#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mwt n LYS 28 N 0.00 3.28 0.13 -0.67 4.01 -1.26 -4.71 118.16 118.94 1mwt n LYS 28 Ca 0.00 0.00 -0.01 0.00 -0.51 0.00 0.00 58.31 57.79 1mwt n LYS 28 Cb 0.00 -0.57 0.23 0.00 -0.51 0.00 0.00 35.03 34.18 1mwt n LYS 28 CO 0.00 0.00 0.00 0.93 -1.11 0.00 0.00 177.40 177.22 1mwt h GLU 29 N 0.00 0.11 0.15 1.97 5.08 -2.00 -3.15 114.58 116.74 1mwt h GLU 29 Ca 0.00 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1mwt h GLU 29 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1mwt h GLU 29 CO 0.00 0.58 -0.14 0.82 -1.00 0.00 0.00 179.01 179.27 1mwt h ILE 30 N 0.09 0.70 -0.28 3.13 2.04 -1.89 -2.01 117.51 119.29 1mwt h ILE 30 Ca 0.00 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.87 1mwt h ILE 30 Cb 0.90 0.70 -0.01 0.00 -0.74 0.00 0.00 36.82 37.66 1mwt h ILE 30 CO 0.07 0.00 0.18 0.78 0.00 0.00 0.00 178.15 179.18 1mwt h ASN 31 N -0.31 0.30 -0.76 1.72 4.21 -1.86 -0.48 115.58 118.40 1mwt h ASN 31 Ca -0.00 -0.01 -0.04 0.00 1.21 0.00 0.00 56.30 57.46 1mwt h ASN 31 Cb 0.29 -0.07 -0.03 0.00 -1.12 0.00 0.00 38.32 37.38 1mwt h ASN 31 CO -0.03 0.21 0.31 0.78 -1.29 0.00 0.00 177.43 177.42 1mwt h ASN 32 N 0.35 1.04 0.01 5.81 2.35 -1.35 0.73 115.58 124.53 1mwt h ASN 32 Ca 0.10 -0.17 -0.21 0.00 -0.55 0.00 0.00 56.30 55.47 1mwt h ASN 32 Cb -0.00 -0.27 0.01 0.00 0.05 0.00 0.00 38.32 38.10 1mwt h ASN 32 CO -0.02 0.92 -0.79 0.74 -1.65 0.00 0.00 177.43 176.63 1mwt h THR 33 N 1.09 1.31 -0.52 2.81 2.02 -0.72 -2.10 112.91 116.80 1mwt h THR 33 Ca 0.25 -2.06 -0.10 0.00 0.77 0.00 0.00 66.41 65.27 1mwt h THR 33 Cb 0.20 2.07 -0.02 0.00 -1.74 0.00 0.00 68.15 68.66 1mwt h THR 33 CO -0.02 0.64 -0.07 0.40 0.37 0.00 0.00 175.52 176.84 1mwt h ILE 34 N 0.44 1.26 -0.13 3.11 2.04 -0.78 -1.32 117.51 122.13 1mwt h ILE 34 Ca -0.05 -1.19 -0.03 0.00 1.00 0.00 0.00 64.86 64.59 1mwt h ILE 34 Cb 1.40 0.94 -0.01 0.00 -0.74 0.00 0.00 36.82 38.41 1mwt h ILE 34 CO 0.15 0.42 -0.07 0.44 0.00 0.00 0.00 178.15 179.09 1mwt h ASP 35 N 0.84 0.18 0.61 1.72 3.32 0.56 -0.59 116.42 123.07 1mwt h ASP 35 Ca 0.14 -0.03 -0.11 0.00 0.02 0.00 0.00 57.03 57.06 1mwt h ASP 35 Cb 0.60 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 40.09 1mwt h ASP 35 CO 0.04 0.28 -0.51 0.00 -1.72 0.00 0.00 179.24 177.33 1mwt h ALA 36 N 1.74 1.06 -0.06 3.45 0.00 -0.59 -1.10 119.26 123.76 1mwt h ALA 36 Ca 0.04 -0.47 -0.04 0.00 0.00 0.00 0.00 54.91 54.44 1mwt h ALA 36 Cb 0.26 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1mwt h ALA 36 CO 0.01 0.64 -0.14 0.82 0.00 0.00 0.00 179.25 180.59 1mwt h ILE 37 N 0.00 1.43 0.00 0.00 2.04 -0.08 -1.39 117.51 119.52 1mwt h ILE 37 Ca -0.01 -1.48 0.00 0.00 1.00 0.00 0.00 64.86 64.37 1mwt h ILE 37 Cb 0.96 2.27 0.00 0.00 -0.74 0.00 0.00 36.82 39.30 1mwt h ILE 37 CO 0.07 0.41 0.00 -1.84 0.00 0.00 0.00 178.15 176.79 1mwt n GLU 38 N -4.62 0.20 0.05 2.37 0.28 -0.74 -2.00 120.64 116.18 1mwt n GLU 38 Ca -0.08 0.35 0.12 0.00 -0.16 0.00 0.00 57.16 57.39 1mwt n GLU 38 Cb 0.38 -1.83 0.24 0.00 1.43 0.00 0.00 31.44 31.66 1mwt n GLU 38 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1mwt n ASP 39 N -2.19 0.63 -1.03 -1.84 9.92 -0.42 -4.38 116.55 117.23 1mwt n ASP 39 Ca 0.03 0.13 -0.12 0.00 -0.53 0.00 0.00 54.79 54.30 1mwt n ASP 39 Cb 0.28 0.03 -0.04 0.00 -0.64 0.00 0.00 41.12 40.75 1mwt n ASP 39 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 1mwt n LYS 40 N -1.98 -0.86 -2.82 -1.24 5.02 -0.75 -4.92 118.16 110.61 1mwt n LYS 40 Ca 0.04 0.82 -0.44 0.00 -2.02 0.00 0.00 58.31 56.72 1mwt n LYS 40 Cb 0.41 -4.87 0.00 0.00 -0.02 0.00 0.00 35.03 30.56 1mwt n LYS 40 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1mwt n ASN 41 N -0.01 5.28 -0.25 4.39 2.85 -0.60 -4.82 115.26 122.09 1mwt n ASN 41 Ca -0.12 -3.04 0.01 0.00 -0.11 0.00 0.00 54.58 51.31 1mwt n ASN 41 Cb 0.45 -1.51 0.13 0.00 1.24 0.00 0.00 39.78 40.09 1mwt n ASN 41 CO 0.00 0.00 0.00 -0.26 -2.11 0.00 0.00 177.26 174.89 1mwt h PHE 42 N 6.62 0.70 -0.66 1.20 -1.00 -1.90 -2.18 116.94 119.71 1mwt h PHE 42 Ca 0.32 0.03 0.10 0.00 2.81 0.00 0.00 57.97 61.23 1mwt h PHE 42 Cb 0.79 -0.21 -0.08 0.00 3.61 0.00 0.00 35.95 40.07 1mwt h PHE 42 CO 1.11 0.29 0.27 0.87 -1.61 0.00 0.00 178.31 179.23 1mwt h LYS 43 N 0.67 0.44 -0.46 1.51 6.56 -1.90 0.22 116.57 123.61 1mwt h LYS 43 Ca 0.35 -0.03 -0.10 0.00 -1.06 0.00 0.00 60.65 59.81 1mwt h LYS 43 Cb 0.31 -0.10 -0.02 0.00 -0.57 0.00 0.00 32.23 31.86 1mwt h LYS 43 CO -0.24 0.29 -0.13 0.37 -2.06 0.00 0.00 179.45 177.69 1mwt h GLN 44 N 0.45 0.86 -0.64 3.15 5.75 -1.82 -2.20 115.11 120.66 1mwt h GLN 44 Ca 0.34 -0.30 -0.02 0.00 -0.15 0.00 0.00 58.65 58.51 1mwt h GLN 44 Cb 0.43 -0.06 -0.03 0.00 1.07 0.00 0.00 27.48 28.88 1mwt h GLN 44 CO -0.32 0.94 0.31 0.28 -2.65 0.00 0.00 178.83 177.39 1mwt h VAL 45 N 0.77 1.21 -0.46 2.39 2.07 -0.48 -1.95 116.25 119.80 1mwt h VAL 45 Ca 0.12 -0.58 -0.04 0.00 0.82 0.00 0.00 66.70 67.02 1mwt h VAL 45 Cb 0.64 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.78 1mwt h VAL 45 CO 0.04 0.24 0.13 0.22 0.02 0.00 0.00 177.57 178.22 1mwt h TYR 46 N 0.90 0.75 -0.09 1.57 3.20 -0.22 -2.69 116.97 120.40 1mwt h TYR 46 Ca 0.22 -0.08 -0.05 0.00 3.14 0.00 0.00 58.73 61.95 1mwt h TYR 46 Cb 0.09 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.14 1mwt h TYR 46 CO 0.01 0.68 -0.20 0.87 -1.64 0.00 0.00 178.16 177.88 1mwt h LYS 47 N 0.60 0.14 -0.21 1.82 1.57 -0.88 -2.41 116.57 117.21 1mwt h LYS 47 Ca 0.15 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 1mwt h LYS 47 Cb 0.30 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.59 1mwt h LYS 47 CO -0.00 0.34 0.00 -0.25 -0.57 0.00 0.00 179.45 178.97 1mwt n ASP 48 N -4.24 1.74 -4.83 0.86 8.00 -0.78 -4.92 116.55 112.37 1mwt n ASP 48 Ca -0.01 -1.77 -0.34 0.00 0.71 0.00 0.00 54.79 53.38 1mwt n ASP 48 Cb 0.30 -0.13 -0.06 0.00 -0.02 0.00 0.00 41.12 41.20 1mwt n ASP 48 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1mwt s SER 49 N -1.45 6.90 1.22 -2.24 0.01 -0.91 0.18 113.70 117.41 1mwt s SER 49 Ca 0.31 1.33 -0.14 0.00 1.31 0.00 0.00 55.95 58.76 1mwt s SER 49 Cb 0.16 -2.39 0.30 0.00 0.21 0.00 0.00 66.02 64.31 1mwt s SER 49 CO 0.24 -0.09 0.94 -1.54 0.41 0.00 0.00 173.24 173.21 1mwt n SER 50 N 0.16 -2.11 -0.10 2.44 3.41 0.68 -4.65 113.62 113.45 1mwt n SER 50 Ca 0.01 -0.26 -0.14 0.00 -0.26 0.00 0.00 58.87 58.22 1mwt n SER 50 Cb 0.52 -1.21 -0.04 0.00 -0.26 0.00 0.00 64.21 63.23 1mwt n SER 50 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 1mwt h TYR 51 N -2.80 0.99 0.26 7.33 5.03 -1.97 -2.48 116.97 123.33 1mwt h TYR 51 Ca -0.62 -0.32 -0.01 0.00 2.58 0.00 0.00 58.73 60.36 1mwt h TYR 51 Cb 1.34 -0.20 0.00 0.00 1.55 0.00 0.00 36.73 39.42 1mwt h TYR 51 CO -0.00 1.11 -0.13 0.97 -1.32 0.00 0.00 178.16 178.79 1mwt h ILE 52 N 0.59 0.61 -0.86 1.81 6.09 -1.98 -2.17 117.51 121.60 1mwt h ILE 52 Ca 0.04 -0.87 0.06 0.00 -1.37 0.00 0.00 64.86 62.73 1mwt h ILE 52 Cb 0.97 0.98 -0.05 0.00 0.47 0.00 0.00 36.82 39.19 1mwt h ILE 52 CO 0.09 0.14 0.56 0.77 -3.07 0.00 0.00 178.15 176.65 1mwt h SER 53 N -0.91 0.86 0.95 2.19 4.64 -1.86 0.13 113.55 119.56 1mwt h SER 53 Ca -0.04 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.26 1mwt h SER 53 Cb 0.50 -0.18 -0.00 0.00 -0.31 0.00 0.00 62.40 62.41 1mwt h SER 53 CO 0.06 0.56 -0.12 0.50 -0.87 0.00 0.00 176.83 176.96 1mwt h LYS 54 N 0.98 0.00 0.00 4.77 3.64 -1.50 -2.93 116.57 121.53 1mwt h LYS 54 Ca 0.37 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.72 1mwt h LYS 54 Cb 0.19 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.00 1mwt h LYS 54 CO -0.13 0.12 -0.15 1.03 -2.27 0.00 0.00 179.45 178.05 1mwt h SER 55 N 0.00 0.00 -0.68 4.20 0.87 -0.14 -3.04 113.55 114.76 1mwt h SER 55 Ca -0.00 -0.64 0.05 0.00 -1.23 0.00 0.00 61.79 59.96 1mwt h SER 55 Cb 0.63 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.55 1mwt h SER 55 CO 0.02 0.91 0.45 0.44 -0.53 0.00 0.00 176.83 178.11 1mwt h ASP 56 N -1.00 0.66 0.13 6.23 3.32 -1.10 -3.31 116.42 121.35 1mwt h ASP 56 Ca -0.03 -0.00 -0.36 0.00 0.02 0.00 0.00 57.03 56.65 1mwt h ASP 56 Cb 0.74 -0.14 -0.05 0.00 0.22 0.00 0.00 39.33 40.10 1mwt h ASP 56 CO -0.02 0.44 -2.17 0.59 -1.72 0.00 0.00 179.24 176.36 1mwt n ASN 57 N -4.47 1.48 0.00 6.45 3.02 -1.11 -5.12 115.26 115.51 1mwt n ASN 57 Ca 0.09 0.10 0.00 0.00 -0.03 0.00 0.00 54.58 54.74 1mwt n ASN 57 Cb 0.18 -0.25 0.00 0.00 -0.61 0.00 0.00 39.78 39.11 1mwt n ASN 57 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1mwt n GLY 58 N 1.96 -0.35 0.18 7.41 0.00 -1.15 -4.23 105.19 109.00 1mwt n GLY 58 Ca -0.34 -1.71 -0.21 0.00 0.00 0.00 0.00 46.02 43.76 1mwt n GLY 58 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1mwt h GLU 59 N 0.00 0.61 -0.04 1.61 4.81 -1.96 -2.98 114.58 116.64 1mwt h GLU 59 Ca 0.00 -0.76 0.00 0.00 -0.13 0.00 0.00 59.36 58.47 1mwt h GLU 59 Cb 0.00 0.24 -0.00 0.00 0.63 0.00 0.00 28.75 29.62 1mwt h GLU 59 CO 0.00 1.33 0.02 0.28 -0.73 0.00 0.00 179.01 179.92 1mwt h VAL 60 N 0.30 1.02 -0.40 0.32 2.07 -1.97 0.26 116.25 117.85 1mwt h VAL 60 Ca -0.16 -0.06 -0.03 0.00 0.82 0.00 0.00 66.70 67.28 1mwt h VAL 60 Cb 1.83 0.99 -0.02 0.00 -1.52 0.00 0.00 31.29 32.57 1mwt h VAL 60 CO 0.22 0.02 0.14 -0.08 0.02 0.00 0.00 177.57 177.89 1mwt h GLU 61 N 0.04 0.58 0.00 1.57 4.57 -1.74 0.21 114.58 119.81 1mwt h GLU 61 Ca 0.01 -0.08 -0.08 0.00 -1.18 0.00 0.00 59.36 58.03 1mwt h GLU 61 Cb 0.01 -0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 28.48 1mwt h GLU 61 CO -0.00 0.50 -0.94 0.52 -1.18 0.00 0.00 179.01 177.91 1mwt h MET 62 N 0.57 0.00 0.00 1.92 2.86 -1.29 -3.37 114.93 115.63 1mwt h MET 62 Ca 0.14 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.78 1mwt h MET 62 Cb 0.16 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.82 1mwt h MET 62 CO -0.01 0.20 -0.78 0.25 1.06 0.00 0.00 176.91 177.64 1mwt n THR 63 N -2.91 0.00 -0.07 2.22 -2.24 0.89 -4.68 114.28 107.48 1mwt n THR 63 Ca -0.03 0.00 -0.22 0.00 -2.27 0.00 0.00 64.05 61.53 1mwt n THR 63 Cb 0.69 -0.21 -0.12 0.00 -2.10 0.00 0.00 70.33 68.59 1mwt n THR 63 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1mwt n GLU 64 N -1.42 0.67 -0.28 -0.78 1.02 0.57 -4.23 120.64 116.19 1mwt n GLU 64 Ca 0.00 0.30 0.01 0.00 -0.02 0.00 0.00 57.16 57.44 1mwt n GLU 64 Cb 0.20 -1.64 0.21 0.00 -0.02 0.00 0.00 31.44 30.18 1mwt n GLU 64 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 1mwt h ARG 65 N -0.31 1.09 -0.11 3.49 2.43 -1.24 -1.71 114.38 118.03 1mwt h ARG 65 Ca -0.49 -0.07 0.02 0.00 -0.81 0.00 0.00 59.98 58.64 1mwt h ARG 65 Cb 1.80 -0.25 -0.00 0.00 -0.42 0.00 0.00 29.97 31.10 1mwt h ARG 65 CO -0.09 0.72 0.07 -1.35 -1.51 0.00 0.00 179.97 177.82 1mwt h PRO 66 N 1.12 0.04 -0.16 0.20 0.11 -1.76 -1.82 132.00 129.73 1mwt h PRO 66 Ca 0.33 -0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.37 1mwt h PRO 66 Cb -0.07 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 31.03 1mwt h PRO 66 CO -0.08 0.03 -0.14 0.82 -0.21 0.00 0.00 178.00 178.41 1mwt h ILE 67 N 0.04 1.33 -0.25 4.15 2.04 -1.48 -1.72 117.51 121.62 1mwt h ILE 67 Ca 0.05 -1.28 0.01 0.00 1.00 0.00 0.00 64.86 64.64 1mwt h ILE 67 Cb 0.14 1.81 -0.01 0.00 -0.74 0.00 0.00 36.82 38.02 1mwt h ILE 67 CO -0.00 0.38 0.16 0.11 0.00 0.00 0.00 178.15 178.79 1mwt h LYS 68 N 0.03 0.31 0.01 2.37 1.57 -1.32 -0.02 116.57 119.53 1mwt h LYS 68 Ca 0.03 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1mwt h LYS 68 Cb 0.66 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.90 1mwt h LYS 68 CO 0.04 0.20 -0.00 0.82 -0.57 0.00 0.00 179.45 179.94 1mwt h ILE 69 N 0.32 1.02 -0.36 1.86 2.04 -1.37 -2.21 117.51 118.80 1mwt h ILE 69 Ca 0.09 -0.08 -0.04 0.00 1.00 0.00 0.00 64.86 65.83 1mwt h ILE 69 Cb -0.02 1.07 -0.02 0.00 -0.74 0.00 0.00 36.82 37.11 1mwt h ILE 69 CO -0.03 0.02 0.05 1.88 0.00 0.00 0.00 178.15 180.07 1mwt h TYR 70 N -0.05 0.55 -0.11 1.37 0.99 -1.18 -2.51 116.97 116.02 1mwt h TYR 70 Ca -0.00 -0.04 -0.11 0.00 2.00 0.00 0.00 58.73 60.58 1mwt h TYR 70 Cb 0.04 -0.17 -0.01 0.00 1.00 0.00 0.00 36.73 37.60 1mwt h TYR 70 CO -0.07 0.51 -0.41 -0.97 -0.00 0.00 0.00 178.16 177.22 1mwt h ASN 71 N 0.53 0.27 0.75 3.88 -1.24 -0.74 -1.46 115.58 117.57 1mwt h ASN 71 Ca 0.12 -0.11 -0.17 0.00 0.71 0.00 0.00 56.30 56.85 1mwt h ASN 71 Cb 0.26 -0.07 -0.02 0.00 0.73 0.00 0.00 38.32 39.22 1mwt h ASN 71 CO 0.00 0.65 -0.80 0.77 -1.29 0.00 0.00 177.43 176.77 1mwt h SER 72 N 0.21 0.05 1.15 1.15 4.64 -1.00 -3.17 113.55 116.59 1mwt h SER 72 Ca 0.02 -0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 1mwt h SER 72 Cb 0.82 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.90 1mwt h SER 72 CO 0.06 0.83 -0.53 -0.07 -0.87 0.00 0.00 176.83 176.25 1mwt h LEU 73 N 0.02 0.00 -1.35 5.97 3.38 -1.35 -3.48 115.31 118.50 1mwt h LEU 73 Ca -0.01 -0.10 -0.15 0.00 0.09 0.00 0.00 57.88 57.71 1mwt h LEU 73 Cb 1.41 0.00 0.06 0.00 0.09 0.00 0.00 40.66 42.22 1mwt h LEU 73 CO 0.11 0.05 -0.29 0.61 0.09 0.00 0.00 178.44 179.00 1mwt n GLY 74 N 1.26 0.24 3.68 0.83 0.00 -0.59 -2.02 105.19 108.60 1mwt n GLY 74 Ca 0.03 -0.27 -0.42 0.00 0.00 0.00 0.00 46.02 45.35 1mwt n GLY 74 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1mwt s VAL 75 N -3.14 3.43 0.00 1.61 -7.23 -0.96 -2.84 120.40 111.27 1mwt s VAL 75 Ca 0.13 0.75 0.00 0.00 -1.81 0.00 0.00 61.98 61.05 1mwt s VAL 75 Cb -0.06 -3.48 0.00 0.00 0.56 0.00 0.00 36.38 33.40 1mwt s VAL 75 CO 0.30 -0.02 0.00 0.29 -0.31 0.00 0.00 175.10 175.35 1mwt n LYS 76 N 6.03 0.00 -4.20 4.82 4.01 0.21 -4.97 118.16 124.06 1mwt n LYS 76 Ca 0.15 0.00 -0.25 0.00 -0.51 0.00 0.00 58.31 57.71 1mwt n LYS 76 Cb 0.42 -0.18 -0.07 0.00 -0.51 0.00 0.00 35.03 34.69 1mwt n LYS 76 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 1mwt s ASP 77 N -1.00 4.90 -0.01 4.39 1.11 -1.26 -4.96 116.67 119.84 1mwt s ASP 77 Ca 0.00 -0.41 0.03 0.00 0.18 0.00 0.00 52.55 52.35 1mwt s ASP 77 Cb 0.00 -1.07 -0.01 0.00 1.07 0.00 0.00 42.92 42.91 1mwt s ASP 77 CO 0.00 0.04 -0.11 -0.63 1.18 0.00 0.00 175.17 175.65 1mwt s ILE 78 N -1.95 0.88 -0.11 0.77 1.01 -1.26 -1.55 121.20 118.99 1mwt s ILE 78 Ca 0.30 -0.47 -0.04 0.00 0.00 0.00 0.00 60.65 60.44 1mwt s ILE 78 Cb -0.08 -0.74 0.06 0.00 0.01 0.00 0.00 42.46 41.70 1mwt s ILE 78 CO 0.20 0.25 0.20 0.20 0.00 0.00 0.00 174.94 175.79 1mwt s ASN 79 N -0.20 0.71 -0.49 3.58 -0.87 -0.02 -4.84 114.94 112.80 1mwt s ASN 79 Ca 0.03 0.35 -0.08 0.00 -1.57 0.00 0.00 52.86 51.59 1mwt s ASN 79 Cb -0.05 0.42 0.13 0.00 -0.02 0.00 0.00 41.25 41.72 1mwt s ASN 79 CO -0.00 -0.25 0.35 -0.63 -2.57 0.00 0.00 177.10 173.99 1mwt s ILE 80 N 2.34 4.09 0.53 0.60 1.01 -1.26 -1.40 121.20 127.11 1mwt s ILE 80 Ca 0.03 -1.95 0.06 0.00 0.00 0.00 0.00 60.65 58.79 1mwt s ILE 80 Cb -0.12 -3.70 0.03 0.00 0.01 0.00 0.00 42.46 38.68 1mwt s ILE 80 CO -0.07 -0.78 0.41 -1.10 0.00 0.00 0.00 174.94 173.39 1mwt s GLN 81 N 1.17 2.28 -1.52 2.79 -0.21 -0.94 -4.74 119.66 118.48 1mwt s GLN 81 Ca 0.07 -1.96 -0.13 0.00 0.02 0.00 0.00 55.36 53.37 1mwt s GLN 81 Cb -0.25 -2.14 0.08 0.00 1.00 0.00 0.00 33.01 31.71 1mwt s GLN 81 CO -0.02 -0.57 0.95 -0.25 -2.12 0.00 0.00 175.29 173.28 1mwt n ASP 82 N -1.74 -4.41 -4.75 5.90 8.00 -1.26 -1.33 116.55 116.97 1mwt n ASP 82 Ca -0.01 -0.79 -0.41 0.00 0.71 0.00 0.00 54.79 54.29 1mwt n ASP 82 Cb 0.64 -3.85 -0.02 0.00 -0.02 0.00 0.00 41.12 37.88 1mwt n ASP 82 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1mwt s ARG 83 N -6.58 4.15 -0.30 -1.24 0.52 -1.26 -4.40 118.95 109.83 1mwt s ARG 83 Ca 0.60 2.53 -0.01 0.00 -0.52 0.00 0.00 55.73 58.34 1mwt s ARG 83 Cb -0.30 -3.04 0.10 0.00 0.52 0.00 0.00 34.95 32.23 1mwt s ARG 83 CO 0.83 -0.59 0.08 0.15 0.02 0.00 0.00 175.30 175.80 1mwt s LYS 84 N -0.55 0.78 -0.15 3.54 1.02 0.26 -4.96 119.74 119.69 1mwt s LYS 84 Ca 0.62 -1.07 -0.23 0.00 0.02 0.00 0.00 55.97 55.32 1mwt s LYS 84 Cb -0.47 -2.08 -0.03 0.00 -0.52 0.00 0.00 37.83 34.73 1mwt s LYS 84 CO 0.48 -0.94 0.71 0.42 -0.92 0.00 0.00 175.35 175.09 1mwt s ILE 85 N 1.59 4.99 0.15 2.17 1.01 -1.26 -1.73 121.20 128.11 1mwt s ILE 85 Ca 0.08 1.39 0.00 0.00 0.00 0.00 0.00 60.65 62.12 1mwt s ILE 85 Cb -0.17 -4.03 -0.00 0.00 0.01 0.00 0.00 42.46 38.27 1mwt s ILE 85 CO -0.22 0.13 0.00 0.29 0.00 0.00 0.00 174.94 175.14 1mwt n LYS 86 N 4.75 1.55 -4.27 2.79 5.02 0.59 -4.99 118.16 123.60 1mwt n LYS 86 Ca 0.00 -1.13 -0.17 0.00 -2.02 0.00 0.00 58.31 54.99 1mwt n LYS 86 Cb 0.50 0.33 -0.14 0.00 -0.02 0.00 0.00 35.03 35.69 1mwt n LYS 86 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1mwt s LYS 87 N -2.55 0.63 0.00 1.97 2.47 -1.26 -3.16 119.74 117.83 1mwt s LYS 87 Ca 0.01 -0.37 0.00 0.00 -1.56 0.00 0.00 55.97 54.05 1mwt s LYS 87 Cb 0.00 -0.59 0.00 0.00 -1.46 0.00 0.00 37.83 35.78 1mwt s LYS 87 CO 0.00 0.16 0.01 0.28 0.16 0.00 0.00 175.35 175.96 1mwt n VAL 88 N 2.64 0.00 -3.83 4.02 0.31 -0.05 -4.90 118.33 116.52 1mwt n VAL 88 Ca -0.15 -0.07 -0.01 0.00 -0.01 0.00 0.00 64.34 64.10 1mwt n VAL 88 Cb 0.57 1.15 0.01 0.00 -0.91 0.00 0.00 33.84 34.65 1mwt n VAL 88 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1mwt s SER 89 N -0.11 -0.04 0.15 4.52 0.15 -1.12 -4.90 113.70 112.35 1mwt s SER 89 Ca 0.00 -0.45 0.22 0.00 0.70 0.00 0.00 55.95 56.42 1mwt s SER 89 Cb 0.00 0.38 0.88 0.00 -1.71 0.00 0.00 66.02 65.57 1mwt s SER 89 CO 0.00 -0.74 1.68 0.29 1.20 0.00 0.00 173.24 175.67 1mwt n LYS 90 N -0.66 0.13 -1.92 5.44 5.02 -1.26 -3.26 118.16 121.66 1mwt n LYS 90 Ca -0.03 0.29 0.03 0.00 -2.02 0.00 0.00 58.31 56.58 1mwt n LYS 90 Cb 0.60 -1.72 0.03 0.00 -0.02 0.00 0.00 35.03 33.92 1mwt n LYS 90 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1mwt n ASN 91 N -1.96 1.16 -3.46 4.39 4.13 -1.26 -4.90 115.26 113.36 1mwt n ASN 91 Ca 0.04 -2.01 -0.18 0.00 1.68 0.00 0.00 54.58 54.11 1mwt n ASN 91 Cb 0.26 -0.35 -0.12 0.00 -1.54 0.00 0.00 39.78 38.03 1mwt n ASN 91 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 1mwt s LYS 92 N -1.18 0.23 -0.13 3.52 1.02 -1.20 -2.83 119.74 119.16 1mwt s LYS 92 Ca 0.32 0.13 -0.01 0.00 0.02 0.00 0.00 55.97 56.42 1mwt s LYS 92 Cb 0.37 -1.04 -0.02 0.00 -0.52 0.00 0.00 37.83 36.62 1mwt s LYS 92 CO -0.13 -0.74 -0.09 0.15 -0.92 0.00 0.00 175.35 173.61 1mwt s LYS 93 N 2.34 3.43 -0.14 1.68 1.02 -0.80 -0.87 119.74 126.40 1mwt s LYS 93 Ca 0.08 -0.62 -0.03 0.00 0.02 0.00 0.00 55.97 55.42 1mwt s LYS 93 Cb -0.15 -2.72 -0.03 0.00 -0.52 0.00 0.00 37.83 34.40 1mwt s LYS 93 CO -0.18 0.26 -0.04 0.50 -0.92 0.00 0.00 175.35 174.98 1mwt s ARG 94 N 0.25 3.56 -0.12 1.68 3.52 -1.19 -1.00 118.95 125.65 1mwt s ARG 94 Ca -0.06 -0.52 0.01 0.00 -0.13 0.00 0.00 55.73 55.02 1mwt s ARG 94 Cb -0.15 -2.87 -0.01 0.00 -1.56 0.00 0.00 34.95 30.36 1mwt s ARG 94 CO 0.04 0.30 -0.16 0.08 -0.81 0.00 0.00 175.30 174.76 1mwt s VAL 95 N 0.20 2.83 -0.13 7.11 1.01 -0.36 -0.30 120.40 130.75 1mwt s VAL 95 Ca -0.02 -0.75 0.01 0.00 0.00 0.00 0.00 61.98 61.22 1mwt s VAL 95 Cb -0.14 -2.16 -0.00 0.00 0.00 0.00 0.00 36.38 34.08 1mwt s VAL 95 CO 0.03 0.54 -0.18 -1.81 0.00 0.00 0.00 175.10 173.68 1mwt s ASP 96 N 0.29 3.52 0.36 3.32 1.01 -0.71 -1.04 116.67 123.42 1mwt s ASP 96 Ca -0.12 -0.48 -0.07 0.00 0.71 0.00 0.00 52.55 52.59 1mwt s ASP 96 Cb -0.16 -1.52 0.02 0.00 1.01 0.00 0.00 42.92 42.27 1mwt s ASP 96 CO 0.06 0.12 0.59 0.00 0.21 0.00 0.00 175.17 176.15 1mwt s ALA 97 N 0.61 0.21 -0.32 5.23 0.00 -1.22 -0.57 121.76 125.69 1mwt s ALA 97 Ca -0.10 -1.23 -0.09 0.00 0.00 0.00 0.00 51.96 50.54 1mwt s ALA 97 Cb -0.16 0.98 0.00 0.00 0.00 0.00 0.00 23.12 23.94 1mwt s ALA 97 CO 0.03 -0.86 0.15 -0.65 0.00 0.00 0.00 175.76 174.43 1mwt s GLN 98 N -2.80 3.19 -0.48 0.00 -1.52 -0.44 -1.16 119.66 116.44 1mwt s GLN 98 Ca 0.25 -0.82 -0.20 0.00 -1.95 0.00 0.00 55.36 52.64 1mwt s GLN 98 Cb -0.02 -3.57 0.04 0.00 -0.22 0.00 0.00 33.01 29.24 1mwt s GLN 98 CO 0.17 -0.48 0.63 -0.47 -0.25 0.00 0.00 175.29 174.89 1mwt s TYR 99 N 1.58 3.05 -0.23 0.91 6.04 0.80 -2.22 117.35 127.29 1mwt s TYR 99 Ca 0.04 -0.35 -0.04 0.00 0.04 0.00 0.00 57.07 56.75 1mwt s TYR 99 Cb -0.18 -3.45 -0.01 0.00 -1.04 0.00 0.00 41.96 37.29 1mwt s TYR 99 CO 0.06 -0.97 -0.02 0.15 -1.54 0.00 0.00 175.55 173.23 1mwt s LYS 100 N 2.71 3.39 -0.08 4.97 1.02 -0.49 -2.31 119.74 128.95 1mwt s LYS 100 Ca 0.18 -0.63 0.04 0.00 0.02 0.00 0.00 55.97 55.59 1mwt s LYS 100 Cb -0.17 -3.08 -0.00 0.00 -0.52 0.00 0.00 37.83 34.06 1mwt s LYS 100 CO 0.14 -0.22 -0.23 0.42 -0.92 0.00 0.00 175.35 174.55 1mwt s ILE 101 N 1.50 1.93 -0.24 2.17 1.01 -0.27 -0.84 121.20 126.46 1mwt s ILE 101 Ca 0.06 -0.96 -0.12 0.00 0.00 0.00 0.00 60.65 59.62 1mwt s ILE 101 Cb -0.15 -1.67 -0.05 0.00 0.01 0.00 0.00 42.46 40.61 1mwt s ILE 101 CO -0.02 0.53 0.23 -0.54 0.00 0.00 0.00 174.94 175.15 1mwt s LYS 102 N 0.22 4.07 0.16 2.79 1.02 -0.60 -0.36 119.74 127.05 1mwt s LYS 102 Ca -0.14 -0.15 0.03 0.00 0.02 0.00 0.00 55.97 55.74 1mwt s LYS 102 Cb -0.16 -3.56 -0.05 0.00 -0.52 0.00 0.00 37.83 33.54 1mwt s LYS 102 CO 0.07 -0.02 -0.05 0.95 -0.92 0.00 0.00 175.35 175.38 1mwt s THR 103 N 1.28 0.97 0.57 2.17 -4.23 -0.65 0.68 115.64 116.42 1mwt s THR 103 Ca 0.11 -2.02 0.27 0.00 -1.18 0.00 0.00 61.69 58.87 1mwt s THR 103 Cb -0.14 -2.00 0.34 0.00 1.34 0.00 0.00 72.50 72.04 1mwt s THR 103 CO 0.06 -0.61 2.23 0.78 -0.54 0.00 0.00 174.62 176.55 1mwt h ASN 104 N 2.72 0.00 0.75 3.99 2.35 -1.25 0.50 115.58 124.64 1mwt h ASN 104 Ca -0.37 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.38 1mwt h ASN 104 Cb 1.20 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.57 1mwt h ASN 104 CO 0.64 0.00 -0.19 -1.22 -1.65 0.00 0.00 177.43 175.01 1mwt n TYR 105 N -3.96 0.00 0.00 1.19 4.02 -1.26 -5.02 117.16 112.13 1mwt n TYR 105 Ca -0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.86 1mwt n TYR 105 Cb 0.09 -0.38 0.00 0.00 -0.02 0.00 0.00 39.34 39.03 1mwt n TYR 105 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1mwt n GLY 106 N 1.47 0.97 3.87 2.72 0.00 0.16 -4.90 105.19 109.49 1mwt n GLY 106 Ca 0.07 -2.03 -0.35 0.00 0.00 0.00 0.00 46.02 43.71 1mwt n GLY 106 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1mwt s ASN 107 N -0.66 6.57 -0.17 1.61 0.01 -1.26 -1.64 114.94 119.40 1mwt