r1i s SER 383 Cb 0.00 -2.28 0.36 0.00 0.10 0.00 0.00 66.02 64.20 1r1i s SER 383 CO 0.00 -2.19 1.59 -0.09 0.98 0.00 0.00 173.24 173.53 1r1i h ARG 384 N -1.24 -0.00 -0.78 4.02 9.65 -1.93 -1.03 114.38 123.07 1r1i h ARG 384 Ca -0.47 0.00 0.08 0.00 -1.10 0.00 0.00 59.98 58.50 1r1i h ARG 384 Cb 1.26 0.00 -0.05 0.00 -1.39 0.00 0.00 29.97 29.79 1r1i h ARG 384 CO 0.55 -0.00 0.51 1.15 2.80 0.00 0.00 179.97 184.98 1r1i h THR 385 N -0.00 0.98 -0.16 0.20 2.02 -1.98 0.69 112.91 114.66 1r1i h THR 385 Ca 0.40 -0.26 -0.15 0.00 0.77 0.00 0.00 66.41 67.17 1r1i h THR 385 Cb 0.61 0.15 0.00 0.00 -1.74 0.00 0.00 68.15 67.17 1r1i h THR 385 CO -0.86 0.14 -0.49 1.88 0.37 0.00 0.00 175.52 176.56 1r1i h TYR 386 N 0.76 0.80 0.52 3.16 0.05 -1.55 -3.29 116.97 117.42 1r1i h TYR 386 Ca 0.35 -0.32 -0.02 0.00 0.05 0.00 0.00 58.73 58.79 1r1i h TYR 386 Cb 0.37 -0.14 -0.00 0.00 1.01 0.00 0.00 36.73 37.97 1r1i h TYR 386 CO -0.00 1.10 -0.32 0.87 -1.05 0.00 0.00 178.16 178.76 1r1i h LYS 387 N 0.27 -0.77 -0.40 4.88 1.57 0.11 0.14 116.57 122.38 1r1i h LYS 387 Ca -0.02 0.05 0.14 0.00 -1.87 0.00 0.00 60.65 58.95 1r1i h LYS 387 Cb 1.11 0.17 -0.07 0.00 0.08 0.00 0.00 32.23 33.52 1r1i h LYS 387 CO 0.10 -0.51 0.11 -1.91 -0.57 0.00 0.00 179.45 176.67 1r1i n GLU 388 N -5.45 -0.03 0.16 3.15 2.13 0.17 -1.34 120.64 119.44 1r1i n GLU 388 Ca -0.12 0.58 0.05 0.00 0.66 0.00 0.00 57.16 58.33 1r1i n GLU 388 Cb 0.35 -0.97 0.28 0.00 0.27 0.00 0.00 31.44 31.37 1r1i n GLU 388 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 1r1i n SER 389 N -4.16 0.27 0.00 4.31 3.41 0.50 -1.56 113.62 116.39 1r1i n SER 389 Ca 0.12 0.49 0.00 0.00 -0.26 0.00 0.00 58.87 59.22 1r1i n SER 389 Cb 0.41 -0.40 0.00 0.00 -0.26 0.00 0.00 64.21 63.96 1r1i n SER 389 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 1r1i n ARG 390 N -1.98 1.55 0.15 4.33 0.63 -0.45 -4.61 116.66 116.28 1r1i n ARG 390 Ca -0.01 -1.02 -0.07 0.00 -0.92 0.00 0.00 57.85 55.84 1r1i n ARG 390 Cb 0.41 -0.78 -0.03 0.00 0.45 0.00 0.00 32.46 32.51 1r1i n ARG 390 CO 0.00 0.00 0.00 -0.91 -2.51 0.00 0.00 177.63 174.21 1r1i h ASN 391 N 0.00 -0.40 -0.03 6.15 2.35 -1.45 -2.96 115.58 119.24 1r1i h ASN 391 Ca 0.00 0.02 0.01 0.00 -0.55 0.00 0.00 56.30 55.78 1r1i h ASN 391 Cb 0.70 0.11 -0.00 0.00 0.05 0.00 0.00 38.32 39.18 1r1i h ASN 391 CO 0.00 -0.25 0.03 0.00 -1.65 0.00 0.00 177.43 175.55 1r1i h ALA 392 N -1.71 1.88 -0.02 -0.83 0.00 -1.84 0.67 119.26 117.42 1r1i h ALA 392 Ca -0.04 -0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.70 1r1i h ALA 392 Cb 0.32 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1r1i h ALA 392 CO 0.05 -0.05 -0.76 0.35 0.00 0.00 0.00 179.25 178.84 1r1i h PHE 393 N 0.00 0.20 0.00 0.00 3.04 -1.82 0.11 116.94 118.47 1r1i h PHE 393 Ca 0.02 -0.10 -0.17 0.00 3.98 0.00 0.00 57.97 61.70 1r1i h PHE 393 Cb 0.07 -0.03 -0.03 0.00 2.56 0.00 0.00 35.95 38.53 1r1i h PHE 393 CO 0.00 0.85 -1.08 0.07 -2.02 0.00 0.00 178.31 176.13 1r1i h ARG 394 N 0.09 0.00 -0.56 1.11 0.11 -0.73 -2.72 114.38 111.69 1r1i h ARG 394 Ca -0.02 0.00 -0.08 0.00 0.10 0.00 0.00 59.98 59.98 1r1i h ARG 394 Cb 1.34 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 32.39 1r1i h ARG 394 CO 0.11 0.48 0.03 -0.22 0.10 0.00 0.00 179.97 180.47 1r1i h LYS 395 N 0.00 0.93 -0.27 0.08 3.64 -1.21 0.75 116.57 120.48 1r1i h LYS 395 Ca -0.10 -0.26 -0.06 0.00 -1.27 0.00 0.00 60.65 58.96 1r1i h LYS 395 Cb 1.59 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 33.29 1r1i h LYS 395 CO 0.07 0.90 -0.11 0.00 -2.27 0.00 0.00 179.45 178.04 1r1i h ALA 396 N 1.16 1.32 0.02 5.00 0.00 -0.83 -1.36 119.26 124.57 1r1i h ALA 396 Ca 0.17 -0.25 -0.33 0.00 0.00 0.00 0.00 54.91 54.50 1r1i h ALA 396 Cb 0.46 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.08 1r1i h ALA 396 CO 0.02 0.46 -1.98 1.28 0.00 0.00 0.00 179.25 179.02 1r1i n LEU 397 N -4.23 1.17 0.00 0.00 4.77 -1.02 -4.70 117.00 112.99 1r1i n LEU 397 Ca 0.00 0.24 0.00 0.00 -0.03 0.00 0.00 56.01 56.22 1r1i n LEU 397 Cb 0.30 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 1r1i n LEU 397 CO 0.40 0.54 -0.14 -1.22 -1.33 0.00 0.00 177.39 175.64 1r1i n TYR 398 N -3.07 0.00 -0.82 -1.77 4.01 0.26 -4.02 117.16 111.74 1r1i n TYR 398 Ca -0.26 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.48 1r1i n TYR 398 Cb 1.07 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 40.10 1r1i n TYR 398 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1r1i n GLY 399 N 1.03 0.89 3.86 2.72 0.00 -0.51 -4.26 105.19 108.91 1r1i n GLY 399 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1r1i n GLY 399 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1r1i s THR 400 N -3.53 4.82 -1.07 2.61 -4.23 -1.26 -4.90 115.64 108.09 1r1i s THR 400 Ca 0.00 0.67 0.12 0.00 -1.18 0.00 0.00 61.69 61.30 1r1i s THR 400 Cb 0.00 -3.63 -0.01 0.00 1.34 0.00 0.00 72.50 70.20 1r1i s THR 400 CO 0.00 -0.17 0.69 0.35 -0.54 0.00 0.00 174.62 174.96 1r1i n THR 401 N -0.36 0.00 -3.86 3.99 -2.24 -0.79 -3.75 114.28 107.26 1r1i n THR 401 Ca 0.02 -0.36 -0.09 0.00 -2.27 0.00 0.00 64.05 61.35 1r1i n THR 401 Cb 0.53 1.13 -0.07 0.00 -2.10 0.00 0.00 70.33 69.82 1r1i n THR 401 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1r1i s SER 402 N -1.59 0.12 0.47 3.42 0.15 -1.19 -5.06 113.70 110.01 1r1i s SER 402 Ca 0.10 -0.62 -0.11 0.00 0.70 0.00 0.00 55.95 56.01 1r1i s SER 402 Cb 0.10 0.33 -0.06 0.00 -1.71 0.00 0.00 66.02 64.67 1r1i s SER 402 CO 0.32 -0.70 0.86 -0.70 1.20 0.00 0.00 173.24 174.22 1r1i s GLU 403 N -3.67 3.76 0.69 5.44 2.56 -1.26 -4.42 118.70 121.80 1r1i s GLU 403 Ca 0.04 0.59 -0.16 0.00 0.00 0.00 0.00 54.97 55.44 1r1i s GLU 403 Cb 0.04 -2.28 0.02 0.00 2.00 0.00 0.00 34.13 33.91 1r1i s GLU 403 CO -0.10 -0.19 1.21 -0.08 -0.56 0.00 0.00 175.26 175.53 1r1i s THR 404 N -2.60 2.43 0.18 -1.70 -1.32 -1.26 -4.89 115.64 106.47 1r1i s THR 404 Ca 0.53 0.22 -0.32 0.00 -1.21 0.00 0.00 61.69 60.91 1r1i s THR 404 Cb -0.10 -2.86 -0.16 0.00 -1.51 0.00 0.00 72.50 67.88 1r1i s THR 404 CO 0.36 -0.10 1.13 0.00 -2.21 0.00 0.00 174.62 173.81 1r1i n ALA 405 N -2.43 -0.80 -0.27 11.08 0.00 -1.26 -4.68 120.51 122.16 1r1i n ALA 405 Ca 0.13 0.46 0.00 0.00 0.00 0.00 0.00 53.44 54.03 1r1i n ALA 405 Cb 0.50 -2.01 0.13 0.00 0.00 0.00 0.00 19.45 18.07 1r1i n ALA 405 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1r1i h THR 406 N 2.56 0.97 -0.28 0.00 2.02 -1.99 0.24 112.91 116.43 1r1i h THR 406 Ca -0.43 -0.27 -0.01 0.00 0.77 0.00 0.00 66.41 66.47 1r1i h THR 406 Cb 1.35 0.11 -0.01 0.00 -1.74 0.00 0.00 68.15 67.85 1r1i h THR 406 CO 0.69 0.14 0.13 4.11 0.37 0.00 0.00 175.52 180.96 1r1i h TRP 407 N 0.79 0.37 0.65 3.16 5.08 -1.96 -1.68 115.95 122.36 1r1i h TRP 407 Ca 0.35 -0.00 -0.03 0.00 1.08 0.00 0.00 58.89 60.29 1r1i h TRP 407 Cb 0.24 -0.12 0.01 0.00 -3.00 0.00 0.00 29.16 26.28 1r1i h TRP 407 CO -0.06 0.28 -0.31 0.00 -1.28 0.00 0.00 178.44 177.06 1r1i h ARG 408 N 0.38 -0.84 -0.58 0.12 3.08 -0.93 0.25 114.38 115.86 1r1i h ARG 408 Ca 0.10 0.06 0.17 0.00 0.07 0.00 0.00 59.98 60.37 1r1i h ARG 408 Cb 0.05 0.19 -0.02 0.00 0.08 0.00 0.00 29.97 30.26 1r1i h ARG 408 CO -0.01 -0.56 0.64 0.00 -1.07 0.00 0.00 179.97 178.97 1r1i h ARG 409 N -1.17 0.00 0.00 0.04 3.08 -0.81 -1.86 114.38 113.66 1r1i h ARG 409 Ca -0.09 0.00 -0.26 0.00 0.07 0.00 0.00 59.98 59.70 1r1i h ARG 409 Cb 0.67 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.68 1r1i h ARG 409 CO 0.15 0.00 -1.53 0.00 -1.07 0.00 0.00 179.97 177.52 1r1i n ALA 411 N -3.75 0.05 0.20 0.00 0.00 0.84 -1.40 120.51 116.46 1r1i n ALA 411 Ca -0.35 0.95 0.04 0.00 0.00 0.00 0.00 53.44 54.09 1r1i n ALA 411 Cb 0.68 -0.50 0.42 0.00 0.00 0.00 0.00 19.45 20.05 1r1i n ALA 411 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1r1i h ASN 412 N 0.00 0.00 -0.31 0.00 2.35 -1.21 -1.66 115.58 114.75 1r1i h ASN 412 Ca 0.38 0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 55.97 1r1i h ASN 412 Cb 0.60 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.96 1r1i h ASN 412 CO -0.92 0.32 -0.38 0.22 -1.65 0.00 0.00 177.43 175.02 1r1i h TYR 413 N 0.00 1.03 0.17 1.19 5.03 -0.35 -2.46 116.97 121.58 1r1i h TYR 413 Ca -0.00 -0.30 -0.30 0.00 2.58 0.00 0.00 58.73 60.70 1r1i h TYR 413 Cb 0.60 -0.22 0.01 0.00 1.55 0.00 0.00 36.73 38.67 1r1i h TYR 413 CO 0.00 1.10 -1.38 -0.39 -1.32 0.00 0.00 178.16 176.17 1r1i h VAL 414 N 0.71 1.36 -1.01 1.81 -1.51 -1.24 -1.72 116.25 114.65 1r1i h VAL 414 Ca 0.06 -2.89 0.23 0.00 -1.23 0.00 0.00 66.70 62.87 1r1i h VAL 414 Cb 0.95 2.95 -0.11 0.00 -2.13 0.00 0.00 31.29 32.95 1r1i h VAL 414 CO 0.09 0.86 0.62 -1.13 -1.23 0.00 0.00 177.57 176.77 1r1i h ASN 415 N 0.10 0.65 1.51 4.19 -1.24 -1.35 0.55 115.58 119.99 1r1i h ASN 415 Ca -0.20 0.11 -0.09 0.00 0.71 0.00 0.00 56.30 56.83 1r1i h ASN 415 Cb 2.05 -0.00 -0.01 0.00 0.73 0.00 0.00 38.32 41.08 1r1i h ASN 415 CO 0.22 0.17 -0.50 1.23 -1.29 0.00 0.00 177.43 177.26 1r1i h GLY 416 N 0.60 0.00 0.00 1.57 0.00 -1.22 -2.89 103.07 101.13 1r1i h GLY 416 Ca 0.60 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.93 1r1i h GLY 416 CO -0.39 0.00 -1.34 0.70 0.00 0.00 0.00 176.54 175.51 1r1i n ASN 417 N -3.16 0.82 -2.71 0.19 3.02 -0.06 -4.50 115.26 108.87 1r1i n ASN 417 Ca 0.01 -0.46 -0.09 0.00 -0.03 0.00 0.00 54.58 54.02 1r1i n ASN 417 Cb 0.70 1.42 0.05 0.00 -0.61 0.00 0.00 39.78 41.34 1r1i n ASN 417 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 1r1i n MET 418 N -1.78 1.14 0.13 3.52 2.81 0.17 -4.98 117.12 118.14 1r1i n MET 418 Ca -0.00 -2.90 0.03 0.00 -1.81 0.00 0.00 57.70 53.01 1r1i n MET 418 Cb 0.38 -1.00 0.40 0.00 -0.71 0.00 0.00 33.22 32.29 1r1i n MET 418 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 1r1i h GLU 419 N 2.77 0.20 0.02 0.03 5.08 -1.65 -0.46 114.58 120.58 1r1i h GLU 419 Ca -0.13 -0.05 -0.13 0.00 -1.00 0.00 0.00 59.36 58.06 1r1i h GLU 419 Cb 1.19 -0.03 0.01 0.00 0.50 0.00 0.00 28.75 30.43 1r1i h GLU 419 CO 0.36 0.36 -0.53 -0.91 -1.00 0.00 0.00 179.01 177.29 1r1i h ASN 420 N 0.19 0.43 0.12 1.42 2.35 -1.93 0.98 115.58 119.14 1r1i h ASN 420 Ca 0.04 -0.80 -0.10 0.00 -0.55 0.00 0.00 56.30 54.88 1r1i h ASN 420 Cb 0.39 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.61 1r1i h ASN 420 CO 0.02 1.18 -0.36 0.00 -1.65 0.00 0.00 177.43 176.63 1r1i h ALA 421 N 0.26 1.10 0.17 -0.83 0.00 -1.89 0.73 119.26 118.80 1r1i h ALA 421 Ca -0.07 -0.39 -0.30 0.00 0.00 0.00 0.00 54.91 54.15 1r1i h ALA 421 Cb 1.28 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.98 1r1i h ALA 421 CO 0.10 0.57 -1.37 0.28 0.00 0.00 0.00 179.25 178.84 1r1i h VAL 422 N 0.29 1.37 -0.81 0.00 2.07 -1.08 -3.25 116.25 114.84 1r1i h VAL 422 Ca 0.03 -2.91 0.15 0.00 0.82 0.00 0.00 66.70 64.79 1r1i h VAL 422 Cb 0.77 2.94 -0.15 0.00 -1.52 0.00 0.00 31.29 33.33 1r1i h VAL 422 CO 0.06 0.86 -0.30 1.23 0.02 0.00 0.00 177.57 179.44 1r1i h GLY 423 N 1.16 0.25 0.40 2.17 0.00 0.19 -2.28 103.07 104.98 1r1i h GLY 423 Ca -0.19 0.39 0.05 0.00 0.00 0.00 0.00 47.33 47.58 1r1i h GLY 423 CO 0.22 -0.26 -0.16 -0.09 0.00 0.00 0.00 176.54 176.25 1r1i h ARG 424 N -0.05 -0.17 -0.62 4.80 2.43 -0.92 -2.85 114.38 117.00 1r1i h ARG 424 Ca 0.34 0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.48 1r1i h ARG 424 Cb 0.59 0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 30.15 1r1i h ARG 424 CO -0.85 -0.12 0.20 -0.07 -1.51 0.00 0.00 179.97 177.63 1r1i h LEU 425 N -0.18 0.86 -0.85 3.80 3.38 -1.53 -2.83 115.31 117.96 1r1i h LEU 425 Ca 0.11 -0.14 -0.05 0.00 0.09 0.00 0.00 57.88 57.89 1r1i h LEU 425 Cb 0.34 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 1r1i h LEU 425 CO -0.27 0.80 0.26 0.22 0.09 0.00 0.00 178.44 179.54 1r1i h TYR 426 N 0.90 1.14 -0.05 1.13 3.20 -1.24 -1.42 116.97 120.63 1r1i h TYR 426 Ca 0.20 -0.10 -0.02 0.00 3.14 0.00 0.00 58.73 61.96 1r1i h TYR 426 Cb 0.25 -0.34 -0.00 0.00 1.54 0.00 0.00 36.73 38.18 1r1i h TYR 426 CO 0.02 0.88 -0.05 -0.39 -1.64 0.00 0.00 178.16 176.98 1r1i h VAL 427 N 1.08 1.38 -0.71 1.81 -1.51 -1.42 -1.55 116.25 115.33 1r1i h VAL 427 Ca 0.24 -1.23 0.14 0.00 -1.23 0.00 0.00 66.70 64.62 1r1i h VAL 427 Cb 0.25 2.10 -0.10 0.00 -2.13 0.00 0.00 31.29 31.42 1r1i h VAL 427 CO -0.01 0.33 0.23 -0.33 -1.23 0.00 0.00 177.57 176.56 1r1i h GLU 428 N -0.34 0.35 -0.35 5.19 5.08 -1.53 0.28 114.58 123.26 1r1i h GLU 428 Ca 0.01 -0.02 -0.06 0.00 -1.00 0.00 0.00 59.36 58.28 1r1i h GLU 428 Cb 0.56 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.72 1r1i h GLU 428 CO 0.01 0.23 -0.05 0.00 -1.00 0.00 0.00 179.01 178.20 1r1i h ALA 429 N 1.54 1.26 0.00 3.43 0.00 -1.08 -3.42 119.26 120.98 1r1i h