#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mys h ALA 35 N 0.00 0.30 -0.12 -1.18 0.00 -2.05 -3.24 119.26 112.96 3mys h ALA 35 Ca 0.00 -1.22 0.04 0.00 0.00 0.00 0.00 54.91 53.73 3mys h ALA 35 Cb 0.00 0.48 -0.05 0.00 0.00 0.00 0.00 17.79 18.22 3mys h ALA 35 CO 0.00 1.16 -0.15 0.35 0.00 0.00 0.00 179.25 180.61 3mys h PHE 36 N 0.08 -0.39 -0.41 0.00 3.04 -2.06 -2.27 116.94 114.93 3mys h PHE 36 Ca -0.34 0.02 0.07 0.00 3.98 0.00 0.00 57.97 61.71 3mys h PHE 36 Cb 2.06 0.19 -0.06 0.00 2.56 0.00 0.00 35.95 40.70 3mys h PHE 36 CO 0.08 -0.22 0.04 0.35 -2.02 0.00 0.00 178.31 176.54 3mys h PHE 37 N -0.19 0.05 -0.14 0.41 3.57 -2.01 -1.72 116.94 116.91 3mys h PHE 37 Ca 0.09 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.58 3mys h PHE 37 Cb 0.32 0.04 -0.01 0.00 2.79 0.00 0.00 35.95 39.10 3mys h PHE 37 CO -0.26 -0.04 -0.10 0.00 -2.23 0.00 0.00 178.31 175.68 3mys h ARG 38 N 0.15 0.21 0.00 1.11 2.47 -1.53 -2.23 114.38 114.56 3mys h ARG 38 Ca 0.20 -0.04 0.00 0.00 -1.26 0.00 0.00 59.98 58.88 3mys h ARG 38 Cb 0.27 -0.03 0.00 0.00 -1.65 0.00 0.00 29.97 28.56 3mys h ARG 38 CO -0.30 0.32 -0.03 -0.91 0.56 0.00 0.00 179.97 179.60 3mys h ASN 39 N 0.20 0.00 0.88 7.04 2.35 -0.77 -3.12 115.58 122.16 3mys h ASN 39 Ca 0.04 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 3mys h ASN 39 Cb 0.30 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.67 3mys h ASN 39 CO 0.02 0.00 0.00 0.23 -1.65 0.00 0.00 177.43 176.03 3mys n MET 40 N -2.62 0.06 -0.01 0.81 2.81 -0.72 -4.30 117.12 113.15 3mys n MET 40 Ca 0.05 0.15 -0.14 0.00 -1.81 0.00 0.00 57.70 55.95 3mys n MET 40 Cb 0.48 -1.58 -0.09 0.00 -0.71 0.00 0.00 33.22 31.31 3mys n MET 40 CO 0.00 0.00 0.00 -0.92 1.51 0.00 0.00 175.97 176.56 3mys h TYR 41 N 0.00 -1.48 -0.80 2.03 3.20 -1.60 -2.89 116.97 115.43 3mys h TYR 41 Ca 0.00 0.06 0.07 0.00 3.14 0.00 0.00 58.73 62.00 3mys h TYR 41 Cb 0.44 0.66 -0.05 0.00 1.54 0.00 0.00 36.73 39.32 3mys h TYR 41 CO 0.00 -0.50 0.52 -0.44 -1.64 0.00 0.00 178.16 176.10 3mys h ASP 42 N -0.53 0.75 0.08 -2.11 5.19 -1.84 -1.36 116.42 116.59 3mys h ASP 42 Ca 0.03 0.01 0.02 0.00 -0.62 0.00 0.00 57.03 56.46 3mys h ASP 42 Cb 0.62 -0.15 -0.03 0.00 0.18 0.00 0.00 39.33 39.95 3mys h ASP 42 CO -0.40 0.48 -0.20 0.50 -3.12 0.00 0.00 179.24 176.49 3mys h LYS 43 N 0.85 -0.36 -0.48 3.56 3.64 -1.78 0.11 116.57 122.11 3mys h LYS 43 Ca 0.35 0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.67 3mys h LYS 43 Cb 0.27 0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.15 3mys h LYS 43 CO -0.13 -0.24 -0.04 1.88 -2.27 0.00 0.00 179.45 178.66 3mys h TYR 44 N -0.37 0.89 -0.21 1.91 0.05 -1.28 -1.18 116.97 116.78 3mys h TYR 44 Ca 0.04 -0.14 -0.01 0.00 0.05 0.00 0.00 58.73 58.66 3mys h TYR 44 Cb 0.41 -0.24 -0.01 0.00 1.01 0.00 0.00 36.73 37.90 3mys h TYR 44 CO -0.21 0.83 0.09 -0.09 -1.05 0.00 0.00 178.16 177.73 3mys h ARG 45 N 0.76 0.32 0.00 4.88 2.43 -1.03 -2.96 114.38 118.77 3mys h ARG 45 Ca 0.14 -0.06 -0.11 0.00 -0.81 0.00 0.00 59.98 59.14 3mys h ARG 45 Cb 0.51 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.99 3mys h ARG 45 CO 0.03 0.37 -0.55 -0.44 -1.51 0.00 0.00 179.97 177.87 3mys h ASP 46 N 0.19 0.00 -0.54 -3.80 3.32 -0.64 -0.31 116.42 114.65 3mys h ASP 46 Ca 0.07 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.12 3mys h ASP 46 Cb 0.17 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.69 3mys h ASP 46 CO -0.01 0.55 0.34 0.00 -1.72 0.00 0.00 179.24 178.40 3mys h ALA 47 N 1.45 0.69 -0.18 3.45 0.00 -1.17 0.13 119.26 123.62 3mys h ALA 47 Ca -0.01 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.73 3mys h ALA 47 Cb 1.07 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.64 3mys h ALA 47 CO 0.07 0.15 -0.37 0.35 0.00 0.00 0.00 179.25 179.45 3mys h PHE 48 N 0.73 0.72 -0.20 0.00 3.57 -1.24 -2.36 116.94 118.17 3mys h PHE 48 Ca 0.20 -0.26 -0.03 0.00 3.53 0.00 0.00 57.97 61.41 3mys h PHE 48 Cb -0.05 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 38.55 3mys h PHE 48 CO -0.03 1.01 0.01 -0.07 -2.23 0.00 0.00 178.31 177.00 3mys h LEU 49 N 0.23 0.26 -0.49 0.59 3.38 -0.93 -2.11 115.31 116.25 3mys h LEU 49 Ca 0.01 -0.03 -0.08 0.00 0.09 0.00 0.00 57.88 57.86 3mys h LEU 49 Cb 0.97 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.64 3mys h LEU 49 CO 0.08 0.31 -0.02 -1.28 0.09 0.00 0.00 178.44 177.62 3mys h SER 50 N 0.28 0.86 -0.67 -0.43 0.87 -0.60 -2.08 113.55 111.80 3mys h SER 50 Ca 0.07 -0.32 0.04 0.00 -1.23 0.00 0.00 61.79 60.35 3mys h SER 50 Cb 0.18 -0.23 -0.05 0.00 -0.44 0.00 0.00 62.40 61.86 3mys h SER 50 CO 0.00 0.97 0.40 -0.74 -0.53 0.00 0.00 176.83 176.93 3mys h HIS 51 N 0.74 0.74 -0.49 2.24 -0.00 -0.84 -1.32 115.15 116.21 3mys h HIS 51 Ca 0.14 0.02 -0.04 0.00 -0.00 0.00 0.00 60.37 60.49 3mys h HIS 51 Cb 0.54 -0.23 -0.02 0.00 -0.00 0.00 0.00 27.41 27.69 3mys h HIS 51 CO 0.04 0.39 0.15 -0.07 -0.00 0.00 0.00 177.93 178.45 3mys h LEU 52 N 0.76 0.66 -0.91 0.26 3.38 -1.32 -2.76 115.31 115.38 3mys h LEU 52 Ca 0.28 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.16 3mys h LEU 52 Cb 0.10 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.68 3mys h LEU 52 CO -0.14 0.63 0.00 -1.13 0.09 0.00 0.00 178.44 177.89 3mys h ASN 53 N 0.71 0.00 1.26 -0.43 -0.73 -0.53 -1.12 115.58 114.74 3mys h ASN 53 Ca 0.17 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.34 3mys h ASN 53 Cb 0.21 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.80 3mys h ASN 53 CO -0.01 0.00 -0.05 -0.62 -0.37 0.00 0.00 177.43 176.38 3mys n GLU 54 N -2.38 0.17 -1.84 6.67 1.02 -0.94 -4.91 120.64 118.43 3mys n GLU 54 Ca 0.01 0.13 -0.38 0.00 -0.02 0.00 0.00 57.16 56.91 3mys n GLU 54 Cb 0.22 -1.69 0.04 0.00 -0.02 0.00 0.00 31.44 29.98 3mys n GLU 54 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 3mys s TYR 55 N -3.07 2.34 -0.94 -0.32 1.51 -0.43 -4.85 117.35 111.59 3mys s TYR 55 Ca 0.11 1.40 -0.24 0.00 -1.01 0.00 0.00 57.07 57.33 3mys s TYR 55 Cb 0.15 -3.74 -0.04 0.00 -0.11 0.00 0.00 41.96 38.22 3mys s TYR 55 CO 0.59 -2.73 1.88 -1.12 -1.11 0.00 0.00 175.55 173.06 3mys s SER 56 N -1.03 5.32 0.05 2.29 0.01 -1.26 -4.90 113.70 114.18 3mys s SER 56 Ca 0.71 -0.87 0.01 0.00 1.31 0.00 0.00 55.95 57.11 3mys s SER 56 Cb -0.39 -2.56 -0.03 0.00 0.21 0.00 0.00 66.02 63.25 3mys s SER 56 CO 0.46 -2.60 -0.05 -0.76 0.41 0.00 0.00 173.24 170.69 3mys s LEU 57 N 9.47 2.38 0.24 2.44 1.43 -1.26 -5.13 118.68 128.25 3mys s LEU 57 Ca 0.67 -0.78 -0.30 0.00 -1.03 0.00 0.00 54.13 52.68 3mys s LEU 57 Cb -0.05 0.02 -0.10 0.00 0.03 0.00 0.00 46.19 46.09 3mys s LEU 57 CO -0.01 -0.41 1.42 -1.61 0.23 0.00 0.00 176.35 175.98 3mys s GLU 58 N -2.80 4.28 0.35 1.70 2.02 -1.26 -4.81 118.70 118.18 3mys s GLU 58 Ca -0.01 2.27 0.15 0.00 0.02 0.00 0.00 54.97 57.40 3mys s GLU 58 Cb -0.01 -3.12 1.14 0.00 0.10 0.00 0.00 34.13 32.24 3mys s GLU 58 CO -0.04 -0.40 1.63 1.49 0.02 0.00 0.00 175.26 177.96 3mys h GLU 59 N 5.11 0.20 -0.49 1.61 4.57 -1.99 0.21 114.58 123.80 3mys h GLU 59 Ca -0.46 -0.01 -0.08 0.00 -1.18 0.00 0.00 59.36 57.63 3mys h GLU 59 Cb 1.22 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 29.74 3mys h GLU 59 CO 0.78 0.14 -0.01 0.93 -1.18 0.00 0.00 179.01 179.66 3mys h GLU 60 N 0.21 0.82 -0.29 1.92 3.07 -2.01 -2.60 114.58 115.71 3mys h GLU 60 Ca 0.76 -0.23 -0.06 0.00 -0.50 0.00 0.00 59.36 59.33 3mys h GLU 60 Cb 1.80 -0.09 -0.01 0.00 -0.84 0.00 0.00 28.75 29.61 3mys h GLU 60 CO -0.67 0.83 -0.04 0.82 -1.40 0.00 0.00 179.01 178.55 3mys h ILE 61 N 0.76 1.27 -1.00 3.13 1.08 -0.96 -2.82 117.51 118.96 3mys h ILE 61 Ca 0.14 -1.03 0.20 0.00 -0.39 0.00 0.00 64.86 63.79 3mys h ILE 61 Cb 0.48 1.37 -0.11 0.00 -3.07 0.00 0.00 36.82 35.49 3mys h ILE 61 CO 0.02 0.33 0.61 0.11 -0.69 0.00 0.00 178.15 178.53 3mys h LYS 62 N 0.30 0.70 -0.03 2.37 1.57 -1.25 -0.31 116.57 119.92 3mys h LYS 62 Ca 0.08 -0.04 -0.20 0.00 -1.87 0.00 0.00 60.65 58.61 3mys h LYS 62 Cb 0.50 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.65 3mys h LYS 62 CO 0.02 0.46 -0.85 1.05 -0.57 0.00 0.00 179.45 179.57 3mys h GLU 63 N 0.72 0.35 -0.17 3.15 4.11 -1.28 -2.21 114.58 119.24 3mys h GLU 63 Ca 0.59 -0.34 -0.01 0.00 0.07 0.00 0.00 59.36 59.67 3mys h GLU 63 Cb 0.97 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.30 3mys h GLU 63 CO -0.39 1.01 0.09 0.45 0.07 0.00 0.00 179.01 180.24 3mys h HIS 64 N 0.21 0.25 -0.49 2.06 3.86 -1.13 -2.29 115.15 117.62 3mys h HIS 64 Ca -0.05 -0.01 0.09 0.00 -1.16 0.00 0.00 60.37 59.24 3mys h HIS 64 Cb 1.46 -0.08 -0.08 0.00 1.06 0.00 0.00 27.41 29.77 3mys h HIS 64 CO 0.05 0.26 0.01 0.82 0.86 0.00 0.00 177.93 179.93 3mys h ILE 65 N 0.16 0.63 -0.08 2.45 5.03 -1.06 0.39 117.51 125.03 3mys h ILE 65 Ca 0.06 -0.04 -0.14 0.00 -0.12 0.00 0.00 64.86 64.62 3mys h ILE 65 Cb 0.11 0.49 -0.01 0.00 -3.03 0.00 0.00 36.82 34.38 3mys h ILE 65 CO -0.01 0.02 -0.57 0.77 -0.68 0.00 0.00 178.15 177.68 3mys h SER 66 N 0.13 0.28 -0.15 1.72 4.64 -1.33 0.01 113.55 118.85 3mys h SER 66 Ca 0.24 -0.15 -0.03 0.00 -0.47 0.00 0.00 61.79 61.38 3mys h SER 66 Cb 0.36 -0.08 -0.00 0.00 -0.31 0.00 0.00 62.40 62.37 3mys h SER 66 CO -0.40 0.79 -0.04 0.50 -0.87 0.00 0.00 176.83 176.82 3mys h LYS 67 N 0.19 0.29 0.33 4.77 3.64 -0.88 -1.22 116.57 123.68 3mys h LYS 67 Ca -0.00 -0.11 -0.02 0.00 -1.27 0.00 0.00 60.65 59.25 3mys h LYS 67 Cb 1.06 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.87 3mys h LYS 67 CO 0.09 0.58 -0.16 -0.92 -2.27 0.00 0.00 179.45 176.77 3mys h TYR 68 N -0.02 -0.41 0.00 1.91 3.20 -0.67 -3.10 116.97 117.89 3mys h TYR 68 Ca 0.04 -0.01 -0.12 0.00 3.14 0.00 0.00 58.73 61.77 3mys h TYR 68 Cb 0.47 0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.86 3mys h TYR 68 CO 0.05 -0.23 -0.59 1.88 -1.64 0.00 0.00 178.16 177.64 3mys h TYR 69 N -0.48 0.00 -0.31 -3.82 0.05 -0.97 -1.47 116.97 109.97 3mys h TYR 69 Ca -0.05 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.72 3mys h TYR 69 Cb 0.37 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.09 3mys h TYR 69 CO -0.04 0.59 0.13 -0.22 -1.05 0.00 0.00 178.16 177.57 3mys h LYS 70 N 0.00 0.45 -0.60 4.88 3.64 -1.27 -1.15 116.57 122.53 3mys h LYS 70 Ca -0.01 -0.08 -0.04 0.00 -1.27 0.00 0.00 60.65 59.26 3mys h LYS 70 Cb 1.22 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.93 3mys h LYS 70 CO 0.08 0.45 0.23 1.25 -2.27 0.00 0.00 179.45 179.19 3mys h LEU 71 N 0.35 0.83 -0.41 5.20 5.85 -1.41 -0.70 115.31 125.02 3mys h LEU 71 Ca 0.10 -0.17 0.06 0.00 0.84 0.00 0.00 57.88 58.71 3mys h LEU 71 Cb 0.16 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 40.92 3mys h LEU 71 CO -0.01 0.78 0.12 0.25 -0.34 0.00 0.00 178.44 179.23 3mys h LEU 72 N 0.83 0.09 0.72 2.25 5.85 -0.95 0.38 115.31 124.47 3mys h LEU 72 Ca 0.20 0.06 -0.04 0.00 0.84 0.00 0.00 57.88 58.94 3mys h LEU 72 Cb 0.21 0.06 0.01 0.00 0.37 0.00 0.00 40.66 41.31 3mys h LEU 72 CO -0.02 0.09 -0.34 -0.26 -0.34 0.00 0.00 178.44 177.57 3mys h PHE 73 N 0.27 -0.89 -0.37 1.25 0.04 -1.06 -2.85 116.94 113.32 3mys h PHE 73 Ca 0.20 -0.02 0.01 0.00 2.80 0.00 0.00 57.97 60.96 3mys h PHE 73 Cb 0.21 0.30 -0.02 0.00 2.20 0.00 0.00 35.95 38.63 3mys h PHE 73 CO -0.17 -0.55 0.22 -0.44 -0.60 0.00 0.00 178.31 176.76 3mys h ASP 74 N -0.98 0.35 0.28 2.17 3.32 -0.45 0.78 116.42 121.89 3mys h ASP 74 Ca -0.10 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 56.88 3mys h ASP 74 Cb 0.74 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 40.21 3mys h ASP 74 CO 0.16 0.26 -0.32 0.22 -1.72 0.00 0.00 179.24 177.84 3mys h TYR 75 N 0.44 0.08 0.00 4.55 3.20 -0.35 -2.93 116.97 121.97 3mys h TYR 75 Ca 0.15 -0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.95 3mys h TYR 75 Cb 0.00 -0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.24 3mys h TYR 75 CO -0.07 0.39 -1.51 0.09 -1.64 0.00 0.00 178.16 175.42 3mys n ASN 76 N -4.14 2.72 0.05 -2.11 3.02 -0.92 -4.57 115.26 109.32 3mys n ASN 76 Ca -0.02 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.53 3mys n ASN 76 Cb 0.38 1.22 -0.06 0.00 -0.61 0.00 0.00 39.78 40.71 3mys n ASN 76 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3mys s LEU 78 N -5.96 4.20 0.00 0.00 1.43 -1.10 -4.63 118.68 112.61 3mys s LEU 78 Ca -0.01 0.31 0.00 0.00 -1.03 0.00 0.00 54.13 53.40 3mys s LEU 78 Cb 0.08 -2.04 0.00 0.00 0.03 0.00 0.00 46.19 44.26 3mys s LEU 78 CO 0.80 0.30 0.00 0.61 0.23 0.00 0.00 176.35 178.29 3mys n GLY 79 N 2.72 0.81 2.75 -3.19 0.00 -1.26 -4.86 105.19 102.16 3mys n GLY 79 Ca -0.18 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.68 3mys n GLY 79 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mys n GLY 80 N 0.00 1.12 0.20 -0.02 0.00 -1.26 -4.97 105.19 100.26 3mys n GLY 80 Ca 0.00 -2.07 0.05 0.00 0.00 0.00 0.00 46.02 43.99 3mys n GLY 80 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3mys h LYS 81 N 0.00 0.00 -1.57 1.61 1.57 -1.99 -3.47 116.57 112.72 3mys h LYS 81 Ca -0.22 0.00 -0.29 0.00 -1.87 0.00 0.00 60.65 58.27 3mys h LYS 81 Cb 0.87 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 33.13 3mys h LYS 81 CO 0.26 0.30 -0.34 0.09 -0.57 0.00 0.00 179.45 179.20 3mys n ASN 82 N -4.04 -4.55 -0.10 0.86 5.03 -1.26 -4.31 115.26 106.89 3mys n ASN 82 Ca -0.02 0.12 0.14 0.00 0.87 0.00 0.00 54.58 55.69 3mys n ASN 82 Cb 0.36 -3.57 0.52 0.00 -1.02 0.00 0.00 39.78 36.07 3mys n ASN 82 CO 0.00 0.00 0.00 0.78 -1.83 0.00 0.00 177.26 176.21 3mys h ASN 83 N 0.00 0.34 0.46 6.41 2.35 -1.95 -1.09 115.58 122.09 3mys h ASN 83 Ca -0.33 0.01 -0.29 0.00 -0.55 0.00 0.00 56.30 55.15 3mys h ASN 83 Cb 1.14 -0.06 0.02 0.00 0.05 0.00 0.00 38.32 39.47 3mys h ASN 83 CO 0.42 0.20 -1.26 0.03 -1.65 0.00 0.00 177.43 175.16 3mys h ARG 84 N 0.37 0.39 0.69 0.81 3.08 -1.92 -1.47 114.38 116.34 3mys h ARG 84 Ca 0.30 -0.61 -0.03 0.00 0.07 0.00 0.00 59.98 59.70 3mys h ARG 84 Cb 0.66 0.22 0.01 0.00 0.08 0.00 0.00 29.97 30.94 3mys h ARG 84 CO -0.08 1.28 -0.33 0.78 -1.07 0.00 0.00 179.97 180.54 3mys h GLY 85 N 1.07 -0.97 0.33 0.04 0.00 -1.69 -2.95 103.07 98.90 3mys h GLY 85 Ca -0.16 0.36 0.19 0.00 0.00 0.00 0.00 47.33 47.71 3mys h GLY 85 CO 0.22 -0.35 0.59 -2.22 0.00 0.00 0.00 176.54 174.78 3mys h ILE 86 N -1.10 0.72 -0.08 2.60 2.04 -1.31 -0.23 117.51 120.16 3mys h ILE 86 Ca -0.10 -0.19 -0.04 0.00 1.00 0.00 0.00 64.86 65.54 3mys h ILE 86 Cb 0.75 0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 36.95 3mys h ILE 86 CO 0.16 0.10 -0.13 0.25 0.00 0.00 0.00 178.15 178.52 3mys h LEU 87 N 0.55 0.11 0.36 1.44 5.85 -1.10 -1.61 115.31 120.91 3mys h LEU 87 Ca 0.48 -0.02 -0.02 0.00 0.84 0.00 0.00 57.88 59.17 3mys h LEU 87 Cb 1.00 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.01 3mys h LEU 87 CO -0.22 0.26 -0.17 0.58 -0.34 0.00 0.00 178.44 178.55 3mys h VAL 88 N 0.12 0.54 -0.32 1.05 2.07 -0.90 -2.52 116.25 116.29 3mys h VAL 88 Ca 0.02 -0.62 0.05 0.00 0.82 0.00 0.00 66.70 66.98 3mys h VAL 88 Cb 0.32 0.80 -0.08 0.00 -1.52 0.00 0.00 31.29 30.80 3mys h VAL 88 CO 0.02 0.10 -0.47 0.40 0.02 0.00 0.00 177.57 177.63 3mys h ILE 89 N -0.89 0.07 -0.72 4.57 5.03 -1.14 -0.09 117.51 124.35 3mys h ILE 89 Ca -0.05 0.00 -0.02 0.00 -0.12 0.00 0.00 64.86 64.67 3mys h ILE 89 Cb 0.54 0.07 -0.03 0.00 -3.03 0.00 0.00 36.82 34.37 