s ASN 107 Ca 0.00 0.67 -0.04 0.00 -0.71 0.00 0.00 52.86 52.78 1mwt s ASN 107 Cb 0.00 -2.13 -0.03 0.00 0.41 0.00 0.00 41.25 39.50 1mwt s ASN 107 CO 0.00 0.23 -0.03 -0.63 -1.51 0.00 0.00 177.10 175.17 1mwt s ILE 108 N -1.31 3.91 -0.44 0.60 1.01 0.51 -4.93 121.20 120.55 1mwt s ILE 108 Ca 0.29 -0.35 0.04 0.00 0.00 0.00 0.00 60.65 60.63 1mwt s ILE 108 Cb -0.14 -2.72 0.17 0.00 0.01 0.00 0.00 42.46 39.78 1mwt s ILE 108 CO 0.16 0.48 0.36 -0.67 0.00 0.00 0.00 174.94 175.27 1mwt n ASP 109 N 3.69 -0.11 -4.55 3.58 4.64 -1.26 -1.12 116.55 121.43 1mwt n ASP 109 Ca -0.17 -2.47 -0.25 0.00 -1.38 0.00 0.00 54.79 50.52 1mwt n ASP 109 Cb 0.52 -0.57 -0.10 0.00 -1.04 0.00 0.00 41.12 39.93 1mwt n ASP 109 CO 0.00 0.00 0.00 -0.13 -0.82 0.00 0.00 177.20 176.25 1mwt s ARG 110 N -0.12 1.88 -0.11 -0.67 0.52 -0.98 -4.95 118.95 114.53 1mwt s ARG 110 Ca 0.32 -1.79 -0.22 0.00 -0.52 0.00 0.00 55.73 53.52 1mwt s ARG 110 Cb 0.03 -1.82 -0.03 0.00 0.52 0.00 0.00 34.95 33.65 1mwt s ARG 110 CO -0.20 0.22 0.66 -0.80 0.02 0.00 0.00 175.30 175.21 1mwt s ASN 111 N -3.61 6.87 0.54 0.23 -0.87 -1.26 -0.14 114.94 116.71 1mwt s ASN 111 Ca 0.32 1.05 0.05 0.00 -1.57 0.00 0.00 52.86 52.71 1mwt s ASN 111 Cb -0.01 -2.38 0.05 0.00 -0.02 0.00 0.00 41.25 38.88 1mwt s ASN 111 CO 0.17 -0.15 0.40 1.33 -2.57 0.00 0.00 177.10 176.28 1mwt n VAL 112 N 4.03 0.00 -3.26 1.60 0.24 -0.31 -4.76 118.33 115.87 1mwt n VAL 112 Ca -0.02 -2.16 -0.05 0.00 -2.04 0.00 0.00 64.34 60.07 1mwt n VAL 112 Cb 0.51 -0.02 -0.04 0.00 -1.47 0.00 0.00 33.84 32.82 1mwt n VAL 112 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 1mwt s GLN 113 N -4.23 0.53 0.26 7.34 0.74 -1.26 -3.43 119.66 119.62 1mwt s GLN 113 Ca 0.30 0.08 -0.12 0.00 0.05 0.00 0.00 55.36 55.68 1mwt s GLN 113 Cb -0.02 -0.15 -0.08 0.00 1.10 0.00 0.00 33.01 33.86 1mwt s GLN 113 CO 0.19 -1.08 0.62 -0.06 -0.55 0.00 0.00 175.29 174.42 1mwt s PHE 114 N 2.41 3.42 -0.02 1.67 0.40 -0.21 -4.92 117.98 120.73 1mwt s PHE 114 Ca 0.11 1.02 0.06 0.00 -0.60 0.00 0.00 56.93 57.53 1mwt s PHE 114 Cb -0.11 -2.38 -0.01 0.00 0.51 0.00 0.00 43.02 41.03 1mwt s PHE 114 CO -0.23 0.21 -0.21 -0.80 0.70 0.00 0.00 175.22 174.89 1mwt s ASN 115 N -2.28 2.46 0.12 1.36 0.01 -1.26 -1.23 114.94 114.12 1mwt s ASN 115 Ca 0.49 -0.38 0.07 0.00 -0.71 0.00 0.00 52.86 52.34 1mwt s ASN 115 Cb -0.11 -0.35 -0.04 0.00 0.41 0.00 0.00 41.25 41.17 1mwt s ASN 115 CO 0.20 0.24 -0.18 -0.36 -1.51 0.00 0.00 177.10 175.49 1mwt s PHE 116 N -0.41 1.65 -0.02 2.20 0.40 -0.17 -0.31 117.98 121.33 1mwt s PHE 116 Ca 0.06 -0.46 -0.02 0.00 -0.60 0.00 0.00 56.93 55.90 1mwt s PHE 116 Cb -0.09 -0.88 0.00 0.00 0.51 0.00 0.00 43.02 42.57 1mwt s PHE 116 CO -0.00 0.21 0.06 0.14 0.70 0.00 0.00 175.22 176.33 1mwt s VAL 117 N -1.63 0.02 -0.00 -0.44 -7.23 -0.62 -1.91 120.40 108.60 1mwt s VAL 117 Ca 0.09 -0.20 -0.30 0.00 -1.81 0.00 0.00 61.98 59.75 1mwt s VAL 117 Cb -0.08 -0.16 -0.04 0.00 0.56 0.00 0.00 36.38 36.66 1mwt s VAL 117 CO 0.04 -0.11 1.21 -0.75 -0.31 0.00 0.00 175.10 175.18 1mwt s LYS 118 N -0.33 4.38 0.00 4.82 2.20 -1.13 -0.83 119.74 128.86 1mwt s LYS 118 Ca -0.04 1.73 0.00 0.00 -0.36 0.00 0.00 55.97 57.30 1mwt s LYS 118 Cb -0.03 -3.47 0.00 0.00 -1.51 0.00 0.00 37.83 32.82 1mwt s LYS 118 CO 0.00 -0.37 0.00 0.39 -0.36 0.00 0.00 175.35 175.01 1mwt n GLU 119 N 4.67 0.00 -2.26 4.03 -0.58 -0.45 -4.89 120.64 121.16 1mwt n GLU 119 Ca 0.10 0.00 -0.19 0.00 -0.42 0.00 0.00 57.16 56.65 1mwt n GLU 119 Cb 0.46 0.00 0.02 0.00 -0.57 0.00 0.00 31.44 31.36 1mwt n GLU 119 CO 0.00 0.00 0.00 -0.40 -0.48 0.00 0.00 177.13 176.25 1mwt n ASP 120 N -0.76 4.13 0.00 1.62 5.75 -1.26 -4.86 116.55 121.17 1mwt n ASP 120 Ca 0.00 -3.38 0.00 0.00 -0.01 0.00 0.00 54.79 51.40 1mwt n ASP 120 Cb 0.00 -0.39 0.00 0.00 -1.03 0.00 0.00 41.12 39.70 1mwt n ASP 120 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1mwt n GLY 121 N -0.63 1.46 3.13 6.12 0.00 -1.26 -5.11 105.19 108.89 1mwt n GLY 121 Ca 0.35 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.28 1mwt n GLY 121 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1mwt s MET 122 N -0.01 0.71 -0.30 1.61 0.23 -1.26 -5.13 119.30 115.16 1mwt s MET 122 Ca 0.00 -1.23 -0.22 0.00 -1.03 0.00 0.00 55.69 53.22 1mwt s MET 122 Cb 0.00 -0.05 -0.01 0.00 -1.53 0.00 0.00 34.83 33.24 1mwt s MET 122 CO 0.00 -0.05 0.70 -1.58 -2.03 0.00 0.00 175.02 172.06 1mwt s TRP 123 N -3.49 3.22 0.19 3.16 0.52 -1.26 -1.35 118.94 119.93 1mwt s TRP 123 Ca 0.08 0.71 -0.02 0.00 0.02 0.00 0.00 56.10 56.89 1mwt s TRP 123 Cb 0.05 -3.07 -0.04 0.00 -1.15 0.00 0.00 33.47 29.25 1mwt s TRP 123 CO -0.06 -0.50 0.39 0.15 0.02 0.00 0.00 176.95 176.95 1mwt s LYS 124 N 2.75 3.54 -0.23 4.98 -0.14 -0.01 -4.86 119.74 125.77 1mwt s LYS 124 Ca 0.28 -0.29 -0.26 0.00 -1.36 0.00 0.00 55.97 54.35 1mwt s LYS 124 Cb -0.15 -2.84 -0.00 0.00 -1.68 0.00 0.00 37.83 33.16 1mwt s LYS 124 CO 0.12 0.41 0.89 -1.17 -0.76 0.00 0.00 175.35 174.84 1mwt s LEU 125 N -3.20 4.10 -1.16 3.17 0.20 0.48 -1.58 118.68 120.69 1mwt s LEU 125 Ca 0.39 1.15 -0.19 0.00 0.69 0.00 0.00 54.13 56.17 1mwt s LEU 125 Cb -0.11 -3.30 0.08 0.00 -0.43 0.00 0.00 46.19 42.43 1mwt s LEU 125 CO 0.28 -0.54 1.55 -0.62 -0.29 0.00 0.00 176.35 176.73 1mwt s ASP 126 N 1.28 6.72 0.36 3.68 3.68 0.58 -0.23 116.67 132.73 1mwt s ASP 126 Ca 0.38 -2.11 -0.28 0.00 2.13 0.00 0.00 52.55 52.67 1mwt s ASP 126 Cb -0.15 -2.54 -0.11 0.00 -1.45 0.00 0.00 42.92 38.66 1mwt s ASP 126 CO 0.08 -1.24 1.50 0.86 0.13 0.00 0.00 175.17 176.49 1mwt s TRP 127 N 4.10 2.65 0.12 -5.34 -0.00 -1.26 -4.47 118.94 114.74 1mwt s TRP 127 Ca 0.48 1.10 -0.14 0.00 -0.00 0.00 0.00 56.10 57.54 1mwt s TRP 127 Cb 0.01 -4.01 0.02 0.00 -0.00 0.00 0.00 33.47 29.49 1mwt s TRP 127 CO -0.01 -3.05 0.34 0.16 -0.00 0.00 0.00 176.95 174.39 1mwt s ASP 128 N -0.03 -0.13 0.34 5.86 3.84 -1.26 -4.77 116.67 120.52 1mwt s ASP 128 Ca 0.55 -0.42 0.15 0.00 -0.00 0.00 0.00 52.55 52.83 1mwt s ASP 128 Cb -0.46 0.44 0.84 0.00 -1.38 0.00 0.00 42.92 42.35 1mwt s ASP 128 CO 0.59 -0.82 1.39 0.45 -0.00 0.00 0.00 175.17 176.78 1mwt h HIS 129 N 2.47 0.00 0.00 2.11 3.86 -1.86 -1.03 115.15 120.70 1mwt h HIS 129 Ca -0.34 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.87 1mwt h HIS 129 Cb 1.24 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.71 1mwt h HIS 129 CO 0.35 0.00 0.00 0.43 0.86 0.00 0.00 177.93 179.57 1mwt n SER 130 N -2.13 0.00 0.13 2.45 7.64 -0.95 -1.57 113.62 119.18 1mwt n SER 130 Ca -0.01 -1.24 0.06 0.00 1.01 0.00 0.00 58.87 58.69 1mwt n SER 130 Cb 0.27 0.00 0.03 0.00 -1.01 0.00 0.00 64.21 63.50 1mwt n SER 130 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 1mwt h VAL 131 N 0.00 0.40 0.02 0.44 2.07 -1.50 -3.29 116.25 114.37 1mwt h VAL 131 Ca 0.00 -1.63 -0.29 0.00 0.82 0.00 0.00 66.70 65.61 1mwt h VAL 131 Cb 0.00 2.04 -0.04 0.00 -1.52 0.00 0.00 31.29 31.77 1mwt h VAL 131 CO 0.00 0.23 -1.56 -0.38 0.02 0.00 0.00 177.57 175.88 1mwt n ILE 132 N -3.00 1.56 -3.67 4.57 5.41 -0.61 -4.92 119.36 118.69 1mwt n ILE 132 Ca -0.01 -0.16 -0.16 0.00 1.00 0.00 0.00 62.75 63.42 1mwt n ILE 132 Cb 0.67 -1.97 -0.15 0.00 -0.71 0.00 0.00 39.64 37.48 1mwt n ILE 132 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 1mwt s ILE 133 N -2.41 -0.25 0.04 1.39 -1.09 -0.99 -5.07 121.20 112.82 1mwt s ILE 133 Ca -0.30 0.34 -0.34 0.00 -2.23 0.00 0.00 60.65 58.13 1mwt s ILE 133 Cb 0.07 -0.30 -0.13 0.00 -1.58 0.00 0.00 42.46 40.53 1mwt s ILE 133 CO 0.60 0.14 1.73 -0.81 -1.23 0.00 0.00 174.94 175.37 1mwt n PRO 134 N 5.25 2.18 0.00 2.79 -0.04 -1.24 -1.33 135.00 142.61 1mwt n PRO 134 Ca -0.06 0.79 0.00 0.00 -0.04 0.00 0.00 63.50 64.19 1mwt n PRO 134 Cb 0.50 -2.60 0.00 0.00 -0.04 0.00 0.00 33.50 31.36 1mwt n PRO 134 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1mwt n GLY 135 N 3.89 3.13 3.78 0.55 0.00 -1.26 -5.00 105.19 110.28 1mwt n GLY 135 Ca 0.20 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.85 1mwt n GLY 135 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1mwt s MET 136 N -0.82 4.19 0.11 1.61 0.00 -0.44 -4.96 119.30 118.99 1mwt s MET 136 Ca 0.00 1.47 0.01 0.00 0.00 0.00 0.00 55.69 57.17 1mwt s MET 136 Cb 0.00 -2.52 -0.00 0.00 0.00 0.00 0.00 34.83 32.31 1mwt s MET 136 CO 0.00 -0.11 0.03 1.04 0.00 0.00 0.00 175.02 175.98 1mwt n GLN 137 N -0.09 0.97 -1.30 4.11 6.02 -1.26 -2.24 117.38 123.59 1mwt n GLN 137 Ca 0.05 -0.88 -0.30 0.00 -0.01 0.00 0.00 57.00 55.86 1mwt n GLN 137 Cb 0.50 0.44 0.12 0.00 1.02 0.00 0.00 30.24 32.32 1mwt n GLN 137 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 177.06 174.46 1mwt s LYS 138 N -2.40 1.60 -1.48 -1.09 0.00 -1.26 -3.94 119.74 111.17 1mwt s LYS 138 Ca 0.04 0.83 -0.10 0.00 0.00 0.00 0.00 55.97 56.74 1mwt s LYS 138 Cb 0.00 -1.85 0.06 0.00 0.00 0.00 0.00 37.83 36.05 1mwt s LYS 138 CO 0.03 -2.00 0.91 -0.25 0.00 0.00 0.00 175.35 174.03 1mwt n ASP 139 N -3.72 -3.87 -4.22 0.03 8.00 -1.26 -4.93 116.55 106.57 1mwt n ASP 139 Ca 0.07 -0.80 -0.13 0.00 0.71 0.00 0.00 54.79 54.65 1mwt n ASP 139 Cb 0.55 -3.89 -0.10 0.00 -0.02 0.00 0.00 41.12 37.66 1mwt n ASP 139 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1mwt s GLN 140 N -6.48 1.19 0.10 -1.24 -0.21 -1.25 -1.13 119.66 110.64 1mwt s GLN 140 Ca 0.50 -1.62 -0.11 0.00 0.02 0.00 0.00 55.36 54.15 1mwt s GLN 140 Cb -0.25 0.09 0.01 0.00 1.00 0.00 0.00 33.01 33.86 1mwt s GLN 140 CO 0.83 -0.32 0.25 -1.54 -2.12 0.00 0.00 175.29 172.39 1mwt s SER 141 N -3.18 0.02 -0.28 5.90 1.04 -0.40 -4.86 113.70 111.95 1mwt s SER 141 Ca 0.35 -0.55 -0.17 0.00 0.48 0.00 0.00 55.95 56.06 1mwt s SER 141 Cb 0.07 0.38 -0.03 0.00 0.10 0.00 0.00 66.02 66.54 1mwt s SER 141 CO 0.10 -0.76 0.48 -0.63 0.98 0.00 0.00 173.24 173.41 1mwt s ILE 142 N -3.81 5.08 -0.04 -1.02 -1.09 -1.26 -1.38 121.20 117.69 1mwt s ILE 142 Ca 0.04 0.72 -0.03 0.00 -2.23 0.00 0.00 60.65 59.15 1mwt s ILE 142 Cb 0.04 -3.82 -0.04 0.00 -1.58 0.00 0.00 42.46 37.06 1mwt s ILE 142 CO -0.11 0.05 0.16 -1.00 -1.23 0.00 0.00 174.94 172.81 1mwt s HIS 143 N 2.27 3.52 -0.27 3.97 3.76 0.07 -4.95 115.29 123.66 1mwt s HIS 143 Ca 0.19 0.38 0.00 0.00 -0.15 0.00 0.00 55.06 55.48 1mwt s HIS 143 Cb -0.16 -1.84 0.08 0.00 1.11 0.00 0.00 32.58 31.77 1mwt s HIS 143 CO 0.10 0.65 0.01 0.42 -0.85 0.00 0.00 174.74 175.08 1mwt s ILE 144 N -1.23 1.35 -0.04 0.60 1.01 -1.26 -0.73 121.20 120.90 1mwt s ILE 144 Ca 0.24 -1.37 0.01 0.00 0.00 0.00 0.00 60.65 59.52 1mwt s ILE 144 Cb -0.12 -1.81 -0.03 0.00 0.01 0.00 0.00 42.46 40.50 1mwt s ILE 144 CO 0.14 -0.35 -0.01 -1.61 0.00 0.00 0.00 174.94 173.11 1mwt s GLU 145 N 1.43 2.82 0.00 2.79 0.41 0.83 -4.95 118.70 122.04 1mwt s GLU 145 Ca 0.02 -0.55 -0.19 0.00 -0.41 0.00 0.00 54.97 53.83 1mwt s GLU 145 Cb -0.18 -2.68 -0.06 0.00 -1.78 0.00 0.00 34.13 29.43 1mwt s GLU 145 CO -0.12 0.65 0.55 1.21 -0.49 0.00 0.00 175.26 177.07 1mwt s ASN 146 N -1.23 6.95 -0.62 -0.19 3.84 -1.26 -0.65 114.94 121.78 1mwt s ASN 146 Ca 0.16 1.13 -0.07 0.00 0.21 0.00 0.00 52.86 54.29 1mwt s ASN 146 Cb -0.11 -2.34 0.16 0.00 -0.55 0.00 0.00 41.25 38.40 1mwt s ASN 146 CO 0.06 0.16 0.48 -0.76 -2.79 0.00 0.00 177.10 174.25 1mwt s LEU 147 N -0.43 5.74 0.38 3.21 1.43 0.19 -4.91 118.68 124.29 1mwt s LEU 147 Ca 0.29 -2.50 -0.27 0.00 -1.03 0.00 0.00 54.13 50.62 1mwt s LEU 147 Cb -0.18 -1.98 -0.11 0.00 0.03 0.00 0.00 46.19 43.95 1mwt s LEU 147 CO 0.16 -0.52 1.34 0.29 0.23 0.00 0.00 176.35 177.86 1mwt n LYS 148 N 4.07 2.21 -4.42 1.70 4.76 -1.26 0.20 118.16 125.42 1mwt n LYS 148 Ca 0.04 0.78 -0.21 0.00 -2.87 0.00 0.00 58.31 56.05 1mwt n LYS 148 Cb 0.41 -2.45 -0.10 0.00 -1.84 0.00 0.00 35.03 31.05 1mwt n LYS 148 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 1mwt s SER 149 N -0.34 2.79 0.07 4.39 1.04 -1.26 -4.84 113.70 115.55 1mwt s SER 149 Ca 0.57 -1.17 0.07 0.00 0.48 0.00 0.00 55.95 55.90 1mwt s SER 149 Cb -0.52 -0.17 -0.03 0.00 0.10 0.00 0.00 66.02 65.40 1mwt s SER 149 CO 0.61 -0.31 -0.19 -1.61 0.98 0.00 0.00 173.24 172.72 1mwt s GLU 150 N -3.71 1.15 0.69 4.02 2.02 -1.26 -4.92 118.70 116.69 1mwt s GLU 150 Ca 0.29 -1.00 -0.16 0.00 0.02 0.00 0.00 54.97 54.12 1mwt s GLU 150 Cb 0.03 -1.30 0.02 0.00 0.10 0.00 0.00 34.13 32.97 1mwt s GLU 150 CO 0.12 0.32 1.19 0.50 0.02 0.00 0.00 175.26 177.41 1mwt s ARG 151 N -1.52 2.44 0.64 1.61 3.52 -1.26 -0.94 118.95 123.45 1mwt s ARG 151 Ca 0.05 1.73 -0.16 0.00 -0.13 0.00 0.00 55.73 57.22 1mwt s ARG 151 Cb -0.09 -1.87 -0.01 0.00 -1.56 0.00 0.00 34.95 31.42 1mwt s ARG 151 CO 0.03 -1.60 1.13 0.20 -0.81 0.00 0.00 175.30 174.24 1mwt s GLY 152 N -2.00 2.28 0.44 8.12 0.00 -0.66 -4.62 107.32 110.88 1mwt s GLY 152 Ca 0.74 0.65 -0.09 0.00 0.00 0.00 0.00 44.72 46.02 1mwt s GLY 152 CO 0.42 1.01 0.79 0.54 0.00 0.00 0.00 173.10 175.85 1mwt s LYS 153 N -3.91 3.69 -0.18 2.90 1.02 -1.26 -4.85 119.74 117.15 1mwt s LYS 153 Ca 0.69 0.39 -0.02 0.00 0.02 0.00 0.00 55.97 57.05 1mwt s LYS 153 Cb -0.22 -2.37 -0.01 0.00 -0.52 0.00 0.00 37.83 34.71 1mwt s LYS 153 CO 0.39 -0.12 -0.09 0.42 -0.92 0.00 0.00 175.35 175.03 1mwt s ILE 154 N -2.54 3.16 0.27 2.17 1.01 -0.38 -0.22 121.20 124.68 1mwt s ILE 154 Ca 0.50 -0.59 0.12 0.00 0.00 0.00 0.00 60.65 60.68 1mwt s ILE 154 Cb -0.10 -2.38 -0.05 0.00 0.01 0.00 0.00 42.46 39.93 1mwt s ILE 154 CO 0.37 0.48 -0.18 -0.76 0.00 0.00 0.00 174.94 174.85 1mwt s LEU 155 N 0.95 2.65 0.65 2.97 1.43 0.25 -0.67 118.68 126.91 1mwt s LEU 155 Ca -0.01 -0.97 0.00 0.00 -1.03 0.00 0.00 54.13 52.11 1mwt s LEU 155 Cb -0.15 -1.18 0.09 0.00 0.03 0.00 0.00 46.19 44.98 1mwt s LEU 155 CO -0.00 0.04 0.90 1.51 0.23 0.00 0.00 176.35 179.03 1mwt s ASP 156 N -3.47 4.76 0.62 2.29 3.84 -0.11 0.03 116.67 124.62 1mwt s ASP 156 Ca 0.30 -0.21 0.29 0.00 -0.00 0.00 0.00 52.55 52.92 1mwt s ASP 156 Cb -0.05 -0.38 1.51 0.00 -1.38 0.00 0.00 42.92 42.61 1mwt s ASP 156 CO 0.15 -1.55 1.89 0.08 -0.00 0.00 0.00 175.17 175.74 1mwt h ARG 157 N -0.27 0.00 -0.33 2.11 0.11 0.21 0.03 114.38 116.24 1mwt h ARG 157 Ca -0.39 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.69 1mwt h ARG 157 Cb 1.28 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.36 1mwt h ARG 157 CO 0.46 0.00 0.00 0.09 0.10 0.00 0.00 179.97 180.62 1mwt n ASN 158 N -3.38 3.94 -0.23 0.08 3.02 -1.26 -4.94 115.26 112.48 1mwt n ASN 158 Ca 0.04 -2.78 -0.03 0.00 -0.03 0.00 0.00 54.58 51.78 1mwt n ASN 158 Cb 0.56 -0.50 -0.01 0.00 -0.61 0.00 0.00 39.78 39.21 1mwt n ASN 158 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1mwt n ASN 159 N -0.11 -3.47 -4.71 6.41 3.02 -0.00 -5.01 115.26 111.39 1mwt n ASN 159 Ca 0.20 0.08 -0.42 0.00 -0.03 0.00 0.00 54.58 54.41 1mwt n ASN 159 Cb 0.83 -1.24 -0.03 0.00 -0.61 0.00 0.00 39.78 38.74 1mwt n ASN 159 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1mwt s VAL 160 N -2.08 3.65 -0.06 2.41 1.01 -1.26 -4.73 120.40 119.35 1mwt s VAL 160 Ca 0.00 1.14 -0.30 0.00 0.00 0.00 0.00 61.98 62.83 1mwt s VAL 160 Cb 0.00 -3.73 -0.03 0.00 0.00 0.00 0.00 36.38 32.61 1mwt s VAL 160 CO 0.00 0.06 1.24 -1.61 0.00 0.00 0.00 175.10 174.79 1mwt s GLU 161 N 1.53 4.32 -0.21 2.72 2.02 -1.26 -0.94 118.70 126.89 1mwt s GLU 161 Ca 0.62 1.72 0.07 0.00 0.02 0.00 0.00 54.97 57.40 1mwt s GLU 161 Cb -0.33 -3.59 -0.17 0.00 0.10 0.00 0.00 34.13 30.14 1mwt s GLU 161 CO 0.28 -0.50 -0.11 1.28 0.02 0.00 0.00 175.26 176.23 1mwt n LEU 162 N 5.43 1.94 -3.68 1.80 4.77 0.16 -4.54 117.00 122.87 1mwt n LEU 162 Ca 0.12 -0.08 -0.21 0.00 -0.03 0.00 0.00 56.01 55.81 1mwt n LEU 162 Cb 0.46 -0.36 -0.18 0.00 -2.33 0.00 0.00 43.42 41.01 1mwt n LEU 162 CO 0.56 0.72 -0.35 0.00 -1.33 0.00 0.00 177.39 176.99 1mwt s ALA 163 N -2.44 0.35 0.00 -1.18 0.00 -0.87 -3.85 121.76 113.77 1mwt s ALA 163 Ca -0.23 0.06 0.00 0.00 0.00 0.00 0.00 51.96 51.80 1mwt s ALA 163 Cb 0.07 -0.70 0.00 0.00 0.00 0.00 0.00 23.12 22.49 1mwt s ALA 163 CO 0.59 -0.57 0.00 0.27 0.00 0.00 0.00 175.76 176.04 1mwt n ASN 164 N 5.27 0.00 -4.30 0.00 0.23 -0.60 -1.25 115.26 114.61 1mwt n ASN 164 Ca -0.04 -0.04 -0.41 0.00 -0.53 0.00 0.00 54.58 53.55 1mwt n ASN 164 Cb 0.50 0.00 -0.09 0.00 -2.08 0.00 0.00 39.78 38.11 1mwt n ASN 164 CO 0.00 0.00 0.00 -0.89 -0.93 0.00 0.00 177.26 175.44 1mwt s THR 165 N -1.53 4.50 0.00 5.53 2.01 -1.26 -1.30 115.64 123.59 1mwt s THR 165 Ca 0.00 -1.35 0.00 0.00 0.31 0.00 0.00 61.69 60.65 1mwt s THR 165 Cb 0.00 -3.75 0.00 0.00 0.01 0.00 0.00 72.50 68.76 1mwt s THR 165 CO 0.00 -0.55 0.00 0.61 -0.69 0.00 0.00 174.62 173.99 1mwt n GLY 166 N 5.00 3.46 3.04 4.40 0.00 -0.27 -4.91 105.19 115.90 1mwt n GLY 166 Ca -0.11 -1.77 -0.14 0.00 0.00 0.00 0.00 46.02 44.00 1mwt n GLY 166 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1mwt s THR 167 N 3.47 0.54 0.35 2.61 -1.32 -1.26 -2.32 115.64 117.71 1mwt s THR 167 Ca 0.00 -0.86 0.06 0.00 -1.21 0.00 0.00 61.69 59.68 1mwt s THR 167 Cb 0.00 -0.57 -0.02 0.00 -1.51 0.00 0.00 72.50 70.40 1mwt s THR 167 CO 0.00 -0.24 0.23 0.00 -2.21 0.00 0.00 174.62 172.41 1mwt n ALA 168 N 1.85 0.66 -3.54 11.08 0.00 0.17 -4.82 120.51 125.92 1mwt n ALA 168 Ca -0.20 -1.95 -0.25 0.00 0.00 0.00 0.00 53.44 51.04 1mwt n ALA 168 Cb 0.56 1.49 -0.17 0.00 0.00 0.00 0.00 19.45 21.33 1mwt n ALA 168 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1mwt s TYR 169 N -3.24 1.53 -0.08 0.00 1.51 0.66 -0.21 117.35 117.51 1mwt s TYR 169 Ca 0.33 -0.61 -0.19 0.00 -1.01 0.00 0.00 57.07 55.59 1mwt s TYR 169 Cb 0.02 -1.14 -0.04 0.00 -0.11 0.00 0.00 41.96 40.69 1mwt s TYR 169 CO 0.23 -0.33 0.53 -1.21 -1.11 0.00 0.00 175.55 173.66 1mwt s GLU 170 N 0.84 4.33 -0.23 -0.62 2.02 0.98 -0.10 118.70 125.91 1mwt s GLU 170 Ca -0.11 0.57 -0.03 0.00 0.02 0.00 0.00 54.97 55.42 1mwt s GLU 170 Cb -0.15 -3.41 0.01 0.00 0.10 0.00 0.00 34.13 30.67 1mwt s GLU 170 CO 0.02 0.20 -0.05 0.42 0.02 0.00 0.00 175.26 175.87 1mwt s ILE 171 N 0.43 3.11 0.00 -1.63 1.01 0.09 0.13 121.20 124.34 1mwt s ILE 171 Ca 0.29 -0.75 0.00 0.00 0.00 0.00 0.00 60.65 60.18 1mwt s ILE 171 Cb -0.16 -2.49 0.00 0.00 0.01 0.00 0.00 42.46 39.82 1mwt s ILE 171 CO 0.13 0.32 0.00 0.61 0.00 0.00 0.00 174.94 176.00 1mwt n GLY 172 N 4.74 4.07 3.28 6.18 0.00 0.38 -1.03 105.19 122.82 1mwt n GLY 172 Ca -0.17 -1.38 -0.27 0.00 0.00 0.00 0.00 46.02 44.19 1mwt n GLY 172 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1mwt s ILE 173 N -1.88 1.84 -0.40 -0.61 1.01 -0.15 -0.49 121.20 120.52 1mwt s ILE 173 Ca 0.00 -1.25 -0.02 0.00 0.00 0.00 0.00 60.65 59.38 1mwt s ILE 173 Cb 0.00 -1.59 0.11 0.00 0.01 0.00 0.00 42.46 40.99 1mwt s ILE 173 CO 0.00 0.29 0.18 -0.69 0.00 0.00 0.00 174.94 174.72 1mwt s VAL 174 N -0.78 3.15 0.00 2.92 1.01 -1.26 -0.40 120.40 125.04 1mwt s VAL 174 Ca 0.09 -2.08 0.00 0.00 0.00 0.00 0.00 61.98 59.99 1mwt s VAL 174 Cb -0.09 -3.17 0.00 0.00 0.00 0.00 0.00 36.38 33.12 1mwt s VAL 174 CO 0.02 -0.67 0.00 -2.65 0.00 0.00 0.00 175.10 171.80 1mwt n PRO 175 N 4.55 0.00 0.05 2.72 -0.02 -1.25 -1.58 135.00 139.47 1mwt n PRO 175 Ca -0.02 0.00 -0.08 0.00 -2.02 0.00 0.00 63.50 61.39 1mwt n PRO 175 Cb 0.41 0.00 -0.05 0.00 -0.02 0.00 0.00 33.50 33.85 1mwt n PRO 175 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1mwt h LYS 176 N 0.00 -0.34 0.00 -0.52 1.57 -1.79 -3.11 116.57 112.38 1mwt h LYS 176 Ca 0.00 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1mwt h LYS 176 Cb 0.00 0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.39 1mwt h LYS 176 CO 0.00 -0.23 0.00 -0.91 -0.57 0.00 0.00 179.45 177.74 1mwt h ASN 177 N -0.36 0.00 -3.60 0.86 2.35 -1.62 -3.43 115.58 109.78 1mwt h ASN 177 Ca -0.00 0.00 -0.67 0.00 -0.55 0.00 0.00 56.30 55.08 1mwt h ASN 177 Cb 0.36 0.00 -0.26 0.00 0.05 0.00 0.00 38.32 38.47 1mwt h ASN 177 CO -0.14 0.00 -0.78 -0.69 -1.65 0.00 0.00 177.43 174.17 1mwt s VAL 178 N -3.61 2.94 0.21 2.81 1.01 -1.18 -4.74 120.40 117.85 1mwt s VAL 178 Ca -0.00 -0.73 -0.22 0.00 0.00 0.00 0.00 61.98 61.03 1mwt s VAL 178 Cb 0.09 -2.19 -0.08 0.00 0.00 0.00 0.00 36.38 34.19 1mwt s VAL 178 CO 0.36 0.55 0.76 -0.55 0.00 0.00 0.00 175.10 176.22 1mwt s SER 179 N -0.03 7.19 0.00 3.32 0.15 -1.26 -4.84 113.70 118.22 1mwt s SER 179 Ca -0.04 1.53 0.17 0.00 0.70 0.00 0.00 55.95 58.31 1mwt s SER 179 Cb -0.14 -2.46 0.96 0.00 -1.71 0.00 0.00 66.02 62.67 1mwt s SER 179 CO 0.04 0.09 1.44 1.17 1.20 0.00 0.00 173.24 177.18 1mwt n LYS 180 N 1.01 0.44 0.05 5.44 4.81 -1.26 -2.51 118.16 126.15 1mwt n LYS 180 Ca -0.03 0.04 -0.22 0.00 -0.87 0.00 0.00 58.31 57.23 1mwt n LYS 180 Cb 0.50 -1.50 -0.15 0.00 0.02 0.00 0.00 35.03 33.91 1mwt n LYS 180 CO 0.00 0.00 0.00 0.87 1.17 0.00 0.00 177.40 179.44 1mwt h LYS 181 N 0.00 0.34 0.00 1.64 1.57 -2.05 -3.29 116.57 114.78 1mwt h LYS 181 Ca 0.00 -0.59 0.00 0.00 -1.87 0.00 0.00 60.65 58.19 1mwt h LYS 181 Cb 0.05 0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.58 1mwt h LYS 181 CO 0.00 1.28 0.00 -0.25 -0.57 0.00 0.00 179.45 179.91 1mwt n ASP 182 N -3.82 0.00 0.28 0.86 9.92 -1.05 -3.03 116.55 119.72 1mwt n ASP 182 Ca -0.22 -0.98 0.18 0.00 -0.53 0.00 0.00 54.79 53.24 1mwt n ASP 182 Cb 0.98 0.00 0.83 0.00 -0.64 0.00 0.00 41.12 42.28 1mwt n ASP 182 CO 0.00 0.00 0.00 1.88 0.13 0.00 0.00 177.20 179.21 1mwt h TYR 183 N 0.00 0.00 0.17 1.24 -1.99 -1.66 -1.19 116.97 113.54 1mwt h TYR 183 Ca 0.00 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.72 1mwt h TYR 183 Cb 0.00 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.73 1mwt h TYR 183 CO 0.00 0.00 -0.08 0.87 -0.00 0.00 0.00 178.16 178.95 1mwt h LYS 184 N 0.00 -0.22 -0.98 4.88 1.57 -1.82 -2.59 116.57 117.41 1mwt h LYS 184 Ca 0.00 0.02 0.07 0.00 -1.87 0.00 0.00 60.65 58.87 1mwt h LYS 184 Cb 0.34 0.05 -0.07 0.00 0.08 0.00 0.00 32.23 32.63 1mwt h LYS 184 CO 0.00 -0.15 0.63 0.00 -0.57 0.00 0.00 179.45 179.36 1mwt h ALA 185 N -1.34 1.46 0.52 3.86 0.00 -1.79 -0.54 119.26 121.43 1mwt h ALA 185 Ca -0.02 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 1mwt h ALA 185 Cb 0.18 -0.28 0.01 0.00 0.00 0.00 0.00 17.79 17.69 1mwt h ALA 185 CO 0.04 0.38 -0.25 0.82 0.00 0.00 0.00 179.25 180.24 1mwt h ILE 186 N 1.11 0.47 -0.95 0.00 2.04 -1.34 -1.23 117.51 117.60 1mwt h ILE 186 Ca 0.43 -0.13 0.10 0.00 1.00 0.00 0.00 64.86 66.25 1mwt h ILE 186 Cb 0.23 0.53 -0.08 0.00 -0.74 0.00 