ALA 429 Ca 0.39 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1r1i h ALA 429 Cb 0.61 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1r1i h ALA 429 CO -0.43 0.49 -0.13 0.00 0.00 0.00 0.00 179.25 179.19 1r1i n ALA 430 N -2.48 1.19 -3.00 0.00 0.00 -0.60 -5.09 120.51 110.54 1r1i n ALA 430 Ca 0.01 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.33 1r1i n ALA 430 Cb 0.29 0.03 -0.14 0.00 0.00 0.00 0.00 19.45 19.63 1r1i n ALA 430 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1r1i s PHE 431 N -1.13 0.05 -0.16 0.00 2.19 -0.00 -4.99 117.98 113.94 1r1i s PHE 431 Ca 0.00 0.01 0.11 0.00 0.33 0.00 0.00 56.93 57.38 1r1i s PHE 431 Cb 0.00 -0.07 -0.23 0.00 -1.31 0.00 0.00 43.02 41.41 1r1i s PHE 431 CO 0.00 -0.02 0.20 0.00 1.83 0.00 0.00 175.22 177.24 1r1i n ALA 432 N 3.24 1.42 0.00 11.12 0.00 -1.26 -4.66 120.51 130.37 1r1i n ALA 432 Ca -0.15 -1.06 0.00 0.00 0.00 0.00 0.00 53.44 52.23 1r1i n ALA 432 Cb 0.58 -0.40 0.00 0.00 0.00 0.00 0.00 19.45 19.64 1r1i n ALA 432 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1r1i n GLY 433 N 1.82 2.33 0.14 0.00 0.00 -1.26 -4.77 105.19 103.46 1r1i n GLY 433 Ca -0.31 -0.49 -0.22 0.00 0.00 0.00 0.00 46.02 44.99 1r1i n GLY 433 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1r1i h GLU 434 N 0.00 0.43 0.00 1.61 4.39 -2.01 -2.53 114.58 116.47 1r1i h GLU 434 Ca 0.00 -0.73 0.00 0.00 0.34 0.00 0.00 59.36 58.97 1r1i h GLU 434 Cb 0.00 0.27 0.00 0.00 -0.10 0.00 0.00 28.75 28.92 1r1i h GLU 434 CO 0.00 1.34 0.00 0.43 -1.16 0.00 0.00 179.01 179.62 1r1i n SER 435 N -3.62 0.00 -0.25 1.42 7.64 -1.26 0.27 113.62 117.83 1r1i n SER 435 Ca -0.19 0.00 0.32 0.00 1.01 0.00 0.00 58.87 60.01 1r1i n SER 435 Cb 1.08 0.00 0.62 0.00 -1.01 0.00 0.00 64.21 64.90 1r1i n SER 435 CO 0.00 0.00 0.00 0.50 -3.01 0.00 0.00 175.04 172.53 1r1i h LYS 436 N 0.00 0.00 0.08 1.43 3.64 -1.83 0.18 116.57 120.06 1r1i h LYS 436 Ca 0.00 0.00 -0.36 0.00 -1.27 0.00 0.00 60.65 59.02 1r1i h LYS 436 Cb 0.00 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.79 1r1i h LYS 436 CO 0.00 0.00 -2.07 0.72 -2.27 0.00 0.00 179.45 175.83 1r1i n HIS 437 N -3.60 0.93 -0.03 1.91 -0.00 0.78 -2.88 115.22 112.34 1r1i n HIS 437 Ca 0.24 0.21 -0.02 0.00 -0.00 0.00 0.00 57.72 58.15 1r1i n HIS 437 Cb 1.37 -1.13 0.24 0.00 -0.00 0.00 0.00 29.99 30.48 1r1i n HIS 437 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.34 176.62 1r1i h VAL 438 N 0.05 1.22 0.70 1.59 2.07 -0.21 -3.05 116.25 118.62 1r1i h VAL 438 Ca -0.44 -0.93 -0.03 0.00 0.82 0.00 0.00 66.70 66.11 1r1i h VAL 438 Cb 2.02 1.00 0.01 0.00 -1.52 0.00 0.00 31.29 32.80 1r1i h VAL 438 CO 0.05 0.32 -0.35 0.58 0.02 0.00 0.00 177.57 178.19 1r1i h VAL 439 N 0.55 0.30 -0.72 2.57 2.07 -1.45 -1.91 116.25 117.65 1r1i h VAL 439 Ca 0.11 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.79 1r1i h VAL 439 Cb 0.42 0.30 -0.12 0.00 -1.52 0.00 0.00 31.29 30.37 1r1i h VAL 439 CO 0.02 0.00 0.09 1.05 0.02 0.00 0.00 177.57 178.75 1r1i h GLU 440 N -0.95 0.18 0.21 1.57 4.11 -1.42 0.47 114.58 118.75 1r1i h GLU 440 Ca -0.09 -0.01 -0.01 0.00 0.07 0.00 0.00 59.36 59.31 1r1i h GLU 440 Cb 0.73 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.95 1r1i h GLU 440 CO 0.15 0.12 -0.10 0.38 0.07 0.00 0.00 179.01 179.63 1r1i h ASP 441 N 0.18 -0.24 -1.00 3.06 3.04 -1.53 0.72 116.42 120.66 1r1i h ASP 441 Ca 0.40 -0.08 0.38 0.00 -3.24 0.00 0.00 57.03 54.49 1r1i h ASP 441 Cb 0.70 0.06 -0.17 0.00 -1.04 0.00 0.00 39.33 38.88 1r1i h ASP 441 CO -0.57 -0.06 0.50 -0.07 -2.04 0.00 0.00 179.24 177.00 1r1i h LEU 442 N -0.40 0.30 -0.05 0.15 3.38 0.58 0.84 115.31 120.11 1r1i h LEU 442 Ca -0.03 0.24 -0.09 0.00 0.09 0.00 0.00 57.88 58.09 1r1i h LEU 442 Cb 0.31 0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.32 1r1i h LEU 442 CO 0.05 -0.36 -0.33 0.40 0.09 0.00 0.00 178.44 178.29 1r1i h ILE 443 N 0.08 1.44 -0.27 1.22 2.04 0.15 -1.46 117.51 120.71 1r1i h ILE 443 Ca 0.80 -1.77 0.02 0.00 1.00 0.00 0.00 64.86 64.91 1r1i h ILE 443 Cb 2.02 2.41 -0.03 0.00 -0.74 0.00 0.00 36.82 40.48 1r1i h ILE 443 CO -0.74 0.51 -0.16 0.00 0.00 0.00 0.00 178.15 177.76 1r1i n ALA 444 N -2.51 -0.17 -0.29 1.87 0.00 0.23 -0.34 120.51 119.30 1r1i n ALA 444 Ca -0.09 0.23 -0.01 0.00 0.00 0.00 0.00 53.44 53.57 1r1i n ALA 444 Cb 0.51 0.32 0.06 0.00 0.00 0.00 0.00 19.45 20.34 1r1i n ALA 444 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1r1i h GLN 445 N 0.00 -0.05 0.00 0.00 4.20 0.85 0.22 115.11 120.32 1r1i h GLN 445 Ca 0.04 0.00 -0.15 0.00 0.06 0.00 0.00 58.65 58.61 1r1i h GLN 445 Cb 0.11 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.88 1r1i h GLN 445 CO -0.25 -0.04 -0.71 0.82 -0.67 0.00 0.00 178.83 177.98 1r1i h ILE 446 N -0.05 1.50 0.04 2.54 5.03 -0.13 -2.38 117.51 124.07 1r1i h ILE 446 Ca 0.33 -2.44 0.01 0.00 -0.12 0.00 0.00 64.86 62.64 1r1i h ILE 446 Cb 0.59 2.32 -0.03 0.00 -3.03 0.00 0.00 36.82 36.66 1r1i h ILE 446 CO -0.83 0.70 -0.33 0.03 -0.68 0.00 0.00 178.15 177.03 1r1i h ARG 447 N 0.00 -0.43 -0.38 2.37 3.08 0.14 -1.10 114.38 118.06 1r1i h ARG 447 Ca -0.01 0.03 0.08 0.00 0.07 0.00 0.00 59.98 60.15 1r1i h ARG 447 Cb 1.26 0.10 -0.08 0.00 0.08 0.00 0.00 29.97 31.33 1r1i h ARG 447 CO 0.09 -0.29 -0.17 1.49 -1.07 0.00 0.00 179.97 180.02 1r1i h GLU 448 N -0.45 -0.10 -0.09 0.04 4.22 -1.14 0.40 114.58 117.47 1r1i h GLU 448 Ca 0.00 0.01 0.03 0.00 0.08 0.00 0.00 59.36 59.47 1r1i h GLU 448 Cb 0.46 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.73 1r1i h GLU 448 CO -0.20 -0.07 0.07 0.28 -2.18 0.00 0.00 179.01 176.91 1r1i h VAL 449 N -0.10 0.88 -0.21 0.32 2.07 -1.29 2.60 116.25 120.52 1r1i h VAL 449 Ca 0.19 0.00 -0.16 0.00 0.82 0.00 0.00 66.70 67.54 1r1i h VAL 449 Cb 0.39 0.95 -0.00 0.00 -1.52 0.00 0.00 31.29 31.11 1r1i h VAL 449 CO -0.45 0.00 -0.54 0.15 0.02 0.00 0.00 177.57 176.75 1r1i h PHE 450 N 0.00 0.78 0.59 1.57 3.04 0.10 -2.98 116.94 120.05 1r1i h PHE 450 Ca 0.04 -0.27 -0.03 0.00 3.98 0.00 0.00 57.97 61.69 1r1i h PHE 450 Cb 0.18 -0.15 0.01 0.00 2.56 0.00 0.00 35.95 38.54 1r1i h PHE 450 CO 0.00 1.03 -0.28 0.82 -2.02 0.00 0.00 178.31 177.85 1r1i h ILE 451 N 0.48 0.33 0.00 1.41 1.08 0.27 -3.18 117.51 117.91 1r1i h ILE 451 Ca 0.01 -0.25 0.00 0.00 -0.39 0.00 0.00 64.86 64.23 1r1i h ILE 451 Cb 1.10 0.42 0.00 0.00 -3.07 0.00 0.00 36.82 35.26 1r1i h ILE 451 CO 0.11 0.03 0.00 0.00 -0.69 0.00 0.00 178.15 177.60 1r1i n GLN 452 N -5.37 0.00 -0.07 2.37 6.02 0.79 -3.02 117.38 118.12 1r1i n GLN 452 Ca -0.12 0.00 -0.09 0.00 -0.01 0.00 0.00 57.00 56.78 1r1i n GLN 452 Cb 0.35 0.00 -0.15 0.00 1.02 0.00 0.00 30.24 31.45 1r1i n GLN 452 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 1r1i n THR 453 N -3.55 1.43 -0.26 5.09 -1.04 -1.14 -3.58 114.28 111.23 1r1i n THR 453 Ca 0.00 -0.82 0.02 0.00 -2.04 0.00 0.00 64.05 61.21 1r1i n THR 453 Cb 0.00 -0.66 0.24 0.00 -1.82 0.00 0.00 70.33 68.09 1r1i n THR 453 CO 0.00 0.00 0.00 0.17 -0.64 0.00 0.00 175.07 174.60 1r1i h LEU 454 N 0.00 0.89 -1.24 -4.42 8.10 -1.65 0.74 115.31 117.73 1r1i h LEU 454 Ca -0.43 -0.01 0.24 0.00 0.11 0.00 0.00 57.88 57.79 1r1i h LEU 454 Cb 2.12 -0.21 -0.10 0.00 -0.44 0.00 0.00 40.66 42.03 1r1i h LEU 454 CO 0.05 0.61 0.64 0.44 -4.11 0.00 0.00 178.44 176.06 1r1i h ASP 455 N 1.03 0.55 0.68 0.17 3.32 -1.76 0.64 116.42 121.06 1r1i h ASP 455 Ca 0.33 0.09 0.00 0.00 0.02 0.00 0.00 57.03 57.47 1r1i h ASP 455 Cb 0.03 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.58 1r1i h ASP 455 CO -0.10 0.13 -0.45 0.47 -1.72 0.00 0.00 179.24 177.58 1r1i n ASP 456 N -4.70 0.48 -4.72 6.45 8.00 0.25 -4.79 116.55 117.52 1r1i n ASP 456 Ca 0.25 -0.04 -0.39 0.00 0.71 0.00 0.00 54.79 55.32 1r1i n ASP 456 Cb 0.78 0.10 -0.05 0.00 -0.02 0.00 0.00 41.12 41.93 1r1i n ASP 456 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1r1i s LEU 457 N -3.32 4.33 0.00 0.64 1.02 0.22 -4.95 118.68 116.63 1r1i s LEU 457 Ca 0.10 1.17 0.22 0.00 0.02 0.00 0.00 54.13 55.64 1r1i s LEU 457 Cb 0.17 -3.03 0.16 0.00 0.02 0.00 0.00 46.19 43.50 1r1i s LEU 457 CO 0.68 -0.07 1.19 1.07 0.02 0.00 0.00 176.35 179.24 1r1i n THR 458 N 3.56 0.00 1.02 5.49 5.66 -1.26 -4.21 114.28 124.55 1r1i n THR 458 Ca -0.03 -0.47 0.11 0.00 -3.05 0.00 0.00 64.05 60.61 1r1i n THR 458 Cb 0.51 1.44 0.02 0.00 -1.55 0.00 0.00 70.33 70.75 1r1i n THR 458 CO 0.00 0.00 0.00 -2.67 -3.05 0.00 0.00 175.07 169.35 1r1i n TRP 459 N 1.11 0.00 -4.10 1.09 4.27 -1.26 -4.90 117.44 113.65 1r1i n TRP 459 Ca 0.13 0.00 -0.22 0.00 -3.89 0.00 0.00 57.50 53.52 1r1i n TRP 459 Cb 0.55 -0.01 -0.04 0.00 -1.36 0.00 0.00 31.31 30.44 1r1i n TRP 459 CO 0.00 0.00 0.00 1.41 -2.29 0.00 0.00 177.69 176.81 1r1i s MET 460 N -2.55 2.93 0.31 -2.67 1.75 -1.26 -4.78 119.30 113.02 1r1i s MET 460 Ca 0.18 -1.06 0.07 0.00 -1.25 0.00 0.00 55.69 53.63 1r1i s MET 460 Cb 0.18 -2.57 -0.02 0.00 2.84 0.00 0.00 34.83 35.26 1r1i s MET 460 CO 0.61 0.39 0.34 0.16 -0.65 0.00 0.00 175.02 175.87 1r1i s ASP 461 N -3.85 5.71 0.00 1.11 3.84 -1.26 -4.92 116.67 117.29 1r1i s ASP 461 Ca 0.33 -0.27 0.24 0.00 -0.00 0.00 0.00 52.55 52.85 1r1i s ASP 461 Cb -0.08 -1.27 0.28 0.00 -1.38 0.00 0.00 42.92 40.47 1r1i s ASP 461 CO 0.25 -0.28 1.26 0.00 -0.00 0.00 0.00 175.17 176.40 1r1i n ALA 462 N -1.43 3.87 0.08 2.11 0.00 -1.26 -0.25 120.51 123.62 1r1i n ALA 462 Ca -0.03 -0.45 -0.13 0.00 0.00 0.00 0.00 53.44 52.83 1r1i n ALA 462 Cb 0.58 -1.00 -0.08 0.00 0.00 0.00 0.00 19.45 18.96 1r1i n ALA 462 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 1r1i h GLU 463 N 0.28 -0.11 -0.37 0.00 9.09 -1.99 -2.85 114.58 118.63 1r1i h GLU 463 Ca 0.00 0.01 -0.13 0.00 0.05 0.00 0.00 59.36 59.29 1r1i h GLU 463 Cb 0.52 0.03 -0.01 0.00 -1.65 0.00 0.00 28.75 27.63 1r1i h GLU 463 CO 0.00 -0.02 -0.26 1.15 0.05 0.00 0.00 179.01 179.93 1r1i h THR 464 N -0.18 1.28 -1.00 -1.06 2.02 -1.71 -1.18 112.91 111.07 1r1i h THR 464 Ca -0.01 -1.42 0.25 0.00 0.77 0.00 0.00 66.41 66.00 1r1i h THR 464 Cb 0.15 1.39 -0.13 0.00 -1.74 0.00 0.00 68.15 67.82 1r1i h THR 464 CO 0.02 0.47 0.59 0.11 0.37 0.00 0.00 175.52 177.08 1r1i h LYS 465 N 0.62 0.54 0.03 6.66 1.79 -0.67 -2.58 116.57 122.96 1r1i h LYS 465 Ca 0.07 -0.03 -0.30 0.00 -2.18 0.00 0.00 60.65 58.21 1r1i h LYS 465 Cb 0.84 -0.12 -0.04 0.00 -1.58 0.00 0.00 32.23 31.32 1r1i h LYS 465 CO 0.07 0.36 -1.68 -0.22 -1.08 0.00 0.00 179.45 176.90 1r1i h LYS 466 N 0.56 0.06 0.46 3.15 3.64 -0.99 -2.67 116.57 120.78 1r1i h LYS 466 Ca 0.65 -0.10 -0.02 0.00 -1.27 0.00 0.00 60.65 59.91 1r1i h LYS 466 Cb 1.27 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.13 1r1i h LYS 466 CO -0.49 0.69 -0.22 0.00 -2.27 0.00 0.00 179.45 177.17 1r1i h ARG 467 N 0.02 -0.59 -0.44 1.90 3.08 -1.18 -2.59 114.38 114.58 1r1i h ARG 467 Ca -0.28 0.04 0.05 0.00 0.07 0.00 0.00 59.98 59.86 1r1i h ARG 467 Cb 2.00 0.13 -0.06 0.00 0.08 0.00 0.00 29.97 32.12 1r1i h ARG 467 CO 0.09 -0.29 -0.23 0.00 -1.07 0.00 0.00 179.97 178.47 1r1i n ALA 468 N -2.52 -0.20 -0.33 0.04 0.00 -0.99 1.57 120.51 118.08 1r1i n ALA 468 Ca -0.11 0.40 0.17 0.00 0.00 0.00 0.00 53.44 53.90 1r1i n ALA 468 Cb 0.30 -0.11 0.32 0.00 0.00 0.00 0.00 19.45 19.96 1r1i n ALA 468 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1r1i n GLU 469 N -4.59 -0.07 -0.25 0.00 2.13 -1.01 -0.29 120.64 116.56 1r1i n GLU 469 Ca 0.02 1.42 0.04 0.00 0.66 0.00 0.00 57.16 59.30 1r1i n GLU 469 Cb 0.14 -2.29 0.18 0.00 0.27 0.00 0.00 31.44 29.73 1r1i n GLU 469 CO 0.00 0.00 0.00 1.49 -0.41 0.00 0.00 177.13 178.21 1r1i h GLU 470 N 0.00 0.46 0.04 5.31 4.81 15.54 -1.69 114.58 139.05 1r1i h GLU 470 Ca 0.61 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.82 1r1i h GLU 470 Cb 1.34 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.61 1r1i h GLU 470 CO -0.88 0.30 -0.02 -0.22 -0.73 0.00 0.00 179.01 177.47 1r1i h LYS 471 N 0.47 -0.05 0.00 1.92 3.64 -0.33 -3.26 116.57 118.96 1r1i h LYS 471 Ca 0.40 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.79 1r1i h LYS 471 Cb 0.58 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.41 1r1i h LYS 471 CO -0.38 0.37 0.00 0.00 -2.27 0.00 0.00 179.45 177.17 1r1i n ALA 472 N -2.34 0.00 0.44 5.00 0.00 -0.64 -0.62 120.51 122.35 1r1i n ALA 472 Ca -0.08 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.42 1r1i n ALA 472 Cb 0.23 0.00 0.30 0.00 0.00 0.00 0.00 19.45 19.97 1r1i n ALA 472 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1r1i n LEU 473 N 0.00 0.06 0.09 0.00 4.32 -1.21 -0.35 117.00 119.92 1r1i n LEU 473 Ca 0.00 0.52 0.13 0.00 -0.02 0.00 0.00 56.01 56.63 1r1i n LEU 473 Cb 0.00 -0.51 0.30 0.00 -1.62 0.00 0.00 43.42 41.59 1r1i n LEU 473 CO 0.00 -0.31 0.66 0.00 -1.22 0.00 0.00 177.39 176.52 1r1i h ALA 474 N 2.42 0.83 -2.58 -1.18 0.00 -0.90 -3.44 119.26 114.41 1r1i h ALA 474 Ca 0.00 0.00 -0.52 0.00 0.00 0.00 0.00 54.91 54.39 1r1i h ALA 474 Cb 0.23 0.00 0.04 0.00 0.00 0.00 0.00 17.79 18.06 1r1i h ALA 474 CO 0.00 0.00 0.99 0.42 0.00 0.00 0.00 179.25 180.66 1r1i s ILE 475 N -3.13 2.50 -0.07 0.00 1.01 0.53 -4.95 121.20 117.08 1r1i s ILE 475 Ca 0.09 0.24 -0.04 0.00 0.00 0.00 0.00 60.65 60.93 1r1i s ILE 475 Cb 0.12 -3.16 -0.04 0.00 0.01 0.00 0.00 42.46 39.40 1r1i s ILE 475 CO 0.65 0.01 0.13 -0.54 0.00 0.00 0.00 174.94 175.19 1r1i s LYS 476 N 1.74 3.35 0.14 2.79 -0.14 -0.84 -5.00 119.74 121.78 1r1i s LYS 476 Ca 0.74 -0.25 0.08 0.00 -1.36 0.00 0.00 55.97 55.18 1r1i s LYS 476 Cb -0.45 -3.09 -0.04 0.00 -1.68 0.00 0.00 37.83 32.57 1r1i s LYS 476 CO 0.33 0.73 -0.10 -1.83 -0.76 0.00 0.00 175.35 173.71 1r1i s GLU 477 N -1.36 2.08 -0.04 1.68 1.03 -1.26 -1.10 118.70 119.74 1r1i s GLU 477 Ca 0.19 -1.14 0.02 0.00 0.03 0.00 0.00 54.97 54.07 1r1i s GLU 477 Cb -0.12 -2.24 0.01 0.00 -0.80 0.00 0.00 34.13 30.99 1r1i s GLU 477 CO 0.09 0.47 -0.07 1.03 -1.33 0.00 0.00 175.26 175.46 1r1i s ARG 478 N -2.48 1.00 -0.05 -4.83 1.81 0.85 -4.91 118.95 110.34 1r1i s ARG 478 Ca 0.23 -0.21 0.00 0.00 -1.72 0.00 0.00 55.73 54.03 1r1i s ARG 478 Cb -0.10 -0.93 0.02 0.00 -0.45 0.00 0.00 34.95 33.49 1r1i s ARG 478 CO 0.14 -0.00 -0.03 0.42 -0.68 0.00 0.00 175.30 175.15 1r1i s ILE 479 N 0.64 0.48 0.00 1.52 1.01 -1.26 -0.46 121.20 123.13 1r1i s ILE 479 Ca -0.10 -0.04 0.00 0.00 0.00 0.00 0.00 60.65 60.51 1r1i s ILE 479 Cb -0.13 -0.55 0.00 0.00 0.01 0.00 0.00 42.46 41.79 1r1i s ILE 479 CO 0.01 0.23 0.00 0.61 0.00 0.00 0.00 174.94 175.79 1r1i n GLY 480 N 4.39 1.81 3.54 6.18 0.00 -0.70 -4.76 105.19 115.65 1r1i n GLY 480 Ca -0.20 0.09 -0.17 0.00 0.00 0.00 0.00 46.02 45.75 1r1i n GLY 480 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1r1i s TYR 481 N 0.00 -0.63 -0.46 1.61 -0.85 -1.26 -2.83 117.35 112.93 1r1i s TYR 481 Ca 0.00 1.12 -0.44 0.00 -0.52 0.00 0.00 57.07 57.22 1r1i s TYR 481 Cb 0.00 0.41 -0.19 0.00 0.38 0.00 0.00 41.96 42.56 1r1i s TYR 481 CO 0.00 -0.55 1.81 -2.30 -1.52 0.00 0.00 175.55 172.99 1r1i n PRO 482 N 1.02 0.23 -0.24 -3.49 -0.02 -1.26 -4.75 135.00 126.49 1r1i n PRO 482 Ca -0.17 0.08 0.32 0.00 -2.02 0.00 0.00 63.50 61.71 1r1i n PRO 482 Cb 0.57 -1.64 0.72 0.00 -0.02 0.00 0.00 33.50 33.13 1r1i n PRO 482 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1r1i h ASP 483 N 6.90 0.00 -0.21 2.55 3.32 -1.99 -0.89 116.42 126.10 1r1i h ASP 483 Ca -0.34 0.00 0.02 0.00 0.02 0.00 0.00 57.03 56.73 1r1i h ASP 483 Cb 1.37 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.90 1r1i h ASP 483 CO 1.01 0.00 -0.12 -0.67 -1.72 0.00 0.00 179.24 177.74 1r1i n ASP 484 N -3.99 -0.22 0.00 6.45 4.64 -1.26 -1.85 116.55 120.31 1r1i n ASP 484 Ca 0.22 0.65 0.14 0.00 -1.38 0.00 0.00 54.79 54.42 1r1i n ASP 484 Cb 1.17 -0.18 0.60 0.00 -1.04 0.00 0.00 41.12 41.67 1r1i n ASP 484 CO 0.00 0.00 0.00 2.30 -0.82 0.00 0.00 177.20 178.68 1r1i n ILE 485 N -3.41 0.05 -0.00 5.18 -5.35 -0.34 0.15 119.36 115.64 1r1i n ILE 485 Ca 0.00 0.00 -0.09 0.00 -0.27 0.00 0.00 62.75 62.39 1r1i n ILE 485 Cb 0.06 -0.52 -0.14 0.00 -1.74 0.00 0.00 39.64 37.30 1r1i n ILE 485 CO 0.00 0.00 0.00 0.58 -1.76 0.00 0.00 176.55 175.37 1r1i h VAL 486 N 0.00 1.00 0.18 7.28 2.07 -1.61 -3.43 116.25 121.74 1r1i h VAL 486 Ca 0.00 -2.81 -0.26 0.00 0.82 0.00 0.00 66.70 64.46 1r1i h VAL 486 Cb 0.50 2.51 0.02 0.00 -1.52 0.00 0.00 31.29 32.81 1r1i h VAL 486 CO 0.00 0.61 -1.16 -1.28 0.02 0.00 0.00 177.57 175.76 1r1i h SER 487 N 0.01 0.59 -3.17 0.57 0.87 0.21 -3.44 113.55 109.20 1r1i h SER 487 Ca -0.24 -0.93 -0.62 0.00 -1.23 0.00 0.00 61.79 58.77 1r1i h SER 487 Cb 1.97 -0.19 -0.41 0.00 -0.44 0.00 0.00 62.40 63.33 1r1i h SER 487 CO 0.09 1.55 -0.66 0.21 -0.53 0.00 0.00 176.83 177.49 1r1i s ASN 488 N -7.20 4.10 0.13 6.23 3.84 -0.67 -4.97 114.94 116.39 1r1i s ASN 488 Ca -0.13 -3.52 -0.19 0.00 0.21 0.00 0.00 52.86 49.23 1r1i s ASN 488 Cb 0.03 -1.38 -0.03 0.00 -0.55 0.00 0.00 41.25 39.31 1r1i s ASN 488 CO 0.86 -0.13 1.73 0.44 -2.79 0.00 0.00 177.10 177.21 1r1i h ASP 489 N 5.69 -0.03 -0.31 -4.21 3.32 -1.88 -2.93 116.42 116.07 1r1i h ASP 489 Ca 0.12 0.04 0.04 0.00 0.02 0.00 0.00 57.03 57.25 1r1i h ASP 489 Cb 0.81 0.06 -0.07 0.00 0.22 0.00 0.00 39.33 40.35 1r1i h ASP 489 CO 0.64 0.02 -0.54 0.78 -1.72 0.00 0.00 179.24 178.41 1r1i h ASN 490 N 0.10 -1.79 -0.72 6.45 -0.26 -1.97 0.31 115.58 117.69 1r1i h ASN 490 Ca 0.09 0.23 0.15 0.00 -0.56 0.00 0.00 56.30 56.21 1r1i h ASN 490 Cb 0.10 0.72 -0.14 0.00 -1.06 0.00 0.00 38.32 37.95 1r1i h ASN 490 CO -0.14 -0.43 -0.15 0.50 -1.06 0.00 0.00 177.43 176.16 1r1i h LYS 491 N -0.46 0.02 0.53 0.81 3.64 -1.95 1.82 116.57 120.98 1r1i h LYS 491 Ca 0.06 -0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.41 1r1i h LYS 491 Cb 0.62 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.44 1r1i h LYS 491 CO -0.53 0.01 -0.27 1.25 -2.27 0.00 0.00 179.45 177.64 1r1i h LEU 492 N 0.02 -0.66 -1.81 5.20 6.46 -0.43 0.21 115.31 124.30 1r1i h LEU 492 Ca 0.36 0.03 0.32 0.00 -0.12 0.00 0.00 57.88 58.46 1r1i h LEU 492 Cb 0.56 0.18 -0.06 0.00 -0.73 0.00 0.00 40.66 40.61 1r1i h LEU 492 CO -0.73 -0.45 0.78 0.78 -0.62 0.00 0.00 178.44 178.21 1r1i h ASN 493 N -0.73 0.13 0.70 1.25 2.35 -0.21 -0.97 115.58 118.10 1r1i h ASN 493 Ca -0.07 0.03 -0.16 0.00 -0.55 0.00 0.00 56.30 55.55 1r1i h ASN 493 Cb 0.57 0.01 -0.02 0.00 0.05 0.00 0.00 38.32 38.92 1r1i h ASN 493 CO 0.11 0.02 -0.74 0.78 -1.65 0.00 0.00 177.43 175.95 1r1i h ASN 494 N 0.11 0.04 1.11 5.81 2.35 0.56 -1.34 115.58 124.22 1r1i h ASN 494 Ca 0.57 -0.03 0.00 0.00 -0.55 0.00 0.00 56.30 56.29 1r1i h ASN 494 Cb 2.01 -0.01 0.00 0.00 0.05 0.00 0.00 38.32 40.37 1r1i h ASN 494 CO -0.10 0.76 -0.23 1.21 -1.65 0.00 0.00 177.43 177.42 1r1i n GLU 495 N -3.68 0.19 0.00 0.81 2.13 0.42 -3.14 120.64 117.36 1r1i n GLU 495 Ca -0.01 0.11 0.08 0.00 0.66 0.00 0.00 57.16 58.00 1r1i n GLU 495 Cb 0.71 -1.68 -0.08 0.00 0.27 0.00 0.00 31.44 30.66 1r1i n GLU 495 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 1r1i n TYR 496 N -1.99 0.00 -0.09 4.31 4.01 -1.09 -4.71 117.16 117.59 1r1i n TYR 496 Ca 0.05 0.00 0.18 0.00 -0.16 0.00 0.00 57.90 57.97 1r1i n TYR 496 Cb 0.41 0.00 0.60 0.00 -0.31 0.00 0.00 39.34 40.03 1r1i n TYR 496 CO 0.00 0.00 0.00 1.25 -0.46 0.00 0.00 176.86 177.65 1r1i h LEU 497 N 0.14 0.19 0.00 7.72 6.46 -1.19 2.37 115.31 131.01 1r1i h LEU 497 Ca 0.00 0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.77 1r1i h LEU 497 Cb 0.39 -0.03 0.00 0.00 -0.73 0.00 0.00 40.66 40.29 1r1i h LEU 497 CO 0.00 0.10 0.00 1.21 -0.62 0.00 0.00 178.44 179.13 1r1i n GLU 498 N -4.42 0.51 -3.46 1.25 4.07 -1.26 -4.72 120.64 112.59 1r1i n GLU 498 Ca 0.12 0.00 -0.37 0.00 -0.06 0.00 0.00 57.16 56.86 1r1i n GLU 498 Cb 0.58 -1.50 -0.07 0.00 -0.06 0.00 0.00 31.44 30.40 1r1i n GLU 498 CO 0.00 0.00 0.00 -0.51 -0.06 0.00 0.00 177.13 176.56 1r1i s LEU 499 N -2.01 4.29 -0.10 4.31 1.43 0.80 -5.05 118.68 122.34 1r1i s LEU 499 Ca 0.24 0.67 -0.04 0.00 -1.03 0.00 0.00 54.13 53.97 1r1i s LEU 499 Cb 0.11 -2.50 0.05 0.00 0.03 0.00 0.00 46.19 43.88 1r1i s LEU 499 CO 0.19 0.10 0.22 0.21 0.23 0.00 0.00 176.35 177.30 1r1i s ASN 500 N 0.29 0.07 -0.12 2.29 3.84 -1.26 -5.06 114.94 115.00 1r1i s ASN 500 Ca 0.21 0.47 -0.00 0.00 0.21 0.00 0.00 52.86 53.75 1r1i s ASN 500 Cb -0.14 0.42 -0.02 0.00 -0.55 0.00 0.00 41.25 40.96 1r1i s ASN 500 CO 0.07 -0.19 -0.11 -0.31 -2.79 0.00 0.00 177.10 173.77 1r1i s TYR 501 N 1.70 2.85 -0.32 0.43 2.02 -1.26 -4.99 117.35 117.78 1r1i s TYR 501 Ca -0.05 -0.43 -0.08 0.00 -0.37 0.00 0.00 57.07 56.15 1r1i s TYR 501 Cb -0.11 -1.82 0.01 0.00 -0.40 0.00 0.00 41.96 39.64 1r1i s TYR 501 CO -0.08 -0.06 0.12 0.15 -1.57 0.00 0.00 175.55 174.11 1r1i s LYS 502 N 0.06 3.00 0.39 -0.62 1.02 -1.26 -4.99 119.74 117.34 1r1i s LYS 502 Ca -0.04 -0.93 0.24 0.00 0.02 0.00 0.00 55.97 55.26 1r1i s LYS 502 Cb -0.14 -3.48 1.29 0.00 -0.52 0.00 0.00 37.83 34.98 1r1i s LYS 502 CO 0.04 -0.52 1.71 0.93 -0.92 0.00 0.00 175.35 176.59 1r1i h GLU 503 N 8.28 0.00 -1.00 1.68 5.08 -1.97 0.57 114.58 127.23 1r1i h GLU 503 Ca -0.29 0.00 -0.47 0.00 -1.00 0.00 0.00 59.36 57.60 1r1i h GLU 503 Cb 1.12 0.00 -0.28 0.00 0.50 0.00 0.00 28.75 30.09 1r1i h GLU 503 CO 0.62 0.00 0.59 -0.40 -1.00 0.00 0.00 179.01 178.82 1r1i n ASP 504 N -2.37 3.69 -2.71 1.42 3.85 -1.26 -4.54 116.55 114.62 1r1i n ASP 504 Ca -0.02 -3.45 -0.06 0.00 -0.71 0.00 0.00 54.79 50.55 1r1i n ASP 504 Cb 0.11 -0.81 0.04 0.00 -1.35 0.00 0.00 41.12 39.12 1r1i n ASP 504 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 1r1i n GLU 505 N -0.98 1.31 -0.07 0.11 1.02 0.20 -4.94 120.64 117.29 1r1i n GLU 505 Ca 0.54 -3.26 -0.08 0.00 -0.02 0.00 0.00 57.16 54.34 1r1i n GLU 505 Cb 1.56 -1.29 -0.01 0.00 -0.02 0.00 0.00 31.44 31.68 1r1i n GLU 505 CO 0.00 0.00 0.00 -0.92 1.18 0.00 0.00 177.13 177.39 1r1i h TYR 506 N 2.83 0.25 -0.08 -0.32 5.03 -1.81 -0.35 116.97 122.52 1r1i h TYR 506 Ca -0.12 0.01 0.04 0.00 2.58 0.00 0.00 58.73 61.24 1r1i h TYR 506 Cb 1.21 -0.07 -0.04 0.00 1.55 0.00 0.00 36.73 39.38 1r1i h TYR 506 CO 0.48 0.14 -0.17 0.35 -1.32 0.00 0.00 178.16 177.64 1r1i h PHE 507 N 0.28 -0.44 -0.69 -3.82 3.04 -1.92 0.42 116.94 113.82 1r1i h PHE 507 Ca 0.11 0.02 0.10 0.00 3.98 0.00 0.00 57.97 62.19 1r1i h PHE 507 Cb 0.04 0.21 -0.04 0.00 2.56 0.00 0.00 35.95 38.71 1r1i h PHE 507 CO -0.10 -0.24 0.45 0.93 -2.02 0.00 0.00 178.31 177.33 1r1i h GLU 508 N -0.24 0.51 0.00 1.11 3.07 -1.65 0.62 114.58 118.00 1r1i h GLU 508 Ca 0.08 -0.03 -0.10 0.00 -0.50 0.00 0.00 59.36 58.81 1r1i h GLU 508 Cb 0.35 -0.12 0.01 0.00 -0.84 0.00 0.00 28.75 28.15 1r1i h GLU 508 CO -0.22 0.34 -0.40 -0.91 -1.40 0.00 0.00 179.01 176.42 1r1i h ASN 509 N 0.53 0.35 -0.94 1.42 -0.26 0.05 -0.41 115.58 116.32 1r1i h ASN 509 Ca 0.32 -0.77 0.28 0.00 -0.56 0.00 0.00 56.30 55.56 1r1i h ASN 509 Cb 0.54 -0.11 -0.16 0.00 -1.06 0.00 0.00 38.32 37.53 1r1i h ASN 509 CO -0.10 1.08 0.22 0.40 -1.06 0.00 0.00 177.43 177.97 1r1i h ILE 510 N -0.34 0.16 0.23 2.81 1.08 0.35 0.62 117.51 122.42 1r1i h ILE 510 Ca -0.05 -0.04 -0.31 0.00 -0.39 0.00 0.00 64.86 64.07 1r1i h ILE 510 Cb 1.14 0.04 0.03 0.00 -3.07 0.00 0.00 36.82 34.96 1r1i h ILE 510 CO 0.08 0.02 -1.40 0.40 -0.69 0.00 0.00 178.15 176.56 1r1i h ILE 511 N 0.11 1.28 -0.13 -0.67 1.08 0.25 -1.86 117.51 117.57 1r1i h ILE 511 Ca 0.62 -2.64 0.02 0.00 -0.39 0.00 0.00 64.86 62.47 1r1i h ILE 511 Cb 1.36 3.04 -0.04 0.00 -3.07 0.00 0.00 36.82 38.10 1r1i h ILE 511 CO -0.77 0.80 -0.29 -0.61 -0.69 0.00 0.00 178.15 176.59 1r1i h GLN 512 N 0.04 -0.26 -0.90 2.37 4.15 -0.50 -1.57 115.11 118.43 1r1i h GLN 512 Ca -0.25 0.02 0.15 0.00 0.77 0.00 0.00 58.65 59.34 1r1i h GLN 512 Cb 2.07 0.06 -0.09 0.00 0.21 0.00 0.00 27.48 29.72 1r1i h GLN 512 CO 0.24 -0.18 0.51 -0.91 -1.93 0.00 0.00 178.83 176.56 1r1i h ASN 513 N -0.27 0.66 0.04 -0.69 2.35 0.40 0.86 115.58 118.93 1r1i h ASN 513 Ca 0.03 0.08 0.00 0.00 -0.55 0.00 0.00 56.30 55.86 1r1i h ASN 513 Cb 0.35 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.67 1r1i h ASN 513 CO -0.27 0.29 -0.12 -0.07 -1.65 0.00 0.00 177.43 175.60 1r1i h LEU 514 N 0.72 -0.37 -1.46 1.61 3.38 -1.11 -2.00 115.31 116.09 1r1i h LEU 514 Ca 0.49 0.04 0.08 0.00 0.09 0.00 0.00 57.88 58.58 1r1i h LEU 514 Cb 0.66 0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.50 1r1i h LEU 514 CO -0.34 -0.13 0.45 0.11 0.09 0.00 0.00 178.44 178.62 1r1i h LYS 515 N -0.18 0.61 0.00 1.13 1.57 0.15 0.32 116.57 120.16 1r1i h LYS 515 Ca -0.00 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1r1i h LYS 515 Cb 0.18 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.35 1r1i h LYS 515 CO -0.06 0.40 0.00 0.34 -0.57 0.00 0.00 179.45 179.56 1r1i n PHE 516 N -4.48 0.00 -0.24 -1.35 -0.00 0.17 -2.33 117.46 109.23 1r1i n PHE 516 Ca 0.11 0.00 0.22 0.00 -0.00 0.00 0.00 57.45 57.78 1r1i n PHE 516 Cb 0.29 0.00 0.57 0.00 -0.00 0.00 0.00 39.48 40.34 1r1i n PHE 516 CO 0.00 0.00 0.00 0.77 -0.00 0.00 0.00 176.76 177.53 1r1i h SER 517 N 0.00 0.30 0.15 -2.13 0.02 0.40 0.37 113.55 112.66 1r1i h SER 517 Ca 0.00 0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 60.98 1r1i h SER 517 Cb 0.00 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.52 1r1i h SER 517 CO 0.00 0.11 -0.07 -0.61 -1.14 0.00 0.00 176.83 175.12 1r1i h GLN 518 N 0.29 -0.19 -0.43 3.45 5.75 -1.48 0.23 115.11 122.74 1r1i h GLN 518 Ca 0.48 0.01 -0.04 0.00 -0.15 0.00 0.00 58.65 58.96 