3mys h ILE 89 CO 0.08 0.00 0.37 -0.07 -0.68 0.00 0.00 178.15 177.85 3mys h LEU 90 N -0.41 0.93 -0.60 1.44 3.38 -1.40 -1.59 115.31 117.06 3mys h LEU 90 Ca 0.10 -0.12 -0.08 0.00 0.09 0.00 0.00 57.88 57.86 3mys h LEU 90 Cb 0.61 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 3mys h LEU 90 CO -0.53 0.78 0.04 0.40 0.09 0.00 0.00 178.44 179.23 3mys h ILE 91 N 1.00 1.26 -0.57 1.22 5.03 -1.11 -1.09 117.51 123.25 3mys h ILE 91 Ca 0.25 -1.08 0.08 0.00 -0.12 0.00 0.00 64.86 63.99 3mys h ILE 91 Cb 0.09 0.79 -0.07 0.00 -3.03 0.00 0.00 36.82 34.60 3mys h ILE 91 CO -0.03 0.39 0.22 0.22 -0.68 0.00 0.00 178.15 178.27 3mys h TYR 92 N 0.92 0.39 0.17 1.37 3.20 -0.32 0.12 116.97 122.83 3mys h TYR 92 Ca 0.17 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 62.06 3mys h TYR 92 Cb 0.50 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 38.68 3mys h TYR 92 CO 0.04 0.12 -0.08 1.49 -1.64 0.00 0.00 178.16 178.08 3mys h GLU 93 N 0.41 -0.22 -0.01 1.82 4.81 -1.09 -3.35 114.58 116.95 3mys h GLU 93 Ca 0.28 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.53 3mys h GLU 93 Cb 0.32 0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.75 3mys h GLU 93 CO -0.27 0.12 -0.02 0.66 -0.73 0.00 0.00 179.01 178.77 3mys n TYR 94 N -5.03 0.00 -0.19 0.92 4.01 -0.43 -3.66 117.16 112.77 3mys n TYR 94 Ca -0.09 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.66 3mys n TYR 94 Cb 0.23 -0.01 0.10 0.00 -0.31 0.00 0.00 39.34 39.35 3mys n TYR 94 CO 0.00 0.00 0.00 -0.39 -0.46 0.00 0.00 176.86 176.01 3mys h VAL 95 N 2.00 0.59 -2.64 -0.72 -1.51 -1.11 -3.33 116.25 109.53 3mys h VAL 95 Ca 0.00 -0.07 -0.11 0.00 -1.23 0.00 0.00 66.70 65.29 3mys h VAL 95 Cb 0.44 0.38 -0.26 0.00 -2.13 0.00 0.00 31.29 29.72 3mys h VAL 95 CO 0.00 0.04 -0.28 -0.75 -1.23 0.00 0.00 177.57 175.35 3mys s LYS 96 N -6.12 0.42 -0.04 5.19 2.20 -1.24 -4.81 119.74 115.33 3mys s LYS 96 Ca -0.13 0.76 -0.30 0.00 -0.36 0.00 0.00 55.97 55.94 3mys s LYS 96 Cb 0.18 0.03 -0.06 0.00 -1.51 0.00 0.00 37.83 36.47 3mys s LYS 96 CO 0.74 -0.14 1.64 1.21 -0.36 0.00 0.00 175.35 178.44 3mys s ASN 97 N 1.18 6.67 -0.07 1.43 2.47 -1.26 -4.92 114.94 120.45 3mys s ASN 97 Ca -0.08 2.25 -0.32 0.00 0.42 0.00 0.00 52.86 55.13 3mys s ASN 97 Cb -0.07 -2.54 0.12 0.00 -1.45 0.00 0.00 41.25 37.31 3mys s ASN 97 CO -0.10 -0.91 1.23 0.00 -3.72 0.00 0.00 177.10 173.59 3mys s ARG 98 N 3.84 0.43 0.18 0.43 1.70 -1.26 -5.15 118.95 119.11 3mys s ARG 98 Ca 0.73 -0.21 -0.28 0.00 -0.47 0.00 0.00 55.73 55.50 3mys s ARG 98 Cb -0.34 0.16 -0.08 0.00 -0.57 0.00 0.00 34.95 34.13 3mys s ARG 98 CO 0.30 -0.19 0.88 0.16 -1.08 0.00 0.00 175.30 175.36 3mys s ASP 99 N -2.68 7.51 -0.10 -2.89 3.84 -1.26 -5.04 116.67 116.05 3mys s ASP 99 Ca 0.12 1.79 -0.01 0.00 -0.00 0.00 0.00 52.55 54.44 3mys s ASP 99 Cb 0.02 -2.56 0.03 0.00 -1.38 0.00 0.00 42.92 39.03 3mys s ASP 99 CO -0.04 0.12 -0.00 -0.63 -0.00 0.00 0.00 175.17 174.61 3mys s ILE 100 N -0.84 0.49 0.62 2.11 1.01 -1.26 -5.15 121.20 118.19 3mys s ILE 100 Ca 0.40 -0.06 -0.04 0.00 0.00 0.00 0.00 60.65 60.96 3mys s ILE 100 Cb -0.24 -0.69 0.04 0.00 0.01 0.00 0.00 42.46 41.57 3mys s ILE 100 CO 0.29 0.19 0.90 0.54 0.00 0.00 0.00 174.94 176.86 3mys s ASN 101 N 1.92 5.14 0.48 3.58 2.20 -1.26 -4.90 114.94 122.11 3mys s ASN 101 Ca 0.04 0.34 0.24 0.00 -0.94 0.00 0.00 52.86 52.53 3mys s ASN 101 Cb -0.13 -1.15 1.24 0.00 -2.00 0.00 0.00 41.25 39.21 3mys s ASN 101 CO -0.06 -1.32 2.00 0.77 -2.94 0.00 0.00 177.10 175.55 3mys h SER 102 N -0.26 0.00 0.24 3.54 4.64 -2.01 -0.48 113.55 119.22 3mys h SER 102 Ca -0.44 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 60.68 3mys h SER 102 Cb 1.30 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.39 3mys h SER 102 CO 0.58 0.17 -0.80 -1.28 -0.87 0.00 0.00 176.83 174.63 3mys h SER 103 N 0.00 0.54 0.47 4.97 0.87 -1.99 -1.79 113.55 116.62 3mys h SER 103 Ca -0.00 -0.38 -0.15 0.00 -1.23 0.00 0.00 61.79 60.03 3mys h SER 103 Cb 0.43 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.22 3mys h SER 103 CO 0.02 1.14 -0.64 -0.33 -0.53 0.00 0.00 176.83 176.49 3mys h GLU 104 N 0.29 0.16 0.00 2.24 5.08 -1.49 -2.86 114.58 118.00 3mys h GLU 104 Ca -0.05 -0.12 -0.14 0.00 -1.00 0.00 0.00 59.36 58.06 3mys h GLU 104 Cb 1.39 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.64 3mys h GLU 104 CO 0.14 0.75 -0.66 -1.49 -1.00 0.00 0.00 179.01 176.75 3mys h TRP 105 N 0.11 0.00 -0.93 4.33 4.06 -1.34 -2.98 115.95 119.20 3mys h TRP 105 Ca -0.01 0.00 0.06 0.00 2.06 0.00 0.00 58.89 61.00 3mys h TRP 105 Cb 1.15 0.00 -0.06 0.00 -1.00 0.00 0.00 29.16 29.25 3mys h TRP 105 CO 0.02 0.66 0.59 1.49 -3.56 0.00 0.00 178.44 177.64 3mys h GLU 106 N 0.00 1.06 -0.20 0.49 4.81 -1.09 0.15 114.58 119.79 3mys h GLU 106 Ca -0.01 -0.06 -0.17 0.00 -0.13 0.00 0.00 59.36 58.99 3mys h GLU 106 Cb 1.33 -0.24 -0.00 0.00 0.63 0.00 0.00 28.75 30.47 3mys h GLU 106 CO 0.09 0.70 -0.58 0.87 -0.73 0.00 0.00 179.01 179.36 3mys h LYS 107 N 1.09 0.64 -0.15 1.92 1.57 -1.44 -2.29 116.57 117.91 3mys h LYS 107 Ca 0.40 -0.42 -0.20 0.00 -1.87 0.00 0.00 60.65 58.55 3mys h LYS 107 Cb 0.14 0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.51 3mys h LYS 107 CO -0.16 1.04 -0.72 0.00 -0.57 0.00 0.00 179.45 179.04 3mys h ALA 108 N 0.87 0.44 0.00 3.86 0.00 -1.38 -2.86 119.26 120.19 3mys h ALA 108 Ca 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 54.91 54.33 3mys h ALA 108 Cb 1.15 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.90 3mys h ALA 108 CO 0.11 0.70 0.00 0.00 0.00 0.00 0.00 179.25 180.07 3mys h ALA 109 N 0.71 1.00 0.04 0.00 0.00 -0.92 -0.64 119.26 119.45 3mys h ALA 109 Ca -0.03 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 3mys h ALA 109 Cb 1.32 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.12 3mys h ALA 109 CO 0.14 0.00 -0.02 0.00 0.00 0.00 0.00 179.25 179.37 3mys h LEU 111 N -0.55 0.71 -0.05 0.00 3.38 -1.22 0.60 115.31 118.18 3mys h LEU 111 Ca -0.01 -0.22 0.02 0.00 0.09 0.00 0.00 57.88 57.76 3mys h LEU 111 Cb 0.49 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 3mys h LEU 111 CO 0.01 0.87 -0.05 0.00 0.09 0.00 0.00 178.44 179.35 3mys h ALA 112 N 1.20 -0.01 0.00 1.53 0.00 -1.18 -2.32 119.26 118.48 3mys h ALA 112 Ca 0.11 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 3mys h ALA 112 Cb 0.61 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 3mys h ALA 112 CO 0.04 -0.53 -0.26 -1.49 0.00 0.00 0.00 179.25 177.00 3mys h TRP 113 N -0.07 0.00 -0.37 0.00 4.06 -0.83 -2.72 115.95 116.03 3mys h TRP 113 Ca 0.04 0.00 -0.09 0.00 2.06 0.00 0.00 58.89 60.90 3mys h TRP 113 Cb 0.12 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.27 3mys h TRP 113 CO -0.14 0.26 -0.15 0.00 -3.56 0.00 0.00 178.44 174.85 3mys h ILE 115 N 0.60 1.27 0.04 0.00 2.04 -1.11 0.16 117.51 120.51 3mys h ILE 115 Ca 0.10 -1.30 -0.22 0.00 1.00 0.00 0.00 64.86 64.44 3mys h ILE 115 Cb 0.60 1.68 -0.01 0.00 -0.74 0.00 0.00 36.82 38.35 3mys h ILE 115 CO 0.04 0.37 -1.01 -0.33 0.00 0.00 0.00 178.15 177.23 3mys h GLU 116 N 0.02 0.20 -0.78 2.37 4.39 -1.29 -0.60 114.58 118.89 3mys h GLU 116 Ca -0.00 -0.27 -0.05 0.00 0.34 0.00 0.00 59.36 59.39 3mys h GLU 116 Cb 0.67 0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 29.38 3mys h GLU 116 CO 0.05 1.05 0.31 0.82 -1.16 0.00 0.00 179.01 180.08 3mys h ILE 117 N 0.09 1.26 -0.36 3.13 2.04 -0.84 0.12 117.51 122.95 3mys h ILE 117 Ca -0.07 -0.82 -0.02 0.00 1.00 0.00 0.00 64.86 64.95 3mys h ILE 117 Cb 1.69 0.34 -0.02 0.00 -0.74 0.00 0.00 36.82 38.09 3mys h ILE 117 CO 0.16 0.33 0.15 0.25 0.00 0.00 0.00 178.15 