0.00 36.82 36.76 1mwt h ILE 186 CO -0.18 0.02 0.59 0.00 0.00 0.00 0.00 178.15 178.59 1mwt h ALA 187 N -0.34 1.38 0.29 1.87 0.00 -1.19 -2.09 119.26 119.18 1mwt h ALA 187 Ca -0.07 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1mwt h ALA 187 Cb 0.57 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 1mwt h ALA 187 CO 0.12 0.26 -0.44 -0.22 0.00 0.00 0.00 179.25 178.96 1mwt h LYS 188 N 1.00 -0.74 -0.62 0.00 1.63 -0.75 -1.13 116.57 115.95 1mwt h LYS 188 Ca 0.45 0.05 0.05 0.00 -0.85 0.00 0.00 60.65 60.35 1mwt h LYS 188 Cb 0.35 0.17 -0.04 0.00 -0.60 0.00 0.00 32.23 32.11 1mwt h LYS 188 CO -0.23 -0.50 0.41 1.49 -3.45 0.00 0.00 179.45 177.18 1mwt h GLU 189 N -0.77 0.66 -0.25 1.90 4.57 -0.89 -2.25 114.58 117.55 1mwt h GLU 189 Ca -0.03 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.11 1mwt h GLU 189 Cb 0.71 -0.15 0.00 0.00 -0.16 0.00 0.00 28.75 29.15 1mwt h GLU 189 CO -0.14 0.44 0.00 1.28 -1.18 0.00 0.00 179.01 179.41 1mwt n LEU 190 N -4.47 1.92 -3.76 1.64 4.77 -0.82 -4.93 117.00 111.35 1mwt n LEU 190 Ca 0.08 -0.86 -0.26 0.00 -0.03 0.00 0.00 56.01 54.94 1mwt n LEU 190 Cb 0.18 -0.16 0.05 0.00 -2.33 0.00 0.00 43.42 41.15 1mwt n LEU 190 CO 0.34 0.43 0.11 -1.20 -1.33 0.00 0.00 177.39 175.74 1mwt n SER 191 N 0.50 -4.27 -4.16 -1.43 7.64 -0.70 -4.94 113.62 106.27 1mwt n SER 191 Ca 0.15 -0.72 -0.17 0.00 1.01 0.00 0.00 58.87 59.15 1mwt n SER 191 Cb 0.35 -4.30 -0.12 0.00 -1.01 0.00 0.00 64.21 59.13 1mwt n SER 191 CO 0.00 0.00 0.00 0.27 -3.01 0.00 0.00 175.04 172.30 1mwt s ILE 192 N -3.38 1.01 0.71 0.44 -4.36 -0.51 -4.80 121.20 110.30 1mwt s ILE 192 Ca 0.46 -1.38 -0.11 0.00 -0.26 0.00 0.00 60.65 59.36 1mwt s ILE 192 Cb -0.22 -1.10 0.01 0.00 1.25 0.00 0.00 42.46 42.40 1mwt s ILE 192 CO 0.79 -0.34 1.07 -0.94 0.24 0.00 0.00 174.94 175.77 1mwt s SER 193 N -1.93 5.34 0.14 4.36 1.04 -1.26 -4.09 113.70 117.29 1mwt s SER 193 Ca -0.01 1.42 -0.11 0.00 0.48 0.00 0.00 55.95 57.73 1mwt s SER 193 Cb -0.08 -2.28 -0.05 0.00 0.10 0.00 0.00 66.02 63.71 1mwt s SER 193 CO 0.02 -1.45 1.45 -0.33 0.98 0.00 0.00 173.24 173.91 1mwt h GLU 194 N -0.72 0.91 -0.43 4.02 5.08 -1.93 -2.97 114.58 118.54 1mwt h GLU 194 Ca -0.45 -0.52 0.08 0.00 -1.00 0.00 0.00 59.36 57.47 1mwt h GLU 194 Cb 1.23 0.04 -0.06 0.00 0.50 0.00 0.00 28.75 30.45 1mwt h GLU 194 CO 0.60 1.16 0.04 0.22 -1.00 0.00 0.00 179.01 180.03 1mwt h ASP 195 N 0.72 -0.10 -0.36 1.42 -0.00 -1.96 -0.60 116.42 115.55 1mwt h ASP 195 Ca 0.04 0.09 0.07 0.00 -0.00 0.00 0.00 57.03 57.23 1mwt h ASP 195 Cb 1.05 0.14 -0.06 0.00 -0.00 0.00 0.00 39.33 40.46 1mwt h ASP 195 CO 0.11 -0.01 -0.02 0.22 -0.00 0.00 0.00 179.24 179.53 1mwt h TYR 196 N 0.15 -0.06 -0.03 0.28 3.20 -1.93 0.19 116.97 118.77 1mwt h TYR 196 Ca 0.21 0.03 0.02 0.00 3.14 0.00 0.00 58.73 62.13 1mwt h TYR 196 Cb 0.29 0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.62 1mwt h TYR 196 CO -0.25 -0.09 -0.08 0.82 -1.64 0.00 0.00 178.16 176.93 1mwt h ILE 197 N 0.08 0.79 -0.51 1.81 2.04 -1.18 -0.83 117.51 119.71 1mwt h ILE 197 Ca 0.18 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.12 1mwt h ILE 197 Cb 0.25 0.79 -0.07 0.00 -0.74 0.00 0.00 36.82 37.06 1mwt h ILE 197 CO -0.32 0.00 0.11 0.50 0.00 0.00 0.00 178.15 178.45 1mwt h LYS 198 N -0.12 0.24 0.21 2.37 3.64 -0.54 0.10 116.57 122.48 1mwt h LYS 198 Ca 0.04 -0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.41 1mwt h LYS 198 Cb 0.17 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 31.90 1mwt h LYS 198 CO -0.10 0.16 -0.50 0.37 -2.27 0.00 0.00 179.45 177.11 1mwt h GLN 199 N 0.25 -0.77 -0.56 1.90 4.15 -0.04 0.25 115.11 120.30 1mwt h GLN 199 Ca 0.26 0.05 0.10 0.00 0.77 0.00 0.00 58.65 59.83 1mwt h GLN 199 Cb 0.34 0.17 -0.08 0.00 0.21 0.00 0.00 27.48 28.13 1mwt h GLN 199 CO -0.33 -0.51 0.10 1.96 -1.93 0.00 0.00 178.83 178.13 1mwt h GLN 200 N -0.80 0.23 0.00 1.69 1.08 -0.56 -2.22 115.11 114.54 1mwt h GLN 200 Ca -0.01 -0.01 -0.05 0.00 -1.45 0.00 0.00 58.65 57.12 1mwt h GLN 200 Cb 0.77 -0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 28.14 1mwt h GLN 200 CO -0.22 0.15 -0.23 0.52 -0.95 0.00 0.00 178.83 178.10 1mwt h MET 201 N 0.24 0.00 -0.67 1.46 2.86 -0.61 -3.12 114.93 115.08 1mwt h MET 201 Ca 0.29 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.93 1mwt h MET 201 Cb 0.41 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.07 1mwt h MET 201 CO -0.38 0.23 0.00 -0.25 1.06 0.00 0.00 176.91 177.57 1mwt n ASP 202 N -3.47 4.14 -4.79 1.22 9.92 0.04 -4.83 116.55 118.78 1mwt n ASP 202 Ca -0.00 -2.55 -0.33 0.00 -0.53 0.00 0.00 54.79 51.37 1mwt n ASP 202 Cb 0.40 -0.59 -0.00 0.00 -0.64 0.00 0.00 41.12 40.29 1mwt n ASP 202 CO 0.00 0.00 0.00 -1.10 0.13 0.00 0.00 177.20 176.23 1mwt s GLN 203 N -2.09 3.46 0.23 -1.24 -0.21 -1.18 -4.96 119.66 113.66 1mwt s GLN 203 Ca 0.39 1.33 -0.07 0.00 0.02 0.00 0.00 55.36 57.02 1mwt s GLN 203 Cb 0.28 -2.05 0.21 0.00 1.00 0.00 0.00 33.01 32.46 1mwt s GLN 203 CO 0.14 -0.71 1.87 -2.95 -2.12 0.00 0.00 175.29 171.51 1mwt h ASN 204 N 0.91 1.12 0.78 5.90 7.08 -1.93 -2.38 115.58 127.06 1mwt h ASN 204 Ca -0.48 -0.09 0.00 0.00 -3.08 0.00 0.00 56.30 52.65 1mwt h ASN 204 Cb 1.23 -0.28 0.00 0.00 -2.08 0.00 0.00 38.32 37.18 1mwt h ASN 204 CO 0.58 0.88 0.00 -2.67 -2.08 0.00 0.00 177.43 174.14 1mwt n TRP 205 N -4.35 0.37 -2.14 4.14 4.27 -1.26 -4.75 117.44 113.72 1mwt n TRP 205 Ca 0.10 0.13 -0.42 0.00 -3.89 0.00 0.00 57.50 53.42 1mwt n TRP 205 Cb 0.08 -0.71 -0.03 0.00 -1.36 0.00 0.00 31.31 29.29 1mwt n TRP 205 CO 0.00 0.00 0.00 0.08 -2.29 0.00 0.00 177.69 175.48 1mwt s VAL 206 N -3.11 3.18 0.39 -1.67 1.01 -0.90 -4.98 120.40 114.32 1mwt s VAL 206 Ca 0.08 0.87 0.05 0.00 0.00 0.00 0.00 61.98 62.98 1mwt s VAL 206 Cb 0.11 -3.56 -0.07 0.00 0.00 0.00 0.00 36.38 32.87 1mwt s VAL 206 CO 0.39 0.08 0.03 -1.10 0.00 0.00 0.00 175.10 174.50 1mwt s GLN 207 N 0.85 1.87 0.44 2.72 -1.52 -1.26 -4.93 119.66 117.82 1mwt s GLN 207 Ca 0.64 -2.06 0.23 0.00 -1.95 0.00 0.00 55.36 52.21 1mwt s GLN 207 Cb -0.38 -1.33 1.22 0.00 -0.22 0.00 0.00 33.01 32.30 1mwt s GLN 207 CO 0.32 -0.13 1.79 0.22 -0.25 0.00 0.00 175.29 177.24 1mwt h ASP 208 N 1.86 0.32 -0.11 5.90 3.58 -1.99 -1.64 116.42 124.35 1mwt h ASP 208 Ca -0.43 0.06 -0.01 0.00 0.42 0.00 0.00 57.03 57.07 1mwt h ASP 208 Cb 1.25 0.01 -0.01 0.00 1.72 0.00 0.00 39.33 42.30 1mwt h ASP 208 CO 0.76 0.06 -0.03 -0.90 -2.88 0.00 0.00 179.24 176.25 1mwt n ASP 209 N -4.51 2.86 -4.75 2.28 3.85 -1.26 -2.24 116.55 112.77 1mwt n ASP 209 Ca 0.25 -3.14 -0.40 0.00 -0.71 0.00 0.00 54.79 50.79 1mwt n ASP 209 Cb 0.95 -0.49 -0.05 0.00 -1.35 0.00 0.00 41.12 40.19 1mwt n ASP 209 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.20 175.30 1mwt s THR 210 N -2.90 4.56 -0.04 2.12 2.01 -0.62 -4.95 115.64 115.82 1mwt s THR 210 Ca 0.36 1.74 -0.28 0.00 0.31 0.00 0.00 61.69 63.82 1mwt s THR 210 Cb 0.31 -4.16 -0.03 0.00 0.01 0.00 0.00 72.50 68.63 1mwt s THR 210 CO 0.04 0.41 0.91 0.12 -0.69 0.00 0.00 174.62 175.41 1mwt s PHE 211 N -0.43 3.60 -0.25 4.92 5.36 -1.26 -4.08 117.98 125.84 1mwt s PHE 211 Ca 0.39 1.55 0.02 0.00 -0.96 0.00 0.00 56.93 57.93 1mwt s PHE 211 Cb -0.22 -3.05 0.05 0.00 -0.34 0.00 0.00 43.02 39.47 1mwt s PHE 211 CO 0.25 -0.03 -0.11 0.08 -1.46 0.00 0.00 175.22 173.95 1mwt s VAL 212 N 1.18 2.26 0.19 3.12 1.01 0.46 -4.95 120.40 123.67 1mwt s VAL 212 Ca 0.47 -1.52 -0.31 0.00 0.00 0.00 0.00 61.98 60.63 1mwt s VAL 212 Cb -0.20 -2.28 -0.09 0.00 0.00 0.00 0.00 36.38 33.81 1mwt s VAL 212 CO 0.23 0.03 1.41 -2.16 0.00 0.00 0.00 175.10 174.62 1mwt s PRO 213 N 1.14 4.30 -0.18 2.72 0.04 -1.26 -0.98 135.00 140.78 1mwt s PRO 213 Ca -0.07 2.19 0.03 0.00 0.04 0.00 0.00 61.00 63.19 1mwt s PRO 213 Cb -0.19 -3.17 -0.13 0.00 0.04 0.00 0.00 34.50 31.05 1mwt s PRO 213 CO -0.05 -0.41 -0.14 1.28 0.04 0.00 0.00 177.00 177.72 1mwt n LEU 214 N 3.04 2.57 -3.53 -3.56 4.77 -0.19 -4.91 117.00 115.18 1mwt n LEU 214 Ca 0.09 -0.09 -0.16 0.00 -0.03 0.00 0.00 56.01 55.82 1mwt n LEU 214 Cb 0.41 -0.52 -0.06 0.00 -2.33 0.00 0.00 43.42 40.93 1mwt n LEU 214 CO 0.59 0.76 0.53 -0.75 -1.33 0.00 0.00 177.39 177.19 1mwt s LYS 215 N -2.38 0.94 0.02 3.23 2.20 -1.06 -5.02 119.74 117.68 1mwt s LYS 215 Ca -0.23 0.19 0.00 0.00 -0.36 0.00 0.00 55.97 55.57 1mwt s LYS 215 Cb 0.06 0.44 -0.04 0.00 -1.51 0.00 0.00 37.83 36.79 1mwt s LYS 215 CO 0.46 -0.30 0.11 0.99 -0.36 0.00 0.00 175.35 176.25 1mwt s THR 216 N -1.32 4.87 -0.00 3.43 2.01 -1.26 -0.73 115.64 122.63 1mwt s THR 216 Ca -0.08 -0.46 0.01 0.00 0.31 0.00 0.00 61.69 61.48 1mwt s THR 216 Cb -0.00 -3.28 -0.00 0.00 0.01 0.00 0.00 72.50 69.22 1mwt s THR 216 CO 0.06 0.27 -0.04 0.68 -0.69 0.00 0.00 174.62 174.90 1mwt s VAL 217 N -1.30 0.28 0.11 3.82 -7.23 0.85 -4.79 120.40 112.14 1mwt s VAL 217 Ca 0.27 -0.19 -0.24 0.00 -1.81 0.00 0.00 61.98 60.00 1mwt s VAL 217 Cb -0.12 -0.25 -0.08 0.00 0.56 0.00 0.00 36.38 36.50 1mwt s VAL 217 CO 0.18 0.05 1.67 0.50 -0.31 0.00 0.00 175.10 177.20 1mwt h LYS 218 N 5.99 -0.27 -5.00 4.82 1.63 -1.92 0.19 116.57 122.00 1mwt h LYS 218 Ca -0.27 0.02 -0.33 0.00 -0.85 0.00 0.00 60.65 59.22 1mwt h LYS 218 Cb 1.20 0.06 -0.18 0.00 -0.60 0.00 0.00 32.23 32.72 1mwt h LYS 218 CO 0.50 -0.18 -0.73 -1.59 -3.45 0.00 0.00 179.45 174.00 1mwt s LYS 219 N -6.13 0.88 -0.89 1.90 -2.85 -1.26 -4.05 119.74 107.34 1mwt s LYS 219 Ca -0.15 -1.19 -0.14 0.00 -1.00 0.00 0.00 55.97 53.50 1mwt s LYS 219 Cb 0.08 -0.56 0.22 0.00 -2.06 0.00 0.00 37.83 35.51 1mwt s LYS 219 CO 0.66 0.09 0.87 1.41 0.10 0.00 0.00 175.35 178.48 1mwt s MET 220 N -2.88 3.72 0.85 1.78 1.75 -1.26 -4.99 119.30 118.28 1mwt s MET 220 Ca 0.07 -2.53 -0.12 0.00 -1.25 0.00 0.00 55.69 51.86 1mwt s MET 220 Cb -0.02 -4.51 0.14 0.00 2.84 0.00 0.00 34.83 33.28 1mwt s MET 220 CO 0.00 -1.33 1.20 0.16 -0.65 0.00 0.00 175.02 174.39 1mwt s ASP 221 N 2.16 3.86 0.44 1.11 3.84 -1.26 -4.76 116.67 122.06 1mwt s ASP 221 Ca 0.22 0.33 0.19 0.00 -0.00 0.00 0.00 52.55 53.29 1mwt s ASP 221 Cb -0.09 -0.62 1.03 0.00 -1.38 0.00 0.00 42.92 41.86 1mwt s ASP 221 CO -0.09 -2.25 1.93 -0.33 -0.00 0.00 0.00 175.17 174.43 1mwt h GLU 222 N -1.20 0.00 0.02 2.11 4.39 -1.96 0.41 114.58 118.35 1mwt h GLU 222 Ca -0.44 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.26 1mwt h GLU 222 Cb 1.27 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.92 1mwt h GLU 222 CO 0.48 0.25 -0.05 1.88 -1.16 0.00 0.00 179.01 180.41 1mwt h TYR 223 N 0.00 -0.14 -0.00 4.33 0.99 -2.00 -2.44 116.97 117.72 1mwt h TYR 223 Ca -0.00 0.00 -0.18 0.00 2.00 0.00 0.00 58.73 60.55 1mwt h TYR 223 Cb 0.52 0.06 -0.02 0.00 1.00 0.00 0.00 36.73 38.29 1mwt h TYR 223 CO 0.00 -0.06 -0.83 -0.07 -0.00 0.00 0.00 178.16 177.20 1mwt h LEU 224 N -0.08 0.13 -1.18 3.88 4.07 -1.95 -2.69 115.31 117.50 1mwt h LEU 224 Ca -0.00 -0.11 0.16 0.00 0.08 0.00 0.00 57.88 58.01 1mwt h LEU 224 Cb 0.07 -0.04 -0.08 0.00 1.08 0.00 0.00 40.66 41.69 1mwt h LEU 224 CO -0.02 0.90 0.60 -1.28 -1.08 0.00 0.00 178.44 177.57 1mwt h SER 225 N 0.06 0.71 1.04 -0.43 0.87 -0.17 0.29 113.55 115.93 1mwt h SER 225 Ca -0.03 0.06 -0.15 0.00 -1.23 0.00 0.00 61.79 60.45 1mwt h SER 225 Cb 1.45 -0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 63.31 1mwt h SER 225 CO 0.12 0.32 -1.02 0.44 -0.53 0.00 0.00 176.83 176.16 1mwt h ASP 226 N 0.73 0.00 -0.73 6.23 5.19 -1.44 -3.20 116.42 123.20 1mwt h ASP 226 Ca 0.50 0.00 0.04 0.00 -0.62 0.00 0.00 57.03 56.95 1mwt h ASP 226 Cb 0.81 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 40.28 1mwt h ASP 226 CO -0.27 0.58 0.48 0.15 -3.12 0.00 0.00 179.24 177.06 1mwt h PHE 227 N 0.00 0.84 -0.26 4.55 3.57 -0.16 0.71 116.94 126.20 1mwt h PHE 227 Ca -0.09 0.02 -0.19 0.00 3.53 0.00 0.00 57.97 61.24 1mwt h PHE 227 Cb 1.52 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 39.98 1mwt h PHE 227 CO 0.00 0.49 -0.60 0.00 -2.23 0.00 0.00 178.31 175.97 1mwt h ALA 228 N 1.58 0.44 -0.61 2.41 0.00 -1.11 -3.05 119.26 118.92 1mwt h ALA 228 Ca 0.29 -0.53 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 1mwt h ALA 228 Cb 0.07 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1mwt h ALA 228 CO -0.08 0.68 0.34 0.87 0.00 0.00 0.00 179.25 181.06 1mwt h LYS 229 N 0.64 0.83 0.51 0.00 1.79 -1.16 0.77 116.57 119.96 1mwt h LYS 229 Ca -0.00 -0.08 -0.03 0.00 -2.18 0.00 0.00 60.65 58.36 1mwt h LYS 229 Cb 1.21 -0.17 0.01 0.00 -1.58 0.00 0.00 32.23 31.69 1mwt h LYS 229 CO 0.13 0.61 -0.25 -0.22 -1.08 0.00 0.00 179.45 178.64 1mwt h LYS 230 N 0.84 -0.66 -0.24 3.15 3.64 -0.82 -2.99 116.57 119.48 1mwt h LYS 230 Ca 0.22 0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.64 1mwt h LYS 230 Cb 0.01 0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.98 1mwt h LYS 230 CO -0.04 -0.44 0.00 1.19 -2.27 0.00 0.00 179.45 177.90 1mwt n PHE 231 N -5.38 0.32 -3.12 1.91 3.01 -1.12 -4.92 117.46 108.16 1mwt n PHE 231 Ca -0.12 -0.16 -0.22 0.00 1.01 0.00 0.00 57.45 57.96 1mwt n PHE 231 Cb 0.29 0.00 0.04 0.00 -0.01 0.00 0.00 39.48 39.80 1mwt n PHE 231 CO 0.00 0.00 0.00 0.72 1.01 0.00 0.00 176.76 178.49 1mwt n HIS 232 N 0.51 -2.13 -1.30 1.38 8.25 0.22 -4.56 115.22 117.59 1mwt n HIS 232 Ca 0.16 0.61 -0.29 0.00 -0.26 0.00 0.00 57.72 57.94 1mwt n HIS 232 Cb 0.35 -4.58 0.15 0.00 1.12 0.00 0.00 29.99 27.03 1mwt n HIS 232 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1mwt s LEU 233 N -6.73 1.86 -0.01 2.41 1.43 0.13 -4.66 118.68 113.11 1mwt s LEU 233 Ca 0.35 1.17 0.05 0.00 -1.03 0.00 0.00 54.13 54.68 1mwt s LEU 233 Cb -0.16 -3.46 -0.03 0.00 0.03 0.00 0.00 46.19 42.58 1mwt s LEU 233 CO 0.44 -2.83 -0.16 -0.89 0.23 0.00 0.00 176.35 173.14 1mwt s THR 234 N -3.06 2.96 -0.02 5.49 2.01 0.35 -4.76 115.64 118.62 1mwt s THR 234 Ca 0.64 -0.93 0.04 0.00 0.31 0.00 0.00 61.69 61.75 1mwt s THR 234 Cb -0.17 -2.20 -0.03 0.00 0.01 0.00 0.00 72.50 70.11 1mwt s THR 234 CO 0.56 0.47 -0.14 0.42 -0.69 0.00 0.00 174.62 175.25 1mwt s THR 235 N -0.83 3.12 -0.09 -0.82 -4.23 -1.26 -0.47 115.64 111.07 1mwt s THR 235 Ca 0.13 -0.83 -0.03 0.00 -1.18 0.00 0.00 61.69 59.78 1mwt s THR 235 Cb -0.11 -2.27 0.05 0.00 1.34 0.00 0.00 72.50 71.51 1mwt s THR 235 CO 0.03 0.50 0.12 0.21 -0.54 0.00 0.00 174.62 174.94 1mwt s ASN 236 N -1.02 1.17 0.24 3.99 2.47 0.12 -4.95 114.94 116.96 1mwt s ASN 236 Ca 0.13 0.06 -0.30 0.00 0.42 0.00 0.00 52.86 53.17 1mwt s ASN 236 Cb -0.11 0.05 -0.11 0.00 -1.45 0.00 0.00 41.25 39.64 1mwt s ASN 236 CO 0.03 -0.27 1.55 -0.70 -3.72 0.00 0.00 177.10 173.99 1mwt s GLU 237 N 2.23 4.19 0.07 0.43 2.12 -1.26 -0.01 118.70 126.46 1mwt s GLU 237 Ca 0.04 2.45 -0.06 0.00 0.36 0.00 0.00 54.97 57.76 1mwt s GLU 237 Cb -0.13 -3.08 -0.01 0.00 0.26 0.00 0.00 34.13 31.16 1mwt s GLU 237 CO -0.06 -0.57 0.11 -0.08 -0.54 0.00 0.00 175.26 174.13 1mwt s THR 238 N 0.34 0.17 0.40 -1.70 -1.32 0.71 -4.88 115.64 109.35 1mwt s THR 238 Ca 0.64 -1.38 -0.23 0.00 -1.21 0.00 0.00 61.69 59.51 1mwt s THR 238 Cb -0.45 -1.37 -0.10 0.00 -1.51 0.00 0.00 72.50 69.07 1mwt s THR 238 CO 0.41 -0.76 0.97 -1.61 -2.21 0.00 0.00 174.62 171.42 1mwt s GLU 239 N -3.80 4.29 -0.06 7.08 2.02 -1.26 0.45 118.70 127.42 1mwt s GLU 239 Ca 0.05 1.26 -0.29 0.00 0.02 0.00 0.00 54.97 56.00 1mwt s GLU 239 Cb 0.06 -2.41 0.10 0.00 0.10 0.00 0.00 34.13 31.98 1mwt s GLU 239 CO -0.10 0.01 0.87 0.45 0.02 0.00 0.00 175.26 176.51 1mwt s SER 240 N -1.91 -0.44 0.22 -0.19 0.15 -0.98 -4.72 113.70 105.83 1mwt s SER 240 Ca 0.58 0.29 -0.32 0.00 0.70 0.00 0.00 55.95 57.21 1mwt s SER 240 Cb -0.14 0.40 -0.14 0.00 -1.71 0.00 0.00 66.02 64.43 1mwt s SER 240 CO 0.19 -0.54 1.36 -1.14 1.20 0.00 0.00 173.24 174.32 1mwt n ARG 241 N 0.34 1.84 -4.16 5.44 3.00 -1.26 -1.12 116.66 120.74 1mwt n ARG 241 Ca -0.12 0.66 -0.16 0.00 -0.00 0.00 0.00 57.85 58.23 1mwt n ARG 241 Cb 0.60 -2.29 -0.13 0.00 0.00 0.00 0.00 32.46 30.64 1mwt n ARG 241 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.63 178.84 1mwt s ASN 242 N 0.27 0.98 -0.33 6.15 2.47 -0.42 -4.73 114.94 119.32 1mwt s ASN 242 Ca 0.70 -0.39 0.00 0.00 0.42 0.00 0.00 52.86 53.60 1mwt s ASN 242 Cb -0.70 -0.03 0.11 0.00 -1.45 0.00 0.00 41.25 39.17 1mwt s ASN 242 CO 0.49 -0.06 0.11 -0.31 -3.72 0.00 0.00 177.10 173.61 1mwt s TYR 243 N -0.86 2.09 0.33 0.43 1.51 -1.26 -1.56 117.35 118.04 1mwt s TYR 243 Ca -0.03 -2.05 0.10 0.00 -1.01 0.00 0.00 57.07 54.08 1mwt s TYR 243 Cb -0.07 -1.95 0.90 0.00 -0.11 0.00 0.00 41.96 40.73 1mwt s TYR 243 CO 0.00 -0.88 1.75 -1.35 -1.11 0.00 0.00 175.55 173.97 1mwt h PRO 244 N 7.81 0.57 0.00 -1.71 0.11 -1.80 0.27 132.00 137.25 1mwt h PRO 244 Ca -0.10 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.97 1mwt h PRO 244 Cb 1.00 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.98 1mwt h PRO 244 CO 0.48 0.38 0.00 1.28 -0.21 0.00 0.00 178.00 179.93 1mwt n LEU 245 N -4.81 0.14 0.00 2.35 4.77 -1.26 -4.95 117.00 113.25 1mwt n LEU 245 Ca 0.26 0.52 0.00 0.00 -0.03 0.00 0.00 56.01 56.76 1mwt n LEU 245 Cb 0.73 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 1mwt n LEU 245 CO 0.19 -0.13 0.00 -0.62 -1.33 0.00 0.00 177.39 175.50 1mwt n GLU 246 N -1.64 0.00 0.23 3.23 1.02 0.95 -1.99 120.64 122.43 1mwt n GLU 246 Ca 0.05 0.00 0.11 0.00 -0.02 0.00 0.00 57.16 57.30 1mwt n GLU 246 Cb 0.29 0.00 0.53 0.00 -0.02 0.00 0.00 31.44 32.24 1mwt n GLU 246 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 1mwt h LYS 247 N 0.00 0.00 0.00 3.49 1.57 -1.88 -3.15 116.57 116.60 1mwt h LYS 247 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1mwt h LYS 247 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1mwt h LYS 247 CO 0.00 0.20 0.00 0.00 -0.57 0.00 0.00 179.45 179.08 1mwt h ALA 248 N 1.80 1.00 0.00 3.86 0.00 -1.78 -2.84 119.26 121.30 1mwt h ALA 248 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1mwt h ALA 248 Cb 0.65 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1mwt h ALA 248 CO 0.03 -0.00 -0.15 0.25 0.00 0.00 0.00 179.25 179.37 1mwt n THR 249 N -3.03 0.92 -0.12 0.00 -2.24 -1.19 -4.82 114.28 103.80 1mwt n THR 249 Ca -0.03 -1.07 -0.05 0.00 -2.27 0.00 0.00 64.05 60.62 1mwt n THR 249 Cb 0.07 0.27 0.03 0.00 -2.10 0.00 0.00 70.33 68.60 1mwt n THR 249 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1mwt h SER 250 N 0.00 0.12 -0.45 3.42 0.02 -1.53 -2.37 113.55 112.76 1mwt h SER 250 Ca 0.00 0.05 -0.09 0.00 -0.84 0.00 0.00 61.79 60.91 1mwt h SER 250 Cb 1.04 0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.60 1mwt h SER 250 CO 0.00 0.10 -0.05 0.45 -1.14 0.00 0.00 176.83 176.19 1mwt h HIS 251 N 0.27 0.92 -0.35 3.45 3.86 -1.90 -1.67 115.15 119.74 1mwt h HIS 251 Ca 0.18 -0.18 -0.16 0.00 -1.16 0.00 0.00 60.37 59.05 1mwt h HIS 251 Cb 0.17 -0.23 -0.01 0.00 1.06 0.00 0.00 27.41 28.40 1mwt h HIS 251 CO -0.16 0.90 -0.40 1.25 0.86 0.00 0.00 177.93 180.38 1mwt h LEU 252 N 0.67 0.93 0.13 2.43 5.85 -1.83 -3.36 115.31 120.12 1mwt h LEU 252 Ca 0.12 -0.43 -0.36 0.00 0.84 0.00 0.00 57.88 58.05 1mwt h LEU 252 Cb 0.57 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.33 1mwt h LEU 252 CO 0.03 1.21 -1.95 -0.07 -0.34 0.00 0.00 178.44 177.32 1mwt h LEU 253 N 0.70 0.42 0.00 2.25 3.38 -1.50 0.04 115.31 120.61 1mwt h LEU 253 Ca 0.05 -0.91 0.00 0.00 0.09 0.00 0.00 57.88 57.12 1mwt h LEU 253 Cb 0.98 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.60 1mwt h LEU 253 CO 0.09 1.81 0.00 0.61 0.09 0.00 0.00 178.44 181.04 1mwt n GLY 254 N 1.96 0.19 3.83 0.83 0.00 -0.63 -1.41 105.19 109.95 1mwt n GLY 254 Ca -0.30 -1.03 -0.06 0.00 0.00 0.00 0.00 46.02 44.63 1mwt n GLY 254 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1mwt s TYR 255 N 0.00 0.00 0.25 1.61 -0.85 -1.21 -4.93 117.35 112.22 1mwt s TYR 255 Ca 0.00 -0.50 0.12 0.00 -0.52 0.00 0.00 57.07 56.17 1mwt s TYR 255 Cb 0.00 0.74 -0.05 0.00 0.38 0.00 0.00 41.96 43.04 1mwt s TYR 255 CO 0.00 -1.21 -0.21 0.14 -1.52 0.00 0.00 175.55 172.75 1mwt s VAL 256 N -2.76 2.45 0.17 -3.49 -7.23 -1.26 -0.18 120.40 108.10 1mwt s VAL 256 Ca 0.16 -2.29 -0.23 0.00 -1.81 0.00 0.00 61.98 57.81 1mwt s VAL 256 Cb -0.04 -2.25 0.06 0.00 0.56 0.00 0.00 36.38 34.72 1mwt s VAL 256 CO 0.07 -0.31 0.60 -0.83 -0.31 0.00 0.00 175.10 174.32 1mwt s GLY 257 N -3.25 -0.56 0.31 2.32 0.00 -0.53 -4.72 107.32 100.88 1mwt s GLY 257 Ca 0.27 0.40 -0.30 0.00 0.00 0.00 0.00 44.72 45.10 1mwt s GLY 257 CO 0.13 0.12 1.58 -1.05 0.00 0.00 0.00 173.10 173.88 1mwt n PRO 258 N -0.38 2.69 -2.09 2.90 -0.02 -1.26 -2.12 135.00 134.71 1mwt n PRO 258 Ca -0.16 0.95 -0.41 0.00 -2.02 0.00 0.00 63.50 61.87 1mwt n PRO 258 Cb 0.64 -2.73 -0.02 0.00 -0.02 0.00 0.00 33.50 31.38 1mwt n PRO 258 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 1mwt s ILE 259 N -0.18 2.70 0.48 4.25 2.07 -0.89 -4.87 121.20 124.76 1mwt s ILE 259 Ca 0.62 0.68 0.06 0.00 -1.41 0.00 0.00 60.65 60.60 1mwt s ILE 259 Cb -0.49 -3.43 0.06 0.00 0.13 0.00 0.00 42.46 38.72 1mwt s ILE 259 CO 0.51 0.15 0.47 -0.46 -1.91 0.00 0.00 174.94 173.70 1mwt n ASN 260 N 1.11 2.28 0.34 4.50 0.23 -1.26 -4.93 115.26 117.53 1mwt n ASN 260 Ca 0.01 -2.53 -0.18 0.00 -0.53 0.00 0.00 54.58 51.36 1mwt n ASN 260 Cb 0.41 -0.15 -0.09 0.00 -2.08 0.00 0.00 39.78 37.88 1mwt n ASN 260 CO 0.00 0.00 0.00 -1.28 -0.93 0.00 0.00 177.26 175.05 1mwt h SER 261 N 0.40 -1.04 -0.72 0.53 0.87 -1.98 -2.31 113.55 109.30 1mwt h SER 261 Ca -0.28 0.07 0.14 0.00 -1.23 0.00 0.00 61.79 60.49 1mwt h SER 261 Cb 1.09 0.32 -0.10 0.00 -0.44 0.00 0.00 62.40 63.27 1mwt h SER 261 CO 0.42 -0.61 0.23 -0.33 -0.53 0.00 0.00 176.83 176.01 1mwt h GLU 262 N -0.96 0.34 -0.95 2.24 3.07 -1.97 0.84 114.58 117.19 1mwt h GLU 262 Ca -0.07 -0.02 0.02 0.00 -0.50 0.00 0.00 59.36 58.79 1mwt h GLU 262 Cb 0.80 -0.08 -0.05 0.00 -0.84 0.00 0.00 28.75 28.58 1mwt h GLU 262 CO 0.05 0.23 0.63 0.93 -1.40 0.00 0.00 179.01 179.44 1mwt h GLU 263 N 0.35 1.21 -0.47 2.33 5.08 -1.92 -1.68 114.58 119.47 1mwt h GLU 263 Ca 0.40 -0.07 -0.11 0.00 -1.00 0.00 0.00 59.36 58.58 1mwt h GLU 263 Cb 0.63 -0.27 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 1mwt h GLU 263 CO -0.44 0.80 -0.13 -0.07 -1.00 0.00 0.00 179.01 178.17 1mwt h LEU 264 N 1.25 0.93 0.00 1.33 3.38 -0.44 -2.21 115.31 119.55 1mwt h LEU 264 Ca 0.36 -0.37 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1mwt