1r1i h GLN 518 Cb 1.38 0.04 -0.02 0.00 1.07 0.00 0.00 27.48 29.95 1r1i h GLN 518 CO -0.15 0.05 0.12 1.03 -2.65 0.00 0.00 178.83 177.23 1r1i h SER 519 N -0.41 0.58 -0.20 -0.69 0.87 0.11 1.17 113.55 114.98 1r1i h SER 519 Ca -0.02 -0.08 0.06 0.00 -1.23 0.00 0.00 61.79 60.52 1r1i h SER 519 Cb 0.32 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.12 1r1i h SER 519 CO 0.03 0.57 0.15 0.50 -0.53 0.00 0.00 176.83 177.56 1r1i h LYS 520 N 0.62 0.00 0.07 2.24 3.64 -0.63 -1.41 116.57 121.10 1r1i h LYS 520 Ca 0.14 0.00 -0.32 0.00 -1.27 0.00 0.00 60.65 59.20 1r1i h LYS 520 Cb 0.21 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.01 1r1i h LYS 520 CO -0.01 0.00 -1.77 0.94 -2.27 0.00 0.00 179.45 176.34 1r1i n GLN 521 N -4.40 0.68 0.28 1.90 -0.06 0.17 -3.77 117.38 112.19 1r1i n GLN 521 Ca 0.02 0.37 0.15 0.00 -2.00 0.00 0.00 57.00 55.54 1r1i n GLN 521 Cb 0.29 -1.71 0.82 0.00 -4.06 0.00 0.00 30.24 25.58 1r1i n GLN 521 CO 0.00 0.00 0.00 -0.07 -0.20 0.00 0.00 177.06 176.79 1r1i h LEU 522 N -0.35 0.00 -1.04 1.69 3.38 0.12 -2.96 115.31 116.15 1r1i h LEU 522 Ca -0.41 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.56 1r1i h LEU 522 Cb 1.76 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.51 1r1i h LEU 522 CO -0.04 0.07 0.25 0.50 0.09 0.00 0.00 178.44 179.32 1r1i h LYS 523 N 0.00 0.00 0.00 1.13 1.63 -1.35 -3.15 116.57 114.84 1r1i h LYS 523 Ca -0.00 0.00 -0.02 0.00 -0.85 0.00 0.00 60.65 59.78 1r1i h LYS 523 Cb 0.25 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 31.87 1r1i h LYS 523 CO 0.01 0.00 -1.67 1.63 -3.45 0.00 0.00 179.45 175.97 1r1i n LYS 524 N -2.14 0.53 -0.20 1.90 5.02 -1.12 -4.54 118.16 117.62 1r1i n LYS 524 Ca -0.01 -0.12 -0.04 0.00 -2.02 0.00 0.00 58.31 56.12 1r1i n LYS 524 Cb 0.28 -1.34 -0.03 0.00 -0.02 0.00 0.00 35.03 33.92 1r1i n LYS 524 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1r1i n LEU 525 N -2.03 -0.45 -1.07 -0.35 -0.00 -1.19 -0.87 117.00 111.03 1r1i n LEU 525 Ca -0.04 0.84 0.08 0.00 -0.00 0.00 0.00 56.01 56.90 1r1i n LEU 525 Cb 0.41 -0.13 0.26 0.00 -0.00 0.00 0.00 43.42 43.96 1r1i n LEU 525 CO 0.30 -0.70 0.72 0.54 -0.00 0.00 0.00 177.39 178.24 1r1i n ARG 526 N -4.62 3.03 -3.85 1.96 5.12 -1.26 -3.97 116.66 113.06 1r1i n ARG 526 Ca 0.02 -2.49 -0.22 0.00 -1.93 0.00 0.00 57.85 53.24 1r1i n ARG 526 Cb 0.14 -1.55 -0.02 0.00 -1.16 0.00 0.00 32.46 29.88 1r1i n ARG 526 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 1r1i s GLU 527 N -1.36 3.45 -0.15 5.56 0.41 -0.05 -5.04 118.70 121.52 1r1i s GLU 527 Ca 0.38 -0.67 -0.24 0.00 -0.41 0.00 0.00 54.97 54.03 1r1i s GLU 527 Cb 0.23 -2.85 -0.02 0.00 -1.78 0.00 0.00 34.13 29.71 1r1i s GLU 527 CO 0.22 0.38 0.76 0.15 -0.49 0.00 0.00 175.26 176.28 1r1i s LYS 528 N -4.03 4.31 0.00 1.61 1.02 -1.26 -4.12 119.74 117.27 1r1i s LYS 528 Ca 0.35 0.91 0.00 0.00 0.02 0.00 0.00 55.97 57.25 1r1i s LYS 528 Cb -0.09 -3.55 0.00 0.00 -0.52 0.00 0.00 37.83 33.67 1r1i s LYS 528 CO 0.30 -0.22 0.00 0.28 -0.92 0.00 0.00 175.35 174.79 1r1i n VAL 529 N 4.51 0.00 -1.90 3.17 0.31 -0.15 -4.76 118.33 119.51 1r1i n VAL 529 Ca 0.02 0.00 -0.43 0.00 -0.01 0.00 0.00 64.34 63.92 1r1i n VAL 529 Cb 0.50 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 33.40 1r1i n VAL 529 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1r1i s ASP 530 N 0.00 5.77 0.64 4.52 -1.08 -1.26 -4.84 116.67 120.42 1r1i s ASP 530 Ca 0.00 1.44 0.32 0.00 -0.52 0.00 0.00 52.55 53.79 1r1i s ASP 530 Cb 0.00 -2.52 1.76 0.00 -1.46 0.00 0.00 42.92 40.70 1r1i s ASP 530 CO 0.00 -1.78 2.05 0.11 0.52 0.00 0.00 175.17 176.07 1r1i h LYS 531 N 13.45 0.00 0.00 4.34 1.57 -2.00 -2.84 116.57 131.10 1r1i h LYS 531 Ca -0.35 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.43 1r1i h LYS 531 Cb 1.19 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.50 1r1i h LYS 531 CO 1.02 0.00 -0.61 -0.25 -0.57 0.00 0.00 179.45 179.04 1r1i n ASP 532 N -3.28 0.63 -4.79 0.86 8.00 -1.26 -4.93 116.55 111.77 1r1i n ASP 532 Ca 0.00 0.03 -0.37 0.00 0.71 0.00 0.00 54.79 55.16 1r1i n ASP 532 Cb 0.35 0.20 -0.06 0.00 -0.02 0.00 0.00 41.12 41.59 1r1i n ASP 532 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1r1i s GLU 533 N -3.13 4.49 0.13 -1.24 2.12 -1.07 -5.06 118.70 114.94 1r1i s GLU 533 Ca 0.07 1.20 -0.05 0.00 0.36 0.00 0.00 54.97 56.55 1r1i s GLU 533 Cb 0.15 -2.83 -0.05 0.00 0.26 0.00 0.00 34.13 31.65 1r1i s GLU 533 CO 0.72 0.31 0.37 -1.58 -0.54 0.00 0.00 175.26 174.54 1r1i s TRP 534 N -1.59 3.49 -0.30 5.30 0.52 -1.26 -5.02 118.94 120.07 1r1i s TRP 534 Ca 0.48 0.56 0.23 0.00 0.02 0.00 0.00 56.10 57.39 1r1i s TRP 534 Cb -0.18 -2.00 0.07 0.00 -1.15 0.00 0.00 33.47 30.20 1r1i s TRP 534 CO 0.23 0.45 1.12 -0.84 0.02 0.00 0.00 176.95 177.94 1r1i h ILE 535 N 2.14 0.00 -4.00 2.03 3.07 -2.02 -3.45 117.51 115.28 1r1i h ILE 535 Ca -0.46 -0.93 -0.69 0.00 1.55 0.00 0.00 64.86 64.33 1r1i h ILE 535 Cb 1.17 1.48 -0.22 0.00 -0.27 0.00 0.00 36.82 38.98 1r1i h ILE 535 CO 0.72 0.00 -0.78 -0.55 -1.05 0.00 0.00 178.15 176.49 1r1i s SER 536 N -5.29 3.94 1.00 2.16 0.15 -1.26 -5.09 113.70 109.30 1r1i s SER 536 Ca 0.01 -0.30 -0.14 0.00 0.70 0.00 0.00 55.95 56.22 1r1i s SER 536 Cb 0.10 -0.75 0.07 0.00 -1.71 0.00 0.00 66.02 63.73 1r1i s SER 536 CO 0.77 0.30 0.40 0.61 1.20 0.00 0.00 173.24 176.52 1r1i n GLY 537 N 1.92 -2.00 0.00 9.45 0.00 -1.26 -4.87 105.19 108.44 1r1i n GLY 537 Ca -0.16 -0.77 0.10 0.00 0.00 0.00 0.00 46.02 45.18 1r1i n GLY 537 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r1i n ALA 538 N -3.90 2.02 -0.01 4.61 0.00 -1.26 -4.31 120.51 117.66 1r1i n ALA 538 Ca 0.06 -0.08 0.06 0.00 0.00 0.00 0.00 53.44 53.47 1r1i n ALA 538 Cb 0.55 -1.34 0.25 0.00 0.00 0.00 0.00 19.45 18.92 1r1i n ALA 538 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1r1i n ALA 539 N -1.40 3.02 -2.76 0.00 0.00 -1.26 -2.81 120.51 115.30 1r1i n ALA 539 Ca 0.07 -1.13 -0.16 0.00 0.00 0.00 0.00 53.44 52.22 1r1i n ALA 539 Cb 0.21 -1.03 -0.13 0.00 0.00 0.00 0.00 19.45 18.49 1r1i n ALA 539 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1r1i s VAL 540 N -1.83 0.68 -0.91 0.00 1.01 -1.26 -4.87 120.40 113.21 1r1i s VAL 540 Ca 0.36 -0.76 -0.00 0.00 0.00 0.00 0.00 61.98 61.58 1r1i s VAL 540 Cb 0.24 -0.64 0.29 0.00 0.00 0.00 0.00 36.38 36.27 1r1i s VAL 540 CO 0.16 -0.09 1.25 0.52 0.00 0.00 0.00 175.10 176.95 1r1i n VAL 541 N 2.12 4.35 -3.91 2.92 0.31 -1.26 -2.17 118.33 120.69 1r1i n VAL 541 Ca -0.18 -5.70 -0.11 0.00 -0.01 0.00 0.00 64.34 58.33 1r1i n VAL 541 Cb 0.56 -2.00 -0.01 0.00 -0.91 0.00 0.00 33.84 31.47 1r1i n VAL 541 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 1r1i n ASN 542 N 0.96 -1.39 -4.10 4.52 2.85 -1.26 -4.78 115.26 112.06 1r1i n ASN 542 Ca 0.29 -2.58 -0.11 0.00 -0.11 0.00 0.00 54.58 52.08 1r1i n ASN 542 Cb 0.35 2.50 -0.08 0.00 1.24 0.00 0.00 39.78 43.79 1r1i n ASN 542 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1r1i s ALA 543 N -2.44 0.57 0.14 5.20 0.00 -1.26 -4.21 121.76 119.75 1r1i s ALA 543 Ca 0.22 -1.32 -0.02 0.00 0.00 0.00 0.00 51.96 50.84 1r1i s ALA 543 Cb -0.02 1.15 -0.04 0.00 0.00 0.00 0.00 23.12 24.22 1r1i s ALA 543 CO 0.16 -0.66 0.09 -0.06 0.00 0.00 0.00 175.76 175.30 1r1i s PHE 544 N -4.08 0.79 -0.00 0.00 0.08 -0.73 -4.99 117.98 109.05 1r1i s PHE 544 Ca 0.29 -1.16 0.00 0.00 0.12 0.00 0.00 56.93 56.18 1r1i s PHE 544 Cb 0.04 -0.41 0.00 0.00 -0.57 0.00 0.00 43.02 42.08 1r1i s PHE 544 CO 0.08 -0.55 -0.01 -0.47 -0.10 0.00 0.00 175.22 174.17 1r1i s TYR 545 N -4.04 0.16 0.11 0.36 5.04 -1.26 -1.91 117.35 115.82 1r1i s TYR 545 Ca 0.23 -0.02 0.06 0.00 -2.44 0.00 0.00 57.07 54.91 1r1i s TYR 545 Cb 0.07 -0.13 -0.04 0.00 0.35 0.00 0.00 41.96 42.21 1r1i s TYR 545 CO 0.02 -0.02 -0.05 0.45 -1.34 0.00 0.00 175.55 174.61 1r1i s SER 546 N 0.10 4.69 -0.16 4.32 0.15 -0.44 -4.97 113.70 117.40 1r1i s SER 546 Ca -0.01 -0.32 -0.26 0.00 0.70 0.00 0.00 55.95 56.07 1r1i s SER 546 Cb -0.02 -1.00 -0.24 0.00 -1.71 0.00 0.00 66.02 63.05 1r1i s SER 546 CO -0.00 0.16 0.60 0.28 1.20 0.00 0.00 173.24 175.47 1r1i h SER 547 N 3.35 0.03 -0.99 5.45 0.02 -1.93 -3.10 113.55 116.38 1r1i h SER 547 Ca -0.48 -0.84 0.26 0.00 -0.84 0.00 0.00 61.79 59.89 1r1i h SER 547 Cb 1.17 -0.01 -0.13 0.00 0.14 0.00 0.00 62.40 63.57 1r1i h SER 547 CO 0.56 1.18 0.56 1.23 -1.14 0.00 0.00 176.83 179.22 1r1i h GLY 548 N -0.94 1.91 0.18 -3.77 0.00 -1.92 -2.88 103.07 95.64 1r1i h GLY 548 Ca -0.12 -0.27 -0.11 0.00 0.00 0.00 0.00 47.33 46.83 1r1i h GLY 548 CO -0.06 -0.32 -1.96 0.54 0.00 0.00 0.00 176.54 174.74 1r1i n ARG 549 N -4.96 0.66 -3.81 4.80 3.00 -1.26 -3.34 116.66 111.75 1r1i n ARG 549 Ca 0.28 -0.08 -0.36 0.00 -0.01 0.00 0.00 57.85 57.67 1r1i n ARG 549 Cb 0.80 -1.57 0.03 0.00 0.00 0.00 0.00 32.46 31.72 1r1i n ARG 549 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 1r1i n ASN 550 N -2.48 -4.97 -4.04 0.55 4.05 -1.09 -4.80 115.26 102.49 1r1i n ASN 550 Ca -0.12 -1.10 -0.20 0.00 0.45 0.00 0.00 54.58 53.62 1r1i n ASN 550 Cb 0.74 -2.77 -0.15 0.00 1.23 0.00 0.00 39.78 38.83 1r1i n ASN 550 CO 0.00 0.00 0.00 -1.58 -3.05 0.00 0.00 177.26 172.63 1r1i s GLN 551 N -6.40 0.87 -0.11 1.20 0.74 -1.19 -1.98 119.66 112.79 1r1i s GLN 551 Ca 0.46 -0.36 -0.02 0.00 0.05 0.00 0.00 55.36 55.50 1r1i s GLN 551 Cb -0.20 -0.84 -0.03 0.00 1.10 0.00 0.00 33.01 33.05 1r1i s GLN 551 CO 0.90 0.20 -0.05 0.96 -0.55 0.00 0.00 175.29 176.75 1r1i s ILE 552 N -0.15 3.83 -0.07 -2.34 -4.36 -0.25 -1.33 121.20 116.53 1r1i s ILE 552 Ca 0.02 -0.40 0.04 0.00 -0.26 0.00 0.00 60.65 60.05 1r1i s ILE 552 Cb -0.05 -2.63 -0.00 0.00 1.25 0.00 0.00 42.46 41.03 1r1i s ILE 552 CO -0.00 0.55 -0.20 -0.69 0.24 0.00 0.00 174.94 174.84 1r1i s VAL 553 N -0.23 1.67 -0.45 8.37 1.01 -0.80 -0.10 120.40 129.87 1r1i s VAL 553 Ca 0.04 -0.82 0.03 0.00 0.00 0.00 0.00 61.98 61.23 1r1i s VAL 553 Cb -0.13 -1.45 0.16 0.00 0.00 0.00 0.00 36.38 34.96 1r1i s VAL 553 CO 0.02 0.47 0.33 -0.36 0.00 0.00 0.00 175.10 175.57 1r1i s PHE 554 N 0.23 1.54 0.19 5.22 0.08 0.39 -1.78 117.98 123.84 1r1i s PHE 554 Ca -0.11 -2.38 -0.29 0.00 0.12 0.00 0.00 56.93 54.27 1r1i s PHE 554 Cb -0.15 -1.33 -0.17 0.00 -0.57 0.00 0.00 43.02 40.81 1r1i s PHE 554 CO 0.05 -0.78 0.64 -2.30 -0.10 0.00 0.00 175.22 172.73 1r1i n PRO 555 N 3.00 0.18 -0.36 0.24 -0.02 -1.26 -1.73 135.00 135.06 1r1i n PRO 555 Ca 0.22 0.06 0.37 0.00 -2.02 0.00 0.00 63.50 62.14 1r1i n PRO 555 Cb 0.42 -1.17 0.73 0.00 -0.02 0.00 0.00 33.50 33.47 1r1i n PRO 555 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1r1i h ALA 556 N 1.37 3.19 -0.54 3.55 0.00 -1.50 -1.54 119.26 123.79 1r1i h ALA 556 Ca -0.32 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.52 1r1i h ALA 556 Cb 1.43 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 19.29 1r1i h ALA 556 CO 0.59 -1.66 0.24 0.78 0.00 0.00 0.00 179.25 179.20 1r1i h GLY 557 N 0.00 0.82 2.00 0.00 0.00 -1.27 0.54 103.07 105.16 1r1i h GLY 557 Ca 0.61 -0.39 -0.18 0.00 0.00 0.00 0.00 47.33 47.37 1r1i h GLY 557 CO -0.01 0.37 -0.84 1.19 0.00 0.00 0.00 176.54 177.26 1r1i h ILE 558 N 0.76 1.48 0.00 2.60 2.10 -1.14 -3.41 117.51 119.89 1r1i h ILE 558 Ca 0.19 -3.00 -0.42 0.00 1.08 0.00 0.00 64.86 62.71 1r1i h ILE 558 Cb 0.11 2.67 0.06 0.00 -1.09 0.00 0.00 36.82 38.58 1r1i h ILE 558 CO -0.02 0.82 1.74 0.18 -1.08 0.00 0.00 178.15 179.79 1r1i n LEU 559 N -3.36 2.26 -3.60 2.19 4.77 0.19 -4.54 117.00 114.90 1r1i n LEU 559 Ca 0.00 -1.98 -0.05 0.00 -0.03 0.00 0.00 56.01 53.96 1r1i n LEU 559 Cb 0.86 -0.76 -0.02 0.00 -2.33 0.00 0.00 43.42 41.17 1r1i n LEU 559 CO 0.45 -0.91 0.85 0.00 -1.33 0.00 0.00 177.39 176.44 1r1i s GLN 560 N 5.33 0.68 0.48 3.23 -2.07 -1.22 -4.91 119.66 121.18 1r1i s GLN 560 Ca 0.43 -0.31 -0.24 0.00 -1.82 0.00 0.00 55.36 53.42 1r1i s GLN 560 Cb 0.10 0.28 -0.07 0.00 -1.09 0.00 0.00 33.01 32.23 1r1i s GLN 560 CO 0.13 -0.30 1.41 -2.30 -1.32 0.00 0.00 175.29 172.91 1r1i n PRO 561 N -0.29 2.06 0.00 9.60 -0.02 -0.94 -1.99 135.00 143.42 1r1i n PRO 561 Ca -0.06 0.74 0.14 0.00 -2.02 0.00 0.00 63.50 62.31 1r1i n PRO 561 Cb 0.61 -2.61 0.56 0.00 -0.02 0.00 0.00 33.50 32.04 1r1i n PRO 561 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1r1i n PRO 562 N -0.47 1.25 -0.10 0.52 -0.04 -1.26 -4.86 135.00 130.04 1r1i n PRO 562 Ca 0.07 -0.62 -0.13 0.00 -0.04 0.00 0.00 63.50 62.77 1r1i n PRO 562 Cb 0.42 -1.49 -0.03 0.00 -0.04 0.00 0.00 33.50 32.36 1r1i n PRO 562 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 1r1i h PHE 563 N 1.52 1.00 -2.49 0.54 0.04 -1.68 -3.45 116.94 112.43 1r1i h PHE 563 Ca 0.00 -0.30 -0.09 0.00 2.80 0.00 0.00 57.97 60.38 1r1i h PHE 