179.04 3mys h LEU 118 N 1.13 0.50 -0.54 1.44 5.85 -0.68 0.15 115.31 123.16 3mys h LEU 118 Ca 0.26 -0.17 0.02 0.00 0.84 0.00 0.00 57.88 58.83 3mys h LEU 118 Cb 0.22 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.09 3mys h LEU 118 CO -0.02 0.53 0.34 -0.61 -0.34 0.00 0.00 178.44 178.34 3mys h GLN 119 N 0.44 0.67 -0.85 1.25 5.75 -0.98 -0.47 115.11 120.91 3mys h GLN 119 Ca 0.12 -0.04 0.10 0.00 -0.15 0.00 0.00 58.65 58.68 3mys h GLN 119 Cb 0.19 -0.15 -0.06 0.00 1.07 0.00 0.00 27.48 28.52 3mys h GLN 119 CO -0.01 0.44 0.55 0.00 -2.65 0.00 0.00 178.83 177.17 3mys h ALA 120 N 1.22 1.71 -0.01 3.38 0.00 -0.11 0.79 119.26 126.24 3mys h ALA 120 Ca 0.21 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 3mys h ALA 120 Cb -0.03 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.59 3mys h ALA 120 CO -0.07 0.10 -0.05 0.00 0.00 0.00 0.00 179.25 179.23 3mys h ALA 121 N 1.58 0.03 -0.79 0.00 0.00 0.15 -2.63 119.26 117.60 3mys h ALA 121 Ca 0.40 -0.34 0.17 0.00 0.00 0.00 0.00 54.91 55.15 3mys h ALA 121 Cb 0.47 -0.00 -0.11 0.00 0.00 0.00 0.00 17.79 18.15 3mys h ALA 121 CO -0.17 -0.12 0.27 0.74 0.00 0.00 0.00 179.25 179.97 3mys h PHE 122 N -0.55 0.44 -0.02 0.00 0.04 -0.80 -1.73 116.94 114.33 3mys h PHE 122 Ca -0.00 0.04 -0.17 0.00 2.80 0.00 0.00 57.97 60.64 3mys h PHE 122 Cb 0.69 -0.07 -0.01 0.00 2.20 0.00 0.00 35.95 38.75 3mys h PHE 122 CO 0.14 -0.04 -0.76 1.37 -0.60 0.00 0.00 178.31 178.43 3mys h LEU 123 N 0.35 0.20 -0.68 1.54 8.10 -0.80 0.43 115.31 124.46 3mys h LEU 123 Ca 0.46 -0.15 -0.12 0.00 0.11 0.00 0.00 57.88 58.18 3mys h LEU 123 Cb 0.79 -0.06 -0.01 0.00 -0.44 0.00 0.00 40.66 40.93 3mys h LEU 123 CO -0.49 0.88 -0.32 0.58 -4.11 0.00 0.00 178.44 174.99 3mys h VAL 124 N 0.11 1.28 -0.02 0.15 2.07 -1.09 -2.10 116.25 116.65 3mys h VAL 124 Ca -0.02 -1.45 -0.05 0.00 0.82 0.00 0.00 66.70 65.99 3mys h VAL 124 Cb 1.33 1.39 0.00 0.00 -1.52 0.00 0.00 31.29 32.49 3mys h VAL 124 CO 0.11 0.47 -0.20 0.00 0.02 0.00 0.00 177.57 177.98 3mys h ALA 125 N 1.08 0.05 -0.85 1.67 0.00 -0.90 -2.65 119.26 117.66 3mys h ALA 125 Ca 0.06 -0.42 0.09 0.00 0.00 0.00 0.00 54.91 54.64 3mys h ALA 125 Cb 0.82 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.56 3mys h ALA 125 CO 0.07 0.04 0.55 0.22 0.00 0.00 0.00 179.25 180.13 3mys h ASP 126 N -0.44 0.76 0.34 0.00 -0.00 -0.12 -0.87 116.42 116.09 3mys h ASP 126 Ca -0.02 0.02 -0.15 0.00 -0.00 0.00 0.00 57.03 56.87 3mys h ASP 126 Cb 0.89 -0.14 -0.01 0.00 -0.00 0.00 0.00 39.33 40.07 3mys h ASP 126 CO 0.04 0.46 -0.63 0.44 -0.00 0.00 0.00 179.24 179.55 3mys h ASP 127 N 0.85 0.33 -0.21 2.28 3.32 -1.31 0.92 116.42 122.59 3mys h ASP 127 Ca 0.39 -0.19 -0.02 0.00 0.02 0.00 0.00 57.03 57.22 3mys h ASP 127 Cb 0.37 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.82 3mys h ASP 127 CO -0.15 0.87 0.04 0.40 -1.72 0.00 0.00 179.24 178.68 3mys h ILE 128 N 0.21 1.22 -0.06 0.35 2.04 -0.86 0.27 117.51 120.67 3mys h ILE 128 Ca -0.01 -0.72 -0.03 0.00 1.00 0.00 0.00 64.86 65.10 3mys h ILE 128 Cb 1.16 1.30 -0.00 0.00 -0.74 0.00 0.00 36.82 38.54 3mys h ILE 128 CO 0.10 0.22 -0.08 0.24 0.00 0.00 0.00 178.15 178.63 3mys h MET 129 N 0.14 0.17 -0.00 2.37 2.86 -1.02 -2.84 114.93 116.60 3mys h MET 129 Ca 0.06 -0.10 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 3mys h MET 129 Cb 0.30 0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.97 3mys h MET 129 CO 0.00 0.64 -0.00 -0.25 1.06 0.00 0.00 176.91 178.36 3mys n ASP 130 N -4.70 0.16 -3.61 1.22 8.00 0.30 -4.92 116.55 113.00 3mys n ASP 130 Ca -0.08 -0.98 -0.27 0.00 0.71 0.00 0.00 54.79 54.17 3mys n ASP 130 Cb 0.32 -0.02 0.05 0.00 -0.02 0.00 0.00 41.12 41.45 3mys n ASP 130 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3mys n LYS 131 N -0.90 -1.79 -0.99 -1.24 4.76 0.31 -4.97 118.16 113.34 3mys n LYS 131 Ca 0.23 0.55 -0.29 0.00 -2.87 0.00 0.00 58.31 55.93 3mys n LYS 131 Cb 0.15 -4.55 0.21 0.00 -1.84 0.00 0.00 35.03 28.99 3mys n LYS 131 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 3mys s GLY 132 N -3.56 1.55 0.00 0.72 0.00 0.69 -5.03 107.32 101.69 3mys s GLY 132 Ca 0.42 -0.42 0.00 0.00 0.00 0.00 0.00 44.72 44.72 3mys s GLY 132 CO 0.83 0.27 0.00 1.18 0.00 0.00 0.00 173.10 175.39 3mys n GLU 133 N -4.50 0.00 -4.06 2.90 1.02 -1.26 -4.88 120.64 109.85 3mys n GLU 133 Ca 0.05 0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 57.06 3mys n GLU 133 Cb 0.57 -0.69 -0.12 0.00 -0.02 0.00 0.00 31.44 31.18 3mys n GLU 133 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 3mys s MET 134 N -1.83 0.51 -0.20 3.49 -1.94 -1.26 -2.70 119.30 115.37 3mys s MET 134 Ca 0.00 -0.71 -0.10 0.00 -1.71 0.00 0.00 55.69 53.17 3mys s MET 134 Cb 0.00 -0.28 0.07 0.00 2.01 0.00 0.00 34.83 36.63 3mys s MET 134 CO 0.00 0.05 0.48 0.50 -0.01 0.00 0.00 175.02 176.04 3mys s ARG 135 N -1.47 0.44 -1.42 2.03 6.06 -0.48 -4.42 118.95 119.71 3mys s ARG 135 Ca -0.09 0.96 -0.08 0.00 -2.50 0.00 0.00 55.73 54.01 3mys s ARG 135 Cb -0.09 0.13 0.05 0.00 0.06 0.00 0.00 34.95 35.09 3mys s ARG 135 CO 0.00 -0.18 0.62 0.54 -2.50 0.00 0.00 175.30 173.78 3mys n ARG 136 N 4.58 -4.33 -1.09 5.12 1.74 -0.99 -2.45 116.66 119.24 3mys n ARG 136 Ca -0.19 0.65 -0.03 0.00 -0.77 0.00 0.00 57.85 57.51 3mys n ARG 136 Cb 0.54 -5.45 -0.01 0.00 -1.02 0.00 0.00 32.46 26.52 3mys n ARG 136 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3mys n ASN 137 N -2.46 -4.19 -4.37 0.55 4.13 -0.10 -4.93 115.26 103.89 3mys n ASN 137 Ca -0.04 0.07 -0.19 0.00 1.68 0.00 0.00 54.58 56.11 3mys n ASN 137 Cb 0.57 -1.95 -0.10 0.00 -1.54 0.00 0.00 39.78 36.75 3mys n ASN 137 CO 0.00 0.00 0.00 -1.59 0.28 0.00 0.00 177.26 175.95 3mys s LYS 138 N -1.48 1.53 0.32 3.52 -2.85 -1.03 -5.08 119.74 114.66 3mys s LYS 138 Ca 0.00 -1.84 -0.29 0.00 -1.00 0.00 0.00 55.97 52.84 3mys s LYS 138 Cb 0.00 -0.53 -0.12 0.00 -2.06 0.00 0.00 37.83 35.12 3mys s LYS 138 CO 0.00 -0.25 1.37 0.66 0.10 0.00 0.00 175.35 177.22 3mys n TYR 139 N -0.57 2.38 -1.67 1.78 0.53 -1.26 -1.38 117.16 116.97 3mys n TYR 139 Ca -0.01 0.48 -0.45 0.00 -1.02 0.00 0.00 57.90 56.90 3mys n TYR 139 Cb 0.66 -2.46 -0.04 0.00 -1.03 0.00 0.00 39.34 36.48 3mys n TYR 139 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 3mys h TRP 141 N 5.39 0.84 0.00 0.00 2.91 -1.94 0.07 115.95 123.23 3mys h TRP 141 Ca -0.45 0.04 -0.03 0.00 1.13 0.00 0.00 58.89 59.58 3mys h TRP 141 Cb 1.26 -0.22 -0.00 0.00 -0.51 0.00 0.00 29.16 29.68 3mys h TRP 141 CO 0.61 0.04 -0.14 0.10 -1.03 0.00 0.00 178.44 178.02 3mys h TYR 142 N 0.52 0.00 0.00 2.65 -0.00 -1.90 -2.77 116.97 115.48 3mys h TYR 142 Ca 0.58 0.00 -0.13 0.00 0.00 0.00 0.00 58.73 59.18 3mys h TYR 142 Cb 1.07 0.00 -0.02 0.00 0.00 0.00 0.00 36.73 37.78 3mys h TYR 142 CO -0.07 0.14 -0.64 -0.07 -0.00 0.00 0.00 178.16 177.51 3mys h LEU 143 N 0.00 0.00 -9.28 0.10 3.38 -1.32 -2.91 115.31 105.28 3mys h LEU 143 Ca -0.00 0.00 -0.68 0.00 0.09 0.00 0.00 57.88 57.29 3mys h LEU 143 Cb 0.57 0.00 0.05 0.00 0.09 0.00 0.00 40.66 41.37 3mys h LEU 143 CO 0.02 0.64 0.55 0.18 0.09 0.00 0.00 178.44 179.92 3mys n LEU 144 N -3.65 1.89 0.25 1.67 4.32 -1.04 -4.76 117.00 115.68 3mys n LEU 144 Ca -0.01 1.11 0.14 0.00 -0.02 0.00 0.00 56.01 57.23 3mys n LEU 144 Cb 0.66 -1.21 0.45 0.00 -1.62 0.00 0.00 43.42 41.71 3mys n LEU 144 CO 0.42 -0.89 0.88 0.11 -1.22 0.00 0.00 177.39 176.70 3mys h LYS 145 N 5.08 0.00 0.00 3.23 1.79 -1.89 0.20 116.57 124.98 3mys h LYS 145 Ca -0.47 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.00 3mys h LYS 145 Cb 1.33 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.98 3mys h LYS 145 CO 0.81 