h LEU 264 Cb -0.08 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.42 1mwt h LEU 264 CO -0.09 1.08 0.00 0.29 0.09 0.00 0.00 178.44 179.81 1mwt n LYS 265 N -4.22 0.29 -4.24 1.13 5.02 0.09 -4.66 118.16 111.57 1mwt n LYS 265 Ca -0.00 0.00 -0.34 0.00 -2.02 0.00 0.00 58.31 55.95 1mwt n LYS 265 Cb 0.40 -1.36 -0.08 0.00 -0.02 0.00 0.00 35.03 33.97 1mwt n LYS 265 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1mwt s GLN 266 N -2.00 3.01 0.13 1.97 -0.21 -0.83 -5.04 119.66 116.69 1mwt s GLN 266 Ca 0.10 -0.43 -0.28 0.00 0.02 0.00 0.00 55.36 54.77 1mwt s GLN 266 Cb 0.05 -2.83 -0.04 0.00 1.00 0.00 0.00 33.01 31.19 1mwt s GLN 266 CO 0.08 0.68 1.60 0.87 -2.12 0.00 0.00 175.29 176.40 1mwt h LYS 267 N 4.74 -0.44 0.00 2.91 1.79 -1.85 -2.11 116.57 121.62 1mwt h LYS 267 Ca -0.51 0.03 0.00 0.00 -2.18 0.00 0.00 60.65 57.99 1mwt h LYS 267 Cb 1.19 0.10 0.00 0.00 -1.58 0.00 0.00 32.23 31.94 1mwt h LYS 267 CO 0.57 -0.29 0.28 -0.85 -1.08 0.00 0.00 179.45 178.08 1mwt n GLU 268 N -5.43 0.08 -1.37 3.15 0.28 -1.26 -1.39 120.64 114.70 1mwt n GLU 268 Ca -0.04 0.54 -0.15 0.00 -0.16 0.00 0.00 57.16 57.36 1mwt n GLU 268 Cb 0.35 -2.05 0.11 0.00 1.43 0.00 0.00 31.44 31.27 1mwt n GLU 268 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 1mwt n TYR 269 N -1.98 1.91 -3.08 -1.84 0.53 -0.79 -5.01 117.16 106.89 1mwt n TYR 269 Ca -0.01 -2.04 -0.39 0.00 -1.02 0.00 0.00 57.90 54.43 1mwt n TYR 269 Cb 0.30 -0.52 -0.05 0.00 -1.03 0.00 0.00 39.34 38.05 1mwt n TYR 269 CO 0.00 0.00 0.00 0.15 -1.02 0.00 0.00 176.86 175.99 1mwt s LYS 270 N -3.48 4.42 0.00 -0.72 1.02 -0.49 -3.50 119.74 117.00 1mwt s LYS 270 Ca 0.49 0.83 0.00 0.00 0.02 0.00 0.00 55.97 57.31 1mwt s LYS 270 Cb 0.42 -3.44 0.00 0.00 -0.52 0.00 0.00 37.83 34.28 1mwt s LYS 270 CO 0.00 0.09 0.00 0.41 -0.92 0.00 0.00 175.35 174.93 1mwt n GLY 271 N 3.10 2.34 3.75 -3.33 0.00 -1.26 -5.07 105.19 104.72 1mwt n GLY 271 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 1mwt n GLY 271 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1mwt s TYR 272 N -2.47 3.52 0.95 1.61 1.51 -1.23 -5.04 117.35 116.21 1mwt s TYR 272 Ca 0.00 1.61 -0.16 0.00 -1.01 0.00 0.00 57.07 57.51 1mwt s TYR 272 Cb 0.00 -3.34 0.23 0.00 -0.11 0.00 0.00 41.96 38.75 1mwt s TYR 272 CO 0.00 -0.77 0.99 1.63 -1.11 0.00 0.00 175.55 176.29 1mwt n LYS 273 N 1.63 -2.16 0.06 -0.62 4.01 -1.26 -4.96 118.16 114.86 1mwt n LYS 273 Ca 0.01 -1.56 0.12 0.00 -0.51 0.00 0.00 58.31 56.37 1mwt n LYS 273 Cb 0.45 -1.29 0.25 0.00 -0.51 0.00 0.00 35.03 33.93 1mwt n LYS 273 CO 0.00 0.00 0.00 -0.25 -1.11 0.00 0.00 177.40 176.04 1mwt n ASP 274 N -4.25 0.65 -0.74 4.39 8.00 -1.26 -3.72 116.55 119.61 1mwt n ASP 274 Ca 0.13 0.17 0.07 0.00 0.71 0.00 0.00 54.79 55.87 1mwt n ASP 274 Cb 0.49 -0.03 0.15 0.00 -0.02 0.00 0.00 41.12 41.71 1mwt n ASP 274 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1mwt n ASP 275 N -2.01 2.85 -4.73 -2.24 5.75 -1.26 -4.78 116.55 110.12 1mwt n ASP 275 Ca 0.04 -1.86 -0.42 0.00 -0.01 0.00 0.00 54.79 52.55 1mwt n ASP 275 Cb 0.42 -0.19 -0.03 0.00 -1.03 0.00 0.00 41.12 40.29 1mwt n ASP 275 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1mwt s ALA 276 N -1.08 3.57 -0.22 2.12 0.00 -1.24 -4.87 121.76 120.03 1mwt s ALA 276 Ca 0.25 1.17 -0.17 0.00 0.00 0.00 0.00 51.96 53.22 1mwt s ALA 276 Cb 0.14 -3.52 -0.04 0.00 0.00 0.00 0.00 23.12 19.71 1mwt s ALA 276 CO 0.20 -0.61 0.44 0.08 0.00 0.00 0.00 175.76 175.87 1mwt s VAL 277 N 0.34 5.15 0.22 0.00 1.01 -1.26 -2.10 120.40 123.77 1mwt s VAL 277 Ca 0.60 0.76 0.08 0.00 0.00 0.00 0.00 61.98 63.42 1mwt s VAL 277 Cb -0.38 -3.76 -0.05 0.00 0.00 0.00 0.00 36.38 32.19 1mwt s VAL 277 CO 0.37 0.19 -0.14 0.27 0.00 0.00 0.00 175.10 175.79 1mwt s ILE 278 N 1.69 1.81 0.13 2.22 -4.36 -0.90 -4.91 121.20 116.88 1mwt s ILE 278 Ca 0.20 -2.23 -0.31 0.00 -0.26 0.00 0.00 60.65 58.05 1mwt s ILE 278 Cb -0.15 -2.12 -0.08 0.00 1.25 0.00 0.00 42.46 41.35 1mwt s ILE 278 CO 0.09 -0.54 1.39 -0.83 0.24 0.00 0.00 174.94 175.29 1mwt s GLY 279 N -3.35 2.01 0.00 6.27 0.00 -1.25 -1.46 107.32 109.55 1mwt s GLY 279 Ca 0.24 1.13 0.22 0.00 0.00 0.00 0.00 44.72 46.31 1mwt s GLY 279 CO 0.08 2.33 0.86 0.28 0.00 0.00 0.00 173.10 176.65 1mwt n LYS 280 N 3.81 0.20 -3.70 2.90 4.76 0.75 -4.25 118.16 122.63 1mwt n LYS 280 Ca 0.11 -0.04 -0.02 0.00 -2.87 0.00 0.00 58.31 55.48 1mwt n LYS 280 Cb 0.42 -1.52 -0.01 0.00 -1.84 0.00 0.00 35.03 32.08 1mwt n LYS 280 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 1mwt s LYS 281 N -3.15 0.93 3.19 1.97 2.20 -1.24 -4.94 119.74 118.70 1mwt s LYS 281 Ca 0.04 -0.50 0.00 0.00 -0.36 0.00 0.00 55.97 55.15 1mwt s LYS 281 Cb 0.15 0.33 0.00 0.00 -1.51 0.00 0.00 37.83 36.80 1mwt s LYS 281 CO 0.86 -0.43 0.00 0.41 -0.36 0.00 0.00 175.35 175.83 1mwt n GLY 282 N -0.45 0.68 0.19 5.54 0.00 -1.26 -3.08 105.19 106.81 1mwt n GLY 282 Ca -0.07 -0.82 0.03 0.00 0.00 0.00 0.00 46.02 45.16 1mwt n GLY 282 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1mwt h LEU 283 N 0.00 0.00 -1.20 0.99 3.38 -0.34 -1.44 115.31 116.70 1mwt h LEU 283 Ca 0.00 0.00 0.14 0.00 0.09 0.00 0.00 57.88 58.11 1mwt h LEU 283 Cb 0.00 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 40.67 1mwt h LEU 283 CO 0.00 0.35 0.59 -0.33 0.09 0.00 0.00 178.44 179.14 1mwt h GLU 284 N 0.00 0.74 0.06 1.13 4.39 -1.27 0.15 114.58 119.78 1mwt h GLU 284 Ca -0.00 -0.04 -0.27 0.00 0.34 0.00 0.00 59.36 59.38 1mwt h GLU 284 Cb 0.63 -0.17 -0.02 0.00 -0.10 0.00 0.00 28.75 29.10 1mwt h GLU 284 CO 0.05 0.49 -1.44 -0.22 -1.16 0.00 0.00 179.01 176.73 1mwt h LYS 285 N 0.77 0.13 -0.40 2.33 3.64 -1.43 -2.18 116.57 119.43 1mwt h LYS 285 Ca 0.47 -0.22 0.11 0.00 -1.27 0.00 0.00 60.65 59.75 1mwt h LYS 285 Cb 0.69 0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.58 1mwt h LYS 285 CO -0.23 1.10 0.34 1.25 -2.27 0.00 0.00 179.45 179.64 1mwt h LEU 286 N -0.55 0.00 -3.49 5.20 5.85 -0.90 -2.32 115.31 119.09 1mwt h LEU 286 Ca -0.34 0.00 -0.18 0.00 0.84 0.00 0.00 57.88 58.20 1mwt h LEU 286 Cb 1.59 0.00 -0.28 0.00 0.37 0.00 0.00 40.66 42.35 1mwt h LEU 286 CO -0.06 0.00 -0.86 -1.22 -0.34 0.00 0.00 178.44 175.96 1mwt n TYR 287 N -4.06 0.55 -0.11 1.25 4.02 0.50 -4.87 117.16 114.44 1mwt n TYR 287 Ca 0.07 -1.29 -0.05 0.00 -0.01 0.00 0.00 57.90 56.61 1mwt n TYR 287 Cb 0.52 -0.22 0.01 0.00 -0.02 0.00 0.00 39.34 39.63 1mwt n TYR 287 CO 0.00 0.00 0.00 0.22 -1.01 0.00 0.00 176.86 176.07 1mwt h ASP 288 N 1.41 -0.35 -0.48 7.72 3.58 -0.80 -2.60 116.42 124.90 1mwt h ASP 288 Ca -0.07 0.11 0.10 0.00 0.42 0.00 0.00 57.03 57.59 1mwt h ASP 288 Cb 1.48 0.23 -0.10 0.00 1.72 0.00 0.00 39.33 42.66 1mwt h ASP 288 CO 0.16 -0.13 -0.18 0.11 -2.88 0.00 0.00 179.24 176.33 1mwt h LYS 289 N -0.01 -0.07 -0.27 0.28 1.57 -1.86 0.61 116.57 116.82 1mwt h LYS 289 Ca 0.18 0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.95 1mwt h LYS 289 Cb 0.27 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.59 1mwt h LYS 289 CO -0.38 -0.05 0.13 0.87 -0.57 0.00 0.00 179.45 179.46 1mwt h LYS 290 N -0.08 0.36 0.00 3.15 1.57 -1.86 -2.57 116.57 117.14 1mwt h LYS 290 Ca 0.23 -0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 58.94 1mwt h LYS 290 Cb 0.43 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 1mwt h LYS 290 CO -0.53 0.28 -0.52 -0.07 -0.57 0.00 0.00 179.45 178.03 1mwt h LEU 291 N 0.36 0.00 -9.78 2.94 3.38 -0.46 -3.12 115.31 108.64 1mwt h LEU 291 Ca 0.10 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.49 1mwt h LEU 291 Cb 0.03 0.00 0.16 0.00 0.09 0.00 0.00 40.66 40.94 1mwt h LEU 291 CO -0.01 0.15 0.06 0.00 0.09 0.00 0.00 178.44 178.72 1mwt n GLN 292 N -2.98 0.87 -4.14 1.13 1.13 0.19 -1.65 117.38 111.93 1mwt n GLN 292 Ca 0.01 0.34 -0.09 0.00 -1.94 0.00 0.00 57.00 55.32 1mwt n GLN 292 Cb 0.60 -2.10 -0.10 0.00 0.11 0.00 0.00 30.24 28.75 1mwt n GLN 292 CO 0.00 0.00 0.00 -3.38 -1.44 0.00 0.00 177.06 172.24 1mwt s HIS 293 N -1.53 0.76 -0.07 1.08 -3.43 -1.26 -3.80 115.29 107.04 1mwt s HIS 293 Ca 0.74 -1.13 -0.03 0.00 -0.80 0.00 0.00 55.06 53.85 1mwt s HIS 293 Cb -0.43 -0.47 0.04 0.00 -1.43 0.00 0.00 32.58 30.30 1mwt s HIS 293 CO 0.48 -0.41 0.14 -2.00 -2.00 0.00 0.00 174.74 170.95 1mwt s GLU 294 N -3.97 0.04 0.78 -0.38 2.12 0.46 -4.97 118.70 112.78 1mwt s GLU 294 Ca 0.16 0.47 -0.14 0.00 0.36 0.00 0.00 54.97 55.82 1mwt s GLU 294 Cb 0.07 -0.26 0.07 0.00 0.26 0.00 0.00 34.13 34.26 1mwt s GLU 294 CO -0.03 -0.26 1.23 -0.51 -0.54 0.00 0.00 175.26 175.14 1mwt s ASP 295 N 1.88 3.76 0.48 -1.70 1.01 -1.26 -0.01 116.67 120.83 1mwt s ASP 295 Ca -0.01 2.42 0.04 0.00 0.71 0.00 0.00 52.55 55.71 1mwt s ASP 295 Cb -0.12 -2.59 0.04 0.00 1.01 0.00 0.00 42.92 41.25 1mwt s ASP 295 CO -0.05 -2.56 0.30 0.61 0.21 0.00 0.00 175.17 173.68 1mwt n GLY 296 N 0.58 2.93 3.67 0.21 0.00 0.13 -4.66 105.19 108.06 1mwt n GLY 296 Ca 0.14 -2.30 -0.08 0.00 0.00 0.00 0.00 46.02 43.78 1mwt n GLY 296 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1mwt s TYR 297 N -2.44 0.09 -0.14 1.61 1.13 -0.76 0.53 117.35 117.37 1mwt s TYR 297 Ca 0.23 -0.48 -0.09 0.00 -1.41 0.00 0.00 57.07 55.31 1mwt s TYR 297 Cb -0.02 0.40 0.05 0.00 -1.10 0.00 0.00 41.96 41.29 1mwt s TYR 297 CO 0.14 -1.06 0.35 0.50 -2.51 0.00 0.00 175.55 172.97 1mwt s ARG 298 N -3.96 0.35 -0.26 -3.49 3.52 0.18 -1.20 118.95 114.09 1mwt s ARG 298 Ca 0.16 0.63 -0.03 0.00 -0.13 0.00 0.00 55.73 56.37 1mwt s ARG 298 Cb -0.03 0.02 0.02 0.00 -1.56 0.00 0.00 34.95 33.40 1mwt s ARG 298 CO 0.06 -0.13 -0.03 0.08 -0.81 0.00 0.00 175.30 174.48 1mwt s VAL 299 N 1.01 3.18 0.30 7.11 1.01 -0.21 -0.12 120.40 132.68 1mwt s VAL 299 Ca -0.07 -0.90 0.03 0.00 0.00 0.00 0.00 61.98 61.04 1mwt s VAL 299 Cb -0.07 -2.61 -0.06 0.00 0.00 0.00 0.00 36.38 33.64 1mwt s VAL 299 CO -0.08 0.19 0.07 0.42 0.00 0.00 0.00 175.10 175.70 1mwt s THR 300 N 1.38 0.96 -0.23 3.92 -4.23 0.09 -0.56 115.64 116.97 1mwt s THR 300 Ca 0.01 -2.00 -0.05 0.00 -1.18 0.00 0.00 61.69 58.47 1mwt s THR 300 Cb -0.17 -2.73 -0.02 0.00 1.34 0.00 0.00 72.50 70.93 1mwt s THR 300 CO -0.03 -0.01 0.00 -0.63 -0.54 0.00 0.00 174.62 173.42 1mwt s ILE 301 N -3.46 3.72 0.02 2.99 1.01 0.49 -0.75 121.20 125.23 1mwt s ILE 301 Ca 0.37 -0.38 0.08 0.00 0.00 0.00 0.00 60.65 60.73 1mwt s ILE 301 Cb 0.08 -2.72 -0.02 0.00 0.01 0.00 0.00 42.46 39.81 1mwt s ILE 301 CO 0.15 0.39 -0.25 -0.69 0.00 0.00 0.00 174.94 174.54 1mwt s VAL 302 N 1.53 1.98 0.15 2.92 1.01 -0.48 -0.80 120.40 126.72 1mwt s VAL 302 Ca 0.06 -1.23 -0.30 0.00 0.00 0.00 0.00 61.98 60.51 1mwt s VAL 302 Cb -0.15 -1.68 -0.07 0.00 0.00 0.00 0.00 36.38 34.48 1mwt s VAL 302 CO -0.01 0.41 1.15 -1.81 0.00 0.00 0.00 175.10 174.84 1mwt s ASP 303 N -0.97 7.17 0.55 3.32 1.01 -0.85 -1.27 116.67 125.63 1mwt s ASP 303 Ca 0.10 2.11 -0.21 0.00 0.71 0.00 0.00 52.55 55.26 1mwt s ASP 303 Cb -0.10 -2.60 -0.05 0.00 1.01 0.00 0.00 42.92 41.19 1mwt s ASP 303 CO 0.01 -0.32 1.31 0.47 0.21 0.00 0.00 175.17 176.85 1mwt n ASP 304 N 2.76 2.45 0.00 0.27 8.00 -0.28 -2.35 116.55 127.39 1mwt n ASP 304 Ca 0.05 0.96 0.00 0.00 0.71 0.00 0.00 54.79 56.51 1mwt n ASP 304 Cb 0.46 -1.55 0.00 0.00 -0.02 0.00 0.00 41.12 40.01 1mwt n ASP 304 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1mwt n ASN 305 N -0.94 0.00 -0.07 -2.24 3.02 -1.26 -4.38 115.26 109.39 1mwt n ASN 305 Ca 0.11 0.00 0.25 0.00 -0.03 0.00 0.00 54.58 54.91 1mwt n ASN 305 Cb 0.45 0.00 0.70 0.00 -0.61 0.00 0.00 39.78 40.32 1mwt n ASN 305 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1mwt h SER 306 N 0.00 0.00 -5.89 6.41 4.64 -2.00 -3.45 113.55 113.27 1mwt h SER 306 Ca 0.00 0.00 -0.43 0.00 -0.47 0.00 0.00 61.79 60.89 1mwt h SER 306 Cb 0.00 0.00 0.06 0.00 -0.31 0.00 0.00 62.40 62.15 1mwt h SER 306 CO 0.00 0.00 -0.70 0.59 -0.87 0.00 0.00 176.83 175.85 1mwt n ASN 307 N -3.82 -5.76 -4.70 4.97 3.02 -0.99 -4.97 115.26 103.00 1mwt n ASN 307 Ca 0.14 -0.60 -0.38 0.00 -0.03 0.00 0.00 54.58 53.71 1mwt n ASN 307 Cb 0.91 -4.57 -0.06 0.00 -0.61 0.00 0.00 39.78 35.45 1mwt n ASN 307 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1mwt s THR 308 N -3.29 5.15 -0.30 3.41 2.01 -1.25 -4.91 115.64 116.46 1mwt s THR 308 Ca 0.59 1.00 -0.29 0.00 0.31 0.00 0.00 61.69 63.31 1mwt s THR 308 Cb -0.28 -3.85 0.01 0.00 0.01 0.00 0.00 72.50 68.40 1mwt s THR 308 CO 0.73 0.28 1.04 -0.63 -0.69 0.00 0.00 174.62 175.35 1mwt s ILE 309 N 0.93 4.57 -0.11 1.82 1.01 -1.26 -2.01 121.20 126.16 1mwt s ILE 309 Ca 0.27 1.76 0.05 0.00 0.00 0.00 0.00 60.65 62.72 1mwt s ILE 309 Cb -0.15 -4.37 -0.24 0.00 0.01 0.00 0.00 42.46 37.71 1mwt s ILE 309 CO 0.11 -0.39 0.39 0.00 0.00 0.00 0.00 174.94 175.05 1mwt n ALA 310 N 6.69 1.26 -3.25 9.38 0.00 0.02 -4.96 120.51 129.66 1mwt n ALA 310 Ca 0.11 -0.80 -0.13 0.00 0.00 0.00 0.00 53.44 52.62 1mwt n ALA 310 Cb 0.47 -0.63 -0.10 0.00 0.00 0.00 0.00 19.45 19.18 1mwt n ALA 310 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1mwt s HIS 311 N -2.56 -0.38 -0.43 0.00 3.76 -1.13 -4.99 115.29 109.55 1mwt s HIS 311 Ca -0.15 0.92 -0.10 0.00 -0.15 0.00 0.00 55.06 55.58 1mwt s HIS 311 Cb 0.07 0.13 0.08 0.00 1.11 0.00 0.00 32.58 33.97 1mwt s HIS 311 CO 0.78 -0.20 0.29 0.99 -0.85 0.00 0.00 174.74 175.75 1mwt s THR 312 N 0.11 4.44 -0.06 1.30 2.01 -1.26 -0.37 115.64 121.80 1mwt s THR 312 Ca -0.01 -1.33 -0.18 0.00 0.31 0.00 0.00 61.69 60.48 1mwt s THR 312 Cb -0.03 -3.70 -0.13 0.00 0.01 0.00 0.00 72.50 68.65 1mwt s THR 312 CO 0.01 -0.53 0.74 -0.07 -0.69 0.00 0.00 174.62 174.08 1mwt h LEU 313 N 8.48 -0.22 -8.33 4.42 3.38 -1.17 -3.47 115.31 118.40 1mwt h LEU 313 Ca -0.24 -0.27 -0.36 0.00 0.09 0.00 0.00 57.88 57.10 1mwt h LEU 313 Cb 1.09 0.06 -0.21 0.00 0.09 0.00 0.00 40.66 41.68 1mwt h LEU 313 CO 0.78 0.32 -0.76 -0.63 0.09 0.00 0.00 178.44 178.24 1mwt s ILE 314 N -3.18 0.90 -0.22 1.22 1.01 -0.89 -4.93 121.20 115.11 1mwt s ILE 314 Ca -0.11 -1.23 -0.10 0.00 0.00 0.00 0.00 60.65 59.21 1mwt s ILE 314 Cb 0.00 -0.91 0.08 0.00 0.01 0.00 0.00 42.46 41.65 1mwt s ILE 314 CO 0.39 -0.29 0.51 -0.70 0.00 0.00 0.00 174.94 174.85 1mwt s GLU 315 N -1.70 0.47 -0.25 2.79 2.12 -1.26 -1.04 118.70 119.82 1mwt s GLU 315 Ca -0.05 1.05 0.01 0.00 0.36 0.00 0.00 54.97 56.35 1mwt s GLU 315 Cb -0.10 0.24 0.05 0.00 0.26 0.00 0.00 34.13 34.58 1mwt s GLU 315 CO 0.02 -0.19 -0.10 0.21 -0.54 0.00 0.00 175.26 174.65 1mwt s LYS 316 N 2.01 2.48 0.34 4.30 2.20 -0.34 -5.00 119.74 125.73 1mwt s LYS 316 Ca -0.07 -1.20 -0.27 0.00 -0.36 0.00 0.00 55.97 54.07 1mwt s LYS 316 Cb -0.09 -2.89 -0.13 0.00 -1.51 0.00 0.00 37.83 33.21 1mwt s LYS 316 CO -0.15 -0.49 1.11 1.63 -0.36 0.00 0.00 175.35 177.09 1mwt n LYS 317 N 4.52 1.63 -2.10 4.03 5.02 -1.26 -1.84 118.16 128.17 1mwt n LYS 317 Ca -0.15 0.57 -0.33 0.00 -2.02 0.00 0.00 58.31 56.38 1mwt n LYS 317 Cb 0.44 -2.06 0.00 0.00 -0.02 0.00 0.00 35.03 33.39 1mwt n LYS 317 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 1mwt s LYS 318 N -1.78 3.41 -0.31 1.97 -2.85 -1.26 -4.42 119.74 114.49 1mwt s LYS 318 Ca 0.58 1.17 0.03 0.00 -1.00 0.00 0.00 55.97 56.76 1mwt s LYS 318 Cb -0.62 -2.05 0.09 0.00 -2.06 0.00 0.00 37.83 33.19 1mwt s LYS 318 CO 0.60 -0.74 0.02 0.15 0.10 0.00 0.00 175.35 175.48 1mwt s LYS 319 N -4.07 1.51 0.51 1.78 1.02 0.99 -4.88 119.74 116.60 1mwt s LYS 319 Ca 0.63 -1.59 -0.20 0.00 0.02 0.00 0.00 55.97 54.82 1mwt s LYS 319 Cb -0.15 -2.93 -0.07 0.00 -0.52 0.00 0.00 37.83 34.16 1mwt s LYS 319 CO 0.36 -0.85 1.08 -0.51 -0.92 0.00 0.00 175.35 174.51 1mwt s ASP 320 N 1.08 6.09 0.57 2.83 1.01 -1.26 -0.40 116.67 126.59 1mwt s ASP 320 Ca 0.06 2.04 -0.16 0.00 0.71 0.00 0.00 52.55 55.20 1mwt s ASP 320 Cb -0.19 -2.57 -0.05 0.00 1.01 0.00 0.00 42.92 41.12 1mwt s ASP 320 CO -0.10 -0.96 1.04 -0.83 0.21 0.00 0.00 175.17 174.53 1mwt s GLY 321 N -1.87 2.10 -0.02 0.21 0.00 -0.11 -4.79 107.32 102.83 1mwt s GLY 321 Ca 0.69 0.32 -0.19 0.00 0.00 0.00 0.00 44.72 45.54 1mwt s GLY 321 CO 0.23 0.63 0.54 0.54 0.00 0.00 0.00 173.10 175.04 1mwt s LYS 322 N -4.10 4.25 0.74 2.90 -0.14 -1.18 -4.10 119.74 118.12 1mwt s LYS 322 Ca 0.62 0.62 -0.14 0.00 -1.36 0.00 0.00 55.97 55.71 1mwt s LYS 322 Cb -0.14 -3.34 0.04 0.00 -1.68 0.00 0.00 37.83 32.72 1mwt s LYS 322 CO 0.36 0.39 1.17 -0.51 -0.76 0.00 0.00 175.35 176.00 1mwt s ASP 323 N -0.22 4.29 -0.12 2.83 1.01 -1.26 -4.38 116.67 118.82 1mwt s ASP 323 Ca 0.29 2.21 0.00 0.00 0.71 0.00 0.00 52.55 55.76 1mwt s ASP 323 Cb -0.17 -2.57 0.02 0.00 1.01 0.00 0.00 42.92 41.21 1mwt s ASP 323 CO 0.15 -2.19 -0.12 -0.63 0.21 0.00 0.00 175.17 172.59 1mwt s ILE 324 N -2.22 1.31 -0.30 0.77 1.01 0.69 -4.90 121.20 117.57 1mwt s ILE 324 Ca 0.71 -0.49 -0.11 0.00 0.00 0.00 0.00 60.65 60.75 1mwt s ILE 324 Cb -0.25 -1.25 -0.04 0.00 0.01 0.00 0.00 42.46 40.93 1mwt s ILE 324 CO 0.47 0.41 0.19 -1.58 0.00 0.00 0.00 174.94 174.43 1mwt s GLN 325 N 1.41 3.77 0.62 2.79 0.74 -1.26 -0.58 119.66 127.14 1mwt s GLN 325 Ca 0.01 -0.44 -0.03 0.00 0.05 0.00 0.00 55.36 54.95 1mwt s GLN 325 Cb -0.13 -3.67 0.04 0.00 1.10 0.00 0.00 33.01 30.34 1mwt s GLN 325 CO -0.07 -0.26 0.89 -0.51 -0.55 0.00 0.00 175.29 174.78 1mwt s LEU 326 N 1.73 3.10 0.07 3.68 1.43 0.10 -0.44 118.68 128.35 1mwt s LEU 326 Ca 0.07 0.31 0.25 0.00 -1.03 0.00 0.00 54.13 53.73 1mwt s LEU 326 Cb -0.16 -3.08 0.59 0.00 0.03 0.00 0.00 46.19 43.56 1mwt s LEU 326 CO 0.10 -1.30 1.50 0.35 0.23 0.00 0.00 176.35 177.23 1mwt n THR 327 N -2.61 0.21 -1.69 5.49 -2.24 0.74 -1.50 114.28 112.67 1mwt n THR 327 Ca 0.07 -0.14 -0.41 0.00 -2.27 0.00 0.00 64.05 61.30 1mwt n THR 327 Cb 0.60 -0.11 0.01 0.00 -2.10 0.00 0.00 70.33 68.73 1mwt n THR 327 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1mwt n ILE 328 N -1.83 2.59 -3.78 2.28 2.08 -0.96 -4.30 119.36 115.44 1mwt n ILE 328 Ca 0.05 -0.50 -0.37 0.00 0.56 0.00 0.00 62.75 62.49 1mwt n ILE 328 Cb 0.39 -1.53 -0.12 0.00 -0.75 0.00 0.00 39.64 37.63 1mwt n ILE 328 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 1mwt s ASP 329 N -0.56 5.23 0.51 4.38 -1.08 0.04 -0.68 116.67 124.51 1mwt s ASP 329 Ca 0.61 -1.65 0.37 0.00 -0.52 0.00 0.00 52.55 51.37 1mwt s ASP 329 Cb -0.51 -1.83 1.53 0.00 -1.46 0.00 0.00 42.92 40.65 1mwt s ASP 329 CO 0.58 -0.45 1.70 0.00 0.52 0.00 0.00 175.17 177.52 1mwt h ALA 330 N 8.12 3.15 0.08 3.66 0.00 -1.94 0.30 119.26 132.63 1mwt h ALA 330 Ca -0.18 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 1mwt h ALA 330 Cb 1.06 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.97 1mwt h ALA 330 CO 0.66 -1.63 -0.06 0.87 0.00 0.00 0.00 179.25 179.09 1mwt h LYS 331 N 0.06 -0.13 -0.07 0.00 1.57 -1.93 0.15 116.57 116.22 1mwt h LYS 331 Ca 0.73 0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 59.49 1mwt h LYS 331 Cb 2.68 0.03 -0.00 0.00 0.08 0.00 0.00 32.23 35.02 1mwt h LYS 331 CO -0.13 -0.09 -0.07 0.28 -0.57 0.00 0.00 179.45 178.87 1mwt h VAL 332 N -0.14 1.38 -0.72 0.50 2.07 -1.27 -1.10 116.25 116.96 1mwt h VAL 332 Ca -0.00 -1.25 0.11 0.00 0.82 0.00 0.00 66.70 66.37 1mwt h VAL 332 Cb 0.12 2.07 -0.08 0.00 -1.52 0.00 0.00 31.29 31.88 1mwt h VAL 332 CO -0.00 0.35 0.33 -0.61 0.02 0.00 0.00 177.57 177.66 1mwt h GLN 333 N -0.28 0.53 0.19 1.57 5.75 -1.21 0.65 115.11 122.31 1mwt h GLN 333 Ca 0.01 -0.03 -0.01 0.00 -0.15 0.00 0.00 58.65 58.47 1mwt h GLN 333 Cb 0.59 -0.12 0.00 0.00 1.07 0.00 0.00 27.48 29.03 1mwt h GLN 333 CO 0.02 0.35 -0.09 -0.22 -2.65 0.00 0.00 178.83 176.23 1mwt h LYS 334 N 0.54 -0.25 0.04 1.69 3.64 -0.67 -2.54 116.57 119.02 1mwt h LYS 334 Ca 0.37 0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.78 1mwt h LYS 334 Cb 0.45 0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 32.30 1mwt h LYS 334 CO -0.31 0.09 -0.15 1.03 -2.27 0.00 0.00 179.45 177.84 1mwt h SER 335 N -0.63 -0.43 -0.87 4.20 0.87 -0.68 -0.79 113.55 115.23 1mwt h SER 335 Ca -0.03 0.06 0.08 0.00 -1.23 0.00 0.00 61.79 60.67 1mwt h SER 335 Cb 0.46 0.17 -0.07 0.00 -0.44 0.00 0.00 62.40 62.52 1mwt h SER 335 CO 0.04 -0.21 0.53 0.40 -0.53 0.00 0.00 176.83 177.06 1mwt h ILE 336 N -0.27 0.98 0.29 2.23 2.04 -0.97 -2.27 117.51 119.54 1mwt h ILE 336 Ca 0.04 -0.32 -0.01 0.00 1.00 0.00 0.00 64.86 65.57 1mwt h ILE 336 Cb 0.31 -0.02 0.00 0.00 -0.74 0.00 0.00 36.82 36.38 1mwt h ILE 336 CO -0.12 0.17 -0.14 0.22 0.00 0.00 0.00 178.15 178.28 1mwt h TYR 337 N 0.92 -0.36 -0.10 1.37 3.20 -0.98 -2.60 116.97 118.41 1mwt h TYR 337 Ca 0.40 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.29 1mwt h TYR 337 Cb 0.27 0.12 -0.00 0.00 1.54 0.00 0.00 36.73 38.66 1mwt h TYR 337 CO -0.04 -0.11 0.16 -0.91 -1.64 0.00 0.00 178.16 175.62 1mwt h ASN 338 N -0.57 0.00 -0.26 -2.11 2.35 -0.88 0.15 115.58 114.27 1mwt h ASN 338 Ca -0.04 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.71 1mwt h ASN 338 Cb 0.42 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.79 1mwt h ASN 338 CO 0.07 0.00 0.00 0.59 -1.65 0.00 0.00 177.43 176.44 1mwt n ASN 339 N -3.55 3.08 0.00 5.81 3.02 -0.88 -4.32 115.26 118.42 1mwt n ASN 339 Ca -0.00 -1.95 0.00 0.00 -0.03 0.00 0.00 54.58 52.60 1mwt n ASN 339 Cb 0.25 -0.16 0.00 0.00 -0.61 0.00 0.00 39.78 39.27 1mwt n ASN 339 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 1mwt n MET 340 N 1.28 -0.02 0.18 3.52 2.81 -0.20 -4.91 117.12 119.78 1mwt n MET 340 Ca 0.18 -0.23 0.18 0.00 -1.81 0.00 0.00 57.70 56.02 1mwt n MET 340 Cb 0.57 -0.60 0.80 0.00 -0.71 0.00 0.00 33.22 33.27 1mwt n MET 340 CO 0.00 0.00 0.00 1.57 1.51 0.00 0.00 175.97 179.05 1mwt h LYS 341 N 0.00 0.00 0.00 0.03 2.10 -0.97 -1.85 116.57 115.88 1mwt h LYS 341 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1mwt h LYS 341 Cb 0.51 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.84 1mwt h LYS 341 CO 0.00 0.00 -1.04 0.09 -2.00 0.00 0.00 179.45 176.50 1mwt n ASN 342 N -3.52 0.82 -4.92 7.07 3.02 -1.26 -4.53 115.26 111.95 1mwt n ASN 342 Ca 0.03 -0.77 -0.28 0.00 -0.03 0.00 0.00 54.58 53.53 1mwt n ASN 342 Cb 0.48 1.00 -0.03 0.00 -0.61 0.00 0.00 39.78 40.61 1mwt n ASN 342 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1mwt s ASP 343 N -3.21 6.39 -0.16 6.41 1.01 -0.70 -4.83 116.67 121.58 1mwt s ASP 343 Ca 0.07 0.38 -0.27 0.00 0.71 0.00 0.00 52.55 53.43 1mwt s ASP 343 Cb 0.16 -2.00 -0.01 0.00 1.01 0.00 0.00 42.92 42.08 1mwt s ASP 343 CO 0.85 0.01 0.89 -0.47 0.21 0.00 0.00 175.17 176.67 1mwt s TYR 344 N -1.77 3.43 -4.52 4.23 6.14 -1.26 -2.26 117.35 121.35 1mwt s TYR 344 Ca 0.38 1.36 0.00 0.00 0.64 0.00 0.00 57.07 59.44 1mwt s TYR 344 Cb -0.11 -3.08 0.00 0.00 0.42 0.00 0.00 41.96 39.18 1mwt s TYR 344 CO 0.28 -0.26 0.00 0.41 0.64 0.00 0.00 175.55 176.62 1mwt n GLY 345 N 3.36 -1.42 3.12 8.97 0.00 0.77 -1.07 105.19 118.92 1mwt n GLY 345 Ca 0.06 -1.19 -0.13 0.00 0.00 0.00 0.00 46.02 44.76 1mwt n GLY 345 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1mwt s SER 346 N -3.88 1.10 -0.09 1.61 1.04 -0.21 -0.87 113.70 112.39 1mwt s SER 346 Ca 0.00 -0.74 -0.01 0.00 0.48 0.00 0.00 55.95 55.68 1mwt s SER 346 Cb 0.00 0.04 0.03 0.00 0.10 0.00 0.00 66.02 66.19 1mwt s SER 346 CO 0.00 -0.29 -0.00 -0.83 0.98 0.00 0.00 173.24 173.10 1mwt s GLY 347 N -2.19 0.54 0.03 7.32 0.00 -0.26 -1.17 107.32 111.59 1mwt s GLY 347 Ca -0.00 -0.24 0.03 0.00 0.00 0.00 0.00 44.72 44.50 1mwt s GLY 347 CO -0.01 1.14 -0.08 -0.51 0.00 0.00 0.00 173.10 173.63 1mwt s THR 348 N 1.93 0.62 0.03 0.90 -4.23 -0.69 0.46 115.64 114.65 1mwt s THR 348 Ca 0.04 -0.76 0.01 0.00 -1.18 0.00 0.00 61.69 59.80 1mwt s THR 348 Cb -0.13 -0.60 -0.02 0.00 1.34 0.00 0.00 72.50 73.09 1mwt s THR 348 CO -0.06 -0.13 -0.05 0.00 -0.54 0.00 0.00 174.62 173.85 1mwt s ALA 349 N -0.83 0.28 0.07 3.99 0.00 -0.09 -0.52 121.76 124.66 1mwt s ALA 349 Ca -0.03 -0.62 -0.04 0.00 0.00 0.00 0.00 51.96 51.27 1mwt s ALA 349 Cb -0.07 0.10 -0.03 0.00 0.00 0.00 0.00 23.12 23.13 1mwt s ALA 349 CO 0.00 -0.10 0.06 -1.50 0.00 0.00 0.00 175.76 174.22 1mwt s ILE 350 N -1.34 0.19 -0.46 0.00 2.07 -0.53 -0.90 121.20 120.23 1mwt s ILE 350 Ca -0.13 -1.58 -0.12 0.00 -1.41 0.00 0.00 60.65 57.41 1mwt s ILE 350 Cb -0.09 -1.48 0.09 0.00 0.13 0.00 0.00 42.46 41.11 1mwt s ILE 350 CO -0.00 -0.85 0.35 -2.28 -1.91 0.00 0.00 174.94 170.25 1mwt s HIS 351 N -3.90 3.32 0.30 3.50 5.65 0.11 -0.90 115.29 123.36 1mwt s HIS 351 Ca 0.07 -1.41 0.01 0.00 0.25 0.00 0.00 55.06 53.98 1mwt s HIS 351 Cb 0.07 -3.24 0.71 0.00 -1.18 0.00 0.00 32.58 28.94 1mwt s HIS 351 CO -0.10 -0.89 1.60 -1.35 -0.65 0.00 0.00 174.74 173.35 1mwt h PRO 352 N 8.57 0.07 0.00 2.88 0.11 -1.83 0.18 132.00 141.98 1mwt h PRO 352 Ca -0.25 -0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.81 1mwt h PRO 352 Cb 1.09 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 1mwt h PRO 352 CO 0.85 0.04 -0.21 1.96 -0.21 0.00 0.00 178.00 180.43 1mwt h GLN 353 N 0.07 0.00 0.00 1.05 7.50 -1.86 -3.36 115.11 118.51 1mwt h GLN 353 Ca 0.57 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.72 1mwt h GLN 353 Cb 1.15 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.68 1mwt h GLN 353 CO -0.82 0.21 -0.29 0.25 -1.50 0.00 0.00 178.83 176.68 1mwt n THR 354 N -3.97 0.00 -0.61 -0.54 -2.24 -0.79 -4.94 114.28 101.18 1mwt n THR 354 Ca -0.02 -0.16 0.00 0.00 -2.27 0.00 0.00 64.05 61.60 1mwt n THR 354 Cb 0.29 0.67 0.00 0.00 -2.10 0.00 0.00 70.33 69.19 1mwt n THR 354 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1mwt n GLY 355 N 1.05 0.79 3.74 3.38 0.00 0.58 -4.60 105.19 110.12 1mwt n GLY 355 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1mwt n GLY 355 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1mwt s GLU 356 N -0.39 4.33 -0.36 1.61 2.02 -1.24 -1.99 118.70 122.68 1mwt s GLU 356 Ca 0.00 2.18 -0.23 0.00 0.02 0.00 0.00 54.97 56.94 1mwt s GLU 356 Cb 0.00 -3.15 0.01 0.00 0.10 0.00 0.00 34.13 31.09 1mwt s GLU 356 CO 0.00 -0.33 0.77 -0.51 0.02 0.00 0.00 175.26 175.21 1mwt s LEU 357 N -0.32 4.15 0.34 1.80 1.43 -0.31 -0.71 118.68 125.04 1mwt s LEU 357 Ca 0.58 0.33 0.23 0.00 -1.03 0.00 0.00 54.13 54.24 1mwt s LEU 357 Cb -0.39 -3.00 0.35 0.00 0.03 0.00 0.00 46.19 43.17 1mwt s LEU 357 CO 0.41 -0.72 1.50 -0.07 0.23 0.00 0.00 176.35 177.71 1mwt h LEU 358 N 9.70 0.00 -7.00 1.79 3.38 -1.21 -2.55 115.31 119.43 1mwt h LEU 358 Ca -0.25 -0.01 0.10 0.00 0.09 0.00 0.00 57.88 57.81 1mwt h LEU 358 Cb 1.10 0.00 -0.28 0.00 0.09 0.00 0.00 40.66 41.57 1mwt h LEU 358 CO 0.90 0.01 0.52 0.00 0.09 0.00 0.00 178.44 179.96 1mwt s ALA 359 N -3.22 -2.12 -0.29 1.53 0.00 -1.04 -0.78 121.76 115.84 1mwt s ALA 359 Ca 0.06 1.93 -0.02 0.00 0.00 0.00 0.00 51.96 53.92 1mwt s ALA 359 Cb 0.08 -1.59 0.10 0.00 0.00 0.00 0.00 23.12 21.71 1mwt s ALA 359 CO 0.69 -0.24 0.10 -0.51 0.00 0.00 0.00 175.76 175.80 1mwt s LEU 360 N 0.49 1.52 0.01 0.00 1.43 -1.26 -0.91 118.68 119.97 1mwt s LEU 360 Ca 0.01 -1.44 0.07 0.00 -1.03 0.00 0.00 54.13 51.73 1mwt s LEU 360 Cb -0.05 -0.65 -0.03 0.00 0.03 0.00 0.00 46.19 45.49 1mwt s LEU 360 CO -0.10 -0.42 -0.19 -0.69 0.23 0.00 0.00 176.35 175.18 1mwt s VAL 361 N 1.82 2.66 -0.04 -1.59 1.01 0.17 -4.73 120.40 119.70 1mwt s VAL 361 Ca 0.09 -1.11 0.01 0.00 0.00 0.00 0.00 61.98 60.97 1mwt s VAL 361 Cb -0.17 -2.07 0.02 0.00 0.00 0.00 0.00 36.38 34.17 1mwt s VAL 361 CO -0.28 0.43 -0.03 -0.55 0.00 0.00 0.00 175.10 174.67 1mwt s SER 362 N -1.15 0.87 0.07 3.32 0.15 -1.26 -1.10 113.70 114.60 1mwt s SER 362 Ca 0.13 -0.10 0.04 0.00 0.70 0.00 0.00 55.95 56.72 1mwt s SER 362 Cb -0.10 -0.39 -0.03 0.00 -1.71 0.00 0.00 66.02 63.78 1mwt s SER 362 CO 0.03 -0.08 -0.11 0.42 1.20 0.00 0.00 173.24 174.71 1mwt s THR 363 N 1.02 0.87 0.97 6.45 -4.23 -0.05 -4.00 115.64 116.67 1mwt s THR 363 Ca -0.10 -1.34 -0.12 0.00 -1.18 0.00 0.00 61.69 58.96 1mwt s THR 363 Cb -0.14 -1.01 0.17 0.00 1.34 0.00 0.00 72.50 72.86 1mwt s THR 363 CO -0.01 -0.38 1.09 -2.84 -0.54 0.00 0.00 174.62 171.94 1mwt s PRO 364 N -2.02 0.63 0.12 3.99 0.02 -0.96 -0.16 135.00 136.62 1mwt s PRO 364 Ca -0.02 0.61 0.01 0.00 0.02 0.00 0.00 61.00 61.62 1mwt s PRO 364 Cb -0.08 -1.75 0.01 0.00 0.02 0.00 0.00 34.50 32.70 1mwt s PRO 364 CO 0.01 -2.62 0.07 0.45 -0.33 0.00 0.00 177.00 174.58 1mwt n SER 365 N -4.11 1.59 -3.74 2.53 2.88 -1.26 -4.35 113.62 107.16 1mwt n SER 365 Ca 0.06 -1.43 -0.11 0.00 -1.33 0.00 0.00 58.87 56.05 1mwt n SER 365 Cb 0.57 0.01 -0.07 0.00 -0.75 0.00 0.00 64.21 63.97 1mwt n SER 365 CO 0.00 0.00 0.00 -0.72 -1.23 0.00 0.00 175.04 173.09 1mwt s TYR 366 N -0.77 -0.11 -0.07 0.66 -0.85 -1.26 -4.86 117.35 110.08 1mwt s TYR 366 Ca 0.05 -0.07 -0.30 0.00 -0.52 0.00 0.00 57.07 56.24 1mwt s TYR 366 Cb -0.00 0.11 -0.02 0.00 0.38 0.00 0.00 41.96 42.42 1mwt s TYR 366 CO 0.03 -0.53 1.08 0.34 -1.52 0.00 0.00 175.55 174.95 1mwt s ASP 367 N -2.20 7.18 0.31 -0.18 -1.08 -1.26 -4.72 116.67 114.71 1mwt s ASP 367 Ca -0.03 1.66 0.24 0.00 -0.52 0.00 0.00 52.55 53.90 1mwt s ASP 367 Cb -0.00 -2.56 0.48 0.00 -1.46 0.00 0.00 42.92 39.38 1mwt s ASP 367 CO -0.05 -0.48 1.59 -0.37 0.52 0.00 0.00 175.17 176.38 1mwt h VAL 368 N 5.02 0.00 -0.38 1.11 -1.51 -1.93 -3.37 116.25 115.19 1mwt h VAL 368 Ca -0.33 -0.77 0.05 0.00 -1.23 0.00 0.00 66.70 64.42 1mwt h VAL 368 Cb 1.16 1.69 -0.05 0.00 -2.13 0.00 0.00 31.29 31.96 1mwt h VAL 368 CO 0.85 0.00 0.09 1.88 -1.23 0.00 0.00 177.57 179.16 1mwt h TYR 369 N 0.00 0.15 -0.15 5.19 0.99 -1.97 -0.20 116.97 120.97 1mwt h TYR 369 Ca 0.00 0.02 0.04 0.00 2.00 0.00 0.00 58.73 60.80 1mwt h TYR 369 Cb 0.88 -0.01 -0.01 0.00 1.00 0.00 0.00 36.73 38.60 1mwt h TYR 369 CO 0.00 0.03 0.11 -1.35 -0.00 0.00 0.00 178.16 176.96 1mwt h PRO 370 N 0.22 0.00 0.00 4.88 0.11 -1.89 0.43 132.00 135.75 1mwt h PRO 370 Ca 0.18 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.27 1mwt h PRO 370 Cb 0.20 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.30 1mwt h PRO 370 CO -0.22 0.00 -0.06 0.74 -0.21 0.00 0.00 178.00 178.25 1mwt h PHE 371 N 0.00 0.00 0.10 0.65 -1.00 -1.28 0.29 116.94 115.70 1mwt h PHE 371 Ca 0.07 0.00 -0.33 0.00 2.81 0.00 0.00 57.97 60.52 1mwt h PHE 371 Cb 0.30 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.84 1mwt h PHE 371 CO 0.00 0.06 -1.78 0.52 -1.61 0.00 0.00 178.31 175.51 1mwt h MET 372 N 0.00 0.21 -0.01 1.51 2.86 0.37 -3.39 114.93 116.49 1mwt h MET 372 Ca -0.00 -0.36 0.00 0.00 -2.06 0.00 0.00 59.70 57.28 1mwt h MET 372 Cb 0.72 0.14 0.00 0.00 0.06 0.00 0.00 31.60 32.51 1mwt h MET 372 CO 0.01 1.03 -0.67 0.66 1.06 0.00 0.00 176.91 179.00 1mwt n TYR 373 N -3.38 0.00 0.00 -0.22 0.53 0.42 -4.94 117.16 109.57 1mwt n TYR 373 Ca -0.23 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.65 1mwt n TYR 373 Cb 1.05 0.00 0.00 0.00 -1.03 0.00 0.00 39.34 39.36 1mwt n TYR 373 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1mwt n GLY 374 N 1.40 0.79 3.22 2.72 0.00 0.10 -4.67 105.19 108.75 1mwt n GLY 374 Ca 0.06 -1.46 -0.13 0.00 0.00 0.00 0.00 46.02 44.49 1mwt n GLY 374 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1mwt s MET 375 N -5.25 1.15 0.93 1.61 0.23 -1.24 -4.84 119.30 111.88 1mwt s MET 375 Ca 0.00 -1.58 -0.14 0.00 -1.03 0.00 0.00 55.69 52.94 1mwt s MET 375 Cb 0.00 0.03 0.15 0.00 -1.53 0.00 0.00 34.83 33.48 1mwt s MET 375 CO 0.00 -0.28 1.18 -1.54 -2.03 0.00 0.00 175.02 172.36 1mwt s SER 376 N -3.16 3.38 0.28 -1.18 1.04 -1.26 -4.90 113.70 107.90 1mwt s SER 376 Ca 0.31 0.74 0.08 0.00 0.48 0.00 0.00 55.95 57.57 1mwt s SER 376 Cb 0.07 -1.15 0.40 0.00 0.10 0.00 0.00 66.02 65.44 1mwt s SER 376 CO 0.08 -2.61 1.65 0.78 0.98 0.00 0.00 173.24 174.12 1mwt h ASN 377 N -1.54 0.13 -0.51 7.02 -0.26 -1.99 -2.60 115.58 115.83 1mwt h ASN 377 Ca -0.48 -0.06 -0.12 0.00 -0.56 0.00 0.00 56.30 55.08 1mwt h ASN 377 Cb 1.31 -0.04 -0.02 0.00 -1.06 0.00 0.00 38.32 38.52 1mwt h ASN 377 CO 0.55 0.64 -0.13 -0.33 -1.06 0.00 0.00 177.43 177.09 1mwt h GLU 378 N 0.09 0.99 -0.39 0.81 5.08 -1.99 -0.38 114.58 118.79 1mwt h GLU 378 Ca -0.00 -0.38 -0.10 0.00 -1.00 0.00 0.00 59.36 57.87 1mwt h GLU 378 Cb 0.97 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.15 1mwt h GLU 378 CO 0.08 1.06 -0.18 0.93 -1.00 0.00 0.00 179.01 179.89 1mwt h GLU 379 N 0.85 0.74 -0.02 2.33 5.08 -1.91 -1.97 114.58 119.68 1mwt h GLU 379 Ca 0.13 -0.28 -0.18 0.00 -1.00 0.00 0.00 59.36 58.03 1mwt h GLU 379 Cb 0.70 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.90 1mwt h GLU 379 CO 0.05 0.87 -0.80 -0.92 -1.00 0.00 0.00 179.01 177.21 1mwt h TYR 380 N 0.66 0.33 -0.08 4.33 3.20 -1.27 -3.20 116.97 120.92 1mwt h TYR 380 Ca 0.10 -0.16 -0.18 0.00 3.14 0.00 0.00 58.73 61.63 1mwt h TYR 380 Cb 0.67 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.89 1mwt h TYR 380 CO 0.03 0.93 -0.70 -0.91 -1.64 0.00 0.00 178.16 175.88 1mwt h ASN 381 N 0.14 0.46 -0.17 -2.11 2.35 -0.96 -2.72 115.58 112.58 1mwt h ASN 381 Ca -0.03 -0.30 0.03 0.00 -0.55 0.00 0.00 56.30 55.45 1mwt h ASN 381 Cb 1.39 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 39.62 1mwt h ASN 381 CO 0.12 1.02 0.12 0.50 -1.65 0.00 0.00 177.43 177.54 1mwt h LYS 382 N 0.27 0.07 0.16 0.81 3.11 -1.36 0.20 116.57 119.83 1mwt h LYS 382 Ca -0.02 -0.00 -0.22 0.00 -2.81 0.00 0.00 60.65 57.59 1mwt h LYS 382 Cb 1.27 -0.02 0.03 0.00 -1.00 0.00 0.00 32.23 32.51 1mwt h LYS 382 CO 0.12 0.04 -0.95 -0.07 -2.81 0.00 0.00 179.45 175.79 1mwt h LEU 383 N 0.07 0.56 -1.22 5.20 3.38 -1.54 -2.93 115.31 118.82 1mwt h LEU 383 Ca 0.08 -0.94 0.00 0.00 0.09 0.00 0.00 57.88 57.11 1mwt h LEU 383 Cb 0.22 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.78 1mwt h LEU 383 CO -0.01 1.46 0.00 0.71 0.09 0.00 0.00 178.44 180.69 1mwt h THR 384 N -0.25 0.00 -0.01 0.22 1.35 -1.08 -3.03 112.91 110.12 1mwt h THR 384 Ca -0.16 -0.59 0.00 0.00 -0.55 0.00 0.00 66.41 65.11 1mwt h THR 384 Cb 1.74 1.59 0.00 0.00 -1.73 0.00 0.00 68.15 69.75 1mwt h THR 384 CO 0.18 0.00 -0.70 -0.62 -0.25 0.00 0.00 175.52 174.13 1mwt n GLU 385 N -3.08 0.69 -1.90 4.72 1.02 0.64 -4.95 120.64 117.78 1mwt n GLU 385 Ca 0.01 -0.57 -0.42 0.00 -0.02 0.00 0.00 57.16 56.16 1mwt n GLU 385 Cb 0.34 -1.49 -0.03 0.00 -0.02 0.00 0.00 31.44 30.24 1mwt n GLU 385 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1mwt s ASP 386 N -2.70 6.58 0.38 1.62 -1.08 -1.11 -4.86 116.67 115.50 1mwt s ASP 386 Ca 0.14 2.51 0.16 0.00 -0.52 0.00 0.00 52.55 54.84 1mwt s ASP 386 Cb 0.17 -2.56 1.06 0.00 -1.46 0.00 0.00 42.92 40.13 1mwt s ASP 386 CO 0.70 -0.90 1.75 0.11 0.52 0.00 0.00 175.17 177.34 1mwt h LYS 387 N 8.46 0.41 0.00 4.34 1.57 -1.92 0.15 116.57 129.59 1mwt h LYS 387 Ca -0.43 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 1mwt h LYS 387 Cb 1.20 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.42 1mwt h LYS 387 CO 0.93 0.27 0.00 1.63 -0.57 0.00 0.00 179.45 181.72 1mwt n LYS 388 N -4.71 0.01 -3.52 3.15 5.02 -1.26 -4.95 118.16 111.91 1mwt n LYS 388 Ca 0.27 0.16 -0.19 0.00 -2.02 0.00 0.00 58.31 56.52 1mwt n LYS 388 Cb 0.87 -1.52 0.06 0.00 -0.02 0.00 0.00 35.03 34.42 1mwt n LYS 388 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1mwt n GLU 389 N -1.55 -4.70 -0.20 1.97 1.02 0.53 -4.43 120.64 113.28 1mwt n GLU 389 Ca 0.05 0.74 0.22 0.00 -0.02 0.00 0.00 57.16 58.14 1mwt n GLU 389 Cb 0.25 -5.46 0.59 0.00 -0.02 0.00 0.00 31.44 26.80 1mwt n GLU 389 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1mwt h PRO 390 N -1.73 0.24 0.00 3.49 0.13 -1.78 -0.85 132.00 131.50 1mwt h PRO 390 Ca -0.61 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.51 1mwt h PRO 390 Cb 1.34 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.42 1mwt h PRO 390 CO 0.51 0.16 0.00 -0.07 -0.23 0.00 0.00 178.00 178.37 1mwt h LEU 391 N 0.25 0.00 -9.54 1.56 4.07 -1.85 -3.43 115.31 106.37 1mwt h LEU 391 Ca 0.44 0.00 -0.52 0.00 0.08 0.00 0.00 57.88 57.87 1mwt h LEU 391 Cb 1.31 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 43.03 1mwt h LEU 391 CO -0.11 0.00 0.34 -0.22 -1.08 0.00 0.00 178.44 177.37 1mwt s LEU 392 N -6.01 4.47 -0.90 1.67 2.96 -0.33 -4.98 118.68 115.57 1mwt s LEU 392 Ca 0.00 1.73 -0.20 0.00 -0.22 0.00 0.00 54.13 55.45 1mwt s LEU 392 Cb 0.09 -3.54 0.11 0.00 0.50 0.00 0.00 46.19 43.36 1mwt s LEU 392 CO 0.51 -0.08 1.13 0.21 -1.32 0.00 0.00 176.35 176.79 1mwt s ASN 393 N 0.14 6.55 0.53 3.68 3.84 -1.26 -4.87 114.94 123.55 1mwt s ASN 393 Ca 0.47 -1.83 0.20 0.00 0.21 0.00 0.00 52.86 51.90 1mwt s ASN 393 Cb -0.23 -2.42 1.39 0.00 -0.55 0.00 0.00 41.25 39.44 1mwt s ASN 393 CO 0.29 -1.16 2.15 0.11 -2.79 0.00 0.00 177.10 175.70 1mwt h LYS 394 N 9.04 0.00 -0.00 0.43 6.56 -1.90 -2.57 116.57 128.12 1mwt h LYS 394 Ca 0.10 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.69 1mwt h LYS 394 Cb 1.03 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.69 1mwt h LYS 394 CO 1.15 0.03 0.00 1.97 -2.06 0.00 0.00 179.45 180.54 1mwt n PHE 395 N -4.30 0.00 -0.09 -1.35 -1.74 -1.26 -3.74 117.46 104.99 1mwt n PHE 395 Ca -0.03 -0.00 -0.14 0.00 -0.56 0.00 0.00 57.45 56.72 1mwt n PHE 395 Cb 0.11 0.00 -0.14 0.00 1.52 0.00 0.00 39.48 40.97 1mwt n PHE 395 CO 0.00 0.00 0.00 0.94 -0.56 0.00 0.00 176.76 177.14 1mwt n GLN 396 N -0.69 0.68 -1.90 3.97 7.27 -0.97 -4.66 117.38 121.08 1mwt n GLN 396 Ca 0.23 0.12 -0.30 0.00 0.07 0.00 0.00 57.00 57.11 1mwt n GLN 396 Cb 0.17 -1.58 0.02 0.00 2.41 0.00 0.00 30.24 31.27 1mwt n GLN 396 CO 0.00 0.00 0.00 0.96 0.07 0.00 0.00 177.06 178.09 1mwt s ILE 397 N -2.52 4.19 0.10 1.69 -4.36 -1.24 -2.04 121.20 117.02 1mwt s ILE 397 Ca -0.19 0.69 -0.01 0.00 -0.26 0.00 0.00 60.65 60.87 1mwt s ILE 397 Cb 0.07 -3.70 -0.04 0.00 1.25 0.00 0.00 42.46 40.04 1mwt s ILE 397 CO 0.74 -0.92 0.27 0.42 0.24 0.00 0.00 174.94 175.70 1mwt s THR 398 N -3.24 5.31 0.34 8.37 -4.23 -1.26 -4.33 115.64 116.59 1mwt s THR 398 Ca 0.56 -0.29 -0.09 0.00 -1.18 0.00 0.00 61.69 60.69 1mwt s THR 398 Cb -0.11 -3.64 0.02 0.00 1.34 0.00 0.00 72.50 70.11 1mwt s THR 398 CO 0.53 0.08 0.58 0.28 -0.54 0.00 0.00 174.62 175.55 1mwt s THR 399 N -1.59 0.00 0.04 3.99 -1.32 0.68 -4.76 115.64 112.68 1mwt s THR 399 Ca 0.37 -1.35 -0.30 0.00 -1.21 0.00 0.00 61.69 59.19 1mwt s THR 399 Cb -0.12 -2.60 -0.06 0.00 -1.51 0.00 0.00 72.50 68.20 1mwt s THR 399 CO 0.27 0.00 1.30 -0.55 -2.21 0.00 0.00 174.62 173.43 1mwt s SER 400 N -3.13 6.95 0.00 8.08 0.15 -1.26 0.04 113.70 124.53 1mwt s SER 400 Ca 0.23 2.09 0.27 0.00 0.70 0.00 0.00 55.95 59.24 1mwt s SER 400 Cb -0.02 -2.57 1.54 0.00 -1.71 0.00 0.00 66.02 63.26 1mwt s SER 400 CO 0.15 -0.60 1.95 -0.81 1.20 0.00 0.00 173.24 175.13 1mwt n PRO 401 N 4.53 0.72 0.00 5.44 -0.04 -1.26 -4.93 135.00 139.45 1mwt n PRO 401 Ca 0.11 0.01 0.00 0.00 -0.04 0.00 0.00 63.50 63.58 1mwt n PRO 401 Cb 0.45 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.41 1mwt n PRO 401 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1mwt n GLY 402 N 0.76 0.00 3.83 0.55 0.00 -1.22 -3.51 105.19 105.60 1mwt n GLY 402 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 1mwt n GLY 402 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1mwt n THR 404 N 0.00 0.00 0.22 2.61 -2.24 -1.26 -3.64 114.28 109.98 1mwt n THR 404 Ca 0.00 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 61.84 1mwt n THR 404 Cb 0.00 0.00 0.56 0.00 -2.10 0.00 0.00 70.33 68.79 1mwt n THR 404 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 1mwt h GLN 405 N 0.00 0.05 -1.00 -0.78 5.75 -1.85 -3.05 115.11 114.22 1mwt h GLN 405 Ca 0.00 -0.01 0.24 0.00 -0.15 0.00 0.00 58.65 58.74 1mwt h GLN 405 Cb 0.00 -0.01 -0.12 0.00 1.07 0.00 0.00 27.48 28.42 1mwt h GLN 405 CO 0.00 0.11 0.59 0.87 -2.65 0.00 0.00 178.83 177.75 1mwt h LYS 406 N 0.05 0.57 -0.38 1.69 1.57 -1.78 0.42 116.57 118.72 1mwt h LYS 406 Ca 0.01 -0.03 -0.06 0.00 -1.87 0.00 0.00 60.65 58.70 1mwt h LYS 406 Cb 0.13 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 1mwt h LYS 406 CO 0.01 0.38 0.00 0.82 -0.57 0.00 0.00 179.45 180.08 1mwt h ILE 407 N 0.59 1.21 0.03 1.86 1.08 -1.89 0.41 117.51 120.80 1mwt h ILE 407 Ca 0.64 -0.85 -0.00 0.00 -0.39 0.00 0.00 64.86 64.26 1mwt h ILE 407 Cb 1.21 0.93 0.00 0.00 -3.07 0.00 0.00 36.82 35.89 1mwt h ILE 407 CO -0.47 0.29 -0.02 -0.07 -0.69 0.00 0.00 178.15 177.19 1mwt h LEU 408 N 0.57 -0.04 -0.61 1.44 -0.00 -0.38 -1.62 115.31 114.68 1mwt h LEU 408 Ca 0.12 -0.27 0.11 0.00 -0.00 0.00 0.00 57.88 57.84 1mwt h LEU 408 Cb 0.36 0.01 -0.08 0.00 -0.00 0.00 0.00 40.66 40.95 1mwt h LEU 408 CO 0.01 0.25 0.15 0.74 -0.00 0.00 0.00 178.44 179.59 1mwt h THR 409 N -0.33 0.66 -0.83 0.22 2.02 -0.82 -1.43 112.91 112.41 1mwt h THR 409 Ca -0.00 -0.10 -0.04 0.00 0.77 0.00 0.00 66.41 67.04 1mwt h THR 409 Cb 0.30 0.35 -0.04 0.00 -1.74 0.00 0.00 68.15 67.02 1mwt h THR 409 CO 0.01 0.05 0.37 0.00 0.37 0.00 0.00 175.52 176.32 1mwt h ALA 410 N 1.47 1.09 -0.66 6.16 0.00 -0.74 -1.37 119.26 125.22 1mwt h ALA 410 Ca 0.32 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1mwt h ALA 410 Cb 0.46 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 1mwt h ALA 410 CO -0.39 0.67 0.39 0.52 0.00 0.00 0.00 179.25 180.44 1mwt h MET 411 N 1.19 0.89 -0.11 0.00 2.07 -0.28 0.13 114.93 118.82 1mwt h MET 411 Ca 0.28 -0.09 -0.01 0.00 -2.07 0.00 0.00 59.70 57.82 1mwt h MET 411 Cb 0.16 -0.19 -0.00 0.00 -1.87 0.00 0.00 31.60 29.70 1mwt h MET 411 CO -0.03 0.65 0.04 0.82 1.07 0.00 0.00 176.91 179.46 1mwt h ILE 412 N 0.89 1.15 -0.78 -1.22 2.04 -0.98 0.11 117.51 118.72 1mwt h ILE 412 Ca 0.23 -0.45 -0.04 0.00 1.00 0.00 0.00 64.86 65.61 1mwt h ILE 412 Cb -0.01 1.25 -0.04 0.00 -0.74 0.00 0.00 36.82 37.28 1mwt h ILE 412 CO -0.04 0.13 0.34 1.23 0.00 0.00 0.00 178.15 179.81 1mwt h GLY 413 N 0.01 1.24 1.84 5.37 0.00 -1.04 -0.27 103.07 110.21 1mwt h GLY 413 Ca 0.04 -0.65 -0.08 0.00 0.00 0.00 0.00 47.33 46.64 1mwt h GLY 413 CO -0.00 0.61 -0.29 1.41 0.00 0.00 0.00 176.54 178.27 1mwt h LEU 414 N 1.12 0.19 -0.05 3.11 3.38 -0.55 -0.80 115.31 121.71 1mwt h LEU 414 Ca 0.26 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.15 1mwt h LEU 414 Cb 0.17 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.87 1mwt h LEU 414 CO -0.03 0.48 -0.07 -1.13 0.09 0.00 0.00 178.44 177.78 1mwt h ASN 415 N 0.17 0.15 -0.13 -0.43 -1.24 -0.03 -3.07 115.58 111.00 1mwt h ASN 415 Ca 0.02 -0.53 0.00 0.00 0.71 0.00 0.00 56.30 56.50 1mwt h ASN 415 Cb 0.61 -0.04 0.00 0.00 0.73 0.00 0.00 38.32 39.62 1mwt h ASN 415 CO 0.04 0.65 0.00 0.59 -1.29 0.00 0.00 177.43 177.43 1mwt n ASN 416 N -4.71 1.44 -0.76 1.15 3.02 -0.18 -4.89 115.26 110.32 1mwt n ASN 416 Ca -0.08 -2.11 -0.06 0.00 -0.03 0.00 0.00 54.58 52.31 1mwt n ASN 416 Cb 0.32 -0.35 -0.03 0.00 -0.61 0.00 0.00 39.78 39.11 1mwt n ASN 416 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1mwt n LYS 417 N 0.04 -1.55 0.00 3.52 5.02 -0.48 -4.74 118.16 119.96 1mwt n LYS 417 Ca 0.05 0.46 0.15 0.00 -2.02 0.00 0.00 58.31 56.95 1mwt n LYS 417 Cb 0.30 -4.36 0.77 0.00 -0.02 0.00 0.00 35.03 31.72 1mwt n LYS 417 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1mwt n THR 418 N -1.40 0.00 -3.75 -0.18 -2.24 -0.43 -4.72 114.28 101.57 1mwt n THR 418 Ca -0.06 -0.10 -0.14 0.00 -2.27 0.00 0.00 64.05 61.48 1mwt n THR 418 Cb 0.30 -0.10 -0.15 0.00 -2.10 0.00 0.00 70.33 68.29 1mwt n THR 418 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1mwt s LEU 419 N -2.03 0.71 0.00 3.22 0.20 -1.01 -4.98 118.68 114.79 1mwt s LEU 419 Ca 0.43 0.27 0.01 0.00 0.69 0.00 0.00 54.13 55.52 1mwt s LEU 419 Cb 0.21 0.30 -0.00 0.00 -0.43 0.00 0.00 46.19 46.27 1mwt s LEU 419 CO 0.36 -0.15 0.36 -0.90 -0.29 0.00 0.00 176.35 175.73 1mwt n ASP 420 N 4.28 -0.99 0.30 3.68 3.85 -1.26 -4.00 116.55 122.40 1mwt n ASP 420 Ca -0.25 -2.66 0.19 0.00 -0.71 0.00 0.00 54.79 51.35 1mwt n ASP 420 Cb 0.51 1.94 0.99 0.00 -1.35 0.00 0.00 41.12 43.20 1mwt n ASP 420 CO 0.00 0.00 0.00 -2.24 -1.01 0.00 0.00 177.20 173.95 1mwt h ASP 421 N 1.67 0.00 -0.11 -1.12 -0.00 -2.01 -1.69 116.42 113.17 1mwt h ASP 421 Ca -0.22 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 56.81 1mwt h ASP 421 Cb 1.00 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 40.33 1mwt h ASP 421 CO 0.30 0.00 0.00 0.29 -0.00 0.00 0.00 179.24 179.83 1mwt n LYS 422 N -3.30 2.12 -2.00 4.15 5.02 -1.26 -4.77 118.16 118.13 1mwt n LYS 422 Ca -0.01 -1.90 -0.38 0.00 -2.02 0.00 0.00 58.31 53.99 1mwt n LYS 422 Cb 0.22 -1.43 0.01 0.00 -0.02 0.00 0.00 35.03 33.81 1mwt n LYS 422 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1mwt s THR 423 N -1.72 2.53 -0.20 -0.18 2.01 -0.64 -5.02 115.64 112.43 1mwt s THR 423 Ca 0.28 0.43 -0.28 0.00 0.31 0.00 0.00 61.69 62.43 