563 Cb 0.41 -0.21 -0.24 0.00 2.20 0.00 0.00 35.95 38.12 1r1i h PHE 563 CO 0.00 1.10 -0.15 -0.59 -0.60 0.00 0.00 178.31 178.07 1r1i s PHE 564 N -4.36 -0.63 -0.02 -0.55 -0.12 -1.10 -1.78 117.98 109.43 1r1i s PHE 564 Ca -0.12 1.43 -0.05 0.00 -0.05 0.00 0.00 56.93 58.15 1r1i s PHE 564 Cb 0.10 0.26 0.00 0.00 -0.63 0.00 0.00 43.02 42.75 1r1i s PHE 564 CO 0.86 -0.32 0.10 0.45 -0.05 0.00 0.00 175.22 176.26 1r1i s SER 565 N 0.73 -0.01 0.66 1.98 0.15 -1.26 -2.22 113.70 113.72 1r1i s SER 565 Ca -0.04 -0.04 0.15 0.00 0.70 0.00 0.00 55.95 56.72 1r1i s SER 565 Cb -0.05 0.20 0.79 0.00 -1.71 0.00 0.00 66.02 65.26 1r1i s SER 565 CO -0.05 -0.20 1.44 0.00 1.20 0.00 0.00 173.24 175.63 1r1i h ALA 566 N 5.15 1.71 0.00 5.45 0.00 -2.00 -2.95 119.26 126.62 1r1i h ALA 566 Ca -0.28 -0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.49 1r1i h ALA 566 Cb 1.20 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.97 1r1i h ALA 566 CO 0.42 -0.70 -1.60 1.04 0.00 0.00 0.00 179.25 178.41 1r1i n GLN 567 N -2.71 2.16 -1.59 0.00 3.00 -1.26 -4.96 117.38 112.01 1r1i n GLN 567 Ca -0.00 -0.02 -0.30 0.00 -0.01 0.00 0.00 57.00 56.67 1r1i n GLN 567 Cb 0.72 -1.24 0.20 0.00 0.00 0.00 0.00 30.24 29.93 1r1i n GLN 567 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.06 178.20 1r1i s GLN 568 N -2.29 -0.05 0.66 -1.09 -2.07 -1.12 -4.75 119.66 108.94 1r1i s GLN 568 Ca -0.04 -0.25 -0.13 0.00 -1.82 0.00 0.00 55.36 53.12 1r1i s GLN 568 Cb 0.03 -1.75 -0.01 0.00 -1.09 0.00 0.00 33.01 30.20 1r1i s GLN 568 CO 0.38 -2.90 1.06 -1.12 -1.32 0.00 0.00 175.29 171.39 1r1i s SER 569 N -4.47 5.48 0.03 12.60 0.01 -1.26 -4.91 113.70 121.17 1r1i s SER 569 Ca 0.72 1.71 0.13 0.00 1.31 0.00 0.00 55.95 59.82 1r1i s SER 569 Cb -0.06 -2.51 -0.18 0.00 0.21 0.00 0.00 66.02 63.47 1r1i s SER 569 CO 0.54 -1.38 0.87 0.78 0.41 0.00 0.00 173.24 174.46 1r1i h ASN 570 N -0.28 0.00 -0.64 2.44 -0.26 -1.95 -2.67 115.58 112.23 1r1i h ASN 570 Ca -0.45 0.00 0.13 0.00 -0.56 0.00 0.00 56.30 55.42 1r1i h ASN 570 Cb 1.22 0.00 -0.12 0.00 -1.06 0.00 0.00 38.32 38.36 1r1i h ASN 570 CO 0.57 0.87 -0.14 -1.54 -1.06 0.00 0.00 177.43 176.12 1r1i n SER 571 N -3.08 -0.21 0.10 5.81 3.41 -1.26 -0.27 113.62 118.12 1r1i n SER 571 Ca -0.11 1.09 0.02 0.00 -0.26 0.00 0.00 58.87 59.62 1r1i n SER 571 Cb 0.96 -0.34 -0.01 0.00 -0.26 0.00 0.00 64.21 64.56 1r1i n SER 571 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1r1i h LEU 572 N 0.00 0.00 -0.28 1.04 3.38 -1.75 -0.48 115.31 117.22 1r1i h LEU 572 Ca 0.31 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.22 1r1i h LEU 572 Cb 0.50 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 1r1i h LEU 572 CO -0.65 0.48 -0.08 0.78 0.09 0.00 0.00 178.44 179.06 1r1i h ASN 573 N 0.00 0.55 0.58 -0.43 2.35 -1.01 -0.20 115.58 117.43 1r1i h ASN 573 Ca -0.06 -0.37 -0.18 0.00 -0.55 0.00 0.00 56.30 55.13 1r1i h ASN 573 Cb 1.42 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 39.63 1r1i h ASN 573 CO 0.05 0.80 -0.80 1.88 -1.65 0.00 0.00 177.43 177.71 1r1i h TYR 574 N 0.30 0.23 -0.15 1.19 0.05 -0.72 0.45 116.97 118.32 1r1i h TYR 574 Ca 0.07 -0.12 0.04 0.00 0.05 0.00 0.00 58.73 58.77 1r1i h TYR 574 Cb 0.56 -0.03 -0.01 0.00 1.01 0.00 0.00 36.73 38.27 1r1i h TYR 574 CO 0.05 0.89 0.12 0.78 -1.05 0.00 0.00 178.16 178.96 1r1i h GLY 575 N 1.87 0.00 0.00 3.88 0.00 -0.98 -2.69 103.07 105.15 1r1i h GLY 575 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.30 1r1i h GLY 575 CO 0.12 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.27 1r1i n GLY 576 N -1.50 0.42 0.35 4.60 0.00 -0.10 -3.56 105.19 105.41 1r1i n GLY 576 Ca 0.01 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.12 1r1i n GLY 576 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1r1i h ILE 577 N 0.00 0.94 -0.18 -0.61 6.09 -1.03 -2.19 117.51 120.54 1r1i h ILE 577 Ca 0.00 -0.20 0.04 0.00 -1.37 0.00 0.00 64.86 63.33 1r1i h ILE 577 Cb 0.00 0.32 -0.04 0.00 0.47 0.00 0.00 36.82 37.58 1r1i h ILE 577 CO 0.00 0.10 -0.07 1.23 -3.07 0.00 0.00 178.15 176.35 1r1i h GLY 578 N 0.57 0.10 2.00 8.18 0.00 -1.03 0.57 103.07 113.46 1r1i h GLY 578 Ca 0.30 0.08 -0.08 0.00 0.00 0.00 0.00 47.33 47.63 1r1i h GLY 578 CO -0.10 -0.09 -0.40 0.00 0.00 0.00 0.00 176.54 175.96 1r1i h MET 579 N -0.03 0.00 -0.19 4.80 -0.00 -1.12 -1.97 114.93 116.42 1r1i h MET 579 Ca 0.09 0.00 -0.12 0.00 -0.00 0.00 0.00 59.70 59.67 1r1i h MET 579 Cb 0.17 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 31.76 1r1i h MET 579 CO -0.20 0.40 -0.38 0.28 -0.00 0.00 0.00 176.91 177.01 1r1i h VAL 580 N 0.00 1.30 -0.12 -0.10 2.07 -0.44 -0.58 116.25 118.38 1r1i h VAL 580 Ca -0.00 -1.50 -0.15 0.00 0.82 0.00 0.00 66.70 65.87 1r1i h VAL 580 Cb 0.75 1.57 -0.01 0.00 -1.52 0.00 0.00 31.29 32.08 1r1i h VAL 580 CO 0.05 0.46 -0.56 0.40 0.02 0.00 0.00 177.57 177.95 1r1i h ILE 581 N 0.36 1.35 0.00 4.57 2.04 0.83 -1.91 117.51 124.75 1r1i h ILE 581 Ca 0.04 -1.84 0.00 0.00 1.00 0.00 0.00 64.86 64.05 1r1i h ILE 581 Cb 0.83 1.87 0.00 0.00 -0.74 0.00 0.00 36.82 38.77 1r1i h ILE 581 CO 0.07 0.56 -0.00 1.23 0.00 0.00 0.00 178.15 180.00 1r1i h GLY 582 N 1.27 0.00 0.80 5.37 0.00 -1.40 -1.91 103.07 107.19 1r1i h GLY 582 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 1r1i h GLY 582 CO 0.09 0.00 -0.24 0.84 0.00 0.00 0.00 176.54 177.23 1r1i h HIS 583 N 0.00 -0.63 -0.26 5.60 -0.00 -0.34 -1.64 115.15 117.89 1r1i h HIS 583 Ca 0.00 -0.01 -0.02 0.00 -0.00 0.00 0.00 60.37 60.33 1r1i h HIS 583 Cb 0.90 0.21 -0.01 0.00 -0.00 0.00 0.00 27.41 28.51 1r1i h HIS 583 CO 0.00 -0.32 0.08 0.93 -0.00 0.00 0.00 177.93 178.62 1r1i h GLU 584 N -0.90 0.40 -0.83 5.26 4.39 -1.35 -2.59 114.58 118.96 1r1i h GLU 584 Ca -0.07 -0.09 0.07 0.00 0.34 0.00 0.00 59.36 59.61 1r1i h GLU 584 Cb 0.60 -0.06 -0.06 0.00 -0.10 0.00 0.00 28.75 29.13 1r1i h GLU 584 CO 0.11 0.48 0.50 0.82 -1.16 0.00 0.00 179.01 179.76 1r1i h ILE 585 N 0.25 1.00 -0.11 3.13 2.04 -1.40 -1.13 117.51 121.28 1r1i h ILE 585 Ca 0.08 -0.31 -0.05 0.00 1.00 0.00 0.00 64.86 65.59 1r1i h ILE 585 Cb 0.25 0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.34 1r1i h ILE 585 CO -0.00 0.16 -0.16 0.74 0.00 0.00 0.00 178.15 178.89 1r1i h THR 586 N 0.89 1.18 -0.25 -0.27 2.02 -0.92 0.27 112.91 115.82 1r1i h THR 586 Ca 0.37 -0.79 0.07 0.00 0.77 0.00 0.00 66.41 66.83 1r1i h THR 586 Cb 0.23 1.27 -0.01 0.00 -1.74 0.00 0.00 68.15 67.89 1r1i h THR 586 CO -0.19 0.24 0.22 0.45 0.37 0.00 0.00 175.52 176.60 1r1i h HIS 587 N 0.17 0.00 0.00 3.16 3.86 -0.85 1.04 115.15 122.53 1r1i h HIS 587 Ca 0.03 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 1r1i h HIS 587 Cb 0.39 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.86 1r1i h HIS 587 CO 0.00 0.00 0.00 0.41 0.86 0.00 0.00 177.93 179.20 1r1i n GLY 588 N -1.51 0.00 0.09 2.45 0.00 0.96 -3.43 105.19 103.75 1r1i n GLY 588 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1r1i n GLY 588 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1r1i n PHE 589 N -1.25 0.00 -0.59 1.61 3.72 0.36 -2.72 117.46 118.59 1r1i n PHE 589 Ca 0.00 -0.13 -0.07 0.00 -0.05 0.00 0.00 57.45 57.20 1r1i n PHE 589 Cb 0.00 -0.02 0.06 0.00 -0.94 0.00 0.00 39.48 38.58 1r1i n PHE 589 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 1r1i n ASP 590 N -0.15 -1.38 0.05 4.37 5.68 -1.15 -4.01 116.55 119.97 1r1i n ASP 590 Ca 0.01 -0.63 0.05 0.00 -0.50 0.00 0.00 54.79 53.72 1r1i n ASP 590 Cb 0.50 -0.25 0.24 0.00 -1.14 0.00 0.00 41.12 40.47 1r1i n ASP 590 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 1r1i n ASP 591 N -3.48 0.20 -0.03 -1.12 5.75 -1.26 -1.34 116.55 115.27 1r1i n ASP 591 Ca 0.04 0.58 -0.02 0.00 -0.01 0.00 0.00 54.79 55.38 1r1i n ASP 591 Cb 0.15 -0.61 -0.01 0.00 -1.03 0.00 0.00 41.12 39.61 1r1i n ASP 591 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1r1i n ASN 592 N -1.76 0.71 0.05 -1.12 2.85 -1.26 -4.63 115.26 110.10 1r1i n ASN 592 Ca 0.00 0.31 0.10 0.00 -0.11 0.00 0.00 54.58 54.88 1r1i n ASN 592 Cb 0.05 -0.63 0.41 0.00 1.24 0.00 0.00 39.78 40.85 1r1i n ASN 592 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1r1i n GLY 593 N 1.63 -1.21 0.36 8.20 0.00 -1.20 -1.69 105.19 111.28 1r1i n GLY 593 Ca -0.04 -0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.09 1r1i n GLY 593 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1r1i h ARG 594 N 0.00 0.43 -0.05 1.61 0.11 -1.00 -1.47 114.38 114.01 1r1i h ARG 594 Ca 0.00 -0.03 0.00 0.00 0.10 0.00 0.00 59.98 60.05 1r1i h ARG 594 Cb 0.36 -0.10 0.00 0.00 1.11 0.00 0.00 29.97 31.34 1r1i h ARG 594 CO 0.00 0.28 0.00 0.09 0.10 0.00 0.00 179.97 180.44 1r1i n ASN 595 N -4.47 0.37 -4.46 0.08 3.02 -0.68 -4.84 115.26 104.29 1r1i n ASN 595 Ca 0.10 -1.68 -0.31 0.00 -0.03 0.00 0.00 54.58 52.66 1r1i n ASN 595 Cb 0.37 -0.03 -0.13 0.00 -0.61 0.00 0.00 39.78 39.38 1r1i n ASN 595 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1r1i s PHE 596 N -1.93 2.58 0.00 3.10 0.08 -0.55 -2.99 117.98 118.26 1r1i s PHE 596 Ca 0.20 -0.25 0.00 0.00 0.12 0.00 0.00 56.93 57.00 1r1i s PHE 596 Cb 0.09 -1.48 0.00 0.00 -0.57 0.00 0.00 43.02 41.06 1r1i s PHE 596 CO 0.15 0.24 0.00 0.27 -0.10 0.00 0.00 175.22 175.78 1r1i n ASN 597 N 1.64 0.00 0.00 1.36 6.94 -0.40 -4.93 115.26 119.87 1r1i n ASN 597 Ca -0.16 -0.97 0.08 0.00 -0.02 0.00 0.00 54.58 53.51 1r1i n ASN 597 Cb 0.52 0.00 0.40 0.00 -2.36 0.00 0.00 39.78 38.34 1r1i n ASN 597 CO 0.00 0.00 0.00 2.29 -1.03 0.00 0.00 177.26 178.52 1r1i n LYS 598 N -0.97 0.11 0.00 -3.83 2.85 -1.26 -3.00 118.16 112.06 1r1i n LYS 598 Ca 0.00 0.17 0.00 0.00 -1.05 0.00 0.00 58.31 57.43 1r1i n LYS 598 Cb 0.00 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 32.88 1r1i n LYS 598 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1r1i n ASP 599 N -1.40 1.49 0.00 -5.58 8.00 -1.26 -4.80 116.55 113.00 1r1i n ASP 599 Ca 0.06 -1.68 0.00 0.00 0.71 0.00 0.00 54.79 53.88 1r1i n ASP 599 Cb 0.17 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.27 1r1i n ASP 599 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1r1i n GLY 600 N -0.34 0.93 3.79 0.44 0.00 -1.16 -4.63 105.19 104.22 1r1i n GLY 600 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 1r1i n GLY 600 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1r1i s ASP 601 N -1.84 6.76 -1.07 1.61 1.01 -1.26 -4.22 116.67 117.65 1r1i s ASP 601 Ca 0.00 0.90 -0.23 0.00 0.71 0.00 0.00 52.55 53.93 1r1i s ASP 601 Cb 0.00 -2.26 -0.04 0.00 1.01 0.00 0.00 42.92 41.63 1r1i s ASP 601 CO 0.00 0.21 1.87 -0.22 0.21 0.00 0.00 175.17 177.24 1r1i s LEU 602 N -0.48 3.22 -0.04 1.23 0.20 0.15 -1.27 118.68 121.70 1r1i s LEU 602 Ca 0.24 -1.34 -0.04 0.00 0.69 0.00 0.00 54.13 53.68 1r1i s LEU 602 Cb -0.16 -2.57 0.01 0.00 -0.43 0.00 0.00 46.19 43.04 1r1i s LEU 602 CO 0.12 -2.59 0.12 0.54 -0.29 0.00 0.00 176.35 174.24 1r1i s VAL 603 N 9.34 0.00 -0.25 1.68 0.11 -1.16 -4.86 120.40 125.26 1r1i s VAL 603 Ca 0.65 -0.01 -0.26 0.00 -2.93 0.00 0.00 61.98 59.44 1r1i s VAL 603 Cb -0.02 -0.17 0.00 0.00 -1.53 0.00 0.00 36.38 34.65 1r1i s VAL 603 CO 0.05 -0.00 0.89 -0.62 -3.33 0.00 0.00 175.10 172.09 1r1i s ASP 604 N 0.05 6.90 -0.12 3.54 -1.08 -1.26 -4.48 116.67 120.21 1r1i s ASP 604 Ca -0.00 1.11 0.15 0.00 -0.52 0.00 0.00 52.55 53.28 1r1i s ASP 604 Cb -0.01 -2.47 0.29 0.00 -1.46 0.00 0.00 42.92 39.27 1r1i s ASP 604 CO 0.00 -0.58 1.15 -2.67 0.52 0.00 0.00 175.17 173.59 1r1i n TRP 605 N 6.14 0.00 -4.09 -5.34 4.27 -1.26 -5.00 117.44 112.16 1r1i n TRP 605 Ca 0.07 -0.94 -0.35 0.00 -3.89 0.00 0.00 57.50 52.40 1r1i n TRP 605 Cb 0.47 -0.16 -0.13 0.00 -1.36 0.00 0.00 31.31 30.13 1r1i n TRP 605 CO 0.00 0.00 0.00 -1.58 -2.29 0.00 0.00 177.69 173.82 1r1i s TRP 606 N -2.32 2.99 -0.45 -2.67 0.52 -1.26 -4.78 118.94 110.96 1r1i s TRP 606 Ca 0.29 -0.64 -0.46 0.00 0.02 0.00 0.00 56.10 55.31 1r1i s TRP 606 Cb 0.27 -2.07 -0.20 0.00 -1.15 0.00 0.00 33.47 30.33 1r1i s TRP 606 CO -0.01 -0.34 1.53 0.25 0.02 0.00 0.00 176.95 178.39 1r1i n THR 607 N 4.36 0.00 -0.00 2.01 -2.24 -1.26 -4.78 114.28 112.36 1r1i n THR 607 Ca -0.18 0.00 -0.00 0.00 -2.27 0.00 0.00 64.05 61.60 1r1i n THR 607 Cb 0.52 -0.45 0.00 0.00 -2.10 0.00 0.00 70.33 68.29 1r1i n THR 607 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 1r1i n GLN 608 N 3.73 -0.00 0.06 -0.78 0.00 -1.26 0.64 117.38 119.76 1r1i n GLN 608 Ca 0.30 0.01 -0.03 0.00 -0.00 0.00 0.00 57.00 57.27 1r1i n GLN 608 Cb -0.05 -0.01 -0.08 0.00 0.00 0.00 0.00 30.24 30.11 1r1i n GLN 608 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.06 177.43 1r1i h GLN 609 N 0.00 0.00 0.00 3.69 5.75 -2.00 -2.93 115.11 119.62 1r1i h GLN 609 Ca 0.00 