0.05 0.00 -0.25 -1.08 0.00 0.00 179.45 178.98 3mys n ASP 146 N -3.14 0.74 0.00 0.86 8.00 -1.26 -4.53 116.55 117.21 3mys n ASP 146 Ca 0.02 0.63 0.00 0.00 0.71 0.00 0.00 54.79 56.15 3mys n ASP 146 Cb 0.42 -0.81 0.00 0.00 -0.02 0.00 0.00 41.12 40.71 3mys n ASP 146 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 3mys n VAL 147 N -2.26 0.00 -0.74 2.53 0.31 -0.53 -5.03 118.33 112.62 3mys n VAL 147 Ca 0.03 0.14 0.07 0.00 -0.01 0.00 0.00 64.34 64.58 3mys n VAL 147 Cb 0.31 -1.07 -0.04 0.00 -0.91 0.00 0.00 33.84 32.13 3mys n VAL 147 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3mys n GLU 148 N -2.23 -1.75 -0.33 5.55 1.02 0.61 -3.12 120.64 120.40 3mys n GLU 148 Ca 0.00 1.42 0.05 0.00 -0.02 0.00 0.00 57.16 58.61 3mys n GLU 148 Cb 0.00 -1.98 0.12 0.00 -0.02 0.00 0.00 31.44 29.56 3mys n GLU 148 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 3mys n THR 149 N -3.00 -0.39 -0.29 2.62 -1.04 -1.20 -1.87 114.28 109.10 3mys n THR 149 Ca -0.04 2.09 0.01 0.00 -2.04 0.00 0.00 64.05 64.06 3mys n THR 149 Cb 0.33 -2.88 0.14 0.00 -1.82 0.00 0.00 70.33 66.10 3mys n THR 149 CO 0.00 0.00 0.00 0.07 -0.64 0.00 0.00 175.07 174.50 3mys h LYS 150 N 0.00 0.85 0.00 -2.82 2.10 -1.93 0.93 116.57 115.70 3mys h LYS 150 Ca 0.42 -0.05 -0.16 0.00 -2.00 0.00 0.00 60.65 58.86 3mys h LYS 150 Cb 0.65 -0.19 -0.02 0.00 -0.90 0.00 0.00 32.23 31.77 3mys h LYS 150 CO -0.93 0.56 -0.77 -0.91 -2.00 0.00 0.00 179.45 175.40 3mys h ASN 151 N 0.88 0.00 -0.35 7.07 2.35 -1.31 -3.12 115.58 121.10 3mys h ASN 151 Ca 0.36 0.00 -0.14 0.00 -0.55 0.00 0.00 56.30 55.97 3mys h ASN 151 Cb 0.21 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.57 3mys h ASN 151 CO -0.19 0.77 -0.35 0.00 -1.65 0.00 0.00 177.43 176.02 3mys h ALA 152 N 1.23 0.51 -0.31 -0.83 0.00 -0.35 0.62 119.26 120.13 3mys h ALA 152 Ca -0.01 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.47 3mys h ALA 152 Cb 1.41 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 19.08 3mys h ALA 152 CO 0.10 0.59 0.19 0.28 0.00 0.00 0.00 179.25 180.41 3mys h VAL 153 N 0.65 1.09 -0.82 0.00 2.07 -0.99 0.11 116.25 118.36 3mys h VAL 153 Ca 0.06 -0.20 -0.02 0.00 0.82 0.00 0.00 66.70 67.35 3mys h VAL 153 Cb 0.93 0.68 -0.04 0.00 -1.52 0.00 0.00 31.29 31.34 3mys h VAL 153 CO 0.09 0.09 0.43 -1.13 0.02 0.00 0.00 177.57 177.07 3mys h ASN 154 N 0.40 1.03 0.17 0.57 -1.24 -1.39 -2.97 115.58 112.16 3mys h ASN 154 Ca 0.11 -0.11 -0.08 0.00 0.71 0.00 0.00 56.30 56.93 3mys h ASN 154 Cb -0.02 -0.26 -0.01 0.00 0.73 0.00 0.00 38.32 38.76 3mys h ASN 154 CO -0.02 0.85 -0.29 0.44 -1.29 0.00 0.00 177.43 177.11 3mys h ASP 155 N 1.14 0.19 -0.70 1.15 3.32 0.90 -2.38 116.42 120.04 3mys h ASP 155 Ca 0.29 -0.06 0.03 0.00 0.02 0.00 0.00 57.03 57.30 3mys h ASP 155 Cb 0.06 -0.05 -0.04 0.00 0.22 0.00 0.00 39.33 39.51 3mys h ASP 155 CO -0.04 0.49 0.44 0.58 -1.72 0.00 0.00 179.24 178.99 3mys h VAL 156 N 0.17 1.11 -0.26 -1.35 2.07 -0.65 0.28 116.25 117.62 3mys h VAL 156 Ca 0.03 -0.30 -0.16 0.00 0.82 0.00 0.00 66.70 67.08 3mys h VAL 156 Cb 0.61 0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 3mys h VAL 156 CO 0.04 0.16 -0.49 -0.07 0.02 0.00 0.00 177.57 177.23 3mys h LEU 157 N 0.87 0.78 0.30 2.57 3.38 -1.49 0.49 115.31 122.22 3mys h LEU 157 Ca 0.28 -0.40 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 3mys h LEU 157 Cb -0.00 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.53 3mys h LEU 157 CO -0.10 1.14 -0.14 0.25 0.09 0.00 0.00 178.44 179.68 3mys h LEU 158 N 0.56 -0.34 -0.68 1.67 5.85 -1.17 0.55 115.31 121.75 3mys h LEU 158 Ca 0.03 -0.09 0.07 0.00 0.84 0.00 0.00 57.88 58.73 3mys h LEU 158 Cb 1.06 0.09 -0.06 0.00 0.37 0.00 0.00 40.66 42.11 3mys h LEU 158 CO 0.10 -0.12 0.36 -0.07 -0.34 0.00 0.00 178.44 178.37 3mys h LEU 159 N -0.55 0.51 -0.84 2.25 3.38 -0.85 0.12 115.31 119.32 3mys h LEU 159 Ca -0.04 0.04 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 3mys h LEU 159 Cb 0.41 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 3mys h LEU 159 CO 0.07 0.31 -0.24 0.22 0.09 0.00 0.00 178.44 178.90 3mys h TYR 160 N 0.65 0.68 0.00 1.13 3.20 -0.64 -2.63 116.97 119.36 3mys h TYR 160 Ca 0.32 -0.15 -0.11 0.00 3.14 0.00 0.00 58.73 61.93 3mys h TYR 160 Cb 0.26 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.35 3mys h TYR 160 CO -0.09 0.79 -0.51 -0.91 -1.64 0.00 0.00 178.16 175.80 3mys h ASN 161 N 0.53 0.00 -0.34 -2.11 2.35 0.24 -3.12 115.58 113.14 3mys h ASN 161 Ca 0.08 0.00 0.06 0.00 -0.55 0.00 0.00 56.30 55.88 3mys h ASN 161 Cb 0.69 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.05 3mys h ASN 161 CO 0.05 0.51 0.23 0.77 -1.65 0.00 0.00 177.43 177.34 3mys h SER 162 N 0.00 0.18 -0.21 5.81 4.64 -0.43 -2.03 113.55 121.52 3mys h SER 162 Ca -0.01 -0.00 0.05 0.00 -0.47 0.00 0.00 61.79 61.36 3mys h SER 162 Cb 1.30 -0.04 -0.05 0.00 -0.31 0.00 0.00 62.40 63.29 3mys h SER 162 CO 0.07 0.12 -0.12 0.40 -0.87 0.00 0.00 176.83 176.42 3mys h ILE 163 N 0.21 0.63 0.00 0.95 2.04 -1.53 -0.82 117.51 118.99 3mys h ILE 163 Ca 0.15 0.00 -0.10 0.00 1.00 0.00 0.00 64.86 65.91 3mys h ILE 163 Cb 0.33 0.63 -0.01 0.00 -0.74 0.00 0.00 36.82 37.02 3mys h ILE 163 CO -0.03 0.00 -0.45 1.88 0.00 0.00 0.00 178.15 179.55 3mys h TYR 164 N -0.11 0.00 -0.36 1.37 0.05 -1.55 -1.53 116.97 114.84 3mys h TYR 164 Ca 0.12 0.00 -0.04 0.00 0.05 0.00 0.00 58.73 58.86 3mys h TYR 164 Cb 0.29 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.01 3mys h TYR 164 CO -0.28 0.45 0.07 -0.22 -1.05 0.00 0.00 178.16 177.13 3mys h LYS 165 N 0.00 0.60 0.34 4.88 1.63 -1.29 -1.64 116.57 121.08 3mys h LYS 165 Ca -0.00 -0.15 -0.02 0.00 -0.85 0.00 0.00 60.65 59.63 3mys h LYS 165 Cb 1.19 -0.07 0.00 0.00 -0.60 0.00 0.00 32.23 32.75 3mys h LYS 165 CO 0.06 0.65 -0.16 -0.07 -3.45 0.00 0.00 179.45 176.48 3mys h LEU 166 N 0.44 -0.38 -0.89 5.20 3.38 -0.60 0.16 115.31 122.61 3mys h LEU 166 Ca 0.11 -0.06 0.18 0.00 0.09 0.00 0.00 57.88 58.20 3mys h LEU 166 Cb 0.34 0.10 -0.11 0.00 0.09 0.00 0.00 40.66 41.08 3mys h LEU 166 CO 0.00 -0.19 0.45 0.40 0.09 0.00 0.00 178.44 179.20 3mys h ILE 167 N -0.56 0.64 -0.09 1.22 2.04 -1.35 -1.48 117.51 117.92 3mys h ILE 167 Ca -0.05 -0.20 -0.01 0.00 1.00 0.00 0.00 64.86 65.61 3mys h ILE 167 Cb 0.42 0.02 -0.00 0.00 -0.74 0.00 0.00 36.82 36.51 3mys h ILE 167 CO 0.08 0.10 0.01 -0.08 0.00 0.00 0.00 178.15 178.26 3mys h GLU 168 N 0.57 0.15 -0.85 2.37 4.81 -0.84 1.02 114.58 121.80 3mys h GLU 168 Ca 0.51 -0.04 0.12 0.00 -0.13 0.00 0.00 59.36 59.82 3mys h GLU 168 Cb 0.83 -0.02 -0.06 0.00 0.63 0.00 0.00 28.75 30.13 3mys h GLU 168 CO -0.42 0.38 0.55 0.82 -0.73 0.00 0.00 179.01 179.61 3mys h ILE 169 N -0.10 0.89 0.00 2.32 2.04 -0.29 -0.62 117.51 121.75 3mys h ILE 169 Ca 0.03 -0.25 0.00 0.00 1.00 0.00 0.00 64.86 65.64 3mys h ILE 169 Cb 0.31 0.11 0.00 0.00 -0.74 0.00 0.00 36.82 36.49 3mys h ILE 169 CO 0.00 0.13 -1.45 -1.22 0.00 0.00 0.00 178.15 175.61 3mys n TYR 170 N -4.53 0.00 -1.00 1.37 4.02 -0.62 -4.55 117.16 111.84 3mys n TYR 170 Ca 0.15 0.00 0.05 0.00 -0.01 0.00 0.00 57.90 58.10 3mys n TYR 170 Cb 0.40 -0.23 0.07 0.00 -0.02 0.00 0.00 39.34 39.56 3mys n TYR 170 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 3mys n LEU 171 N -1.85 1.65 -0.41 7.72 4.32 0.35 -4.81 117.00 123.96 3mys n LEU 171 Ca -0.02 -2.22 0.37 0.00 -0.02 0.00 0.00 56.01 54.12 3mys n LEU 171 Cb 0.27 -0.22 0.63 0.00 -1.62 0.00 0.00 43.42 42.47 3mys n LEU 171 CO 0.22 0.52 1.13 -1.14 -1.22 0.00 0.00 177.39 176.90 3mys n ARG 172 N -0.85 -0.04 0.00 3.23 0.63 -0.24 -2.24 116.66 117.15 3mys n ARG 172 Ca 0.08 1.24 0.04 0.00 -0.92 