1mwt s THR 423 Cb 0.19 -3.23 0.12 0.00 0.01 0.00 0.00 72.50 69.59 1mwt s THR 423 CO 0.28 0.02 0.99 -0.94 -0.69 0.00 0.00 174.62 174.28 1mwt s SER 424 N -0.95 -0.42 0.09 3.53 1.04 -1.26 -3.82 113.70 111.91 1mwt s SER 424 Ca 0.64 0.61 0.09 0.00 0.48 0.00 0.00 55.95 57.77 1mwt s SER 424 Cb -0.37 0.55 -0.03 0.00 0.10 0.00 0.00 66.02 66.27 1mwt s SER 424 CO 0.45 -0.28 -0.23 -0.31 0.98 0.00 0.00 173.24 173.85 1mwt s TYR 425 N -0.58 2.03 -0.43 5.02 1.51 -0.44 -4.86 117.35 119.61 1mwt s TYR 425 Ca -0.00 -0.40 -0.25 0.00 -1.01 0.00 0.00 57.07 55.41 1mwt s TYR 425 Cb -0.02 -1.15 0.02 0.00 -0.11 0.00 0.00 41.96 40.70 1mwt s TYR 425 CO -0.01 0.20 0.90 0.21 -1.11 0.00 0.00 175.55 175.75 1mwt s LYS 426 N -1.67 3.62 -0.12 -0.62 2.20 -1.26 -1.05 119.74 120.84 1mwt s LYS 426 Ca 0.10 0.26 0.03 0.00 -0.36 0.00 0.00 55.97 56.00 1mwt s LYS 426 Cb -0.10 -3.89 -0.00 0.00 -1.51 0.00 0.00 37.83 32.34 1mwt s LYS 426 CO 0.04 -1.11 -0.21 0.42 -0.36 0.00 0.00 175.35 174.13 1mwt s ILE 427 N 3.60 2.29 -0.01 5.43 1.01 -0.45 -4.99 121.20 128.07 1mwt s ILE 427 Ca 0.36 -0.92 0.02 0.00 0.00 0.00 0.00 60.65 60.11 1mwt s ILE 427 Cb -0.11 -1.91 0.00 0.00 0.01 0.00 0.00 42.46 40.45 1mwt s ILE 427 CO 0.23 0.55 -0.06 -1.81 0.00 0.00 0.00 174.94 173.85 1mwt s ASP 428 N 0.50 0.74 0.00 3.58 1.11 -1.26 -1.88 116.67 119.46 1mwt s ASP 428 Ca -0.13 -0.11 0.00 0.00 0.18 0.00 0.00 52.55 52.49 1mwt s ASP 428 Cb -0.17 -0.16 0.00 0.00 1.07 0.00 0.00 42.92 43.67 1mwt s ASP 428 CO 0.05 0.04 0.00 0.61 1.18 0.00 0.00 175.17 177.05 1mwt n GLY 429 N 3.20 -1.99 0.08 0.21 0.00 -1.26 -4.55 105.19 100.87 1mwt n GLY 429 Ca -0.16 -1.58 -0.08 0.00 0.00 0.00 0.00 46.02 44.20 1mwt n GLY 429 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1mwt h LYS 430 N 0.00 0.00 -5.23 1.61 1.63 -1.96 -3.46 116.57 109.16 1mwt h LYS 430 Ca 0.00 0.00 -0.62 0.00 -0.85 0.00 0.00 60.65 59.18 1mwt h LYS 430 Cb 0.00 0.00 -0.13 0.00 -0.60 0.00 0.00 32.23 31.50 1mwt h LYS 430 CO 0.00 0.63 -0.54 0.20 -3.45 0.00 0.00 179.45 176.29 1mwt s GLY 431 N -4.99 2.76 -0.26 5.01 0.00 -1.26 -1.83 107.32 106.75 1mwt s GLY 431 Ca -0.03 -1.03 -0.27 0.00 0.00 0.00 0.00 44.72 43.40 1mwt s GLY 431 CO 0.82 -2.06 1.19 0.86 0.00 0.00 0.00 173.10 173.92 1mwt s TRP 432 N -2.98 -0.27 0.02 1.90 -0.00 -0.79 -4.83 118.94 112.00 1mwt s TRP 432 Ca 0.17 0.61 -0.00 0.00 -0.00 0.00 0.00 56.10 56.88 1mwt s TRP 432 Cb 0.04 0.43 -0.02 0.00 -0.00 0.00 0.00 33.47 33.92 1mwt s TRP 432 CO 0.09 -0.17 -0.03 1.14 -0.00 0.00 0.00 176.95 177.99 1mwt s GLN 433 N -0.25 0.35 0.05 5.86 -2.07 -1.26 -0.70 119.66 121.64 1mwt s GLN 433 Ca 0.04 -0.69 -0.19 0.00 -1.82 0.00 0.00 55.36 52.70 1mwt s GLN 433 Cb -0.04 0.12 -0.14 0.00 -1.09 0.00 0.00 33.01 31.86 1mwt s GLN 433 CO -0.08 -0.06 1.32 -0.22 -1.32 0.00 0.00 175.29 174.94 1mwt h LYS 434 N 4.45 0.43 -4.18 9.60 3.64 -2.01 -3.48 116.57 125.03 1mwt h LYS 434 Ca -0.32 -0.25 -0.25 0.00 -1.27 0.00 0.00 60.65 58.56 1mwt h LYS 434 Cb 1.20 0.02 -0.10 0.00 -0.41 0.00 0.00 32.23 32.94 1mwt h LYS 434 CO 0.44 0.84 -0.27 0.16 -2.27 0.00 0.00 179.45 178.34 1mwt s ASP 435 N -6.28 0.68 0.47 4.20 3.84 -1.26 -5.06 116.67 113.25 1mwt s ASP 435 Ca -0.14 -1.39 0.26 0.00 -0.00 0.00 0.00 52.55 51.28 1mwt s ASP 435 Cb 0.06 0.59 1.08 0.00 -1.38 0.00 0.00 42.92 43.27 1mwt s ASP 435 CO 0.78 -1.17 1.89 0.11 -0.00 0.00 0.00 175.17 176.78 1mwt h LYS 436 N 2.22 0.00 -0.07 2.11 1.57 -1.93 -3.03 116.57 117.43 1mwt h LYS 436 Ca -0.29 0.00 0.02 0.00 -1.87 0.00 0.00 60.65 58.51 1mwt h LYS 436 Cb 1.24 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.55 1mwt h LYS 436 CO 0.40 0.19 0.07 0.66 -0.57 0.00 0.00 179.45 180.20 1mwt h SER 437 N 0.00 0.00 0.00 0.86 4.64 -2.01 0.27 113.55 117.32 1mwt h SER 437 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1mwt h SER 437 Cb 0.64 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.73 1mwt h SER 437 CO 0.02 0.00 0.00 0.79 -0.87 0.00 0.00 176.83 176.77 1mwt n TRP 438 N -4.02 0.00 0.00 4.77 7.02 -1.15 -4.87 117.44 119.19 1mwt n TRP 438 Ca -0.01 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.47 1mwt n TRP 438 Cb 0.17 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.06 1mwt n TRP 438 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1mwt n GLY 439 N -0.75 3.74 1.73 6.99 0.00 0.08 -0.94 105.19 116.04 1mwt n GLY 439 Ca 0.02 0.19 0.08 0.00 0.00 0.00 0.00 46.02 46.30 1mwt n GLY 439 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mwt n GLY 440 N 0.00 3.04 3.82 -0.02 0.00 -1.26 -4.96 105.19 105.81 1mwt n GLY 440 Ca 0.00 -0.92 -0.37 0.00 0.00 0.00 0.00 46.02 44.73 1mwt n GLY 440 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1mwt s TYR 441 N -2.54 3.63 -0.03 1.61 5.04 -0.12 -5.09 117.35 119.85 1mwt s TYR 441 Ca 0.53 0.79 -0.02 0.00 -2.44 0.00 0.00 57.07 55.93 1mwt s TYR 441 Cb 0.39 -2.22 0.02 0.00 0.35 0.00 0.00 41.96 40.50 1mwt s TYR 441 CO 0.17 0.56 0.07 -0.80 -1.34 0.00 0.00 175.55 174.22 1mwt s ASN 442 N -0.66 -0.03 -0.06 4.32 0.01 -1.26 -4.68 114.94 112.58 1mwt s ASN 442 Ca 0.20 0.14 -0.30 0.00 -0.71 0.00 0.00 52.86 52.20 1mwt s ASN 442 Cb -0.15 0.08 -0.04 0.00 0.41 0.00 0.00 41.25 41.56 1mwt s ASN 442 CO 0.09 -0.09 1.31 -0.69 -1.51 0.00 0.00 177.10 176.21 1mwt s VAL 443 N 0.68 4.04 0.19 1.60 1.01 0.12 -4.71 120.40 123.33 1mwt s VAL 443 Ca -0.05 1.36 0.08 0.00 0.00 0.00 0.00 61.98 63.36 1mwt s VAL 443 Cb -0.07 -3.87 -0.04 0.00 0.00 0.00 0.00 36.38 32.39 1mwt s VAL 443 CO -0.03 -0.03 -0.02 0.42 0.00 0.00 0.00 175.10 175.44 1mwt s THR 444 N 2.66 3.56 0.06 3.92 -4.23 -1.26 -1.88 115.64 118.47 1mwt s THR 444 Ca 0.59 -1.54 0.09 0.00 -1.18 0.00 0.00 61.69 59.65 1mwt s THR 444 Cb -0.27 -2.80 -0.03 0.00 1.34 0.00 0.00 72.50 70.74 1mwt s THR 444 CO 0.22 -0.14 -0.23 0.00 -0.54 0.00 0.00 174.62 173.93 1mwt s ARG 445 N -3.00 1.81 0.02 3.99 1.70 -0.76 -4.58 118.95 118.12 1mwt s ARG 445 Ca 0.27 -1.12 -0.25 0.00 -0.47 0.00 0.00 55.73 54.16 1mwt s ARG 445 Cb -0.09 -2.04 -0.18 0.00 -0.57 0.00 0.00 34.95 32.08 1mwt s ARG 445 CO 0.18 0.51 1.39 -0.92 -1.08 0.00 0.00 175.30 175.38 1mwt h TYR 446 N 4.47 -0.18 -3.75 5.89 3.20 -1.90 -3.42 116.97 121.29 1mwt h TYR 446 Ca -0.48 -0.00 -0.65 0.00 3.14 0.00 0.00 58.73 60.74 1mwt h TYR 446 Cb 1.15 0.06 -0.20 0.00 1.54 0.00 0.00 36.73 39.28 1mwt h TYR 446 CO 0.53 0.12 -0.57 -2.00 -1.64 0.00 0.00 178.16 174.60 1mwt s GLU 447 N -4.99 3.70 -0.62 1.82 2.12 -1.26 -5.05 118.70 114.42 1mwt s GLU 447 Ca -0.15 -0.47 -0.24 0.00 0.36 0.00 0.00 54.97 54.47 1mwt s GLU 447 Cb 0.03 -3.52 0.05 0.00 0.26 0.00 0.00 34.13 30.95 1mwt s GLU 447 CO 0.62 -0.24 1.01 0.08 -0.54 0.00 0.00 175.26 176.19 1mwt s VAL 448 N 1.68 4.25 -0.42 3.70 1.01 -1.26 -4.96 120.40 124.39 1mwt s VAL 448 Ca 0.06 0.10 0.04 0.00 0.00 0.00 0.00 61.98 62.18 1mwt s VAL 448 Cb -0.16 -4.66 0.11 0.00 0.00 0.00 0.00 36.38 31.68 1mwt s VAL 448 CO 0.07 -1.36 0.15 -0.69 0.00 0.00 0.00 175.10 173.27 1mwt s VAL 449 N 4.30 2.43 0.27 2.92 1.01 -1.26 -5.04 120.40 125.03 1mwt s VAL 449 Ca 0.29 -2.81 -0.29 0.00 0.00 0.00 0.00 61.98 59.16 1mwt s VAL 449 Cb -0.13 -2.74 -0.09 0.00 0.00 0.00 0.00 36.38 33.41 1mwt s VAL 449 CO 0.16 -0.69 1.23 0.20 0.00 0.00 0.00 175.10 176.00 1mwt s ASN 450 N 0.34 6.98 0.00 3.32 0.01 -1.26 -4.85 114.94 119.48 1mwt s ASN 450 Ca 0.14 2.45 0.00 0.00 -0.71 0.00 0.00 52.86 54.74 1mwt s ASN 450 Cb -0.22 -2.63 0.00 0.00 0.41 0.00 0.00 41.25 38.81 1mwt s ASN 450 CO -0.04 -0.40 0.00 0.61 -1.51 0.00 0.00 177.10 175.76 1mwt n GLY 451 N 1.42 0.64 3.73 0.66 0.00 -0.79 -5.02 105.19 105.83 1mwt n GLY 451 Ca 0.02 -2.01 -0.40 0.00 0.00 0.00 0.00 46.02 43.62 1mwt n GLY 451 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1mwt s ASN 452 N -4.00 7.08 -0.18 1.61 0.01 -1.26 -1.34 114.94 116.86 1mwt s ASN 452 Ca 0.00 1.30 0.01 0.00 -0.71 0.00 0.00 52.86 53.46 1mwt s ASN 452 Cb 0.00 -2.44 0.03 0.00 0.41 0.00 0.00 41.25 39.25 1mwt s ASN 452 CO 0.00 -0.08 -0.17 -0.63 -1.51 0.00 0.00 177.10 174.71 1mwt s ILE 453 N 0.51 1.92 0.00 0.60 -1.09 -0.22 -4.92 121.20 118.00 1mwt s ILE 453 Ca 0.39 -0.93 0.00 0.00 -2.23 0.00 0.00 60.65 57.88 1mwt s ILE 453 Cb -0.19 -1.79 0.00 0.00 -1.58 0.00 0.00 42.46 38.90 1mwt s ILE 453 CO 0.20 0.44 0.00 -0.90 -1.23 0.00 0.00 174.94 173.46 1mwt n ASP 454 N 4.65 0.00 -0.05 3.58 5.68 -1.26 -1.32 116.55 127.83 1mwt n ASP 454 Ca -0.19 -0.98 -0.12 0.00 -0.50 0.00 0.00 54.79 53.00 1mwt n ASP 454 Cb 0.49 0.00 -0.07 0.00 -1.14 0.00 0.00 41.12 40.40 1mwt n ASP 454 CO 0.00 0.00 0.00 0.25 -1.33 0.00 0.00 177.20 176.12 1mwt h LEU 455 N 0.00 0.29 -0.35 -2.12 5.85 -1.86 -2.28 115.31 114.84 1mwt h LEU 455 Ca 0.00 -0.41 0.08 0.00 0.84 0.00 0.00 57.88 58.38 1mwt h LEU 455 Cb 0.00 -0.08 -0.08 0.00 0.37 0.00 0.00 40.66 40.87 1mwt h LEU 455 CO 0.00 0.64 -0.26 0.50 -0.34 0.00 0.00 178.44 178.98 1mwt h LYS 456 N -0.06 -0.21 -0.69 1.25 3.64 -1.92 -0.25 116.57 118.33 1mwt h LYS 456 Ca 0.03 0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.36 1mwt h LYS 456 Cb 0.53 0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.37 1mwt h LYS 456 CO 0.02 -0.14 0.19 0.37 -2.27 0.00 0.00 179.45 177.62 1mwt h GLN 457 N -0.22 1.08 -0.68 1.90 5.75 -1.96 -1.58 115.11 119.40 1mwt h GLN 457 Ca 0.17 -0.24 -0.05 0.00 -0.15 0.00 0.00 58.65 58.38 1mwt h GLN 457 Cb 0.49 -0.15 -0.03 0.00 1.07 0.00 0.00 27.48 28.86 1mwt h GLN 457 CO -0.48 0.94 0.22 0.00 -2.65 0.00 0.00 178.83 176.87 1mwt h ALA 458 N 1.17 1.12 -0.15 3.38 0.00 -0.76 -1.62 119.26 122.39 1mwt h ALA 458 Ca 0.22 -0.20 -0.13 0.00 0.00 0.00 0.00 54.91 54.80 1mwt h ALA 458 Cb 0.33 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1mwt h ALA 458 CO -0.00 0.61 -0.40 0.82 0.00 0.00 0.00 179.25 180.28 1mwt h ILE 459 N 1.00 1.35 -0.07 0.00 2.04 -0.85 0.22 117.51 121.20 1mwt h ILE 459 Ca 0.22 -1.67 0.03 0.00 1.00 0.00 0.00 64.86 64.44 1mwt h ILE 459 Cb 0.26 2.03 -0.03 0.00 -0.74 0.00 0.00 36.82 38.34 1mwt h ILE 459 CO -0.01 0.51 -0.10 -0.08 0.00 0.00 0.00 178.15 178.47 1mwt h GLU 460 N 0.16 -0.13 -0.39 2.37 4.81 -1.00 -2.63 114.58 117.76 1mwt h GLU 460 Ca -0.01 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1mwt h GLU 460 Cb 1.01 0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.42 1mwt h GLU 460 CO 0.09 -0.09 0.00 -1.13 -0.73 0.00 0.00 179.01 177.15 1mwt n SER 461 N -5.23 3.08 -3.54 1.04 3.41 -0.64 -4.59 113.62 107.16 1mwt n SER 461 Ca -0.04 -1.94 -0.19 0.00 -0.26 0.00 0.00 58.87 56.43 1mwt n SER 461 Cb 0.15 -0.25 0.01 0.00 -0.26 0.00 0.00 64.21 63.86 1mwt n SER 461 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1mwt n SER 462 N 1.23 -5.89 -4.60 4.04 2.88 0.49 -4.67 113.62 107.10 1mwt n SER 462 Ca 0.19 -0.71 -0.43 0.00 -1.33 0.00 0.00 58.87 56.59 1mwt n SER 462 Cb 0.54 -3.26 -0.02 0.00 -0.75 0.00 0.00 64.21 60.71 1mwt n SER 462 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1mwt s ASP 463 N -3.13 6.52 0.15 -3.46 2.15 0.34 -4.75 116.67 114.49 1mwt s ASP 463 Ca 0.14 0.61 -0.16 0.00 0.43 0.00 0.00 52.55 53.56 1mwt s ASP 463 Cb -0.05 -2.55 0.01 0.00 -0.30 0.00 0.00 42.92 40.04 1mwt s ASP 463 CO 0.84 -1.32 1.81 0.78 -0.17 0.00 0.00 175.17 177.11 1mwt h ASN 464 N 9.79 0.47 -0.19 -0.34 2.35 -1.89 -2.99 115.58 122.77 1mwt h ASN 464 Ca -0.25 -0.02 0.01 0.00 -0.55 0.00 0.00 56.30 55.49 1mwt h ASN 464 Cb 1.08 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 39.31 1mwt h ASN 464 CO 1.11 0.35 0.10 0.40 -1.65 0.00 0.00 177.43 177.75 1mwt h ILE 465 N 0.55 1.01 -0.21 2.81 2.04 -1.86 -0.39 117.51 121.46 1mwt h ILE 465 Ca 0.15 -0.07 0.06 0.00 1.00 0.00 0.00 64.86 65.99 1mwt h ILE 465 Cb -0.05 0.77 -0.06 0.00 -0.74 0.00 0.00 36.82 36.74 1mwt h ILE 465 CO -0.03 0.04 -0.20 0.15 0.00 0.00 0.00 178.15 178.11 1mwt h PHE 466 N 0.22 -0.50 0.00 1.37 3.57 -1.96 0.84 116.94 120.47 1mwt h PHE 466 Ca 0.08 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.61 1mwt h PHE 466 Cb 0.01 0.26 -0.00 0.00 2.79 0.00 0.00 35.95 39.00 1mwt h PHE 466 CO -0.09 -0.27 -0.01 0.74 -2.23 0.00 0.00 178.31 176.45 1mwt h PHE 467 N -0.21 0.00 -0.36 0.41 -1.00 -1.38 -1.53 116.94 112.87 1mwt h PHE 467 Ca 0.13 0.00 -0.15 0.00 2.81 0.00 0.00 57.97 60.76 1mwt h PHE 467 Cb 0.40 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.95 1mwt h PHE 467 CO -0.34 0.01 -0.36 0.00 -1.61 0.00 0.00 178.31 176.01 1mwt h ALA 468 N 1.99 0.68 -0.35 2.45 0.00 0.73 -2.68 119.26 122.09 1mwt h ALA 468 Ca -0.00 -0.44 -0.04 0.00 0.00 0.00 0.00 54.91 54.43 1mwt h ALA 468 Cb 0.53 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1mwt h ALA 468 CO 0.00 0.67 0.04 0.00 0.00 0.00 0.00 179.25 179.96 1mwt h ARG 469 N 0.70 0.58 -0.68 0.00 2.47 0.04 -1.93 114.38 115.57 1mwt h ARG 469 Ca 0.07 -0.16 0.08 0.00 -1.26 0.00 0.00 59.98 58.71 1mwt h ARG 469 Cb 0.92 -0.06 -0.07 0.00 -1.65 0.00 0.00 29.97 29.11 1mwt h ARG 469 CO 0.08 0.67 0.33 0.28 0.56 0.00 0.00 179.97 181.90 1mwt h VAL 470 N 0.41 0.87 -0.01 2.04 2.07 -1.26 -0.38 116.25 119.98 1mwt h VAL 470 Ca 0.10 -0.20 -0.00 0.00 0.82 0.00 0.00 66.70 67.42 1mwt h VAL 470 Cb 0.38 0.23 -0.00 0.00 -1.52 0.00 0.00 31.29 30.38 1mwt h VAL 470 CO 0.01 0.11 0.00 0.00 0.02 0.00 0.00 177.57 177.71 1mwt h ALA 471 N 1.40 0.02 -0.55 1.67 0.00 -1.33 -1.03 119.26 119.44 1mwt h ALA 471 Ca 0.33 -0.11 0.06 0.00 0.00 0.00 0.00 54.91 55.18 1mwt h ALA 471 Cb 0.32 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.05 1mwt h ALA 471 CO -0.25 -0.37 0.26 -0.07 0.00 0.00 0.00 179.25 178.82 1mwt h LEU 472 N -0.20 0.34 -0.61 0.00 3.38 -0.84 -1.51 115.31 115.86 1mwt h LEU 472 Ca 0.00 0.04 -0.08 0.00 0.09 0.00 0.00 57.88 57.94 1mwt h LEU 472 Cb 0.23 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 1mwt h LEU 472 CO 0.00 0.22 0.07 -0.33 0.09 0.00 0.00 178.44 178.49 1mwt h GLU 473 N 0.48 1.03 -0.37 1.13 5.08 -1.04 -3.08 114.58 117.82 1mwt h GLU 473 Ca 0.25 -0.29 0.07 0.00 -1.00 0.00 0.00 59.36 58.39 1mwt h GLU 473 Cb 0.21 -0.11 -0.07 0.00 0.50 0.00 0.00 28.75 29.29 1mwt h GLU 473 CO -0.20 0.98 -0.05 -0.07 -1.00 0.00 0.00 179.01 178.67 1mwt h LEU 474 N 0.94 -0.25 0.00 1.33 3.38 -0.35 -3.49 115.31 116.87 1mwt h LEU 474 Ca 0.18 0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.25 1mwt h LEU 474 Cb 0.47 0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.41 1mwt h LEU 474 CO 0.02 -0.09 0.00 0.61 0.09 0.00 0.00 178.44 179.07 1mwt n GLY 475 N -1.27 1.40 0.49 0.83 0.00 -0.65 -4.29 105.19 101.70 1mwt n GLY 475 Ca 0.02 -1.42 0.31 0.00 0.00 0.00 0.00 46.02 44.93 1mwt n GLY 475 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1mwt h SER 476 N 0.00 0.15 0.03 1.61 4.64 -1.82 -0.76 113.55 117.41 1mwt h SER 476 Ca 0.00 0.03 -0.00 0.00 -0.47 0.00 0.00 61.79 61.35 1mwt h SER 476 Cb 0.00 0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 1mwt h SER 476 CO 0.00 0.02 -0.02 0.50 -0.87 0.00 0.00 176.83 176.47 1mwt h LYS 477 N 0.13 -0.04 0.00 4.77 3.64 -1.90 -2.56 116.57 120.61 1mwt h LYS 477 Ca 0.58 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.96 1mwt h LYS 477 Cb 2.01 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.84 1mwt h LYS 477 CO -0.11 0.53 0.00 0.87 -2.27 0.00 0.00 179.45 178.46 1mwt h LYS 478 N -0.65 0.00 0.27 1.90 1.57 -1.51 -2.04 116.57 116.11 1mwt h LYS 478 Ca -0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 1mwt h LYS 478 Cb 0.59 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.90 1mwt h LYS 478 CO 0.01 0.00 -0.13 0.35 -0.57 0.00 0.00 179.45 179.11 1mwt h PHE 479 N 0.00 -0.34 -0.96 -1.35 3.57 -1.14 0.51 116.94 117.22 1mwt h PHE 479 Ca 0.00 -0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.59 1mwt h PHE 479 Cb 0.42 0.11 -0.07 0.00 2.79 0.00 0.00 35.95 39.20 1mwt h PHE 479 CO 0.00 -0.10 0.62 0.93 -2.23 0.00 0.00 178.31 177.53 1mwt h GLU 480 N -1.04 0.97 -0.40 1.11 5.08 -1.40 0.24 114.58 119.14 1mwt h GLU 480 Ca -0.04 -0.06 -0.10 0.00 -1.00 0.00 0.00 59.36 58.16 1mwt h GLU 480 Cb 0.40 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.41 1mwt h GLU 480 CO 0.06 0.64 -0.17 0.87 -1.00 0.00 0.00 179.01 179.42 1mwt h LYS 481 N 1.00 0.76 -0.33 2.33 1.57 -1.41 -1.15 116.57 119.34 1mwt h LYS 481 Ca 0.45 -0.28 -0.05 0.00 -1.87 0.00 0.00 60.65 58.91 1mwt h LYS 481 Cb 0.38 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.62 1mwt h LYS 481 CO -0.21 0.88 0.02 0.78 -0.57 0.00 0.00 179.45 180.35 1mwt h GLY 482 N 0.97 0.61 0.83 3.86 0.00 0.14 -1.49 103.07 108.00 1mwt h GLY 482 Ca 0.11 -0.43 -0.01 0.00 0.00 0.00 0.00 47.33 47.00 1mwt h GLY 482 CO 0.05 0.40 -0.06 -0.33 0.00 0.00 0.00 176.54 176.60 1mwt h MET 483 N 0.38 -0.16 0.00 4.80 2.86 -0.51 -1.76 114.93 120.54 1mwt h MET 483 Ca 0.10 0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.73 1mwt h MET 483 Cb 0.41 0.04 -0.00 0.00 0.06 0.00 0.00 31.60 32.11 1mwt h MET 483 CO 0.01 0.03 -0.07 0.87 1.06 0.00 0.00 176.91 178.82 1mwt h LYS 484 N -0.34 0.00 -0.03 1.72 1.57 -1.24 0.24 116.57 118.49 1mwt h LYS 484 Ca -0.02 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.67 1mwt h LYS 484 Cb 0.27 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.57 1mwt h LYS 484 CO 0.03 0.07 -0.41 -0.22 -0.57 0.00 0.00 179.45 178.34 1mwt h LYS 485 N 0.00 0.07 0.00 3.15 3.64 -0.96 -0.30 116.57 122.16 1mwt h LYS 485 Ca -0.00 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1mwt h LYS 485 Cb 0.12 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.94 1mwt h LYS 485 CO 0.01 0.47 0.00 1.28 -2.27 0.00 0.00 179.45 178.94 1mwt n LEU 486 N -4.04 0.79 0.00 5.20 4.77 0.72 -4.91 117.00 119.53 1mwt n LEU 486 Ca -0.02 0.59 0.00 0.00 -0.03 0.00 0.00 56.01 56.55 1mwt n LEU 486 Cb 0.45 -0.35 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 1mwt n LEU 486 CO 0.40 -0.23 0.00 0.61 -1.33 0.00 0.00 177.39 176.84 1mwt n GLY 487 N 1.14 0.59 3.66 -0.72 0.00 -0.12 -4.93 105.19 104.81 1mwt n GLY 487 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 1mwt n GLY 487 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1mwt s VAL 488 N -2.00 3.65 0.00 1.61 1.01 -0.62 -2.50 120.40 121.55 1mwt s VAL 488 Ca 0.00 0.78 0.00 0.00 0.00 0.00 0.00 61.98 62.76 1mwt s VAL 488 Cb 0.00 -3.53 0.00 0.00 0.00 0.00 0.00 36.38 32.85 1mwt s VAL 488 CO 0.00 -0.10 0.00 0.61 0.00 0.00 0.00 175.10 175.61 1mwt n GLY 489 N 4.16 1.77 3.85 4.51 0.00 -1.25 -4.07 105.19 114.18 1mwt n GLY 489 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 1mwt n GLY 489 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1mwt s GLU 490 N -0.12 0.93 0.21 1.61 2.02 -1.04 -4.66 118.70 117.65 1mwt s GLU 490 Ca 0.00 -0.07 -0.30 0.00 0.02 0.00 0.00 54.97 54.63 1mwt s GLU 490 Cb 0.00 -1.85 -0.08 0.00 0.10 0.00 0.00 34.13 32.30 1mwt s GLU 490 CO 0.00 -2.27 1.06 -0.51 0.02 0.00 0.00 175.26 173.56 1mwt s ASP 491 N -4.50 7.34 -0.42 -0.19 1.01 -1.26 -4.58 116.67 114.08 1mwt s ASP 491 Ca 0.68 2.09 -0.28 0.00 0.71 0.00 0.00 52.55 55.75 1mwt s ASP 491 Cb -0.09 -2.61 0.02 0.00 1.01 0.00 0.00 42.92 41.25 1mwt s ASP 491 CO 0.52 -0.13 1.04 -0.63 0.21 0.00 0.00 175.17 176.18 1mwt s ILE 492 N -0.59 4.40 -0.61 0.77 1.01 -1.26 -4.92 121.20 119.99 1mwt s ILE 492 Ca 0.47 1.25 -0.11 0.00 0.00 0.00 0.00 60.65 62.26 1mwt s ILE 492 Cb -0.29 -4.48 -0.10 0.00 0.01 0.00 0.00 42.46 37.61 1mwt s ILE 492 CO 0.36 -0.76 1.79 -0.81 0.00 0.00 0.00 174.94 175.52 1mwt n PRO 493 N 7.29 1.33 -4.07 2.79 -0.04 -1.26 -4.85 135.00 136.18 1mwt n PRO 493 Ca 0.10 -1.32 -0.24 0.00 -0.04 0.00 0.00 63.50 62.00 1mwt n PRO 493 Cb 0.48 -2.48 -0.07 0.00 -0.04 0.00 0.00 33.50 31.39 1mwt n PRO 493 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1mwt s SER 494 N 4.45 4.49 -0.14 3.54 0.15 -1.25 -4.32 113.70 120.60 1mwt s SER 494 Ca 0.39 -1.04 0.17 0.00 0.70 0.00 0.00 55.95 56.16 1mwt s SER 494 Cb 0.10 -0.49 0.73 0.00 -1.71 0.00 0.00 66.02 64.65 1mwt s SER 494 CO 0.05 -0.55 1.64 -0.90 1.20 0.00 0.00 173.24 174.67 1mwt n ASP 495 N -1.27 4.93 -3.79 5.45 3.85 -1.26 -4.85 116.55 119.62 1mwt n ASP 495 Ca -0.01 -2.56 -0.13 0.00 -0.71 0.00 0.00 54.79 51.38 1mwt n ASP 495 Cb 0.64 -0.61 -0.11 0.00 -1.35 0.00 0.00 41.12 39.70 1mwt n ASP 495 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.20 175.72 1mwt s TYR 496 N -2.08 -0.21 -0.19 2.11 6.14 -1.26 -4.87 117.35 116.98 1mwt s TYR 496 Ca 0.51 0.48 -0.29 0.00 0.64 0.00 0.00 57.07 58.41 1mwt s TYR 496 Cb 0.34 0.07 -0.04 0.00 0.42 0.00 0.00 41.96 42.76 1mwt s TYR 496 CO 0.22 -0.21 1.80 -2.14 0.64 0.00 0.00 175.55 175.86 1mwt s PRO 497 N -0.39 3.67 -0.11 4.97 0.02 -1.26 -5.02 135.00 136.88 1mwt s PRO 497 Ca -0.05 1.85 0.02 0.00 0.02 0.00 0.00 61.00 62.84 1mwt s PRO 497 Cb -0.03 -4.14 0.01 0.00 0.02 0.00 0.00 34.50 30.36 1mwt s PRO 497 CO 0.01 -1.46 -0.17 -0.06 -0.33 0.00 0.00 177.00 175.00 1mwt s PHE 498 N 5.86 2.07 0.15 6.54 0.40 -1.26 -4.91 117.98 126.84 1mwt s PHE 498 Ca 0.80 -0.96 -0.32 0.00 -0.60 0.00 0.00 56.93 55.86 1mwt s PHE 498 Cb -0.29 -1.47 -0.12 0.00 0.51 0.00 0.00 43.02 41.66 1mwt s PHE 498 CO 0.33 -0.47 1.76 0.66 0.70 0.00 0.00 175.22 178.20 1mwt n TYR 499 N 4.08 2.62 -1.74 0.36 4.02 -0.86 -4.68 117.16 120.95 1mwt n TYR 499 Ca -0.20 -0.02 -0.38 0.00 -0.01 0.00 0.00 57.90 57.30 1mwt n TYR 499 Cb 0.51 -2.68 0.05 0.00 -0.02 0.00 0.00 39.34 37.21 1mwt n TYR 499 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 176.86 175.05 1mwt s ASN 500 N 1.92 4.94 0.60 7.72 -0.87 -1.26 -4.54 114.94 123.45 1mwt s ASN 500 Ca 0.79 2.73 0.02 0.00 -1.57 0.00 0.00 52.86 54.83 1mwt s ASN 500 Cb -0.52 -2.63 0.07 0.00 -0.02 0.00 0.00 41.25 38.14 1mwt s ASN 500 CO 0.36 -1.79 0.83 0.00 -2.57 0.00 0.00 177.10 173.93 1mwt s ALA 501 N -1.33 3.94 0.01 0.60 0.00 -1.26 -4.87 121.76 118.84 1mwt s ALA 501 Ca 0.77 -1.54 0.01 0.00 0.00 0.00 0.00 51.96 51.20 1mwt s ALA 501 Cb -0.40 -1.98 -0.01 0.00 0.00 0.00 0.00 23.12 20.73 1mwt s ALA 501 CO 0.45 -0.95 -0.05 1.14 0.00 0.00 0.00 175.76 176.35 1mwt s GLN 502 N -4.85 0.36 0.12 0.00 -2.07 -0.73 -3.79 119.66 108.69 1mwt s GLN 502 Ca 0.60 -0.27 0.10 0.00 -1.82 0.00 0.00 55.36 53.97 1mwt s GLN 502 Cb -0.08 -0.29 -0.16 0.00 -1.09 0.00 0.00 33.01 31.38 1mwt s GLN 502 CO 0.40 0.07 1.18 0.82 -1.32 0.00 0.00 175.29 176.44 