0.00 -0.09 0.00 -0.15 0.00 0.00 58.65 58.41 1r1i h GLN 609 Cb 0.00 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.54 1r1i h GLN 609 CO -0.00 0.56 -0.41 0.77 -2.65 0.00 0.00 178.83 177.09 1r1i h SER 610 N 0.00 0.00 0.40 -0.69 0.02 -0.10 -2.09 113.55 111.09 1r1i h SER 610 Ca -0.11 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.82 1r1i h SER 610 Cb 1.66 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.21 1r1i h SER 610 CO 0.08 0.41 -0.19 0.00 -1.14 0.00 0.00 176.83 175.99 1r1i h ALA 611 N 1.59 -0.54 0.00 3.77 0.00 -0.94 -2.32 119.26 120.82 1r1i h ALA 611 Ca -0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1r1i h ALA 611 Cb 0.82 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1r1i h ALA 611 CO 0.05 -0.75 0.00 0.77 0.00 0.00 0.00 179.25 179.32 1r1i h SER 612 N -0.65 0.00 0.14 0.00 0.02 -1.33 0.11 113.55 111.85 1r1i h SER 612 Ca -0.06 0.00 -0.23 0.00 -0.84 0.00 0.00 61.79 60.66 1r1i h SER 612 Cb 0.47 0.00 0.02 0.00 0.14 0.00 0.00 62.40 63.03 1r1i h SER 612 CO 0.09 0.00 -1.09 0.78 -1.14 0.00 0.00 176.83 175.47 1r1i h ASN 613 N 0.00 0.48 -0.15 3.07 4.21 -1.32 -1.43 115.58 120.43 1r1i h ASN 613 Ca 0.00 -0.92 0.04 0.00 1.21 0.00 0.00 56.30 56.64 1r1i h ASN 613 Cb 0.33 -0.16 -0.07 0.00 -1.12 0.00 0.00 38.32 37.31 1r1i h ASN 613 CO 0.00 1.50 -0.42 0.15 -1.29 0.00 0.00 177.43 177.37 1r1i h PHE 614 N -0.30 -1.20 -0.98 1.19 3.04 -0.23 1.00 116.94 119.46 1r1i h PHE 614 Ca -0.21 0.05 0.04 0.00 3.98 0.00 0.00 57.97 61.83 1r1i h PHE 614 Cb 1.74 0.55 -0.06 0.00 2.56 0.00 0.00 35.95 40.74 1r1i h PHE 614 CO 0.17 -0.47 0.64 0.87 -2.02 0.00 0.00 178.31 177.49 1r1i h LYS 615 N -0.48 1.18 -0.37 1.11 1.57 -1.41 0.70 116.57 118.88 1r1i h LYS 615 Ca 0.08 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1r1i h LYS 615 Cb 0.62 -0.27 -0.02 0.00 0.08 0.00 0.00 32.23 32.65 1r1i h LYS 615 CO -0.41 0.78 0.23 1.49 -0.57 0.00 0.00 179.45 180.97 1r1i h GLU 616 N 1.22 0.49 -0.09 3.15 4.81 0.34 0.51 114.58 125.00 1r1i h GLU 616 Ca 0.40 -0.04 -0.11 0.00 -0.13 0.00 0.00 59.36 59.48 1r1i h GLU 616 Cb 0.04 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.32 1r1i h GLU 616 CO -0.13 0.34 -0.38 1.96 -0.73 0.00 0.00 179.01 180.07 1r1i h GLN 617 N 0.49 0.42 0.00 1.92 1.08 0.31 -3.27 115.11 116.05 1r1i h GLN 617 Ca 0.13 -0.33 -0.02 0.00 -1.45 0.00 0.00 58.65 56.98 1r1i h GLN 617 Cb -0.03 0.07 -0.00 0.00 -0.05 0.00 0.00 27.48 27.46 1r1i h GLN 617 CO -0.03 0.96 -0.10 0.66 -0.95 0.00 0.00 178.83 179.37 1r1i h SER 618 N -0.03 0.00 -0.11 1.46 4.64 0.73 0.56 113.55 120.79 1r1i h SER 618 Ca -0.02 0.00 0.03 0.00 -0.47 0.00 0.00 61.79 61.33 1r1i h SER 618 Cb 1.03 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.11 1r1i h SER 618 CO 0.08 0.10 0.19 -0.61 -0.87 0.00 0.00 176.83 175.72 1r1i h GLN 619 N 0.00 0.00 -0.04 4.77 5.75 -0.03 -1.99 115.11 123.57 1r1i h GLN 619 Ca -0.00 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.49 1r1i h GLN 619 Cb 0.93 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.48 1r1i h GLN 619 CO 0.01 0.00 -0.02 0.00 -2.65 0.00 0.00 178.83 176.18 1r1i h MET 621 N -0.32 0.34 -0.93 0.00 2.86 -1.56 0.20 114.93 115.52 1r1i h MET 621 Ca 0.01 -0.02 0.27 0.00 -2.06 0.00 0.00 59.70 57.90 1r1i h MET 621 Cb 0.45 -0.08 -0.16 0.00 0.06 0.00 0.00 31.60 31.88 1r1i h MET 621 CO 0.01 0.22 0.26 0.28 1.06 0.00 0.00 176.91 178.74 1r1i h VAL 622 N 0.35 0.21 0.13 -2.22 2.07 -1.08 -2.16 116.25 113.55 1r1i h VAL 622 Ca 0.30 -0.05 -0.33 0.00 0.82 0.00 0.00 66.70 67.44 1r1i h VAL 622 Cb 0.40 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.21 1r1i h VAL 622 CO -0.33 0.03 -1.70 1.88 0.02 0.00 0.00 177.57 177.46 1r1i h TYR 623 N 0.15 0.51 0.00 1.57 0.05 -0.66 -2.99 116.97 115.60 1r1i h TYR 623 Ca 0.62 -0.37 0.00 0.00 0.05 0.00 0.00 58.73 59.03 1r1i h TYR 623 Cb 1.33 -0.02 0.00 0.00 1.01 0.00 0.00 36.73 39.05 1r1i h TYR 623 CO -0.26 1.52 0.00 0.94 -1.05 0.00 0.00 178.16 179.31 1r1i n GLN 624 N -3.47 0.00 0.28 4.88 7.27 -0.51 -2.76 117.38 123.07 1r1i n GLN 624 Ca -0.22 0.51 0.15 0.00 0.07 0.00 0.00 57.00 57.51 1r1i n GLN 624 Cb 1.06 -1.27 0.84 0.00 2.41 0.00 0.00 30.24 33.28 1r1i n GLN 624 CO 0.00 0.00 0.00 1.88 0.07 0.00 0.00 177.06 179.01 1r1i h TYR 625 N 0.00 0.00 0.00 3.69 -1.99 -1.61 0.12 116.97 117.18 1r1i h TYR 625 Ca 0.00 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.73 1r1i h TYR 625 Cb 0.00 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 38.73 1r1i h TYR 625 CO -0.19 0.06 -0.01 0.78 -0.00 0.00 0.00 178.16 178.81 1r1i h GLY 626 N 0.56 0.00 -1.26 3.88 0.00 -1.36 -2.40 103.07 102.48 1r1i h GLY 626 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1r1i h GLY 626 CO 0.01 0.00 -0.00 0.70 0.00 0.00 0.00 176.54 177.25 1r1i n ASN 627 N -3.15 2.31 -4.68 0.19 3.02 0.02 -4.56 115.26 108.41 1r1i n ASN 627 Ca -0.01 -1.65 -0.43 0.00 -0.03 0.00 0.00 54.58 52.45 1r1i n ASN 627 Cb 0.19 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.32 1r1i n ASN 627 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1r1i n PHE 628 N 0.88 2.54 -4.50 3.10 3.72 -0.90 -5.03 117.46 117.27 1r1i n PHE 628 Ca 0.09 -0.17 -0.30 0.00 -0.05 0.00 0.00 57.45 57.02 1r1i n PHE 628 Cb 0.39 -2.73 -0.12 0.00 -0.94 0.00 0.00 39.48 36.08 1r1i n PHE 628 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1r1i s SER 629 N 3.26 3.89 -0.24 4.37 0.15 -1.26 -2.49 113.70 121.38 1r1i s SER 629 Ca 0.85 -0.46 0.02 0.00 0.70 0.00 0.00 55.95 57.05 1r1i s SER 629 Cb -0.50 -0.61 0.05 0.00 -1.71 0.00 0.00 66.02 63.24 1r1i s SER 629 CO 0.40 0.22 -0.12 0.86 1.20 0.00 0.00 173.24 175.81 1r1i s TRP 630 N -1.02 3.14 0.20 3.44 -0.00 0.01 -4.92 118.94 119.79 1r1i s TRP 630 Ca 0.16 -2.10 -0.08 0.00 -0.00 0.00 0.00 56.10 54.08 1r1i s TRP 630 Cb -0.11 -1.95 0.11 0.00 -0.00 0.00 0.00 33.47 31.53 1r1i s TRP 630 CO 0.08 -0.85 1.71 0.38 -0.00 0.00 0.00 176.95 178.27 1r1i h ASP 631 N 7.84 1.08 0.64 5.86 -0.00 -1.88 0.50 116.42 130.45 1r1i h ASP 631 Ca -0.26 -0.23 0.00 0.00 -0.00 0.00 0.00 57.03 56.53 1r1i h ASP 631 Cb 1.07 -0.28 0.00 0.00 -0.00 0.00 0.00 39.33 40.11 1r1i h ASP 631 CO 0.51 1.03 0.00 -0.07 -0.00 0.00 0.00 179.24 180.71 1r1i h LEU 632 N 1.07 0.00 -3.71 0.15 3.38 -1.95 0.26 115.31 114.51 1r1i h LEU 632 Ca 0.22 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.93 1r1i h LEU 632 Cb 0.37 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 40.97 1r1i h LEU 632 CO 0.00 0.00 0.29 0.00 0.09 0.00 0.00 178.44 178.83 1r1i n ALA 633 N -2.00 4.65 -3.01 1.53 0.00 -0.17 -4.38 120.51 117.14 1r1i n ALA 633 Ca -0.00 -2.57 -0.21 0.00 0.00 0.00 0.00 53.44 50.66 1r1i n ALA 633 Cb 0.21 -1.19 0.04 0.00 0.00 0.00 0.00 19.45 18.51 1r1i n ALA 633 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1r1i n GLY 634 N -0.52 -0.45 2.99 0.00 0.00 0.90 -3.28 105.19 104.82 1r1i n GLY 634 Ca 0.43 0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.53 1r1i n GLY 634 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r1i n GLY 635 N -1.51 2.83 3.18 -0.02 0.00 0.16 -4.96 105.19 104.85 1r1i n GLY 635 Ca -0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.52 1r1i n GLY 635 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1r1i n GLN 636 N -2.00 0.00 -3.23 1.61 6.02 -1.21 -3.36 117.38 115.22 1r1i n GLN 636 Ca 0.00 0.00 -0.39 0.00 -0.01 0.00 0.00 57.00 56.60 1r1i n GLN 636 Cb 0.00 -0.97 -0.06 0.00 1.02 0.00 0.00 30.24 30.24 1r1i n GLN 636 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.06 175.04 1r1i s HIS 637 N -1.68 3.64 1.01 1.08 3.76 -1.26 -0.81 115.29 121.03 1r1i s HIS 637 Ca 0.57 1.13 -0.26 0.00 -0.15 0.00 0.00 55.06 56.35 1r1i s HIS 637 Cb -0.59 -2.60 -0.16 0.00 1.11 0.00 0.00 32.58 30.33 1r1i s HIS 637 CO 0.61 0.30 -1.34 1.28 -0.85 0.00 0.00 174.74 174.74 1r1i n LEU 638 N 2.98 -3.13 -4.20 0.89 4.77 -1.04 -4.97 117.00 112.30 1r1i n LEU 638 Ca -0.07 0.00 -0.36 0.00 -0.03 0.00 0.00 56.01 55.56 1r1i n LEU 638 Cb 0.51 -0.57 -0.13 0.00 -2.33 0.00 0.00 43.42 40.90 1r1i n LEU 638 CO 0.43 -2.82 -0.33 0.21 -1.33 0.00 0.00 177.39 173.56 1r1i s ASN 639 N -1.09 5.01 0.31 -1.43 3.84 -1.26 -4.80 114.94 115.52 1r1i s ASN 639 Ca 0.38 -1.23 0.23 0.00 0.21 0.00 0.00 52.86 52.46 1r1i s ASN 639 Cb 0.06 -1.76 0.29 0.00 -0.55 0.00 0.00 41.25 39.30 1r1i s ASN 639 CO 0.67 -0.28 1.43 1.23 -2.79 0.00 0.00 177.10 177.36 1r1i h GLY 640 N 8.06 0.00 0.00 1.21 0.00 -1.87 -2.37 103.07 108.10 1r1i h GLY 640 Ca -0.22 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.11 1r1i h GLY 640 CO 0.55 0.00 -0.02 -2.22 0.00 0.00 0.00 176.54 174.85 1r1i h ILE 641 N 0.00 1.54 0.00 2.60 2.04 -1.94 -2.59 117.51 119.16 1r1i h ILE 641 Ca 0.00 -2.16 0.00 0.00 1.00 0.00 0.00 64.86 63.70 1r1i h ILE 641 Cb 0.94 2.91 0.00 0.00 -0.74 0.00 0.00 36.82 39.94 1r1i h ILE 641 CO 0.00 0.52 0.04 0.78 0.00 0.00 0.00 178.15 179.50 1r1i h ASN 642 N -1.00 0.00 -0.12 1.72 2.35 -1.90 -0.74 115.58 115.88 1r1i h ASN 642 Ca -0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 1r1i h ASN 642 Cb 0.87 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.24 1r1i h ASN 642 CO -0.00 0.00 0.00 0.35 -1.65 0.00 0.00 177.43 176.13 1r1i n THR 643 N -2.80 0.15 0.06 2.81 -2.24 -0.90 -4.69 114.28 106.67 1r1i n THR 643 Ca -0.02 -0.57 -0.12 0.00 -2.27 0.00 0.00 64.05 61.06 1r1i n THR 643 Cb 0.10 1.31 -0.05 0.00 -2.10 0.00 0.00 70.33 69.59 1r1i n THR 643 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1r1i h LEU 644 N 4.19 -0.93 -0.08 3.22 5.85 -0.70 -1.09 115.31 125.76 1r1i h LEU 644 Ca 0.00 0.12 0.03 0.00 0.84 0.00 0.00 57.88 58.87 1r1i h LEU 644 Cb 0.91 0.37 -0.06 0.00 0.37 0.00 0.00 40.66 42.25 1r1i h LEU 644 CO 0.00 -0.38 -0.51 1.23 -0.34 0.00 0.00 178.44 178.45 1r1i h GLY 645 N -0.46 -1.00 1.31 3.75 0.00 -1.84 0.45 103.07 105.28 1r1i h GLY 645 Ca 0.06 0.63 -0.15 0.00 0.00 0.00 0.00 47.33 47.87 1r1i h GLY 645 CO -0.26 -0.22 -0.42 0.83 0.00 0.00 0.00 176.54 176.47 1r1i h GLU 646 N -0.60 0.76 -0.01 4.80 4.39 -1.71 -1.66 114.58 120.55 1r1i h GLU 646 Ca 0.04 -0.41 0.02 0.00 0.34 0.00 0.00 59.36 59.35 1r1i h GLU 646 Cb 0.69 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.33 1r1i h GLU 646 CO -0.40 1.03 -0.11 -0.91 -1.16 0.00 0.00 179.01 177.47 1r1i h ASN 647 N 0.61 -0.31 -0.73 1.42 2.35 -0.30 -1.51 115.58 117.11 1r1i h ASN 647 Ca 0.04 0.05 0.12 0.00 -0.55 0.00 0.00 56.30 55.96 1r1i h ASN 647 Cb 0.98 0.13 -0.05 0.00 0.05 0.00 0.00 38.32 39.43 1r1i h ASN 647 CO 0.09 -0.15 0.48 0.40 -1.65 0.00 0.00 177.43 176.60 1r1i h ILE 648 N -0.18 0.88 0.00 2.81 2.04 0.58 -0.54 117.51 123.10 1r1i h ILE 648 Ca 0.04 -0.18 0.00 0.00 1.00 0.00 0.00 64.86 65.72 1r1i h ILE 648 Cb 0.23 0.29 0.00 0.00 -0.74 0.00 0.00 36.82 36.60 1r1i h ILE 648 CO -0.11 0.10 -0.86 0.00 0.00 0.00 0.00 178.15 177.27 1r1i h ALA 649 N 1.64 0.56 0.42 1.87 0.00 -1.07 -2.78 119.26 119.90 1r1i h ALA 649 Ca 0.35 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.25 1r1i h ALA 649 Cb 0.62 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 1r1i h ALA 649 CO -0.12 0.00 -0.29 -0.44 0.00 0.00 0.00 179.25 178.40 1r1i h ASP 650 N 0.00 -0.75 -0.72 0.00 3.45 -0.04 -2.21 116.42 116.15 1r1i h ASP 650 Ca 0.00 0.05 -0.03 0.00 0.43 0.00 0.00 57.03 57.48 1r1i h ASP 650 Cb 0.97 0.23 -0.03 0.00 -0.56 0.00 0.00 39.33 39.94 1r1i h ASP 650 CO 0.00 -0.45 0.33 0.78 -1.57 0.00 0.00 179.24 178.33 1r1i h ASN 651 N -0.70 0.96 0.00 6.45 2.35 -1.47 -0.72 115.58 122.45 1r1i h ASN 651 Ca -0.04 -0.14 -0.00 0.00 -0.55 0.00 0.00 56.30 55.56 1r1i h ASN 651 Cb 0.59 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 38.71 1r1i h ASN 651 CO 0.02 0.84 -0.00 1.23 -1.65 0.00 0.00 177.43 177.87 1r1i h GLY 652 N 1.02 -0.01 1.19 2.83 0.00 -1.58 -3.07 103.07 103.45 1r1i h GLY 652 Ca 0.25 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.46 1r1i h GLY 652 CO -0.03 -0.00 -0.17 -1.33 0.00 0.00 0.00 176.54 175.01 1r1i h GLY 653 N -0.05 1.02 0.90 4.60 0.00 -0.76 0.32 103.07 109.10 1r1i h GLY 653 Ca -0.00 -0.85 -0.04 0.00 0.00 0.00 0.00 47.33 46.44 1r1i h GLY 653 CO 0.00 0.78 -0.36 -2.00 0.00 0.00 0.00 176.54 174.96 1r1i h LEU 654 N 0.82 -0.85 0.10 3.11 5.85 -1.18 -1.92 115.31 121.23 1r1i h LEU 654 Ca 0.12 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.87 1r1i h LEU 654 Cb 0.72 0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.95 1r1i h LEU 654 CO 0.06 -0.55 -0.22 1.23 -0.34 0.00 0.00 178.44 178.62 1r1i h GLY 655 N -1.12 -0.39 -0.53 3.75 0.00 -1.49 0.68 103.07 103.97 1r1i h GLY 655 Ca -0.10 0.26 0.15 0.00 0.00 0.00 0.00 47.33 47.63 1r1i h GLY 655 CO 0.17 -0.20 0.02 -1.06 0.00 0.00 0.00 