1mwt h ILE 503 N 4.93 1.37 -2.21 3.63 2.04 -1.86 -2.29 117.51 123.13 1mwt h ILE 503 Ca -0.29 -3.03 0.20 0.00 1.00 0.00 0.00 64.86 62.74 1mwt h ILE 503 Cb 1.20 2.66 -0.08 0.00 -0.74 0.00 0.00 36.82 39.86 1mwt h ILE 503 CO 0.48 0.78 0.56 -0.94 0.00 0.00 0.00 178.15 179.04 1mwt s SER 504 N -6.52 -0.13 -0.01 1.72 1.04 -1.26 -3.53 113.70 105.02 1mwt s SER 504 Ca 0.00 -0.40 -0.24 0.00 0.48 0.00 0.00 55.95 55.79 1mwt s SER 504 Cb 0.09 0.43 -0.17 0.00 0.10 0.00 0.00 66.02 66.47 1mwt s SER 504 CO 0.81 -0.81 1.16 0.78 0.98 0.00 0.00 173.24 176.16 1mwt h ASN 505 N 2.00 -0.26 0.00 7.02 2.35 -1.94 -3.44 115.58 121.31 1mwt h ASN 505 Ca -0.26 -0.25 0.00 0.00 -0.55 0.00 0.00 56.30 55.24 1mwt h ASN 505 Cb 1.22 0.07 0.00 0.00 0.05 0.00 0.00 38.32 39.66 1mwt h ASN 505 CO 0.28 0.16 0.00 1.17 -1.65 0.00 0.00 177.43 177.39 1mwt n LYS 506 N -5.04 0.00 -2.07 0.81 4.81 -1.26 -5.15 118.16 110.26 1mwt n LYS 506 Ca -0.09 0.00 -0.04 0.00 -0.87 0.00 0.00 58.31 57.32 1mwt n LYS 506 Cb 0.26 -0.07 -0.00 0.00 0.02 0.00 0.00 35.03 35.24 1mwt n LYS 506 CO 0.00 0.00 0.00 0.27 1.17 0.00 0.00 177.40 178.84 1mwt n ASN 507 N -1.61 -0.48 -1.21 3.14 0.23 -1.26 -5.07 115.26 109.00 1mwt n ASN 507 Ca 0.00 -1.50 -0.04 0.00 -0.53 0.00 0.00 54.58 52.51 1mwt n ASN 507 Cb 0.00 0.85 0.21 0.00 -2.08 0.00 0.00 39.78 38.76 1mwt n ASN 507 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 1mwt n LEU 508 N 0.00 4.30 -0.08 -4.53 4.77 -1.26 -4.71 117.00 115.49 1mwt n LEU 508 Ca -0.01 -3.65 -0.08 0.00 -0.03 0.00 0.00 56.01 52.25 1mwt n LEU 508 Cb 0.17 -0.64 -0.00 0.00 -2.33 0.00 0.00 43.42 40.61 1mwt n LEU 508 CO 0.08 1.16 0.93 0.44 -1.33 0.00 0.00 177.39 178.67 1mwt h ASP 509 N 1.12 0.12 -2.58 -1.43 3.45 -1.97 -3.41 116.42 111.72 1mwt h ASP 509 Ca 0.22 0.03 -0.53 0.00 0.43 0.00 0.00 57.03 57.18 1mwt h ASP 509 Cb 1.72 0.01 0.02 0.00 -0.56 0.00 0.00 39.33 40.53 1mwt h ASP 509 CO 0.42 0.11 1.08 0.21 -1.57 0.00 0.00 179.24 179.49 1mwt s ASN 510 N -5.34 6.55 0.49 6.45 3.84 -1.26 -4.89 114.94 120.78 1mwt s ASN 510 Ca -0.13 2.52 0.24 0.00 0.21 0.00 0.00 52.86 55.71 1mwt s ASN 510 Cb 0.11 -2.55 1.25 0.00 -0.55 0.00 0.00 41.25 39.51 1mwt s ASN 510 CO 0.70 -0.95 2.00 -0.33 -2.79 0.00 0.00 177.10 175.73 1mwt h GLU 511 N 9.04 0.00 0.08 0.43 5.08 -1.99 -2.14 114.58 125.09 1mwt h GLU 511 Ca -0.44 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 57.92 1mwt h GLU 511 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 1mwt h GLU 511 CO 0.94 0.17 -0.04 0.82 -1.00 0.00 0.00 179.01 179.90 1mwt h ILE 512 N 0.00 1.16 -0.77 3.13 2.04 -1.94 -0.60 117.51 120.53 1mwt h ILE 512 Ca -0.00 -1.38 0.15 0.00 1.00 0.00 0.00 64.86 64.63 1mwt h ILE 512 Cb 0.44 1.98 -0.05 0.00 -0.74 0.00 0.00 36.82 38.45 1mwt h ILE 512 CO 0.02 0.31 0.51 0.25 0.00 0.00 0.00 178.15 179.25 1mwt h LEU 513 N -0.79 0.42 -0.74 1.44 7.12 -1.92 0.49 115.31 121.32 1mwt h LEU 513 Ca -0.01 0.02 -0.13 0.00 0.13 0.00 0.00 57.88 57.89 1mwt h LEU 513 Cb 0.60 -0.06 -0.02 0.00 -0.53 0.00 0.00 40.66 40.65 1mwt h LEU 513 CO 0.02 0.21 -0.60 0.25 -0.13 0.00 0.00 178.44 178.20 1mwt h LEU 514 N 0.44 0.12 0.12 2.25 7.12 -1.31 -1.97 115.31 122.08 1mwt h LEU 514 Ca 0.38 -0.07 -0.01 0.00 0.13 0.00 0.00 57.88 58.32 1mwt h LEU 514 Cb 0.85 -0.04 0.00 0.00 -0.53 0.00 0.00 40.66 40.94 1mwt h LEU 514 CO -0.13 0.69 -0.06 0.00 -0.13 0.00 0.00 178.44 178.81 1mwt h ALA 515 N 1.31 -0.16 -0.66 1.25 0.00 0.16 -3.08 119.26 118.07 1mwt h ALA 515 Ca -0.01 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 1mwt h ALA 515 Cb 1.07 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.90 1mwt h ALA 515 CO 0.08 -0.41 0.30 -0.44 0.00 0.00 0.00 179.25 178.78 1mwt h ASP 516 N -0.52 0.89 -0.75 0.00 3.32 -1.23 -2.51 116.42 115.61 1mwt h ASP 516 Ca -0.02 -0.15 0.16 0.00 0.02 0.00 0.00 57.03 57.04 1mwt h ASP 516 Cb 0.42 -0.23 -0.05 0.00 0.22 0.00 0.00 39.33 39.69 1mwt h ASP 516 CO 0.03 0.79 0.51 0.28 -1.72 0.00 0.00 179.24 179.13 1mwt h SER 517 N 0.93 0.35 -0.62 6.45 0.02 -1.39 0.20 113.55 119.48 1mwt h SER 517 Ca 0.22 0.02 0.15 0.00 -0.84 0.00 0.00 61.79 61.35 1mwt h SER 517 Cb 0.16 -0.05 -0.03 0.00 0.14 0.00 0.00 62.40 62.62 1mwt h SER 517 CO -0.02 0.18 0.43 1.23 -1.14 0.00 0.00 176.83 177.50 1mwt h GLY 518 N 0.37 0.27 -0.43 -3.77 0.00 -1.35 -2.49 103.07 95.66 1mwt h GLY 518 Ca 0.37 -0.07 -0.01 0.00 0.00 0.00 0.00 47.33 47.63 1mwt h GLY 518 CO -0.11 0.03 -0.20 1.58 0.00 0.00 0.00 176.54 177.83 1mwt n TYR 519 N -4.41 0.00 -1.83 5.60 0.18 -0.01 -4.23 117.16 112.46 1mwt n TYR 519 Ca 0.12 -1.04 -0.04 0.00 1.88 0.00 0.00 57.90 58.81 1mwt n TYR 519 Cb 0.58 -0.17 -0.01 0.00 -0.38 0.00 0.00 39.34 39.37 1mwt n TYR 519 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1mwt n GLY 520 N -1.19 0.33 1.04 -7.48 0.00 -0.83 -4.72 105.19 92.34 1mwt n GLY 520 Ca 0.15 -0.76 0.01 0.00 0.00 0.00 0.00 46.02 45.43 1mwt n GLY 520 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1mwt n GLN 521 N -1.78 1.65 0.00 1.61 6.02 -0.81 -3.43 117.38 120.64 1mwt n GLN 521 Ca -0.05 -3.24 0.00 0.00 -0.01 0.00 0.00 57.00 53.70 1mwt n GLN 521 Cb 0.43 -1.46 0.00 0.00 1.02 0.00 0.00 30.24 30.23 1mwt n GLN 521 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1mwt n GLY 522 N -0.78 1.13 0.07 1.08 0.00 -1.26 -4.69 105.19 100.75 1mwt n GLY 522 Ca 0.20 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.24 1mwt n GLY 522 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1mwt n GLU 523 N 0.00 2.82 -2.17 1.61 1.02 -1.26 -4.98 120.64 117.68 1mwt n GLU 523 Ca 0.00 -1.67 -0.42 0.00 -0.02 0.00 0.00 57.16 55.05 1mwt n GLU 523 Cb 0.00 -1.08 -0.03 0.00 -0.02 0.00 0.00 31.44 30.31 1mwt n GLU 523 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1mwt s ILE 524 N -1.21 3.13 -0.06 -3.67 1.01 -1.23 -4.08 121.20 115.10 1mwt s ILE 524 Ca 0.06 0.90 -0.01 0.00 0.00 0.00 0.00 60.65 61.60 1mwt s ILE 524 Cb 0.04 -3.58 0.03 0.00 0.01 0.00 0.00 42.46 38.96 1mwt s ILE 524 CO 0.02 0.12 -0.00 -0.76 0.00 0.00 0.00 174.94 174.31 1mwt s LEU 525 N 0.16 0.78 0.04 2.97 1.43 -0.86 -4.23 118.68 118.97 1mwt s LEU 525 Ca 0.59 -0.07 0.01 0.00 -1.03 0.00 0.00 54.13 53.63 1mwt s LEU 525 Cb -0.38 -0.39 -0.03 0.00 0.03 0.00 0.00 46.19 45.43 1mwt s LEU 525 CO 0.37 -0.16 -0.06 -0.63 0.23 0.00 0.00 176.35 176.11 1mwt s ILE 526 N 1.64 0.37 0.29 -0.59 1.01 0.11 -1.78 121.20 122.25 1mwt s ILE 526 Ca -0.00 -1.16 -0.18 0.00 0.00 0.00 0.00 60.65 59.31 1mwt s ILE 526 Cb -0.13 -0.66 -0.09 0.00 0.01 0.00 0.00 42.46 41.60 1mwt s ILE 526 CO -0.04 -0.52 0.77 0.21 0.00 0.00 0.00 174.94 175.36 1mwt s ASN 527 N -1.78 6.95 0.23 3.58 3.84 -1.26 -0.23 114.94 126.27 1mwt s ASN 527 Ca -0.09 1.42 -0.06 0.00 0.21 0.00 0.00 52.86 54.34 1mwt s ASN 527 Cb -0.07 -2.42 0.41 0.00 -0.55 0.00 0.00 41.25 38.61 1mwt s ASN 527 CO -0.01 -0.11 1.69 -0.65 -2.79 0.00 0.00 177.10 175.23 1mwt h PRO 528 N 2.77 0.27 -0.62 0.43 0.11 -1.83 -1.90 132.00 131.23 1mwt h PRO 528 Ca -0.48 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.58 1mwt h PRO 528 Cb 1.18 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 32.20 1mwt h PRO 528 CO 0.65 0.18 0.23 0.28 -0.21 0.00 0.00 178.00 179.13 1mwt h VAL 529 N 0.28 1.22 -0.38 3.15 2.07 -1.94 -0.23 116.25 120.42 1mwt h VAL 529 Ca 0.38 -0.72 -0.07 0.00 0.82 0.00 0.00 66.70 67.12 1mwt h VAL 529 Cb 0.62 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 30.88 1mwt h VAL 529 CO -0.47 0.28 -0.03 -0.61 0.02 0.00 0.00 177.57 176.76 1mwt h GLN 530 N 0.90 0.70 -0.30 1.57 4.15 -1.76 0.15 115.11 120.52 1mwt h GLN 530 Ca 0.21 -0.24 0.03 0.00 0.77 0.00 0.00 58.65 59.42 1mwt h GLN 530 Cb 0.20 -0.06 -0.03 0.00 0.21 0.00 0.00 27.48 27.80 1mwt h GLN 530 CO -0.02 0.81 0.11 0.82 -1.93 0.00 0.00 178.83 178.62 1mwt h ILE 531 N 0.51 0.92 -0.87 2.39 2.04 -0.94 -0.49 117.51 121.08 1mwt h ILE 531 Ca 0.11 -0.08 0.00 0.00 1.00 0.00 0.00 64.86 65.89 1mwt h ILE 531 Cb 0.52 0.66 -0.04 0.00 -0.74 0.00 0.00 36.82 37.22 1mwt h ILE 531 CO 0.03 0.04 0.56 -0.07 0.00 0.00 0.00 178.15 178.71 1mwt h LEU 532 N 0.24 1.01 -0.55 1.44 3.38 -0.76 -1.33 115.31 118.74 1mwt h LEU 532 Ca 0.13 -0.04 0.04 0.00 0.09 0.00 0.00 57.88 58.10 1mwt h LEU 532 Cb 0.10 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.55 1mwt h LEU 532 CO -0.13 0.75 0.31 0.28 0.09 0.00 0.00 178.44 179.73 1mwt h SER 533 N 1.19 0.47 -0.47 -0.43 0.02 0.44 -0.57 113.55 114.21 1mwt h SER 533 Ca 0.32 0.02 -0.13 0.00 -0.84 0.00 0.00 61.79 61.16 1mwt h SER 533 Cb -0.11 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.34 1mwt h SER 533 CO -0.07 0.33 -0.21 0.40 -1.14 0.00 0.00 176.83 176.14 1mwt h ILE 534 N 0.60 1.27 0.00 3.27 2.04 -0.48 -2.62 117.51 121.59 1mwt h ILE 534 Ca 0.23 -1.37 -0.03 0.00 1.00 0.00 0.00 64.86 64.69 1mwt h ILE 534 Cb 0.09 1.16 -0.00 0.00 -0.74 0.00 0.00 36.82 37.32 1mwt h ILE 534 CO -0.13 0.47 -0.14 1.88 0.00 0.00 0.00 178.15 180.23 1mwt h TYR 535 N 0.81 0.00 -0.21 1.37 -1.99 -0.95 -2.85 116.97 113.15 1mwt h TYR 535 Ca 0.11 0.00 0.03 0.00 2.00 0.00 0.00 58.73 60.87 1mwt h TYR 535 Cb 0.79 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.51 1mwt h TYR 535 CO 0.05 0.14 0.15 0.77 -0.00 0.00 0.00 178.16 179.27 1mwt h SER 536 N 0.00 0.13 -0.43 3.88 0.02 -0.70 -1.74 113.55 114.71 1mwt h SER 536 Ca -0.00 -0.00 0.12 0.00 -0.84 0.00 0.00 61.79 61.07 1mwt h SER 536 Cb 0.46 -0.03 -0.02 0.00 0.14 0.00 0.00 62.40 62.95 1mwt h SER 536 CO 0.02 0.09 0.37 0.00 -1.14 0.00 0.00 176.83 176.17 1mwt h ALA 537 N 1.88 2.25 0.00 3.77 0.00 -1.59 0.39 119.26 125.96 1mwt h ALA 537 Ca 0.09 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1mwt h ALA 537 Cb 0.17 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 1mwt h ALA 537 CO -0.01 -0.59 -0.06 -0.07 0.00 0.00 0.00 179.25 178.52 1mwt h LEU 538 N 0.00 0.00 -2.95 0.00 3.38 -1.53 -1.28 115.31 112.93 1mwt h LEU 538 Ca 0.20 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.17 1mwt h LEU 538 Cb 0.93 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.67 1mwt h LEU 538 CO -0.00 0.06 -0.26 -0.62 0.09 0.00 0.00 178.44 177.71 1mwt n GLU 539 N -3.96 1.28 -2.36 1.13 -0.58 0.13 -4.65 120.64 111.62 1mwt n GLU 539 Ca -0.03 -2.75 -0.01 0.00 -0.42 0.00 0.00 57.16 53.95 1mwt n GLU 539 Cb 0.15 -1.43 0.05 0.00 -0.57 0.00 0.00 31.44 29.64 1mwt n GLU 539 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1mwt n ASN 540 N -1.16 1.73 -3.87 1.62 4.05 -0.77 -4.29 115.26 112.57 1mwt n ASN 540 Ca 0.16 -2.23 -0.24 0.00 0.45 0.00 0.00 54.58 52.71 1mwt n ASN 540 Cb 0.68 -0.42 -0.00 0.00 1.23 0.00 0.00 39.78 41.27 1mwt n ASN 540 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 177.26 174.80 1mwt n ASN 541 N -0.36 -0.80 0.00 1.20 3.02 -1.24 -1.15 115.26 115.93 1mwt n ASN 541 Ca 0.10 -0.93 0.00 0.00 -0.03 0.00 0.00 54.58 53.72 1mwt n ASN 541 Cb 0.90 -3.43 0.00 0.00 -0.61 0.00 0.00 39.78 36.64 1mwt n ASN 541 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1mwt n GLY 542 N -1.82 0.85 3.92 7.41 0.00 -0.52 -4.84 105.19 110.19 1mwt n GLY 542 Ca -0.29 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.47 1mwt n GLY 542 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1mwt s ASN 543 N -2.71 6.18 -0.23 1.61 0.01 -0.30 -0.37 114.94 119.13 1mwt s ASN 543 Ca 0.00 0.11 -0.02 0.00 -0.71 0.00 0.00 52.86 52.23 1mwt s ASN 543 Cb 0.00 -1.81 0.01 0.00 0.41 0.00 0.00 41.25 39.86 1mwt s ASN 543 CO 0.00 0.05 -0.07 -0.63 -1.51 0.00 0.00 177.10 174.94 1mwt s ILE 544 N -1.76 2.95 0.31 0.60 1.01 0.61 -3.81 121.20 121.10 1mwt s ILE 544 Ca 0.34 -0.81 -0.12 0.00 0.00 0.00 0.00 60.65 60.06 1mwt s ILE 544 Cb -0.11 -2.41 -0.08 0.00 0.01 0.00 0.00 42.46 39.88 1mwt s ILE 544 CO 0.28 0.33 0.67 0.20 0.00 0.00 0.00 174.94 176.42 1mwt s ASN 545 N 1.38 6.66 0.24 3.58 -0.87 -1.26 0.34 114.94 125.02 1mwt s ASN 545 Ca 0.03 1.11 -0.30 0.00 -1.57 0.00 0.00 52.86 52.13 1mwt s ASN 545 Cb -0.15 -2.30 -0.09 0.00 -0.02 0.00 0.00 41.25 38.68 1mwt s ASN 545 CO -0.05 -0.20 1.34 0.00 -2.57 0.00 0.00 177.10 175.62 1mwt s ALA 546 N -2.00 3.55 0.13 0.60 0.00 -0.43 -4.67 121.76 118.93 1mwt s ALA 546 Ca 0.51 1.20 -0.29 0.00 0.00 0.00 0.00 51.96 53.38 1mwt s ALA 546 Cb -0.11 -3.50 -0.07 0.00 0.00 0.00 0.00 23.12 19.45 1mwt s ALA 546 CO 0.22 -0.61 0.91 -1.25 0.00 0.00 0.00 175.76 175.03 1mwt s PRO 547 N -0.56 4.69 0.10 0.00 0.04 -1.26 -4.42 135.00 133.59 1mwt s PRO 547 Ca 0.56 1.37 -0.17 0.00 0.04 0.00 0.00 61.00 62.80 1mwt s PRO 547 Cb -0.39 -3.34 0.04 0.00 0.04 0.00 0.00 34.50 30.84 1mwt s PRO 547 CO 0.43 0.32 0.41 -3.38 0.04 0.00 0.00 177.00 174.81 1mwt s HIS 548 N -0.36 -0.22 -0.15 0.56 -3.43 -0.84 -3.97 115.29 106.89 1mwt s HIS 548 Ca 0.43 -0.01 0.01 0.00 -0.80 0.00 0.00 55.06 54.70 1mwt s HIS 548 Cb -0.23 0.25 0.01 0.00 -1.43 0.00 0.00 32.58 31.17 1mwt s HIS 548 CO 0.29 -0.66 0.44 1.47 -2.00 0.00 0.00 174.74 174.27 1mwt n LEU 549 N -0.01 0.89 -4.80 5.38 -0.00 -1.26 -1.17 117.00 116.03 1mwt n LEU 549 Ca -0.17 -0.89 -0.36 0.00 -0.00 0.00 0.00 56.01 54.59 1mwt n LEU 549 Cb 0.63 0.00 -0.07 0.00 -0.00 0.00 0.00 43.42 43.97 1mwt n LEU 549 CO 0.18 0.21 -0.20 -0.76 -0.00 0.00 0.00 177.39 176.82 1mwt s LEU 550 N -0.53 4.18 0.32 1.47 1.43 -1.26 -0.19 118.68 124.10 1mwt s LEU 550 Ca 0.01 0.33 0.02 0.00 -1.03 0.00 0.00 54.13 53.47 1mwt s LEU 550 Cb 0.01 -2.03 0.54 0.00 0.03 0.00 0.00 46.19 44.74 1mwt s LEU 550 CO 0.02 0.33 1.88 0.50 0.23 0.00 0.00 176.35 179.32 1mwt h LYS 551 N 5.53 0.68 -0.37 1.70 1.63 -1.00 -3.01 116.57 121.72 1mwt h LYS 551 Ca -0.50 -0.12 0.00 0.00 -0.85 0.00 0.00 60.65 59.18 1mwt h LYS 551 Cb 1.20 -0.11 -0.02 0.00 -0.60 0.00 0.00 32.23 32.70 1mwt h LYS 551 CO 0.62 0.62 0.24 -0.44 -3.45 0.00 0.00 179.45 177.04 1mwt h ASP 552 N 0.66 0.43 -1.77 4.20 3.32 -1.95 -3.44 116.42 117.88 1mwt h ASP 552 Ca 0.15 -0.03 -0.67 0.00 0.02 0.00 0.00 57.03 56.50 1mwt h ASP 552 Cb 0.25 -0.11 0.06 0.00 0.22 0.00 0.00 39.33 39.75 1mwt h ASP 552 CO -0.00 0.33 0.43 0.41 -1.72 0.00 0.00 179.24 178.68 1mwt n THR 553 N -4.82 0.19 -2.79 0.35 -1.04 -1.14 -4.92 114.28 100.12 1mwt n THR 553 Ca -0.00 -0.05 -0.40 0.00 -2.04 0.00 0.00 64.05 61.56 1mwt n THR 553 Cb 0.03 -0.86 -0.06 0.00 -1.82 0.00 0.00 70.33 67.62 1mwt n THR 553 CO 0.00 0.00 0.00 -1.59 -0.64 0.00 0.00 175.07 172.84 1mwt s LYS 554 N 0.31 4.78 -0.53 -2.82 0.00 -1.26 -4.96 119.74 115.26 1mwt s LYS 554 Ca 0.82 1.42 -0.27 0.00 0.00 0.00 0.00 55.97 57.94 1mwt s LYS 554 Cb -0.92 -3.22 -0.02 0.00 0.00 0.00 0.00 37.83 33.66 1mwt s LYS 554 CO 0.48 0.50 1.90 -0.80 0.00 0.00 0.00 175.35 177.42 1mwt s ASN 555 N -1.23 5.35 0.29 0.03 0.01 -1.26 -4.95 114.94 113.18 1mwt s ASN 555 Ca 0.41 0.64 0.09 0.00 -0.71 0.00 0.00 52.86 53.30 1mwt s ASN 555 Cb -0.25 -2.53 -0.04 0.00 0.41 0.00 0.00 41.25 38.84 1mwt s ASN 555 CO 0.30 -2.26 0.02 -1.59 -1.51 0.00 0.00 177.10 172.06 1mwt s LYS 556 N 6.81 2.25 -0.08 -0.60 -2.85 -1.26 -5.03 119.74 118.99 1mwt s LYS 556 Ca 0.73 -1.51 -0.18 0.00 -1.00 0.00 0.00 55.97 54.01 1mwt s LYS 556 Cb -0.15 -2.11 -0.05 0.00 -2.06 0.00 0.00 37.83 33.46 1mwt s LYS 556 CO 0.24 0.27 0.48 0.08 0.10 0.00 0.00 175.35 176.53 1mwt s VAL 557 N -2.38 5.11 -0.26 1.79 1.01 -1.26 -1.32 120.40 123.08 1mwt s VAL 557 Ca 0.33 0.97 -0.12 0.00 0.00 0.00 0.00 61.98 63.17 1mwt s VAL 557 Cb -0.04 -3.81 -0.14 0.00 0.00 0.00 0.00 36.38 32.38 1mwt s VAL 557 CO 0.20 0.39 -0.25 1.87 0.00 0.00 0.00 175.10 177.31 1mwt n TRP 558 N 3.16 0.15 -4.29 5.22 -0.00 0.15 -4.77 117.44 117.07 1mwt n TRP 558 Ca -0.08 0.06 -0.18 0.00 -0.00 0.00 0.00 57.50 57.30 1mwt n TRP 558 Cb 0.52 -1.02 -0.14 0.00 -0.00 0.00 0.00 31.31 30.67 1mwt n TRP 558 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 177.69 177.84 1mwt s LYS 559 N -2.50 0.63 0.26 5.87 -0.14 -0.59 -4.99 119.74 118.28 1mwt s LYS 559 Ca -0.37 -0.31 0.09 0.00 -1.36 0.00 0.00 55.97 54.03 1mwt s LYS 559 Cb 0.13 -0.60 -0.04 0.00 -1.68 0.00 0.00 37.83 35.63 1mwt s LYS 559 CO 0.53 0.16 0.00 0.15 -0.76 0.00 0.00 175.35 175.44 1mwt s LYS 560 N -0.26 2.32 -1.13 1.68 1.02 -1.26 -0.29 119.74 121.83 1mwt s LYS 560 Ca 0.02 -1.38 -0.30 0.00 0.02 0.00 0.00 55.97 54.34 1mwt s LYS 560 Cb -0.03 -2.19 0.04 0.00 -0.52 0.00 0.00 37.83 35.13 1mwt s LYS 560 CO -0.00 0.37 0.65 0.09 -0.92 0.00 0.00 175.35 175.54 1mwt n ASN 561 N -0.83 -4.06 0.06 2.83 3.02 -1.24 -4.86 115.26 110.18 1mwt n ASN 561 Ca -0.07 -1.24 -0.06 0.00 -0.03 0.00 0.00 54.58 53.19 1mwt n ASN 561 Cb 0.59 -1.53 -0.10 0.00 -0.61 0.00 0.00 39.78 38.12 1mwt n ASN 561 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 1mwt h ILE 562 N -2.21 1.55 -1.66 2.41 1.08 -1.01 -3.47 117.51 114.20 1mwt h ILE 562 Ca -0.69 -3.22 0.05 0.00 -0.39 0.00 0.00 64.86 60.61 1mwt h ILE 562 Cb 1.37 2.76 -0.24 0.00 -3.07 0.00 0.00 36.82 37.64 1mwt h ILE 562 CO 0.48 0.88 0.42 -0.51 -0.69 0.00 0.00 178.15 178.74 1mwt s ILE 563 N -2.73 0.00 0.77 -0.67 2.07 -1.25 -4.90 121.20 114.49 1mwt s ILE 563 Ca 0.01 0.00 -0.11 0.00 -1.41 0.00 0.00 60.65 59.14 1mwt s ILE 563 Cb 0.10 -1.00 0.05 0.00 0.13 0.00 0.00 42.46 41.74 1mwt s ILE 563 CO 0.81 0.00 1.09 -0.94 -1.91 0.00 0.00 174.94 173.99 1mwt s SER 564 N -0.17 4.71 0.15 4.50 1.04 -1.26 -4.16 113.70 118.51 1mwt s SER 564 Ca 0.01 1.39 -0.18 0.00 0.48 0.00 0.00 55.95 57.64 1mwt s SER 564 Cb -0.04 -2.16 0.03 0.00 0.10 0.00 0.00 66.02 63.96 1mwt s SER 564 CO -0.02 -1.84 1.70 0.50 0.98 0.00 0.00 173.24 174.56 1mwt h LYS 565 N -1.00 0.05 -0.53 4.02 3.64 -2.00 -1.46 116.57 119.29 1mwt h LYS 565 Ca -0.46 -0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 58.80 1mwt h LYS 565 Cb 1.25 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 33.04 1mwt h LYS 565 CO 0.59 0.03 -0.11 1.05 -2.27 0.00 0.00 179.45 178.73 1mwt h GLU 566 N 0.05 0.99 -0.09 1.90 4.11 -2.01 -2.89 114.58 116.64 1mwt h GLU 566 Ca 0.14 -0.36 -0.07 0.00 0.07 0.00 0.00 59.36 59.14 1mwt h GLU 566 Cb 0.20 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 1mwt h GLU 566 CO -0.26 1.04 -0.24 -0.91 0.07 0.00 0.00 179.01 178.71 1mwt h ASN 567 N 0.88 0.15 -0.06 3.06 2.35 -1.87 -2.88 115.58 117.21 1mwt h ASN 567 Ca 0.14 -0.04 0.01 0.00 -0.55 0.00 0.00 56.30 55.86 1mwt h ASN 567 Cb 0.67 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 38.99 1mwt h ASN 567 CO 0.05 0.40 -0.03 0.40 -1.65 0.00 0.00 177.43 176.61 1mwt h ILE 568 N 0.14 0.91 -0.19 2.81 2.04 -1.06 -1.85 117.51 120.31 1mwt h ILE 568 Ca 0.02 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.91 1mwt h ILE 568 Cb 0.51 0.91 -0.01 0.00 -0.74 0.00 0.00 36.82 37.50 1mwt h ILE 568 CO 0.04 0.00 0.13 0.78 0.00 0.00 0.00 178.15 179.10 1mwt h ASN 569 N -0.02 0.13 -0.34 1.72 2.35 -1.45 0.16 115.58 118.13 1mwt h ASN 569 Ca 0.03 -0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.72 1mwt h ASN 569 Cb 0.07 -0.03 -0.02 0.00 0.05 0.00 0.00 38.32 38.39 1mwt h ASN 569 CO -0.07 0.09 0.02 0.25 -1.65 0.00 0.00 177.43 176.07 1mwt h LEU 570 N 0.16 0.65 0.14 1.61 5.85 -1.17 -1.46 115.31 121.09 1mwt h LEU 570 Ca 0.08 -0.14 -0.25 0.00 0.84 0.00 0.00 57.88 58.42 1mwt h LEU 570 Cb 0.13 -0.17 0.01 0.00 0.37 0.00 0.00 40.66 41.00 1mwt h LEU 570 CO -0.01 0.71 -1.18 -0.07 -0.34 0.00 0.00 178.44 177.54 1mwt h LEU 571 N 0.65 0.48 -1.45 2.25 3.38 -0.79 -2.97 115.31 116.85 1mwt h LEU 571 Ca 0.14 -0.90 0.00 0.00 0.09 0.00 0.00 57.88 57.20 1mwt h LEU 571 Cb 0.38 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.97 1mwt h LEU 571 CO 0.01 1.54 0.00 0.71 0.09 0.00 0.00 178.44 180.79 1mwt h THR 572 N -0.27 0.00 0.01 0.22 1.35 -1.03 0.29 112.91 113.48 1mwt h THR 572 Ca -0.23 -0.17 -0.00 0.00 -0.55 0.00 0.00 66.41 65.46 1mwt h THR 572 Cb 1.77 0.90 0.00 0.00 -1.73 0.00 0.00 68.15 69.09 1mwt h THR 572 CO 0.12 0.00 -0.00 -0.78 -0.25 0.00 0.00 175.52 174.61 1mwt h ASP 573 N 0.00 -0.01 -0.44 5.36 1.82 -1.31 -2.61 116.42 119.23 1mwt h ASP 573 Ca 0.00 -0.81 -0.05 0.00 -0.39 0.00 0.00 57.03 55.77 1mwt h ASP 573 Cb 0.21 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 40.20 1mwt h ASP 573 CO 0.00 0.86 0.09 1.23 -1.61 0.00 0.00 179.24 179.82 1mwt h GLY 574 N -0.94 0.85 1.94 -0.78 0.00 -1.24 -2.38 103.07 100.52 1mwt h GLY 574 Ca -0.00 -0.50 -0.06 0.00 0.00 0.00 0.00 47.33 46.77 1mwt h GLY 574 CO 0.00 0.47 -0.27 -0.33 0.00 0.00 0.00 176.54 176.41 1mwt h MET 575 N 0.75 0.07 -0.04 4.80 2.86 -1.05 -1.85 114.93 120.48 1mwt h MET 575 Ca 0.16 -0.02 -0.08 0.00 -2.06 0.00 0.00 59.70 57.70 1mwt h MET 575 Cb 0.32 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.96 1mwt h MET 575 CO 0.00 0.34 -0.36 0.37 1.06 0.00 0.00 176.91 178.32 1mwt h GLN 576 N 0.06 0.08 -0.11 1.72 4.15 -1.02 -2.41 115.11 117.58 1mwt h GLN 576 Ca 0.01 -0.03 -0.13 0.00 0.77 0.00 0.00 58.65 59.27 1mwt h GLN 576 Cb 0.52 -0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.19 1mwt h GLN 576 CO 0.04 0.43 -0.50 1.96 -1.93 0.00 0.00 178.83 178.83 1mwt h GLN 577 N 0.07 0.30 -0.76 1.69 1.08 -1.18 -0.28 115.11 116.04 1mwt h GLN 577 Ca 0.01 -0.17 0.03 0.00 -1.45 0.00 0.00 58.65 57.06 1mwt h GLN 577 Cb 0.67 0.01 -0.04 0.00 -0.05 0.00 0.00 27.48 28.07 1mwt h GLN 577 CO 0.05 0.74 0.50 0.28 -0.95 0.00 0.00 178.83 179.44 1mwt h VAL 578 N 0.24 1.13 0.00 -0.54 2.07 -1.23 -1.83 116.25 116.08 1mwt h VAL 578 Ca 0.01 -0.32 -0.00 0.00 0.82 0.00 0.00 66.70 67.20 1mwt h VAL 578 Cb 0.97 0.11 -0.00 0.00 -1.52 0.00 0.00 31.29 30.85 1mwt h VAL 578 CO 0.08 0.17 -0.19 0.58 0.02 0.00 0.00 177.57 178.23 1mwt h VAL 579 N 0.94 0.07 0.00 2.57 2.07 -1.44 0.58 116.25 121.04 1mwt h VAL 579 Ca 0.30 -1.06 0.00 0.00 0.82 0.00 0.00 66.70 66.76 1mwt h VAL 579 Cb 0.02 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 29.93 1mwt h VAL 579 CO -0.08 0.02 0.00 0.78 0.02 0.00 0.00 177.57 178.31 1mwt h ASN 580 N -1.00 0.00 0.00 0.57 2.35 -1.10 -1.38 115.58 115.02 1mwt h ASN 580 Ca -0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 1mwt h ASN 580 Cb 0.22 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.59 1mwt h ASN 580 CO -0.00 0.00 0.00 0.29 -1.65 0.00 0.00 177.43 176.07 1mwt n LYS 581 N -2.61 0.00 -0.15 0.81 5.02 -0.70 -4.63 118.16 115.90 1mwt n LYS 581 Ca -0.02 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.17 