176.54 175.47 1r1i n GLN 656 N -5.34 -0.04 -0.02 4.80 6.02 0.11 -1.45 117.38 121.46 1r1i n GLN 656 Ca -0.06 0.80 -0.20 0.00 -0.01 0.00 0.00 57.00 57.52 1r1i n GLN 656 Cb 0.26 -1.27 -0.14 0.00 1.02 0.00 0.00 30.24 30.11 1r1i n GLN 656 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1r1i n ALA 657 N -3.37 1.00 -0.19 -1.58 0.00 0.21 -2.11 120.51 114.48 1r1i n ALA 657 Ca 0.13 -0.68 -0.13 0.00 0.00 0.00 0.00 53.44 52.76 1r1i n ALA 657 Cb 0.42 -0.61 -0.10 0.00 0.00 0.00 0.00 19.45 19.16 1r1i n ALA 657 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1r1i h TYR 658 N 0.06 -1.73 -0.72 0.00 3.20 -0.18 0.28 116.97 117.87 1r1i h TYR 658 Ca -0.44 0.09 0.13 0.00 3.14 0.00 0.00 58.73 61.65 1r1i h TYR 658 Cb 2.02 0.83 -0.09 0.00 1.54 0.00 0.00 36.73 41.03 1r1i h TYR 658 CO 0.07 -0.47 0.29 0.00 -1.64 0.00 0.00 178.16 176.41 1r1i h ARG 659 N -0.32 0.44 -0.38 1.82 3.08 -1.20 2.29 114.38 120.11 1r1i h ARG 659 Ca 0.09 -0.03 0.08 0.00 0.07 0.00 0.00 59.98 60.19 1r1i h ARG 659 Cb 0.56 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.49 1r1i h ARG 659 CO -0.67 0.29 0.26 0.00 -1.07 0.00 0.00 179.97 178.79 1r1i h ALA 660 N 1.51 2.14 0.16 0.04 0.00 -0.78 -1.55 119.26 120.78 1r1i h ALA 660 Ca 0.39 -0.01 -0.34 0.00 0.00 0.00 0.00 54.91 54.95 1r1i h ALA 660 Cb 0.55 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1r1i h ALA 660 CO -0.37 -0.23 -1.70 -0.92 0.00 0.00 0.00 179.25 176.03 1r1i h TYR 661 N 0.17 0.62 0.22 0.00 3.20 0.57 -3.03 116.97 118.72 1r1i h TYR 661 Ca 0.18 -0.45 -0.00 0.00 3.14 0.00 0.00 58.73 61.59 1r1i h TYR 661 Cb 0.47 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.70 1r1i h TYR 661 CO -0.00 1.58 -0.33 1.96 -1.64 0.00 0.00 178.16 179.73 1r1i h GLN 662 N 0.09 -0.56 -0.70 1.82 4.20 0.01 0.18 115.11 120.15 1r1i h GLN 662 Ca -0.32 0.04 0.26 0.00 0.06 0.00 0.00 58.65 58.69 1r1i h GLN 662 Cb 2.07 0.13 -0.09 0.00 0.30 0.00 0.00 27.48 29.89 1r1i h GLN 662 CO 0.17 -0.37 0.43 0.09 -0.67 0.00 0.00 178.83 178.48 1r1i n ASN 663 N -4.36 0.15 -0.03 1.46 4.13 -0.61 0.16 115.26 116.16 1r1i n ASN 663 Ca -0.07 0.83 -0.15 0.00 1.68 0.00 0.00 54.58 56.87 1r1i n ASN 663 Cb 0.28 -0.41 -0.09 0.00 -1.54 0.00 0.00 39.78 38.03 1r1i n ASN 663 CO 0.00 0.00 0.00 0.22 0.28 0.00 0.00 177.26 177.76 1r1i h TYR 664 N 0.00 0.60 0.00 3.10 5.03 -0.60 -1.99 116.97 123.12 1r1i h TYR 664 Ca 0.49 -0.26 0.00 0.00 2.58 0.00 0.00 58.73 61.54 1r1i h TYR 664 Cb 1.48 -0.09 0.00 0.00 1.55 0.00 0.00 36.73 39.66 1r1i h TYR 664 CO -0.00 1.02 0.00 -0.89 -1.32 0.00 0.00 178.16 176.97 1r1i n ILE 665 N -4.31 0.00 -0.28 1.81 2.08 0.43 -1.18 119.36 117.91 1r1i n ILE 665 Ca -0.08 0.34 -0.08 0.00 0.56 0.00 0.00 62.75 63.49 1r1i n ILE 665 Cb 0.56 -0.53 -0.07 0.00 -0.75 0.00 0.00 39.64 38.85 1r1i n ILE 665 CO 0.00 0.00 0.00 0.11 0.56 0.00 0.00 176.55 177.22 1r1i h LYS 666 N 0.00 -0.01 0.00 0.38 1.57 -0.65 0.47 116.57 118.33 1r1i h LYS 666 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1r1i h LYS 666 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1r1i h LYS 666 CO 0.00 -0.01 -0.62 1.17 -0.57 0.00 0.00 179.45 179.42 1r1i n LYS 667 N -4.54 0.22 0.00 3.15 4.81 -0.79 -3.96 118.16 117.05 1r1i n LYS 667 Ca 0.01 0.06 0.00 0.00 -0.87 0.00 0.00 58.31 57.51 1r1i n LYS 667 Cb 0.18 -1.63 0.00 0.00 0.02 0.00 0.00 35.03 33.60 1r1i n LYS 667 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1r1i n ASN 668 N -1.95 4.99 -0.16 3.14 3.02 -0.32 -5.10 115.26 118.88 1r1i n ASN 668 Ca 0.04 0.00 0.01 0.00 -0.03 0.00 0.00 54.58 54.60 1r1i n ASN 668 Cb 0.41 0.80 -0.01 0.00 -0.61 0.00 0.00 39.78 40.38 1r1i n ASN 668 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1r1i n GLY 669 N 2.69 -2.78 3.77 7.41 0.00 0.16 -5.00 105.19 111.45 1r1i n GLY 669 Ca 0.00 -1.36 -0.34 0.00 0.00 0.00 0.00 46.02 44.32 1r1i n GLY 669 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1r1i s GLU 670 N -3.46 3.08 0.23 1.61 2.56 -1.26 -4.80 118.70 116.67 1r1i s GLU 670 Ca 0.00 1.49 0.10 0.00 0.00 0.00 0.00 54.97 56.56 1r1i s GLU 670 Cb 0.00 -1.98 -0.04 0.00 2.00 0.00 0.00 34.13 34.11 1r1i s GLU 670 CO 0.00 -1.05 -0.13 -1.83 -0.56 0.00 0.00 175.26 171.69 1r1i s GLU 671 N -3.71 1.91 0.33 4.30 -1.05 -1.26 -5.07 118.70 114.14 1r1i s GLU 671 Ca 0.70 -1.50 -0.29 0.00 -0.15 0.00 0.00 54.97 53.73 1r1i s GLU 671 Cb -0.22 -1.99 -0.10 0.00 -0.44 0.00 0.00 34.13 31.38 1r1i s GLU 671 CO 0.34 0.38 1.37 0.15 0.95 0.00 0.00 175.26 178.45 1r1i s LYS 672 N -3.20 4.29 0.69 -4.83 1.02 -1.26 -4.97 119.74 111.48 1r1i s LYS 672 Ca 0.27 2.30 -0.11 0.00 0.02 0.00 0.00 55.97 58.45 1r1i s LYS 672 Cb -0.07 -3.06 0.00 0.00 -0.52 0.00 0.00 37.83 34.19 1r1i s LYS 672 CO 0.15 -0.30 1.06 -0.51 -0.92 0.00 0.00 175.35 174.84 1r1i s LEU 673 N -1.60 3.05 0.05 3.17 1.02 -1.23 -4.41 118.68 118.72 1r1i s LEU 673 Ca 0.52 1.44 0.04 0.00 0.02 0.00 0.00 54.13 56.15 1r1i s LEU 673 Cb -0.41 -4.32 -0.04 0.00 0.02 0.00 0.00 46.19 41.44 1r1i s LEU 673 CO 0.53 -1.34 -0.01 -0.76 0.02 0.00 0.00 176.35 174.79 1r1i s LEU 674 N -5.45 3.42 0.96 1.79 1.43 -1.26 0.73 118.68 120.30 1r1i s LEU 674 Ca 0.58 -0.13 -0.12 0.00 -1.03 0.00 0.00 54.13 53.42 1r1i s LEU 674 Cb -0.13 -2.08 0.08 0.00 0.03 0.00 0.00 46.19 44.10 1r1i s LEU 674 CO 0.54 0.22 0.64 -2.65 0.23 0.00 0.00 176.35 175.33 1r1i n PRO 675 N 0.96 -0.49 0.00 1.29 -0.02 -1.26 -4.08 135.00 131.40 1r1i n PRO 675 Ca -0.13 -0.10 0.00 0.00 -2.02 0.00 0.00 63.50 61.26 1r1i n PRO 675 Cb 0.52 -2.02 0.00 0.00 -0.02 0.00 0.00 33.50 31.98 1r1i n PRO 675 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1r1i n GLY 676 N 1.13 3.02 3.05 -1.23 0.00 -1.26 -4.80 105.19 105.10 1r1i n GLY 676 Ca 0.08 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.79 1r1i n GLY 676 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1r1i s LEU 677 N 0.00 2.25 -1.50 0.99 1.43 -1.26 -5.02 118.68 115.57 1r1i s LEU 677 Ca 0.00 -0.79 -0.10 0.00 -1.03 0.00 0.00 54.13 52.22 1r1i s LEU 677 Cb 0.00 -1.34 0.00 0.00 0.03 0.00 0.00 46.19 44.88 1r1i s LEU 677 CO 0.00 -0.08 2.60 0.47 0.23 0.00 0.00 176.35 179.56 1r1i n ASP 678 N 4.65 7.28 -4.02 2.29 8.00 -1.26 -4.83 116.55 128.66 1r1i n ASP 678 Ca -0.17 -2.79 -0.08 0.00 0.71 0.00 0.00 54.79 52.45 1r1i n ASP 678 Cb 0.48 -1.53 -0.10 0.00 -0.02 0.00 0.00 41.12 39.94 1r1i n ASP 678 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1r1i s LEU 679 N 0.10 2.29 0.55 0.64 1.43 -1.26 -5.16 118.68 117.25 1r1i s LEU 679 Ca 0.59 -0.71 -0.03 0.00 -1.03 0.00 0.00 54.13 52.96 1r1i s LEU 679 Cb 0.17 0.20 0.01 0.00 0.03 0.00 0.00 46.19 46.60 1r1i s LEU 679 CO -0.07 -0.45 0.81 0.54 0.23 0.00 0.00 176.35 177.42 1r1i s ASN 680 N -2.14 5.56 0.34 2.29 2.20 -1.26 -4.91 114.94 117.02 1r1i s ASN 680 Ca -0.05 0.44 0.04 0.00 -0.94 0.00 0.00 52.86 52.35 1r1i s ASN 680 Cb -0.02 -1.47 0.67 0.00 -2.00 0.00 0.00 41.25 38.43 1r1i s ASN 680 CO -0.05 -0.99 1.93 0.45 -2.94 0.00 0.00 177.10 175.49 1r1i h HIS 681 N 0.02 0.88 -0.71 1.54 3.86 -1.98 -0.91 115.15 117.85 1r1i h HIS 681 Ca -0.45 0.02 0.06 0.00 -1.16 0.00 0.00 60.37 58.84 1r1i h HIS 681 Cb 1.27 -0.29 -0.06 0.00 1.06 0.00 0.00 27.41 29.39 1r1i h HIS 681 CO 0.44 0.44 0.41 0.87 0.86 0.00 0.00 177.93 180.95 1r1i h LYS 682 N 0.85 0.72 -0.04 2.45 1.57 -1.98 0.22 116.57 120.36 1r1i h LYS 682 Ca 0.36 -0.04 -0.13 0.00 -1.87 0.00 0.00 60.65 58.97 1r1i h LYS 682 Cb 0.30 -0.16 0.01 0.00 0.08 0.00 0.00 32.23 32.46 1r1i h LYS 682 CO -0.13 0.48 -0.48 -0.56 -0.57 0.00 0.00 179.45 178.19 1r1i h GLN 683 N 0.74 0.40 -1.15 3.15 3.07 -1.56 -2.76 115.11 117.00 1r1i h GLN 683 Ca 0.32 -0.37 0.33 0.00 0.09 0.00 0.00 58.65 59.02 1r1i h GLN 683 Cb 0.20 0.09 -0.10 0.00 0.08 0.00 0.00 27.48 27.75 1r1i h GLN 683 CO -0.19 1.03 0.74 -0.07 0.09 0.00 0.00 178.83 180.43 1r1i h LEU 684 N -0.10 0.35 -0.34 0.06 3.38 -0.19 0.71 115.31 119.18 1r1i h LEU 684 Ca -0.05 0.10 0.07 0.00 0.09 0.00 0.00 57.88 58.10 1r1i h LEU 684 Cb 1.16 0.06 -0.08 0.00 0.09 0.00 0.00 40.66 41.89 1r1i h LEU 684 CO 0.10 -0.02 -0.20 0.15 0.09 0.00 0.00 178.44 178.56 1r1i h PHE 685 N 0.26 -0.50 -0.04 1.13 3.04 -0.31 -0.47 116.94 120.05 1r1i h PHE 685 Ca 0.68 0.04 -0.16 0.00 3.98 0.00 0.00 57.97 62.51 1r1i h PHE 685 Cb 1.94 0.27 -0.01 0.00 2.56 0.00 0.00 35.95 40.71 1r1i h PHE 685 CO -0.00 -0.27 -0.69 0.74 -2.02 0.00 0.00 178.31 176.06 1r1i h PHE 686 N -0.15 0.27 0.21 0.41 0.05 0.11 -2.76 116.94 115.08 1r1i h PHE 686 Ca 0.17 -0.12 0.01 0.00 3.82 0.00 0.00 57.97 61.85 1r1i h PHE 686 Cb 0.41 -0.04 -0.03 0.00 2.00 0.00 0.00 35.95 38.30 1r1i h PHE 686 CO -0.40 0.83 -0.27 1.25 -0.18 0.00 0.00 178.31 179.53 1r1i h LEU 687 N 0.14 -0.76 -0.46 1.54 6.46 0.10 0.26 115.31 122.60 1r1i h LEU 687 Ca -0.02 0.08 -0.06 0.00 -0.12 0.00 0.00 57.88 57.76 1r1i h LEU 687 Cb 1.23 0.27 -0.02 0.00 -0.73 0.00 0.00 40.66 41.41 1r1i h LEU 687 CO 0.10 -0.38 0.04 -1.13 -0.62 0.00 0.00 178.44 176.45 1r1i h ASN 688 N -0.54 0.76 -0.34 1.25 -0.00 -1.03 -0.41 115.58 115.27 1r1i h ASN 688 Ca 0.01 -0.28 0.07 0.00 -0.00 0.00 0.00 56.30 56.09 1r1i h ASN 688 Cb 0.53 -0.20 -0.08 0.00 -0.00 0.00 0.00 38.32 38.56 1r1i h ASN 688 CO -0.10 0.86 -0.36 0.15 -0.00 0.00 0.00 177.43 177.98 1r1i h PHE 689 N 0.64 -1.01 -0.86 0.67 3.04 -1.33 -0.94 116.94 117.16 1r1i h PHE 689 Ca 0.14 0.06 0.11 0.00 3.98 0.00 0.00 57.97 62.26 1r1i h PHE 689 Cb 0.44 0.49 -0.08 0.00 2.56 0.00 0.00 35.95 39.36 1r1i h PHE 689 CO 0.03 -0.41 0.49 0.00 -2.02 0.00 0.00 178.31 176.40 1r1i h ALA 690 N 0.57 1.26 0.00 2.41 0.00 -0.18 -3.08 119.26 120.25 1r1i h ALA 690 Ca 0.14 0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.97 1r1i h ALA 690 Cb 0.56 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 1r1i h ALA 690 CO -0.51 0.06 -0.69 1.96 0.00 0.00 0.00 179.25 180.08 1r1i h GLN 691 N 0.77 0.00 -1.63 0.00 4.20 0.23 -2.41 115.11 116.27 1r1i h GLN 691 Ca 0.43 0.00 0.52 0.00 0.06 0.00 0.00 58.65 59.66 1r1i h GLN 691 Cb 0.47 0.00 -0.11 0.00 0.30 0.00 0.00 27.48 28.14 1r1i h GLN 691 CO -0.28 0.58 1.12 0.28 -0.67 0.00 0.00 178.83 179.85 1r1i n VAL 692 N -3.22 -0.14 -0.34 -0.54 0.31 -0.76 -1.62 118.33 112.04 1r1i n VAL 692 Ca 0.00 1.64 0.04 0.00 -0.01 0.00 0.00 64.34 66.01 1r1i n VAL 692 Cb 0.79 -2.70 0.08 0.00 -0.91 0.00 0.00 33.84 31.10 1r1i n VAL 692 CO 0.00 0.00 0.00 0.79 -1.32 0.00 0.00 176.83 176.30 1r1i n TRP 693 N -4.32 0.17 -1.67 3.52 7.02 -0.91 -3.70 117.44 117.55 1r1i n TRP 693 Ca 0.42 -0.63 -0.45 0.00 -1.02 0.00 0.00 57.50 55.81 1r1i n TRP 693 Cb 1.75 -0.09 -0.03 0.00 -2.42 0.00 0.00 31.31 30.52 1r1i n TRP 693 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1r1i n GLY 695 N 2.29 0.46 0.72 0.00 0.00 -1.26 -2.15 105.19 105.24 1r1i n GLY 695 Ca 0.12 -1.75 -0.02 0.00 0.00 0.00 0.00 46.02 44.37 1r1i n GLY 695 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1r1i n THR 696 N 9.00 0.00 -3.74 2.61 5.66 -0.80 -4.90 114.28 122.11 1r1i n THR 696 Ca 0.00 -0.28 -0.12 0.00 -3.05 0.00 0.00 64.05 60.59 1r1i n THR 696 Cb 0.00 0.21 -0.11 0.00 -1.55 0.00 0.00 70.33 68.88 1r1i n THR 696 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 175.07 171.71 1r1i s TYR 697 N -6.04 -0.43 0.45 1.09 2.02 -1.26 -2.76 117.35 110.41 1r1i s TYR 697 Ca 0.05 1.02 -0.21 0.00 -0.37 0.00 0.00 57.07 57.56 1r1i s TYR 697 Cb -0.01 0.16 -0.10 0.00 -0.40 0.00 0.00 41.96 41.61 1r1i s TYR 697 CO 0.03 -0.23 0.98 1.03 -1.57 0.00 0.00 175.55 175.80 1r1i s ARG 698 N 0.53 4.09 0.20 -0.62 0.52 -0.58 -4.91 118.95 118.18 1r1i s ARG 698 Ca -0.03 1.21 -0.11 0.00 -0.52 0.00 0.00 55.73 56.28 1r1i s ARG 698 Cb -0.04 -2.16 0.24 0.00 0.52 0.00 0.00 34.95 33.50 1r1i s ARG 698 CO -0.03 -0.16 1.71 -1.35 0.02 0.00 0.00 175.30 175.49 1r1i h PRO 699 N 1.81 0.25 -0.55 3.54 0.11 -1.91 -1.70 132.00 133.56 1r1i h PRO 699 Ca -0.49 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.60 1r1i h PRO 699 Cb 1.19 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 32.22 1r1i h PRO 699 CO 0.60 0.17 0.31 0.93 -0.21 0.00 0.00 178.00 179.80 1r1i h GLU 700 N 0.26 0.75 0.00 1.05 3.07 -1.88 -2.09 114.58 115.73 1r1i h GLU 700 Ca 0.28 -0.07 -0.02 0.00 -0.50 0.00 0.00 59.36 59.05 1r1i h GLU 700 Cb 0.39 -0.16 -0.00 0.00 -0.84 0.00 0.00 28.75 28.14 1r1i h GLU 700 CO -0.36 0.54 -0.90 -0.92 -1.40 0.00 0.00 179.01 175.97 1r1i h TYR 701 N 0.76 0.00 -0.05 4.33 5.03 -1.47 -2.74 116.97 122.83 1r1i h TYR 701 Ca 0.20 0.00 -0.01 0.00 2.58 0.00 0.00 58.73 61.50 1r1i h TYR 701 Cb 0.01 0.00 -0.00 0.00 1.55 0.00 0.00 36.73 38.28 1r1i h TYR 701 CO 0.00 0.09 0.01 0.00 -1.32 0.00 0.00 178.16 176.94 1r1i h ALA 702 N 1.91 0.06 -0.65 1.82 0.00 -0.79 2.34 119.26 123.95 1r1i h ALA 702 Ca -0.02 -0.13 0.14 0.00 0.00 0.00 0.00 54.91 54.90 1r1i h ALA 702 Cb 1.09 -0.02 -0.11 0.00 0.00 0.00 0.00 17.79 18.75 1r1i h ALA 702 CO 0.01 -0.31 0.02 0.28 0.00 0.00 0.00 179.25 179.26 1r1i h VAL 703 N -0.15 0.47 0.33 0.00 2.07 -1.40 0.18 116.25 117.75 1r1i h VAL 703 Ca 0.01 -0.05 -0.02 0.00 0.82 0.00 0.00 66.70 67.47 1r1i h VAL 703 Cb 0.26 0.33 0.00 0.00 -1.52 0.00 0.00 31.29 30.35 1r1i h VAL 703 CO 0.00 0.02 -0.16 -1.13 0.02 0.00 0.00 177.57 176.33 1r1i h ASN 704 N 0.14 -0.38 -0.63 0.57 -0.00 -1.12 -3.14 115.58 111.02 1r1i h ASN 704 Ca 0.35 -0.17 0.13 0.00 -0.00 0.00 0.00 56.30 56.61 1r1i h ASN 704 Cb 0.57 0.10 -0.11 0.00 -0.00 0.00 0.00 38.32 38.88 1r1i h ASN 704 CO -0.55 0.00 -0.05 -1.28 -0.00 0.00 0.00 177.43 175.56 1r1i h SER 705 N -0.81 -0.38 0.05 1.15 0.87 0.43 -1.00 113.55 113.86 1r1i h SER 705 Ca -0.05 0.17 -0.00 0.00 -1.23 0.00 0.00 61.79 60.68 1r1i h SER 705 Cb 0.52 0.31 -0.00 0.00 -0.44 0.00 0.00 62.40 62.79 1r1i h SER 705 CO 0.07 -0.15 -0.01 0.40 -0.53 0.00 0.00 176.83 176.61 1r1i h ILE 706 N 0.07 0.39 -0.00 2.23 2.04 -0.63 0.22 117.51 121.83 1r1i h ILE 706 Ca 0.32 -0.06 0.00 0.00 1.00 0.00 0.00 64.86 66.12 1r1i h ILE 706 Cb 0.52 1.04 0.00 0.00 -0.74 0.00 0.00 36.82 37.64 1r1i h ILE 706 CO -0.58 0.01 -0.80 0.29 0.00 0.00 0.00 178.15 177.07 1r1i n LYS 707 N -3.62 1.28 0.00 2.37 4.76 -0.48 -4.52 118.16 117.94 1r1i n LYS 707 Ca -0.03 -0.03 0.00 0.00 -2.87 0.00 0.00 58.31 55.38 1r1i n LYS 707 Cb 0.10 -1.32 0.00 0.00 -1.84 0.00 0.00 35.03 31.97 1r1i n LYS 707 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 1r1i n THR 708 N -1.36 0.00 -3.22 -0.18 -2.24 -0.52 -4.95 114.28 101.81 1r1i n THR 708 Ca 0.03 -0.07 -0.33 0.00 -2.27 0.00 0.00 64.05 61.42 1r1i n THR 708 Cb 0.27 0.46 -0.06 0.00 -2.10 0.00 0.00 70.33 68.91 1r1i n THR 708 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1r1i s ASP 709 N -1.02 6.74 -0.00 3.42 -1.08 0.66 -4.98 116.67 120.41 1r1i s ASP 709 Ca 0.00 1.18 0.15 0.00 -0.52 0.00 0.00 52.55 53.36 1r1i s ASP 709 Cb 0.00 -2.33 -0.17 0.00 -1.46 0.00 0.00 42.92 38.96 1r1i s ASP 709 CO 0.00 -0.15 0.63 1.33 0.52 0.00 0.00 175.17 177.50 1r1i n VAL 710 N -0.23 0.00 -2.63 1.11 0.24 -1.26 -4.81 118.33 110.75 1r1i n VAL 710 Ca 0.02 -0.15 -0.39 0.00 -2.04 0.00 0.00 64.34 61.78 1r1i n VAL 710 Cb 0.53 0.97 -0.05 0.00 -1.47 0.00 0.00 33.84 33.82 1r1i n VAL 710 CO 0.00 0.00 0.00 -1.00 -2.14 0.00 0.00 176.83 173.69 1r1i s HIS 711 N -2.44 3.69 0.45 6.34 3.76 -1.26 -4.34 115.29 121.49 1r1i s HIS 711 Ca 0.05 1.78 -0.21 0.00 -0.15 0.00 0.00 55.06 56.53 1r1i s HIS 711 Cb 0.11 -3.10 -0.13 0.00 1.11 0.00 0.00 32.58 30.58 1r1i s HIS 711 CO 0.62 -0.09 0.36 0.43 -0.85 0.00 0.00 174.74 175.21 1r1i n SER 712 N 0.99 -1.67 -4.71 1.40 7.64 -1.26 -4.98 113.62 111.03 1r1i n SER 712 Ca 0.00 0.83 -0.35 0.00 1.01 0.00 0.00 58.87 60.35 1r1i n SER 712 Cb 0.47 -1.04 0.10 0.00 -1.01 0.00 0.00 64.21 62.73 1r1i n SER 712 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1r1i n PRO 713 N 0.74 0.67 -0.11 1.43 -0.04 -1.26 -4.71 135.00 131.73 1r1i n PRO 713 Ca 0.11 0.30 -0.04 0.00 -0.04 0.00 0.00 63.50 63.83 1r1i n PRO 713 Cb 0.42 -2.49 0.17 0.00 -0.04 0.00 0.00 33.50 31.56 1r1i n PRO 713 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1r1i h GLY 714 N -0.16 0.85 1.21 0.55 0.00 -1.95 -0.15 103.07 103.42 1r1i h GLY 714 Ca -0.49 -0.54 -0.02 0.00 0.00 0.00 0.00 47.33 46.28 1r1i h GLY 714 CO 0.50 0.50 0.38 3.45 0.00 0.00 0.00 176.54 181.37 1r1i h ASN 715 N 0.75 0.93 0.90 0.19 -1.07 -1.91 -1.59 115.58 113.78 1r1i h ASN 715 Ca 0.15 -0.09 0.00 0.00 0.07 0.00 0.00 56.30 56.43 1r1i h ASN 715 Cb 0.40 -0.24 0.00 0.00 -2.07 0.00 0.00 38.32 36.41 1r1i h ASN 715 CO 0.01 0.77 -0.37 0.49 0.07 0.00 0.00 177.43 178.40 1r1i n PHE 716 N -4.34 0.38 0.20 4.14 3.01 -0.82 -2.11 117.46 117.92 1r1i n PHE 716 Ca 0.07 0.11 0.04 0.00 1.01 0.00 0.00 57.45 58.68 1r1i n PHE 716 Cb 0.12 -0.57 0.43 0.00 -0.01 0.00 0.00 39.48 39.45 1r1i n PHE 716 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1r1i h ARG 717 N 0.00 0.02 0.00 -1.08 3.08 -0.10 -2.21 114.38 114.09 1r1i h ARG 717 Ca 0.00 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.04 1r1i h ARG 717 Cb 0.64 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.68 1r1i h ARG 717 CO 0.00 0.28 -0.00 0.82 -1.07 0.00 0.00 179.97 180.00 1r1i h ILE 718 N 0.02 1.78 0.22 2.04 2.04 -1.26 -3.14 117.51 119.21 1r1i h ILE 718 Ca 0.00 -2.29 -0.31 0.00 1.00 0.00 0.00 64.86 63.26 1r1i h ILE 718 Cb 0.47 3.34 0.04 0.00 -0.74 0.00 0.00 36.82 39.92 1r1i h ILE 718 CO 0.03 0.59 -1.36 0.40 0.00 0.00 0.00 178.15 177.82 1r1i h ILE 719 N -0.98 1.31 -0.20 -0.67 2.04 -1.41 0.34 117.51 117.94 1r1i h ILE 719 Ca -0.00 -2.64 0.04 0.00 1.00 0.00 0.00 64.86 63.26 1r1i h ILE 719 Cb 0.97 3.02 -0.04 0.00 -0.74 0.00 0.00 36.82 40.03 1r1i h ILE 719 CO 0.00 0.79 -0.06 1.23 0.00 0.00 0.00 178.15 180.11 1r1i h GLY 720 N 0.10 0.14 1.06 5.37 0.00 -1.60 0.92 103.07 109.06 1r1i h GLY 720 Ca -0.23 0.07 -0.16 0.00 0.00 0.00 0.00 47.33 47.01 1r1i h GLY 720 CO 0.26 -0.08 -0.48 -0.84 0.00 0.00 0.00 176.54 175.40 1r1i h THR 721 N -0.01 1.29 -0.45 4.70 2.02 -1.48 -2.88 112.91 116.11 1r1i h THR 721 Ca 0.10 -1.67 -0.06 0.00 0.77 0.00 0.00 66.41 65.54 1r1i h THR 721 Cb 0.16 1.70 -0.02 0.00 -1.74 0.00 0.00 68.15 68.26 1r1i h THR 721 CO -0.22 0.54 0.03 -0.07 0.37 0.00 0.00 175.52 176.17 1r1i h LEU 722 N 0.53 0.75 -1.16 2.58 4.07 -0.16 -2.07 115.31 119.85 1r1i h LEU 722 Ca 0.01 -0.29 0.00 0.00 0.08 0.00 0.00 57.88 57.69 1r1i h LEU 722 Cb 1.08 -0.20 0.00 0.00 1.08 0.00 0.00 40.66 42.62 1r1i h LEU 722 CO 0.11 0.85 0.24 1.56 -1.08 0.00 0.00 178.44 180.12 1r1i h GLN 723 N 0.62 0.00 -0.15 1.13 4.20 0.11 0.62 115.11 121.64 1r1i h GLN 723 Ca 0.13 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.84 1r1i h GLN 723 Cb 0.45 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.23 1r1i h GLN 723 CO 0.02 0.00 0.00 0.09 -0.67 0.00 0.00 178.83 178.27 1r1i n ASN 724 N -2.22 2.31 -4.27 1.46 3.02 -0.79 -4.43 115.26 110.34 1r1i n ASN 724 Ca -0.01 -1.69 -0.38 0.00 -0.03 0.00 0.00 54.58 52.47 1r1i n ASN 724 Cb 0.27 -0.10 -0.12 0.00 -0.61 0.00 0.00 39.78 39.22 1r1i n ASN 724 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1r1i s SER 725 N -0.93 5.38 0.09 6.41 0.15 0.21 -4.81 113.70 120.21 1r1i s SER 725 Ca 0.16 -1.20 -0.25 0.00 0.70 0.00 0.00 55.95 55.37 1r1i s SER 725 Cb 0.10 -1.89 -0.13 0.00 -1.71 0.00 0.00 66.02 62.39 1r1i s SER 725 CO 0.14 -0.36 1.71 0.00 1.20 0.00 0.00 173.24 175.92 1r1i h ALA 726 N 8.25 -0.18 -1.12 5.45 0.00 -1.92 -2.30 119.26 127.45 1r1i h ALA 726 Ca -0.23 -0.03 0.32 0.00 0.00 0.00 0.00 54.91 54.98 1r1i h ALA 726 Cb 1.08 0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.95 1r1i h ALA 726 CO 0.63 -0.61 0.80 0.93 0.00 0.00 0.00 179.25 181.00 1r1i h GLU 727 N -0.20 0.03 0.00 0.00 3.07 -1.96 -2.04 114.58 113.47 1r1i h GLU 727 Ca 0.00 -0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1r1i h GLU 727 Cb 0.19 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.09 1r1i h GLU 727 CO -0.02 0.02 0.00 0.34 -1.40 0.00 0.00 179.01 177.95 1r1i n PHE 728 N -4.23 0.00 0.00 4.33 -0.00 -0.89 -2.15 117.46 114.52 1r1i n PHE 728 Ca 0.24 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.69 1r1i n PHE 728 Cb 1.17 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 40.65 1r1i n PHE 728 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.76 177.19 1r1i n SER 729 N -0.41 0.00 -0.07 -2.13 7.64 -1.00 0.15 113.62 117.81 1r1i n SER 729 Ca 0.00 0.25 -0.12 0.00 1.01 0.00 0.00 58.87 60.01 1r1i n SER 729 Cb 0.00 -0.25 -0.10 0.00 -1.01 0.00 0.00 64.21 62.85 1r1i n SER 729 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 1r1i h GLU 730 N 0.00 0.00 -1.09 1.43 4.57 -1.46 -0.31 114.58 117.72 1r1i h GLU 730 Ca 0.00 0.00 0.41 0.00 -1.18 0.00 0.00 59.36 58.59 1r1i h GLU 730 Cb 0.00 0.00 -0.16 0.00 -0.16 0.00 0.00 28.75 28.43 1r1i h GLU 730 CO 0.00 0.77 0.63 0.00 -1.18 0.00 0.00 179.01 179.23 1r1i h ALA 731 N -0.30 2.29 0.00 2.92 0.00 0.20 -1.78 119.26 122.59 1r1i h ALA 731 Ca -0.05 0.22 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1r1i h ALA 731 Cb 0.84 0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1r1i h ALA 731 CO -0.03 -1.02 -0.03 1.19 0.00 0.00 0.00 179.25 179.35 1r1i n PHE 732 N -5.09 0.00 -3.53 0.00 3.72 -1.04 -4.84 117.46 106.68 1r1i n PHE 732 Ca 0.37 -0.71 -0.19 0.00 -0.05 0.00 0.00 57.45 56.87 1r1i n PHE 732 Cb 1.30 -0.10 0.01 0.00 -0.94 0.00 0.00 39.48 39.74 1r1i n PHE 732 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 1r1i n HIS 733 N -0.95 -2.44 -4.02 1.38 8.25 -0.67 -4.83 115.22 111.95 1r1i n HIS 733 Ca 0.09 0.98 -0.35 0.00 -0.26 0.00 0.00 57.72 58.17 1r1i n HIS 733 Cb 0.50 -3.06 -0.13 0.00 1.12 0.00 0.00 29.99 28.42 1r1i n HIS 733 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1r1i n ARG 735 N 4.40 1.19 -0.38 0.00 0.63 -1.26 -4.85 116.66 116.38 1r1i n ARG 735 Ca -0.17 0.43 -0.12 0.00 -0.92 0.00 0.00 57.85 57.06 1r1i n ARG 735 Cb 0.52 -1.98 0.00 0.00 0.45 0.00 0.00 32.46 31.45 1r1i n ARG 735 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 1r1i n LYS 736 N 2.05 0.00 -1.28 -0.14 4.01 -1.26 -0.93 118.16 120.61 1r1i n LYS 736 Ca 0.16 0.00 -0.02 0.00 -0.51 0.00 0.00 58.31 57.94 1r1i n LYS 736 Cb 0.23 -0.30 -0.01 0.00 -0.51 0.00 0.00 35.03 34.44 1r1i n LYS 736 CO 0.00 0.00 0.00 0.09 -1.11 0.00 0.00 177.40 176.38 1r1i n ASN 737 N 0.75 -0.69 -4.69 4.39 3.02 -0.36 -4.88 115.26 112.80 1r1i n ASN 737 Ca 0.03 0.11 -0.44 0.00 -0.03 0.00 0.00 54.58 54.25 1r1i n ASN 737 Cb 0.14 -1.00 -0.02 0.00 -0.61 0.00 0.00 39.78 38.29 1r1i n ASN 737 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1r1i n SER 738 N 0.40 2.86 -0.02 6.41 7.64 -0.10 -4.86 113.62 125.95 1r1i n SER 738 Ca -0.02 1.17 0.18 0.00 1.01 0.00 0.00 58.87 61.20 1r1i n SER 738 Cb 0.14 -1.46 0.63 0.00 -1.01 0.00 0.00 64.21 62.51 1r1i n SER 738 CO 0.00 0.00 0.00 0.22 -3.01 0.00 0.00 175.04 172.25 1r1i h TYR 739 N 3.69 0.14 -0.10 1.43 5.03 -1.85 10.74 116.97 136.05 1r1i h TYR 739 Ca -0.46 0.00 0.00 0.00 2.58 0.00 0.00 58.73 60.86 1r1i h TYR 739 Cb 1.27 -0.04 0.00 0.00 1.55 0.00 0.00 36.73 39.51 1r1i h TYR 739 CO 0.55 0.06 0.00 -1.33 -1.32 0.00 0.00 178.16 176.11 1r1i n MET 740 N -4.42 1.29 -2.73 1.82 0.00 -0.96 -4.45 117.12 107.67 1r1i n MET 740 Ca 0.10 -0.44 -0.10 0.00 0.00 0.00 0.00 57.70 57.26 1r1i n MET 740 Cb 0.53 -1.20 0.04 0.00 0.00 0.00 0.00 33.22 32.59 1r1i n MET 740 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 175.97 174.26 1r1i n ASN 741 N -0.24 0.75 -4.80 7.83 5.15 3.39 -4.24 115.26 123.09 1r1i n ASN 741 Ca 0.09 -2.73 -0.34 0.00 -0.60 0.00 0.00 54.58 50.99 1r1i n ASN 741 Cb 0.13 -0.23 -0.05 0.00 -0.53 0.00 0.00 39.78 39.10 1r1i n ASN 741 CO 0.00 0.00 0.00 -2.84 1.40 0.00 0.00 177.26 175.82 1r1i s PRO 742 N -2.43 4.07 0.04 1.20 0.02 -1.13 -1.22 135.00 135.54 1r1i s PRO 742 Ca 0.28 1.29 -0.24 0.00 0.02 0.00 0.00 61.00 62.35 1r1i s PRO 742 Cb 0.43 -2.23 -0.16 0.00 0.02 0.00 0.00 34.50 32.56 1r1i s PRO 742 CO 0.00 -0.19 1.50 1.49 -0.33 0.00 0.00 177.00 179.48 1r1i h GLU 743 N 1.93 0.06 -6.47 5.54 4.22 -1.94 -3.40 114.58 114.52 1r1i h GLU 743 Ca -0.49 -0.02 -0.53 0.00 0.08 0.00 0.00 59.36 58.40 1r1i h GLU 743 Cb 1.20 -0.01 0.02 0.00 0.50 0.00 0.00 28.75 30.47 1r1i h GLU 743 CO 0.61 0.30 0.96 0.21 -2.18 0.00 0.00 179.01 178.91 1r1i s LYS 744 N -5.17 4.21 -0.04 1.92 2.20 -1.26 -4.99 119.74 116.61 1r1i s LYS 744 Ca -0.14 2.31 -0.01 0.00 -0.36 0.00 0.00 55.97 57.76 1r1i s LYS 744 Cb 0.04 -3.52 0.03 0.00 -1.51 0.00 0.00 37.83 32.87 1r1i s LYS 744 CO 0.68 -0.70 0.04 0.15 -0.36 0.00 0.00 175.35 175.16 1r1i s LYS 745 N 2.36 0.01 0.04 4.03 1.02 -1.26 -4.98 119.74 120.96 1r1i s LYS 745 Ca 0.72 0.28 -0.26 0.00 0.02 0.00 0.00 55.97 56.73 1r1i s LYS 745 Cb -0.40 -0.46 -0.05 0.00 -0.52 0.00 0.00 37.83 36.40 1r1i s LYS 745 CO 0.32 -0.26 0.82 0.00 -0.92 0.00 0.00 175.35 175.31 1r1i s ARG 747 N 0.18 0.46 0.00 0.00 3.52 -1.26 -4.91 118.95 116.94 1r1i s ARG 747 Ca 0.42 -0.22 0.00 0.00 -0.13 0.00 0.00 55.73 55.79 1r1i s ARG 747 Cb -0.21 0.20 0.00 0.00 -1.56 0.00 0.00 34.95 33.38 1r1i s ARG 747 CO 0.24 -0.11 0.00 1.33 -0.81 0.00 0.00 175.30 175.96 1r1i n VAL 748 N 1.75 0.00 -0.32 7.11 0.24 -1.26 -4.73 118.33 121.11 1r1i n VAL 748 Ca -0.20 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.10 1r1i n VAL 748 Cb 0.56 -0.21 0.00 0.00 -1.47 0.00 0.00 33.84 32.72 1r1i n VAL 748 CO 0.00 0.00 0.00 0.79 -2.14 0.00 0.00 176.83 175.48