1mwt n LYS 581 Cb 0.06 0.00 -0.05 0.00 -0.02 0.00 0.00 35.03 35.03 1mwt n LYS 581 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 1mwt h THR 582 N 0.00 0.10 -0.59 -0.18 2.02 -1.56 -2.53 112.91 110.17 1mwt h THR 582 Ca 0.00 0.00 -0.19 0.00 0.77 0.00 0.00 66.41 66.99 1mwt h THR 582 Cb 0.00 0.10 -0.11 0.00 -1.74 0.00 0.00 68.15 66.40 1mwt h THR 582 CO 0.00 0.00 0.18 1.41 0.37 0.00 0.00 175.52 177.48 1mwt n HIS 583 N -5.41 1.96 0.02 3.16 8.25 0.19 -4.70 115.22 118.69 1mwt n HIS 583 Ca -0.00 -1.26 0.20 0.00 -0.26 0.00 0.00 57.72 56.39 1mwt n HIS 583 Cb 0.35 -0.60 0.69 0.00 1.12 0.00 0.00 29.99 31.55 1mwt n HIS 583 CO 0.00 0.00 0.00 1.57 0.64 0.00 0.00 176.34 178.55 1mwt h LYS 584 N 2.07 0.00 0.00 -0.41 2.10 -0.78 -1.02 116.57 118.53 1mwt h LYS 584 Ca 0.23 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.88 1mwt h LYS 584 Cb 2.08 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.41 1mwt h LYS 584 CO 0.60 0.00 0.00 0.39 -2.00 0.00 0.00 179.45 178.44 1mwt n GLU 585 N -4.35 0.22 -0.02 0.07 -0.58 -1.26 -3.37 120.64 111.34 1mwt n GLU 585 Ca 0.09 0.33 -0.03 0.00 -0.42 0.00 0.00 57.16 57.13 1mwt n GLU 585 Cb 0.58 -1.84 -0.03 0.00 -0.57 0.00 0.00 31.44 29.58 1mwt n GLU 585 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1mwt n ASP 586 N -2.23 3.78 0.00 1.62 8.00 -0.43 -4.88 116.55 122.40 1mwt n ASP 586 Ca 0.04 -0.01 0.00 0.00 0.71 0.00 0.00 54.79 55.52 1mwt n ASP 586 Cb 0.31 0.28 0.00 0.00 -0.02 0.00 0.00 41.12 41.70 1mwt n ASP 586 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1mwt n ILE 587 N -2.39 0.00 -1.71 0.53 3.06 -0.95 -4.01 119.36 113.89 1mwt n ILE 587 Ca -0.08 -0.08 -0.43 0.00 -2.50 0.00 0.00 62.75 59.66 1mwt n ILE 587 Cb 0.62 0.57 -0.01 0.00 0.54 0.00 0.00 39.64 41.36 1mwt n ILE 587 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1mwt n TYR 588 N -1.38 2.43 -3.85 9.51 4.19 -1.22 -4.75 117.16 122.10 1mwt n TYR 588 Ca 0.00 0.46 -0.13 0.00 3.31 0.00 0.00 57.90 61.54 1mwt n TYR 588 Cb 0.00 -2.47 -0.14 0.00 0.49 0.00 0.00 39.34 37.21 1mwt n TYR 588 CO 0.00 0.00 0.00 1.03 0.91 0.00 0.00 176.86 178.80 1mwt s ARG 589 N -1.29 0.00 0.18 2.98 1.81 -1.26 -4.97 118.95 116.40 1mwt s ARG 589 Ca 0.60 0.04 -0.08 0.00 -1.72 0.00 0.00 55.73 54.56 1mwt s ARG 589 Cb -0.57 -0.06 0.07 0.00 -0.45 0.00 0.00 34.95 33.94 1mwt s ARG 589 CO 0.57 -0.04 1.59 0.77 -0.68 0.00 0.00 175.30 177.52 1mwt h SER 590 N 6.41 0.98 0.12 0.23 0.02 -1.98 -3.11 113.55 116.22 1mwt h SER 590 Ca -0.29 -0.34 0.00 0.00 -0.84 0.00 0.00 61.79 60.32 1mwt h SER 590 Cb 1.19 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 63.46 1mwt h SER 590 CO 0.50 1.12 0.00 0.00 -1.14 0.00 0.00 176.83 177.31 1mwt n TYR 591 N -4.13 0.00 -3.75 3.45 0.18 -1.26 -4.85 117.16 106.80 1mwt n TYR 591 Ca 0.01 0.00 -0.10 0.00 1.88 0.00 0.00 57.90 59.69 1mwt n TYR 591 Cb 0.43 -0.08 -0.06 0.00 -0.38 0.00 0.00 39.34 39.25 1mwt n TYR 591 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 1mwt s ALA 592 N -2.15 -0.57 -1.13 -3.48 0.00 -1.17 -4.98 121.76 108.27 1mwt s ALA 592 Ca 0.33 -0.35 -0.03 0.00 0.00 0.00 0.00 51.96 51.91 1mwt s ALA 592 Cb 0.17 0.60 0.25 0.00 0.00 0.00 0.00 23.12 24.14 1mwt s ALA 592 CO 0.31 -0.58 1.92 -1.71 0.00 0.00 0.00 175.76 175.70 1mwt n ASN 593 N -0.14 7.22 -4.72 0.00 4.05 -1.26 -4.52 115.26 115.88 1mwt n ASN 593 Ca -0.15 -3.46 -0.42 0.00 0.45 0.00 0.00 54.58 51.00 1mwt n ASN 593 Cb 0.63 -1.26 -0.03 0.00 1.23 0.00 0.00 39.78 40.35 1mwt n ASN 593 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 1mwt s LEU 594 N -3.19 4.39 0.15 1.20 1.43 -1.26 -0.71 118.68 120.69 1mwt s LEU 594 Ca 0.42 2.36 0.02 0.00 -1.03 0.00 0.00 54.13 55.89 1mwt s LEU 594 Cb 0.16 -3.60 -0.04 0.00 0.03 0.00 0.00 46.19 42.74 1mwt s LEU 594 CO -0.07 -0.61 -0.03 0.27 0.23 0.00 0.00 176.35 176.15 1mwt s ILE 595 N 0.73 0.73 -0.35 -0.59 -4.36 -0.91 -4.65 121.20 111.79 1mwt s ILE 595 Ca 0.62 -1.98 0.00 0.00 -0.26 0.00 0.00 60.65 59.03 1mwt s ILE 595 Cb -0.37 -1.97 0.00 0.00 1.25 0.00 0.00 42.46 41.37 1mwt s ILE 595 CO 0.33 -0.61 0.00 0.61 0.24 0.00 0.00 174.94 175.51 1mwt n GLY 596 N -0.18 -0.95 3.04 6.27 0.00 -0.96 -2.30 105.19 110.10 1mwt n GLY 596 Ca -0.08 -0.74 -0.13 0.00 0.00 0.00 0.00 46.02 45.07 1mwt n GLY 596 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1mwt s LYS 597 N -0.14 0.19 0.39 1.61 2.47 -0.64 -4.49 119.74 119.14 1mwt s LYS 597 Ca 0.00 0.42 0.06 0.00 -1.56 0.00 0.00 55.97 54.90 1mwt s LYS 597 Cb 0.00 -0.06 0.00 0.00 -1.46 0.00 0.00 37.83 36.31 1mwt s LYS 597 CO 0.00 -0.12 0.54 -1.54 0.16 0.00 0.00 175.35 174.39 1mwt s SER 598 N 0.90 5.80 -0.19 1.43 1.04 -1.26 -1.88 113.70 119.53 1mwt s SER 598 Ca -0.06 -0.23 -0.27 0.00 0.48 0.00 0.00 55.95 55.86 1mwt s SER 598 Cb -0.08 -1.01 0.08 0.00 0.10 0.00 0.00 66.02 65.11 1mwt s SER 598 CO -0.05 -0.62 0.78 -0.83 0.98 0.00 0.00 173.24 173.50 1mwt s GLY 599 N -4.26 -0.46 -0.28 7.32 0.00 -0.13 -4.14 107.32 105.37 1mwt s GLY 599 Ca 0.50 1.91 -0.01 0.00 0.00 0.00 0.00 44.72 47.11 1mwt s GLY 599 CO 0.33 1.44 0.27 -1.59 0.00 0.00 0.00 173.10 173.55 1mwt s THR 600 N -0.29 -0.37 0.37 0.90 2.01 -1.25 0.81 115.64 117.82 1mwt s THR 600 Ca -0.03 -0.44 0.00 0.00 0.31 0.00 0.00 61.69 61.53 1mwt s THR 600 Cb -0.03 -0.93 -0.03 0.00 0.01 0.00 0.00 72.50 71.52 1mwt s THR 600 CO 0.03 -0.44 0.58 0.00 -0.69 0.00 0.00 174.62 174.10 1mwt s ALA 601 N 2.34 3.68 -0.21 7.40 0.00 0.03 -4.88 121.76 130.12 1mwt s ALA 601 Ca 0.09 -0.90 -0.10 0.00 0.00 0.00 0.00 51.96 51.05 1mwt s ALA 601 Cb -0.14 -2.15 -0.05 0.00 0.00 0.00 0.00 23.12 20.78 1mwt s ALA 601 CO -0.30 -0.09 0.13 -1.21 0.00 0.00 0.00 175.76 174.29 1mwt s GLU 602 N -4.38 4.13 0.00 0.00 2.02 -1.26 -0.97 118.70 118.24 1mwt s GLU 602 Ca 0.42 -0.25 0.00 0.00 0.02 0.00 0.00 54.97 55.16 1mwt s GLU 602 Cb -0.10 -3.43 0.00 0.00 0.10 0.00 0.00 34.13 30.70 1mwt s GLU 602 CO 0.37 0.23 0.00 -0.11 0.02 0.00 0.00 175.26 175.77 1mwt n LEU 603 N 3.73 0.00 0.00 1.80 7.94 -1.26 -4.94 117.00 124.27 1mwt n LEU 603 Ca -0.16 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.74 1mwt n LEU 603 Cb 0.52 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.47 1mwt n LEU 603 CO 0.36 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 177.25 1mwt n GLY 611 N 2.87 0.00 0.88 -3.96 0.00 -1.26 -4.92 105.19 98.80 1mwt n GLY 611 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 1mwt n GLY 611 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1mwt n ARG 612 N 0.00 0.09 -4.45 1.61 5.12 -1.26 -5.04 116.66 112.73 1mwt n ARG 612 Ca 0.00 0.04 -0.21 0.00 -1.93 0.00 0.00 57.85 55.75 1mwt n ARG 612 Cb 0.00 -0.65 -0.14 0.00 -1.16 0.00 0.00 32.46 30.51 1mwt n ARG 612 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 1mwt s GLN 613 N -2.11 1.00 -0.19 5.56 -0.21 -1.26 -4.57 119.66 117.88 1mwt s GLN 613 Ca -0.05 -0.67 -0.07 0.00 0.02 0.00 0.00 55.36 54.58 1mwt s GLN 613 Cb 0.02 -1.00 -0.04 0.00 1.00 0.00 0.00 33.01 32.99 1mwt s GLN 613 CO 0.07 0.26 0.06 0.42 -2.12 0.00 0.00 175.29 173.98 1mwt s ILE 614 N -0.67 4.75 -0.03 1.08 -1.09 -0.15 -0.70 121.20 124.39 1mwt s ILE 614 Ca 0.03 -0.05 -0.03 0.00 -2.23 0.00 0.00 60.65 58.37 1mwt s ILE 614 Cb -0.07 -3.15 -0.04 0.00 -1.58 0.00 0.00 42.46 37.62 1mwt s ILE 614 CO 0.01 0.44 0.15 -0.83 -1.23 0.00 0.00 174.94 173.48 1mwt s GLY 615 N 0.52 2.13 0.00 6.18 0.00 0.23 -0.79 107.32 115.60 1mwt s GLY 615 Ca 0.03 -0.76 0.03 0.00 0.00 0.00 0.00 44.72 44.02 1mwt s GLY 615 CO 0.01 -0.61 -0.11 -0.98 0.00 0.00 0.00 173.10 171.41 1mwt s TRP 616 N -1.23 0.96 -0.23 1.90 0.52 0.24 -1.25 118.94 119.85 1mwt s TRP 616 Ca 0.24 -0.22 -0.06 0.00 0.02 0.00 0.00 56.10 56.07 1mwt s TRP 616 Cb -0.12 -0.61 0.11 0.00 -1.15 0.00 0.00 33.47 31.71 1mwt s TRP 616 CO 0.14 -0.01 0.47 0.12 0.02 0.00 0.00 176.95 177.70 1mwt s PHE 617 N -0.40 -0.98 -0.05 -1.98 5.36 -0.72 -0.95 117.98 118.26 1mwt s PHE 617 Ca 0.03 1.59 0.01 0.00 -0.96 0.00 0.00 56.93 57.59 1mwt s PHE 617 Cb -0.05 0.38 -0.03 0.00 -0.34 0.00 0.00 43.02 42.98 1mwt s PHE 617 CO -0.00 -0.59 -0.05 0.42 -1.46 0.00 0.00 175.22 173.54 1mwt s ILE 618 N 2.68 3.87 0.08 3.12 1.01 -0.79 -0.84 121.20 130.33 1mwt s ILE 618 Ca 0.02 -0.52 -0.27 0.00 0.00 0.00 0.00 60.65 59.89 1mwt s ILE 618 Cb -0.13 -2.63 0.08 0.00 0.01 0.00 0.00 42.46 39.79 1mwt s ILE 618 CO -0.15 0.53 0.92 -0.94 0.00 0.00 0.00 174.94 175.29 1mwt s SER 619 N -1.06 -0.27 0.07 3.58 1.04 -0.20 -1.62 113.70 115.24 1mwt s SER 619 Ca 0.15 -0.21 -0.26 0.00 0.48 0.00 0.00 55.95 56.11 1mwt s SER 619 Cb -0.11 0.44 0.09 0.00 0.10 0.00 0.00 66.02 66.54 1mwt s SER 619 CO 0.04 -0.77 0.78 -0.72 0.98 0.00 0.00 173.24 173.55 1mwt s TYR 620 N -3.22 -0.40 -0.35 5.02 1.13 -0.97 -0.46 117.35 118.10 1mwt s TYR 620 Ca 0.09 0.22 -0.25 0.00 -1.41 0.00 0.00 57.07 55.72 1mwt s TYR 620 Cb -0.01 0.56 0.01 0.00 -1.10 0.00 0.00 41.96 41.42 1mwt s TYR 620 CO -0.03 -0.69 0.87 0.34 -2.51 0.00 0.00 175.55 173.53 1mwt s ASP 621 N -2.62 6.67 0.48 -0.18 3.68 -1.26 -2.14 116.67 121.30 1mwt s ASP 621 Ca 0.04 0.59 0.18 0.00 2.13 0.00 0.00 52.55 55.50 1mwt s ASP 621 Cb -0.01 -2.44 1.19 0.00 -1.45 0.00 0.00 42.92 40.21 1mwt s ASP 621 CO -0.10 -0.77 2.05 0.50 0.13 0.00 0.00 175.17 176.98 1mwt h LYS 622 N 8.35 0.00 -0.01 4.34 1.63 -1.28 0.01 116.57 129.61 1mwt h LYS 622 Ca -0.24 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.56 1mwt h LYS 622 Cb 1.08 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.71 1mwt h LYS 622 CO 0.95 0.13 -0.06 -0.25 -3.45 0.00 0.00 179.45 176.76 1mwt n ASP 623 N -4.18 1.36 -2.75 4.20 8.00 -1.26 -4.34 116.55 117.58 1mwt n ASP 623 Ca -0.02 -1.33 -0.09 0.00 0.71 0.00 0.00 54.79 54.05 1mwt n ASP 623 Cb 0.21 0.03 0.09 0.00 -0.02 0.00 0.00 41.12 41.43 1mwt n ASP 623 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1mwt n ASN 624 N -0.05 -2.15 -2.28 -2.24 5.15 -0.74 -5.05 115.26 107.89 1mwt n ASN 624 Ca 0.17 -3.54 -0.01 0.00 -0.60 0.00 0.00 54.58 50.61 1mwt n ASN 624 Cb 0.35 1.72 -0.01 0.00 -0.53 0.00 0.00 39.78 41.31 1mwt n ASN 624 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 1mwt n PRO 625 N 0.25 0.17 -0.06 1.20 -0.04 -0.09 -4.32 135.00 132.11 1mwt n PRO 625 Ca 0.06 -0.07 0.12 0.00 -0.04 0.00 0.00 63.50 63.57 1mwt n PRO 625 Cb 0.72 -1.52 0.40 0.00 -0.04 0.00 0.00 33.50 33.06 1mwt n PRO 625 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1mwt n ASN 626 N 2.61 1.79 -3.64 3.54 6.94 -1.26 -4.57 115.26 120.68 1mwt n ASN 626 Ca 0.03 -1.67 -0.05 0.00 -0.02 0.00 0.00 54.58 52.87 1mwt n ASN 626 Cb 0.08 -0.08 -0.06 0.00 -2.36 0.00 0.00 39.78 37.36 1mwt n ASN 626 CO 0.00 0.00 0.00 -0.32 -1.03 0.00 0.00 177.26 175.91 1mwt s MET 627 N -1.85 0.64 -0.18 -3.83 0.00 -1.26 -4.45 119.30 108.38 1mwt s MET 627 Ca 0.34 1.22 -0.02 0.00 0.00 0.00 0.00 55.69 57.24 1mwt s MET 627 Cb 0.19 0.30 -0.01 0.00 0.00 0.00 0.00 34.83 35.32 1mwt s MET 627 CO 0.29 -0.15 -0.10 -1.64 0.00 0.00 0.00 175.02 173.42 1mwt s MET 628 N 1.91 3.34 -0.03 4.11 -1.94 -0.08 -4.29 119.30 122.32 1mwt s MET 628 Ca -0.09 -0.67 0.05 0.00 -1.71 0.00 0.00 55.69 53.27 1mwt s MET 628 Cb -0.06 -2.79 -0.03 0.00 2.01 0.00 0.00 34.83 33.96 1mwt s MET 628 CO -0.19 -0.02 -0.18 1.41 -0.01 0.00 0.00 175.02 176.03 1mwt s MET 629 N 0.96 2.34 -0.16 2.03 0.00 0.39 -1.45 119.30 123.41 1mwt s MET 629 Ca -0.02 -0.80 0.01 0.00 0.00 0.00 0.00 55.69 54.88 1mwt s MET 629 Cb -0.15 -2.27 0.02 0.00 0.00 0.00 0.00 34.83 32.44 1mwt s MET 629 CO -0.01 0.60 -0.16 0.00 0.00 0.00 0.00 175.02 175.45 1mwt s ALA 630 N -0.73 2.02 -0.29 4.11 0.00 0.32 -1.04 121.76 126.15 1mwt s ALA 630 Ca 0.12 -1.03 -0.05 0.00 0.00 0.00 0.00 51.96 51.00 1mwt s ALA 630 Cb -0.10 -1.11 0.02 0.00 0.00 0.00 0.00 23.12 21.92 1mwt s ALA 630 CO 0.01 -0.41 0.03 0.42 0.00 0.00 0.00 175.76 175.81 1mwt s ILE 631 N 1.42 3.50 -0.19 0.00 -1.09 -0.02 -1.70 121.20 123.11 1mwt s ILE 631 Ca 0.04 -0.94 -0.01 0.00 -2.23 0.00 0.00 60.65 57.51 1mwt s ILE 631 Cb -0.13 -2.85 0.00 0.00 -1.58 0.00 0.00 42.46 37.90 1mwt s ILE 631 CO -0.11 0.05 -0.12 0.21 -1.23 0.00 0.00 174.94 173.75 1mwt s ASN 632 N 1.40 3.82 0.01 3.58 3.84 -0.31 -1.76 114.94 125.52 1mwt s ASN 632 Ca 0.00 -0.48 0.04 0.00 0.21 0.00 0.00 52.86 52.64 1mwt s ASN 632 Cb -0.18 -1.62 -0.01 0.00 -0.55 0.00 0.00 41.25 38.89 1mwt s ASN 632 CO 0.00 0.02 -0.12 -0.69 -2.79 0.00 0.00 177.10 173.52 1mwt s VAL 633 N 1.21 0.96 -0.01 -5.21 1.01 -0.38 -1.04 120.40 116.95 1mwt s VAL 633 Ca 0.02 -0.70 -0.02 0.00 0.00 0.00 0.00 61.98 61.28 1mwt s VAL 633 Cb -0.14 -0.84 -0.04 0.00 0.00 0.00 0.00 36.38 35.36 1mwt s VAL 633 CO -0.05 0.13 0.15 -0.75 0.00 0.00 0.00 175.10 174.59 1mwt s LYS 634 N -0.65 3.33 -0.45 2.72 2.20 -0.23 0.76 119.74 127.42 1mwt s LYS 634 Ca 0.03 -0.37 -0.01 0.00 -0.36 0.00 0.00 55.97 55.26 1mwt s LYS 634 Cb -0.06 -3.03 -0.01 0.00 -1.51 0.00 0.00 37.83 33.22 1mwt s LYS 634 CO 0.00 0.67 0.38 -0.25 -0.36 0.00 0.00 175.35 175.79 1mwt n ASP 635 N 1.04 -2.76 -0.94 1.43 8.00 0.13 -4.54 116.55 118.91 1mwt n ASP 635 Ca -0.12 -0.26 0.10 0.00 0.71 0.00 0.00 54.79 55.23 1mwt n ASP 635 Cb 0.53 -2.34 0.15 0.00 -0.02 0.00 0.00 41.12 39.44 1mwt n ASP 635 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 1mwt n VAL 636 N -2.21 0.34 -0.32 2.53 0.24 -0.60 -4.63 118.33 113.68 1mwt n VAL 636 Ca -0.08 -0.67 0.21 0.00 -2.04 0.00 0.00 64.34 61.75 1mwt n VAL 636 Cb 0.56 1.11 0.41 0.00 -1.47 0.00 0.00 33.84 34.44 1mwt n VAL 636 CO 0.00 0.00 0.00 0.06 -2.14 0.00 0.00 176.83 174.75 1mwt h GLN 637 N 3.92 0.13 -0.02 7.34 -0.00 -1.92 0.11 115.11 124.67 1mwt h GLN 637 Ca 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 58.65 58.64 1mwt h GLN 637 Cb 0.88 -0.03 0.00 0.00 -0.00 0.00 0.00 27.48 28.33 1mwt h GLN 637 CO 0.00 0.09 -0.15 -0.25 -0.00 0.00 0.00 178.83 178.52 1mwt n ASP 638 N -5.25 2.46 -1.37 0.06 8.00 -1.26 -4.34 116.55 114.84 1mwt n ASP 638 Ca 0.28 -1.73 0.08 0.00 0.71 0.00 0.00 54.79 54.14 1mwt n ASP 638 Cb 0.92 0.17 0.31 0.00 -0.02 0.00 0.00 41.12 42.49 1mwt n ASP 638 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1mwt n LYS 639 N 0.76 3.21 -0.67 -1.24 5.02 0.28 -4.89 118.16 120.62 1mwt n LYS 639 Ca 0.11 -2.44 0.00 0.00 -2.02 0.00 0.00 58.31 53.96 1mwt n LYS 639 Cb 0.49 -1.76 0.00 0.00 -0.02 0.00 0.00 35.03 33.75 1mwt n LYS 639 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1mwt n GLY 640 N 1.12 0.82 7.00 0.72 0.00 -1.16 -3.68 105.19 110.00 1mwt n GLY 640 Ca 0.22 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.70 1mwt n GLY 640 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1mwt n MET 641 N -2.07 0.00 0.26 1.61 2.81 -0.54 -1.56 117.12 117.63 1mwt n MET 641 Ca 0.00 0.00 0.17 0.00 -1.81 0.00 0.00 57.70 56.06 1mwt n MET 641 Cb 0.08 0.00 0.80 0.00 -0.71 0.00 0.00 33.22 33.38 1mwt n MET 641 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1mwt h ALA 642 N -0.76 1.59 -0.51 3.04 0.00 -1.88 0.24 119.26 120.96 1mwt h ALA 642 Ca 0.00 -0.00 0.10 0.00 0.00 0.00 0.00 54.91 55.01 1mwt h ALA 642 Cb 0.00 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1mwt h ALA 642 CO 0.00 -0.43 0.35 0.77 0.00 0.00 0.00 179.25 179.94 1mwt h SER 643 N 0.00 0.22 -0.25 0.00 0.02 -1.58 0.13 113.55 112.09 1mwt h SER 643 Ca 0.06 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.01 1mwt h SER 643 Cb 0.79 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.28 1mwt h SER 643 CO -0.00 0.13 0.12 0.22 -1.14 0.00 0.00 176.83 176.16 1mwt h TYR 644 N 0.24 0.36 -0.73 3.45 3.20 -1.01 0.05 116.97 122.53 1mwt h TYR 644 Ca 0.24 -0.02 0.01 0.00 3.14 0.00 0.00 58.73 62.10 1mwt h TYR 644 Cb 0.62 -0.11 -0.04 0.00 1.54 0.00 0.00 36.73 38.74 1mwt h TYR 644 CO -0.00 0.35 0.48 -0.91 -1.64 0.00 0.00 178.16 176.44 1mwt h ASN 645 N 0.26 0.83 -0.30 -2.11 2.35 -0.97 -1.94 115.58 113.71 1mwt h ASN 645 Ca 0.08 -0.02 -0.10 0.00 -0.55 0.00 0.00 56.30 55.71 1mwt h ASN 645 Cb 0.13 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.27 1mwt h ASN 645 CO -0.01 0.60 -0.16 0.00 -1.65 0.00 0.00 177.43 176.21 1mwt h ALA 646 N 1.55 0.97 -0.33 -0.83 0.00 -0.32 -2.38 119.26 117.93 1mwt h ALA 646 Ca 0.27 -0.34 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 1mwt h ALA 646 Cb -0.11 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1mwt h ALA 646 CO -0.06 0.60 0.06 0.87 0.00 0.00 0.00 179.25 180.73 1mwt h LYS 647 N 0.66 0.54 -0.65 0.00 1.57 -0.27 -1.70 116.57 116.71 1mwt h LYS 647 Ca 0.11 -0.14 0.07 0.00 -1.87 0.00 0.00 60.65 58.82 1mwt h LYS 647 Cb 0.64 -0.07 -0.06 0.00 0.08 0.00 0.00 32.23 32.82 1mwt h LYS 647 CO 0.04 0.61 0.34 0.82 -0.57 0.00 0.00 179.45 180.69 1mwt h ILE 648 N 0.37 0.91 -0.45 1.86 2.04 -1.34 -1.46 117.51 119.44 1mwt h ILE 648 Ca 0.10 -0.21 -0.01 0.00 1.00 0.00 0.00 64.86 65.74 1mwt h ILE 648 Cb 0.33 0.25 -0.02 0.00 -0.74 0.00 0.00 36.82 36.64 1mwt h ILE 648 CO 0.00 0.11 0.25 0.28 0.00 0.00 0.00 178.15 178.79 1mwt h SER 649 N 0.61 0.56 -0.73 1.72 0.02 -1.20 -2.04 113.55 112.49 1mwt h SER 649 Ca 0.31 -0.09 0.05 0.00 -0.84 0.00 0.00 61.79 61.22 1mwt h SER 649 Cb 0.26 -0.14 -0.04 0.00 0.14 0.00 0.00 62.40 62.61 1mwt h SER 649 CO -0.22 0.49 0.48 1.23 -1.14 0.00 0.00 176.83 177.67 1mwt h GLY 650 N 0.59 0.99 2.00 -3.77 0.00 -0.37 -1.55 103.07 100.97 1mwt h GLY 650 Ca 0.16 -0.33 -0.15 0.00 0.00 0.00 0.00 47.33 47.01 1mwt h GLY 650 CO -0.03 0.26 -0.71 0.50 0.00 0.00 0.00 176.54 176.57 1mwt h LYS 651 N 0.82 0.00 -0.23 4.80 1.57 -0.81 -0.84 116.57 121.88 1mwt h LYS 651 Ca 0.30 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 59.02 1mwt h LYS 651 Cb 0.16 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 1mwt h LYS 651 CO -0.10 0.71 -0.10 0.28 -0.57 0.00 0.00 179.45 179.67 1mwt h VAL 652 N 0.00 1.30 -0.62 0.50 2.07 -0.70 -1.84 116.25 116.96 1mwt h VAL 652 Ca -0.01 -1.17 -0.01 0.00 0.82 0.00 0.00 66.70 66.34 1mwt h VAL 652 Cb 1.26 1.58 -0.03 0.00 -1.52 0.00 0.00 31.29 32.58 1mwt h VAL 652 CO 0.09 0.36 0.35 1.88 0.02 0.00 0.00 177.57 180.27 1mwt h TYR 653 N 0.19 0.85 -0.78 1.57 -1.99 -1.17 -0.22 116.97 115.42 1mwt h TYR 653 Ca 0.05 -0.02 0.08 0.00 2.00 0.00 0.00 58.73 60.84 1mwt h TYR 653 Cb 0.60 -0.27 -0.07 0.00 2.00 0.00 0.00 36.73 38.99 1mwt h TYR 653 CO 0.06 0.60 0.44 -0.44 -0.00 0.00 0.00 178.16 178.83 1mwt h ASP 654 N 0.84 0.65 -0.23 3.88 3.32 -1.00 0.32 116.42 124.21 1mwt h ASP 654 Ca 0.22 0.04 -0.03 0.00 0.02 0.00 0.00 57.03 57.28 1mwt h ASP 654 Cb 0.03 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.48 1mwt h ASP 654 CO -0.04 0.39 0.02 -0.08 -1.72 0.00 0.00 179.24 177.82 1mwt h GLU 655 N 0.78 0.38 0.00 3.56 4.81 -0.72 0.38 114.58 123.77 1mwt h GLU 655 Ca 0.36 -0.11 -0.03 0.00 -0.13 0.00 0.00 59.36 59.45 1mwt h GLU 655 Cb 0.28 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.61 1mwt h GLU 655 CO -0.22 0.54 -0.14 -0.07 -0.73 0.00 0.00 179.01 178.40 1mwt h LEU 656 N 0.17 0.00 -2.46 1.64 3.38 -0.56 -3.10 115.31 114.38 1mwt h LEU 656 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1mwt h LEU 656 Cb 0.36 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.11 1mwt h LEU 656 CO 0.01 0.14 0.00 -1.22 0.09 0.00 0.00 178.44 177.46 1mwt n TYR 657 N -3.20 0.41 -4.09 1.13 4.02 0.11 -3.32 117.16 112.23 1mwt n TYR 657 Ca 0.02 -0.35 -0.31 0.00 -0.01 0.00 0.00 57.90 57.25 1mwt n TYR 657 Cb 0.47 -0.01 -0.03 0.00 -0.02 0.00 0.00 39.34 39.75 1mwt n TYR 657 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 1mwt n GLU 658 N 0.79 -3.18 -1.85 -0.72 1.02 0.11 0.02 120.64 116.82 1mwt n GLU 658 Ca 0.13 0.38 -0.20 0.00 -0.02 0.00 0.00 57.16 57.45 1mwt n GLU 658 Cb 0.44 -4.75 -0.06 0.00 -0.02 0.00 0.00 31.44 27.04 1mwt n GLU 658 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1mwt n ASN 659 N -2.83 -5.40 0.00 1.62 4.13 0.41 -2.59 115.26 110.59 1mwt n ASN 659 Ca -0.13 0.33 0.00 0.00 1.68 0.00 0.00 54.58 56.46 1mwt n ASN 659 Cb 0.60 -4.69 0.00 0.00 -1.54 0.00 0.00 39.78 34.15 1mwt n ASN 659 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1mwt n GLY 660 N -0.57 0.88 0.00 7.41 0.00 0.10 -4.92 105.19 108.09 1mwt n GLY 660 Ca -0.21 0.00 0.15 0.00 0.00 0.00 0.00 46.02 45.96 1mwt n GLY 660 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1mwt n ASN 661 N 0.00 0.00 -3.23 1.61 3.02 -0.95 -4.89 115.26 110.82 1mwt n ASN 661 Ca 0.00 -0.10 -0.10 0.00 -0.03 0.00 0.00 54.58 54.36 1mwt n ASN 661 Cb 0.00 -0.30 -0.00 0.00 -0.61 0.00 0.00 39.78 38.87 1mwt n ASN 661 CO 0.00 0.00 0.00 -1.59 -2.62 0.00 0.00 177.26 173.05 1mwt s LYS 662 N -2.60 2.04 -0.13 3.52 -2.85 -1.08 -5.02 119.74 113.61 1mwt s LYS 662 Ca 0.27 -1.42 0.02 0.00 -1.00 0.00 0.00 55.97 53.85 1mwt s LYS 662 Cb 0.20 0.57 0.01 0.00 -2.06 0.00 0.00 37.83 36.56 1mwt s LYS 662 CO 0.47 -0.93 -0.21 0.15 0.10 0.00 0.00 175.35 174.93 1mwt s LYS 663 N -2.86 2.90 0.31 1.78 3.01 -1.26 -4.62 119.74 118.99 1mwt s LYS 663 Ca 0.18 -0.81 -0.28 0.00 -1.01 0.00 0.00 55.97 54.06 1mwt s LYS 663 Cb -0.04 -2.35 -0.13 0.00 -1.01 0.00 0.00 37.83 34.30 1mwt s LYS 663 CO 0.12 -0.02 1.05 0.98 0.51 0.00 0.00 175.35 178.00 1mwt n TYR 664 N 4.08 1.42 -3.66 3.18 4.19 -1.21 -4.97 117.16 120.19 1mwt n TYR 664 Ca -0.20 0.67 -0.23 0.00 3.31 0.00 0.00 57.90 61.45 1mwt n TYR 664 Cb 0.51 -2.27 -0.17 0.00 0.49 0.00 0.00 39.34 37.90 1mwt n TYR 664 CO 0.00 0.00 0.00 0.34 0.91 0.00 0.00 176.86 178.11 1mwt s ASP 665 N -0.53 1.77 0.59 2.98 2.15 -1.26 -5.02 116.67 117.35 1mwt s ASP 665 Ca 0.58 -0.27 0.30 0.00 0.43 0.00 0.00 52.55 53.60 1mwt s ASP 665 Cb -0.67 -0.23 1.82 0.00 -0.30 0.00 0.00 42.92 43.54 1mwt s ASP 665 CO 0.60 -0.29 2.23 0.16 -0.17 0.00 0.00 175.17 177.70 1mwt h ILE 666 N 6.43 0.49 -0.67 4.11 3.07 -1.93 -2.08 117.51 126.92 1mwt h ILE 666 Ca -0.14 0.00 -0.12 0.00 1.55 0.00 0.00 64.86 66.15 1mwt h ILE 666 Cb 1.13 0.96 -0.07 0.00 -0.27 0.00 0.00 36.82 38.58 1mwt h ILE 666 CO 0.23 0.00 0.15 0.47 -1.05 0.00 0.00 178.15 177.95 1mwt n ASP 667 N -3.80 5.27 -0.96 2.16 10.43 -1.26 -4.80 116.55 123.59 1mwt n ASP 667 Ca -0.02 -3.10 0.12 0.00 2.57 0.00 0.00 54.79 54.36 1mwt n ASP 667 Cb 0.13 -0.72 0.10 0.00 1.84 0.00 0.00 41.12 42.47 1mwt n ASP 667 CO 0.00 0.00 0.00 1.21 -1.07 0.00 0.00 177.20 177.34