0.00 0.00 57.85 58.29 3mys n ARG 172 Cb 0.55 -2.38 0.02 0.00 0.45 0.00 0.00 32.46 31.10 3mys n ARG 172 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 3mys n ASN 173 N -4.79 1.42 -4.79 6.15 5.03 -1.26 -4.99 115.26 112.03 3mys n ASN 173 Ca 0.38 -1.21 -0.34 0.00 0.87 0.00 0.00 54.58 54.29 3mys n ASN 173 Cb 1.44 0.20 -0.00 0.00 -1.02 0.00 0.00 39.78 40.39 3mys n ASN 173 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 3mys s GLU 174 N -0.89 3.41 0.48 3.52 0.41 -0.95 -4.93 118.70 119.75 3mys s GLU 174 Ca 0.08 1.41 0.28 0.00 -0.41 0.00 0.00 54.97 56.32 3mys s GLU 174 Cb 0.07 -2.03 0.86 0.00 -1.78 0.00 0.00 34.13 31.24 3mys s GLU 174 CO 0.14 -0.77 1.80 0.66 -0.49 0.00 0.00 175.26 176.60 3mys h SER 175 N 0.97 0.00 1.35 -0.19 4.64 -1.94 -3.12 113.55 115.26 3mys h SER 175 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 3mys h SER 175 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 3mys h SER 175 CO 0.57 0.05 -0.21 0.00 -0.87 0.00 0.00 176.83 176.38 3mys n TYR 177 N -2.32 -0.14 -0.25 0.00 9.36 -1.18 -0.49 117.16 122.13 3mys n TYR 177 Ca 0.05 0.84 -0.07 0.00 3.32 0.00 0.00 57.90 62.04 3mys n TYR 177 Cb 0.45 -0.65 0.06 0.00 -0.63 0.00 0.00 39.34 38.57 3mys n TYR 177 CO 0.00 0.00 0.00 0.28 0.22 0.00 0.00 176.86 177.36 3mys h VAL 178 N 0.00 1.26 -0.51 2.97 2.07 -1.85 -1.72 116.25 118.47 3mys h VAL 178 Ca 0.17 -0.94 -0.09 0.00 0.82 0.00 0.00 66.70 66.66 3mys h VAL 178 Cb 0.34 0.50 -0.02 0.00 -1.52 0.00 0.00 31.29 30.59 3mys h VAL 178 CO -0.65 0.37 -0.04 0.44 0.02 0.00 0.00 177.57 177.70 3mys h ASP 179 N 1.08 0.87 0.28 0.57 3.32 -1.09 -2.32 116.42 119.12 3mys h ASP 179 Ca 0.23 -0.25 -0.01 0.00 0.02 0.00 0.00 57.03 57.02 3mys h ASP 179 Cb 0.34 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.66 3mys h ASP 179 CO -0.00 0.96 -0.13 0.58 -1.72 0.00 0.00 179.24 178.93 3mys h VAL 180 N 0.82 0.76 -0.00 -1.35 2.07 -0.20 -1.84 116.25 116.50 3mys h VAL 180 Ca 0.15 -0.19 -0.04 0.00 0.82 0.00 0.00 66.70 67.43 3mys h VAL 180 Cb 0.55 0.87 -0.01 0.00 -1.52 0.00 0.00 31.29 31.18 3mys h VAL 180 CO 0.03 0.04 -0.19 0.16 0.02 0.00 0.00 177.57 177.63 3mys h ILE 181 N -0.47 1.14 -0.12 4.57 -2.65 -1.30 -1.00 117.51 117.68 3mys h ILE 181 Ca -0.04 -0.66 -0.13 0.00 1.03 0.00 0.00 64.86 65.06 3mys h ILE 181 Cb 0.35 1.35 -0.01 0.00 -2.05 0.00 0.00 36.82 36.46 3mys h ILE 181 CO 0.06 0.19 -0.50 0.00 0.03 0.00 0.00 178.15 177.94 3mys h ALA 182 N 1.80 0.93 -0.40 0.16 0.00 -1.30 -1.25 119.26 119.20 3mys h ALA 182 Ca -0.00 -0.48 -0.14 0.00 0.00 0.00 0.00 54.91 54.29 3mys h ALA 182 Cb 0.34 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 3mys h ALA 182 CO 0.02 0.66 -0.30 1.15 0.00 0.00 0.00 179.25 180.78 3mys h THR 183 N 0.25 1.27 -0.40 0.00 2.02 -0.33 -1.17 112.91 114.55 3mys h THR 183 Ca 0.01 -1.46 -0.02 0.00 0.77 0.00 0.00 66.41 65.71 3mys h THR 183 Cb 0.97 1.28 -0.02 0.00 -1.74 0.00 0.00 68.15 68.64 3mys h THR 183 CO 0.08 0.49 0.18 -0.26 0.37 0.00 0.00 175.52 176.39 3mys h PHE 184 N 0.75 0.59 0.20 3.16 -1.00 -1.20 -2.58 116.94 116.86 3mys h PHE 184 Ca 0.08 -0.03 -0.01 0.00 2.81 0.00 0.00 57.97 60.82 3mys h PHE 184 Cb 0.87 -0.18 0.00 0.00 3.61 0.00 0.00 35.95 40.25 3mys h PHE 184 CO 0.05 0.50 -0.10 -0.09 -1.61 0.00 0.00 178.31 177.07 3mys h ARG 185 N 0.51 -0.26 -0.43 1.51 2.43 -1.02 -1.24 114.38 115.87 3mys h ARG 185 Ca 0.14 0.02 -0.11 0.00 -0.81 0.00 0.00 59.98 59.22 3mys h ARG 185 Cb 0.14 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.74 3mys h ARG 185 CO -0.02 -0.15 -0.16 -0.44 -1.51 0.00 0.00 179.97 177.69 3mys h ASP 186 N -0.30 0.82 -0.41 -3.80 3.32 -1.28 -0.85 116.42 113.92 3mys h ASP 186 Ca -0.03 -0.27 -0.11 0.00 0.02 0.00 0.00 57.03 56.64 3mys h ASP 186 Cb 0.23 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.55 3mys h ASP 186 CO 0.05 0.98 -0.16 0.00 -1.72 0.00 0.00 179.24 178.39 3mys h ALA 187 N 1.08 0.57 -0.12 3.45 0.00 -1.43 -1.20 119.26 121.61 3mys h ALA 187 Ca 0.11 -0.35 0.03 0.00 0.00 0.00 0.00 54.91 54.70 3mys h ALA 187 Cb 0.67 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 3mys h ALA 187 CO 0.05 0.49 -0.05 1.15 0.00 0.00 0.00 179.25 180.89 3mys h THR 188 N 0.64 0.83 -0.34 0.00 2.02 -1.00 -0.92 112.91 114.14 3mys h THR 188 Ca 0.10 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.34 3mys h THR 188 Cb 0.71 0.83 -0.06 0.00 -1.74 0.00 0.00 68.15 67.89 3mys h THR 188 CO 0.05 0.00 -0.02 -0.07 0.37 0.00 0.00 175.52 175.85 3mys h LEU 189 N -0.03 -0.18 -0.89 2.58 4.07 -1.03 0.48 115.31 120.31 3mys h LEU 189 Ca 0.06 0.08 0.03 0.00 0.08 0.00 0.00 57.88 58.13 3mys h LEU 189 Cb 0.13 0.16 -0.05 0.00 1.08 0.00 0.00 40.66 41.97 3mys h LEU 189 CO -0.14 -0.05 0.58 0.11 -1.08 0.00 0.00 178.44 177.85 3mys h LYS 190 N 0.07 1.11 -0.67 1.13 1.57 -1.07 -2.23 116.57 116.48 3mys h LYS 190 Ca 0.16 -0.07 -0.04 0.00 -1.87 0.00 0.00 60.65 58.83 3mys h LYS 190 Cb 0.23 -0.25 -0.03 0.00 0.08 0.00 0.00 32.23 32.26 3mys h LYS 190 CO -0.29 0.74 0.25 1.15 -0.57 0.00 0.00 179.45 180.72 3mys h THR 191 N 1.14 1.25 -0.61 -0.16 2.02 -0.27 -0.55 112.91 115.74 3mys h THR 191 Ca 0.35 -0.79 0.03 0.00 0.77 0.00 0.00 66.41 66.76 3mys h THR 191 Cb -0.04 0.50 -0.04 0.00 -1.74 0.00 0.00 68.15 66.83 3mys h THR 191 CO -0.10 0.31 0.37 0.40 0.37 0.00 0.00 175.52 176.87 3mys h ILE 192 N 0.96 1.07 -0.67 3.11 2.04 -0.49 0.07 117.51 123.60 3mys h ILE 192 Ca 0.22 -0.25 -0.04 0.00 1.00 0.00 0.00 64.86 65.79 3mys h ILE 192 Cb 0.24 0.27 -0.03 0.00 -0.74 0.00 0.00 36.82 36.56 3mys h ILE 192 CO -0.01 0.13 0.24 0.40 0.00 0.00 0.00 178.15 178.91 3mys h ILE 193 N 0.73 1.24 -0.44 -0.67 1.08 -1.15 -0.57 117.51 117.73 3mys h ILE 193 Ca 0.25 -0.77 -0.08 0.00 -0.39 0.00 0.00 64.86 63.87 3mys h ILE 193 Cb 0.02 0.47 -0.02 0.00 -3.07 0.00 0.00 36.82 34.22 3mys h ILE 193 CO -0.10 0.31 -0.04 1.23 -0.69 0.00 0.00 178.15 178.85 3mys h GLY 194 N 1.05 0.80 1.04 5.37 0.00 -0.15 -2.03 103.07 109.16 3mys h GLY 194 Ca 0.22 -0.55 -0.15 0.00 0.00 0.00 0.00 47.33 46.85 3mys h GLY 194 CO -0.02 0.51 -0.39 -1.61 0.00 0.00 0.00 176.54 175.03 3mys h GLN 195 N 0.69 0.78 -0.05 4.80 5.75 -0.71 -0.99 115.11 125.38 3mys h GLN 195 Ca 0.13 -0.45 0.01 0.00 -0.15 0.00 0.00 58.65 58.19 3mys h GLN 195 Cb 0.49 0.04 -0.01 0.00 1.07 0.00 0.00 27.48 29.06 3mys h GLN 195 CO 0.02 1.08 -0.02 1.25 -2.65 0.00 0.00 178.83 178.52 3mys h HIS 196 N 0.53 -0.04 -0.37 3.99 2.76 -1.02 -0.57 115.15 120.44 3mys h HIS 196 Ca 0.03 0.01 0.01 0.00 -2.20 0.00 0.00 60.37 58.21 3mys h HIS 196 Cb 0.99 0.02 -0.02 0.00 1.55 0.00 0.00 27.41 29.95 3mys h HIS 196 CO 0.07 -0.03 0.23 -0.07 -1.30 0.00 0.00 177.93 176.84 3mys h LEU 197 N -0.00 0.40 -2.06 0.26 3.38 -1.32 0.38 115.31 116.34 3mys h LEU 197 Ca 0.03 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 3mys h LEU 197 Cb 0.05 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 3mys h LEU 197 CO -0.06 0.29 -0.05 -0.78 0.09 0.00 0.00 178.44 177.93 3mys h ASP 198 N 0.48 0.00 0.63 -0.43 3.58 -0.97 0.35 116.42 120.06 3mys h ASP 198 Ca 0.14 0.00 -0.27 0.00 0.42 0.00 0.00 57.03 57.32 3mys h ASP 198 Cb -0.04 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 40.98 3mys h ASP 198 CO -0.04 0.05 -1.45 0.74 -2.88 0.00 0.00 179.24 175.66 3mys h THR 199 N 0.00 1.19 0.00 2.25 2.02 -0.36 -3.41 112.91 114.60 3mys h THR 199 Ca -0.00 -2.94 0.00 0.00 0.77 0.00 0.00 66.41 64.24 3mys h THR 199 Cb 0.10 2.65 0.00 0.00 -1.74 0.00 0.00 68.15 69.16 3mys h THR 199 CO 0.01 0.74 -0.23 0.59 0.37 0.00 0.00 175.52 176.99 3mys n ASN 200 N -3.26 0.32 -0.31 4.18 3.02 0.05 -4.70 115.26 114.56 3mys n ASN 200 Ca -0.12 -0.58 0.26 0.00 -0.03 0.00 0.00 54.58 54.11 3mys n ASN 200 Cb 1.01 1.01 0.58 0.00 -0.61 0.00 0.00 39.78 41.77 3mys n ASN 200 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 3mys h ILE 201 N 0.00 0.50 -0.53 2.41 6.09 -0.53 0.13 117.51 125.58 3mys h ILE 201 Ca 0.00 -0.09 -0.05 0.00 -1.37 0.00 0.00 64.86 63.34 3mys h ILE 201 Cb 0.11 0.21 -0.03 0.00 0.47 0.00 0.00 36.82 37.57 3mys h ILE 201 CO 0.00 0.05 0.06 0.49 -3.07 0.00 0.00 178.15 175.68 3mys n PHE 202 N -4.49 1.87 -3.21 2.19 3.72 -1.26 -4.80 117.46 111.48 3mys n PHE 202 Ca 0.25 -0.90 -0.28 0.00 -0.05 0.00 0.00 57.45 56.47 3mys n PHE 202 Cb 0.98 -0.51 -0.02 0.00 -0.94 0.00 0.00 39.48 38.98 3mys n PHE 202 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 3mys s SER 203 N -1.18 6.41 0.27 4.37 1.04 0.45 -4.53 113.70 120.54 3mys s SER 203 Ca 0.52 0.75 -0.07 0.00 0.48 0.00 0.00 55.95 57.63 3mys s SER 203 Cb 0.41 -2.16 0.49 0.00 0.10 0.00 0.00 66.02 64.86 3mys s SER 203 CO 0.13 -0.28 1.58 0.44 0.98 0.00 0.00 173.24 176.09 3mys h ASP 204 N 1.32 -0.73 0.65 7.02 3.32 -1.94 0.35 116.42 126.40 3mys h ASP 204 Ca -0.48 0.27 -0.01 0.00 0.02 0.00 0.00 57.03 56.83 3mys h ASP 204 Cb 1.20 0.54 -0.00 0.00 0.22 0.00 0.00 39.33 41.28 3mys h ASP 204 CO 0.65 -0.31 -0.06 0.07 -1.72 0.00 0.00 179.24 177.87 3mys h LYS 205 N 0.01 0.00 0.13 3.56 5.09 -1.91 0.18 116.57 123.64 3mys h LYS 205 Ca 0.47 0.00 -0.32 0.00 0.09 0.00 0.00 60.65 60.89 3mys h LYS 205 Cb 0.80 0.00 -0.01 0.00 0.10 0.00 0.00 32.23 33.12 3mys h LYS 205 CO -0.92 0.06 -1.62 1.88 -2.09 0.00 0.00 179.45 176.76 3mys h TYR 206 N 0.00 0.50 0.00 0.07 0.99 -1.22 -3.29 116.97 114.02 3mys h TYR 206 Ca -0.00 -0.37 -0.08 0.00 2.00 0.00 0.00 58.73 60.28 3mys h TYR 206 Cb 0.41 -0.02 -0.01 0.00 1.00 0.00 0.00 36.73 38.11 3mys h TYR 206 CO 0.00 1.46 -0.39 0.77 -0.00 0.00 0.00 178.16 180.00 3mys h SER 207 N 0.08 0.00 -2.27 3.88 0.02 -0.77 -3.34 113.55 111.15 3mys h SER 207 Ca -0.28 0.00 -0.60 0.00 -0.84 0.00 0.00 61.79 60.07 3mys h SER 207 Cb 2.04 0.00 -0.41 0.00 0.14 0.00 0.00 62.40 64.17 3mys h SER 207 CO 0.16 0.39 -0.55 0.47 -1.14 0.00 0.00 176.83 176.17 3mys n ASP 208 N -3.56 4.38 0.00 3.07 9.92 0.00 -4.93 116.55 125.43 3mys n ASP 208 Ca -0.00 -3.60 0.02 0.00 -0.53 0.00 0.00 54.79 50.67 3mys n ASP 208 Cb 0.52 -0.63 0.12 0.00 -0.64 0.00 0.00 41.12 40.49 3mys n ASP 208 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3mys n ALA 209 N 0.15 1.69 0.17 2.24 0.00 -1.24 -2.05 120.51 121.46 3mys n ALA 209 Ca 0.31 -0.03 0.02 0.00 0.00 0.00 0.00 53.44 53.75 3mys n ALA 209 Cb 0.39 -1.07 -0.03 0.00 0.00 0.00 0.00 19.45 18.75 3mys n ALA 209 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3mys n HIS 210 N -0.89 0.00 -3.30 0.00 8.25 -1.26 -4.88 115.22 113.14 3mys n HIS 210 Ca 0.03 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.11 3mys n HIS 210 Cb 0.01 -0.01 -0.06 0.00 1.12 0.00 0.00 29.99 31.05 3mys n HIS 210 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 3mys s ARG 211 N -1.53 4.32 0.59 -0.41 0.52 -0.87 -5.07 118.95 116.49 3mys s ARG 211 Ca 0.01 0.51 -0.19 0.00 -0.52 0.00 0.00 55.73 55.54 3mys s ARG 211 Cb 0.03 -3.41 -0.04 0.00 0.52 0.00 0.00 34.95 32.05 3mys s ARG 211 CO 0.17 0.21 1.17 -1.83 0.02 0.00 0.00 175.30 175.05 3mys s GLU 212 N 0.42 3.06 -0.15 3.54 -1.05 -1.26 -4.95 118.70 118.31 3mys s GLU 212 Ca 0.27 1.72 -0.35 0.00 -0.15 0.00 0.00 54.97 56.46 3mys s GLU 212 Cb -0.16 -1.95 -0.12 0.00 -0.44 0.00 0.00 34.13 31.46 3mys s GLU 212 CO 0.12 -1.11 1.90 -0.89 0.95 0.00 0.00 175.26 176.23 3mys n ILE 213 N -1.60 0.50 -2.45 1.83 5.41 -1.26 -4.89 119.36 116.90 3mys n ILE 213 Ca 0.13 -0.12 -0.41 0.00 1.00 0.00 0.00 62.75 63.35 3mys n ILE 213 Cb 0.50 -1.78 -0.03 0.00 -0.71 0.00 0.00 39.64 37.62 3mys n ILE 213 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 3mys s ASP 214 N 4.44 6.05 0.00 4.38 2.15 -1.26 -4.86 116.67 127.57 3mys s ASP 214 Ca 0.95 -0.17 0.00 0.00 0.43 0.00 0.00 52.55 53.76 3mys s ASP 214 Cb -0.75 -2.55 0.00 0.00 -0.30 0.00 0.00 42.92 39.31 3mys s ASP 214 CO 0.53 -1.87 0.64 1.33 -0.17 0.00 0.00 175.17 175.64 3mys n VAL 215 N 6.60 0.00 0.05 1.11 0.24 -1.26 -2.04 118.33 123.03 3mys n VAL 215 Ca 0.08 0.00 0.01 0.00 -2.04 0.00 0.00 64.34 62.38 3mys n VAL 215 Cb 0.49 -0.19 0.01 0.00 -1.47 0.00 0.00 33.84 32.68 3mys n VAL 215 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 3mys n ASN 216 N -0.34 1.25 -4.45 -1.34 3.02 -1.26 -4.94 115.26 107.20 3mys n ASN 216 Ca 0.00 -1.18 -0.43 0.00 -0.03 0.00 0.00 54.58 52.93 3mys n ASN 216 Cb 0.05 -0.00 -0.09 0.00 -0.61 0.00 0.00 39.78 39.12 3mys n ASN 216 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 3mys s ASN 217 N -0.23 6.13 -0.14 6.41 2.47 -0.87 -4.90 114.94 123.81 3mys s ASN 217 Ca 0.02 -0.94 0.16 0.00 0.42 0.00 0.00 52.86 52.52 3mys s ASN 217 Cb 0.01 -2.18 0.41 0.00 -1.45 0.00 0.00 41.25 38.05 3mys s ASN 217 CO 0.02 -0.52 1.31 2.30 -3.72 0.00 0.00 177.10 176.49 3mys n ILE 218 N 5.22 2.00 -1.10 -5.21 -5.35 -1.26 -4.98 119.36 108.68 3mys n ILE 218 Ca -0.11 -1.88 -0.31 0.00 -0.27 0.00 0.00 62.75 60.19 3mys n ILE 218 Cb 0.46 -0.15 0.12 0.00 -1.74 0.00 0.00 39.64 38.34 3mys n ILE 218 CO 0.00 0.00 0.00 0.20 -1.76 0.00 0.00 176.55 174.99 3mys s ASN 219 N -2.09 3.86 0.36 7.28 0.01 -1.26 -5.01 114.94 118.09 3mys s ASN 219 Ca 0.35 1.84 -0.27 0.00 -0.71 0.00 0.00 52.86 54.07 3mys s ASN 219 Cb 0.29 -2.47 -0.10 0.00 0.41 0.00 0.00 41.25 39.39 3mys s ASN 219 CO 0.07 -2.45 1.28 0.54 -1.51 0.00 0.00 177.10 175.04 3mys s VAL 220 N -2.84 2.75 0.57 1.60 0.11 -1.26 -4.96 120.40 116.37 3mys s VAL 220 Ca 0.63 0.72 -0.20 0.00 -2.93 0.00 0.00 61.98 60.19 3mys s VAL 220 Cb -0.19 -3.44 -0.04 0.00 -1.53 0.00 0.00 36.38 31.18 3mys s VAL 220 CO 0.57 0.14 1.25 -2.65 -3.33 0.00 0.00 175.10 171.08 3mys n PRO 221 N 0.52 1.39 -1.38 1.54 -0.02 -1.26 -4.96 135.00 130.83 3mys n PRO 221 Ca 0.02 0.52 -0.35 0.00 -2.02 0.00 0.00 63.50 61.66 3mys n PRO 221 Cb 0.43 -2.45 0.09 0.00 -0.02 0.00 0.00 33.50 31.55 3mys n PRO 221 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3mys n GLU 222 N -1.13 0.56 -0.96 -0.52 4.71 -1.26 -4.87 120.64 117.18 3mys n GLU 222 Ca 0.12 0.25 -0.38 0.00 -0.01 0.00 0.00 57.16 57.15 3mys n GLU 222 Cb 0.45 -2.36 -0.05 0.00 -1.01 0.00 0.00 31.44 28.48 3mys n GLU 222 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3mys n GLN 223 N -2.25 0.00 -2.74 3.49 -0.00 -1.26 -4.88 117.38 109.74 3mys n GLN 223 Ca 0.14 0.00 -0.38 0.00 -0.00 0.00 0.00 57.00 56.76 3mys n GLN 223 Cb 0.49 -0.92 -0.06 0.00 -0.00 0.00 0.00 30.24 29.75 3mys n GLN 223 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.06 174.92 3mys s PRO 224 N 0.47 4.66 0.10 2.61 0.02 -1.26 -5.06 135.00 136.54 3mys s PRO 224 Ca 0.58 1.42 0.01 0.00 0.02 0.00 0.00 61.00 63.03 3mys s PRO 224 Cb -0.82 -2.97 -0.04 0.00 0.02 0.00 0.00 34.50 30.69 3mys s PRO 224 CO 0.39 0.33 -0.04 0.14 -0.33 0.00 0.00 177.00 177.49 3mys s VAL 225 N -1.44 0.52 0.55 3.83 -7.23 -1.26 -4.85 120.40 110.51 3mys s VAL 225 Ca 0.47 -1.91 -0.19 0.00 -1.81 0.00 0.00 61.98 58.54 3mys s VAL 225 Cb -0.22 -1.73 -0.06 0.00 0.56 0.00 0.00 36.38 34.93 3mys s VAL 225 CO 0.28 -0.82 1.14 0.27 -0.31 0.00 0.00 175.10 175.66 3mys s ILE 226 N -3.74 3.08 -0.24 -0.62 -4.36 -1.26 -4.80 121.20 109.27 3mys s ILE 226 Ca 0.13 0.68 -0.03 0.00 -0.26 0.00 0.00 60.65 61.18 3mys s ILE 226 Cb 0.06 -3.28 0.01 0.00 1.25 0.00 0.00 42.46 40.51 3mys s ILE 226 CO -0.04 -0.14 -0.06 -0.62 0.24 0.00 0.00 174.94 174.32 3mys s ASP 227 N -1.73 4.26 0.43 4.36 -1.08 -1.26 -5.01 116.67 116.64 3mys s ASP 227 Ca 0.73 -0.67 0.17 0.00 -0.52 0.00 0.00 52.55 52.27 3mys s ASP 227 Cb -0.25 -1.69 0.96 0.00 -1.46 0.00 0.00 42.92 40.48 3mys s ASP 227 CO 0.28 -0.08 1.91 0.16 0.52 0.00 0.00 175.17 177.96 3mys h ILE 228 N 5.94 1.02 0.00 4.11 -2.65 -1.96 -1.26 117.51 122.70 3mys h ILE 228 Ca -0.37 -0.97 -0.01 0.00 1.03 0.00 0.00 64.86 64.54 3mys h ILE 228 Cb 1.13 1.55 -0.00 0.00 -2.05 0.00 0.00 36.82 37.45 3mys h ILE 228 CO 0.59 0.26 -0.04 0.78 0.03 0.00 0.00 178.15 179.78 3mys h ASN 229 N 0.00 0.00 0.16 2.16 2.35 -2.01 -2.30 115.58 115.94 3mys h ASN 229 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3mys h ASN 229 Cb 0.53 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.90 3mys h ASN 229 CO 0.03 0.04 -1.05 0.23 -1.65 0.00 0.00 177.43 175.03 3mys n MET 230 N -3.36 0.14 -2.54 0.81 2.81 -0.49 -4.66 117.12 109.84 3mys n MET 230 Ca -0.02 -0.02 -0.42 0.00 -1.81 0.00 0.00 57.70 55.43 3mys n MET 230 Cb 0.17 -1.52 -0.01 0.00 -0.71 0.00 0.00 33.22 31.15 3mys n MET 230 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 3mys s ILE 231 N -3.10 4.07 0.21 2.02 1.01 -0.87 -4.77 121.20 119.77 3mys s ILE 231 Ca 0.06 -1.82 -0.14 0.00 0.00 0.00 0.00 60.65 58.74 3mys s ILE 231 Cb 0.16 -5.15 0.01 0.00 0.01 0.00 0.00 42.46 37.49 3mys s ILE 231 CO 0.84 -1.94 0.45 0.54 0.00 0.00 0.00 174.94 174.83 3mys s ASN 232 N 4.43 -0.13 0.10 3.58 2.20 -1.26 -4.99 114.94 118.87 3mys s ASN 232 Ca 0.55 -0.72 -0.02 0.00 -0.94 0.00 0.00 52.86 51.73 3mys s ASN 232 Cb 0.04 0.55 -0.22 0.00 -2.00 0.00 0.00 41.25 39.62 3mys s ASN 232 CO 0.08 -1.05 1.21 0.15 -2.94 0.00 0.00 177.10 174.55 3mys h PHE 233 N 2.30 0.40 -0.04 1.54 3.57 -1.97 -2.76 116.94 119.97 3mys h PHE 233 Ca -0.28 -0.28 0.03 0.00 3.53 0.00 0.00 57.97 60.97 3mys h PHE 233 Cb 1.25 -0.02 -0.04 0.00 2.79 0.00 0.00 35.95 39.93 3mys h PHE 233 CO 0.38 1.19 -0.15 0.78 -2.23 0.00 0.00 178.31 178.27 3mys h GLY 234 N 1.82 -0.16 0.49 2.40 0.00 -1.98 -0.61 103.07 105.03 3mys h GLY 234 Ca -0.10 0.18 0.04 0.00 0.00 0.00 0.00 47.33 47.45 3mys h GLY 234 CO 0.18 -0.15 -0.15 -2.08 0.00 0.00 0.00 176.54 174.34 3mys h VAL 235 N -0.23 0.60 -0.51 4.60 2.07 -1.88 -2.51 116.25 118.39 3mys h VAL 235 Ca 0.07 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.69 3mys h VAL 235 Cb 0.32 0.60 -0.10 0.00 -1.52 0.00 0.00 31.29 30.59 3mys h VAL 235 CO -0.18 0.00 -0.20 0.22 0.02 0.00 0.00 177.57 177.43 3mys h TYR 236 N -0.20 -0.49 -0.14 1.57 3.20 -1.11 -1.21 116.97 118.59 3mys h TYR 236 Ca 0.09 0.05 -0.01 0.00 3.14 0.00 0.00 58.73 62.00 3mys h TYR 236 Cb 0.32 0.29 -0.01 0.00 1.54 0.00 0.00 36.73 38.88 3mys h TYR 236 CO -0.26 -0.29 0.05 0.87 -1.64 0.00 0.00 178.16 176.90 3mys h LYS 237 N -0.08 0.21 -1.00 1.82 1.57 -1.08 -0.33 116.57 117.68 3mys h LYS 237 Ca 0.24 -0.04 0.25 0.00 -1.87 0.00 0.00 60.65 59.23 3mys h LYS 237 Cb 0.45 -0.03 -0.19 0.00 0.08 0.00 0.00 32.23 32.54 3mys h LYS 237 CO -0.56 0.31 -0.07 -0.91 -0.57 0.00 0.00 179.45 177.65 3mys h ASN 238 N 0.07 -0.64 -0.02 0.86 -0.26 -0.90 0.27 115.58 114.96 3mys h ASN 238 Ca 0.05 0.29 -0.03 0.00 -0.56 0.00 0.00 56.30 56.05 3mys h ASN 238 Cb 0.18 0.54 0.00 0.00 -1.06 0.00 0.00 38.32 37.98 3mys h ASN 238 CO -0.00 -0.35 -0.09 0.40 -1.06 0.00 0.00 177.43 176.33 3mys h ILE 239 N 0.00 1.51 -0.04 2.81 2.04 -0.44 -3.23 117.51 120.16 3mys h ILE 239 Ca 0.56 -1.63 -0.18 0.00 1.00 0.00 0.00 64.86 64.61 3mys h ILE 239 Cb 1.07 2.55 -0.01 0.00 -0.74 0.00 0.00 36.82 39.69 3mys h ILE 239 CO -0.97 0.44 -0.75 0.58 0.00 0.00 0.00 178.15 177.45 3mys h VAL 240 N -0.54 1.43 0.38 1.67 2.07 -0.44 0.20 116.25 121.02 3mys h VAL 240 Ca -0.01 -2.30 -0.02 0.00 0.82 0.00 0.00 66.70 65.20 3mys h VAL 240 Cb 0.76 2.23 0.00 0.00 -1.52 0.00 0.00 31.29 32.76 3mys h VAL 240 CO 0.02 0.68 -0.20 0.40 0.02 0.00 0.00 177.57 178.49 3mys h ILE 241 N 0.16 0.59 -0.62 4.57 5.03 -0.60 -1.28 117.51 125.38 3mys h ILE 241 Ca -0.03 0.00 -0.07 0.00 -0.12 0.00 0.00 64.86 64.64 3mys h ILE 241 Cb 1.33 0.59 -0.02 0.00 -3.03 0.00 0.00 36.82 35.68 3mys h ILE 241 CO 0.12 0.00 0.12 0.45 -0.68 0.00 0.00 178.15 178.16 3mys h HIS 242 N -0.53 1.06 -0.03 1.37 -0.00 -1.54 0.72 115.15 116.20 3mys h HIS 242 Ca -0.05 -0.14 -0.13 0.00 -0.00 0.00 0.00 60.37 60.05 3mys h HIS 242 Cb 0.42 -0.30 -0.02 0.00 -0.00 0.00 0.00 27.41 27.52 3mys h HIS 242 CO -0.06 0.90 -0.59 -0.22 -0.00 0.00 0.00 177.93 177.96 3mys h LYS 243 N 0.92 0.09 0.00 2.45 3.64 -0.54 -3.12 116.57 120.01 3mys h LYS 243 Ca 0.19 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 3mys h LYS 243 Cb 0.40 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.22 3mys h LYS 243 CO 0.01 0.65 -0.70 2.41 -2.27 0.00 0.00 179.45 179.55 3mys n THR 244 N -3.86 0.00 -0.01 1.00 -1.04 -0.49 -4.84 114.28 105.04 3mys n THR 244 Ca -0.02 0.00 -0.16 0.00 -2.04 0.00 0.00 64.05 61.83 3mys n THR 244 Cb 0.60 -0.36 -0.05 0.00 -1.82 0.00 0.00 70.33 68.69 3mys n THR 244 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3mys h ALA 245 N 0.00 0.36 -0.16 2.41 0.00 -0.88 -0.99 119.26 120.00 3mys h ALA 245 Ca 0.00 -0.60 -0.02 0.00 0.00 0.00 0.00 54.91 54.29 3mys h ALA 245 Cb 0.70 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 3mys h ALA 245 CO 0.00 0.70 0.01 1.88 0.00 0.00 0.00 179.25 181.84 3mys h TYR 246 N 0.51 0.30 0.01 0.00 -1.99 -1.80 -1.88 116.97 112.13 3mys h TYR 246 Ca -0.05 -0.05 -0.24 0.00 2.00 0.00 0.00 58.73 60.39 3mys h TYR 246 Cb 1.39 -0.08 -0.03 0.00 2.00 0.00 0.00 36.73 40.00 3mys h TYR 246 CO 0.08 0.48 -1.27 0.10 -0.00 0.00 0.00 178.16 177.55 3mys h TYR 247 N 0.04 0.05 0.00 4.88 -0.00 -1.80 0.17 116.97 120.32 3mys h TYR 247 Ca 0.05 -0.04 -0.10 0.00 0.00 0.00 0.00 58.73 58.64 3mys h TYR 247 Cb 0.35 -0.00 -0.02 0.00 0.00 0.00 0.00 36.73 37.06 3mys h TYR 247 CO 0.03 1.04 -0.79 0.77 -0.00 0.00 0.00 178.16 179.21 3mys h SER 248 N 0.01 0.00 0.00 0.10 0.02 -1.23 -3.39 113.55 109.05 3mys h SER 248 Ca -0.12 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.83 3mys h SER 248 Cb 1.87 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.41 3mys h SER 248 CO 0.12 0.41 0.00 0.49 -1.14 0.00 0.00 176.83 176.71 3mys n PHE 249 N -3.04 -1.10 -0.14 3.45 3.72 -0.75 -4.70 117.46 114.90 3mys n PHE 249 Ca -0.02 0.19 -0.04 0.00 -0.05 0.00 0.00 57.45 57.54 3mys n PHE 249 Cb 0.72 0.26 0.02 0.00 -0.94 0.00 0.00 39.48 39.55 3mys n PHE 249 CO 0.00 0.00 0.00 0.35 -0.05 0.00 0.00 176.76 177.06 3mys h PHE 250 N 0.00 -0.34 0.13 1.38 3.57 -1.37 -2.54 116.94 117.76 3mys h PHE 250 Ca 0.00 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.54 3mys h PHE 250 Cb 0.00 0.22 0.00 0.00 2.79 0.00 0.00 35.95 38.96 3mys h PHE 250 CO 0.00 -0.23 -0.06 1.25 -2.23 0.00 0.00 178.31 177.04 3mys h LEU 251 N -0.04 -0.14 -1.23 0.59 5.85 -0.85 0.21 115.31 119.70 3mys h LEU 251 Ca 0.22 -0.07 -0.05 0.00 0.84 0.00 0.00 57.88 58.82 3mys h LEU 251 Cb 0.38 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.42 3mys h LEU 251 CO -0.49 -0.02 0.04 1.55 -0.34 0.00 0.00 178.44 179.18 3mys h PRO 252 N -0.26 0.57 -0.03 5.25 0.13 -1.74 -0.30 132.00 135.62 3mys h PRO 252 Ca -0.02 -0.11 -0.04 0.00 -0.87 0.00 0.00 66.00 64.96 3mys h PRO 252 Cb 0.21 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 31.25 3mys h PRO 252 CO 0.03 0.57 -0.12 0.82 -0.23 0.00 0.00 178.00 179.06 3mys h ILE 253 N 0.55 1.48 -0.39 -3.56 2.04 -1.21 -2.27 117.51 114.14 3mys h ILE 253 Ca 0.12 -1.60 0.03 0.00 1.00 0.00 0.00 64.86 64.41 3mys h ILE 253 Cb 0.29 2.47 -0.02 0.00 -0.74 0.00 0.00 36.82 38.82 3mys h ILE 253 CO 0.01 0.43 0.26 0.58 0.00 0.00 0.00 178.15 179.43 3mys h VAL 254 N -0.46 1.03 0.29 1.67 2.07 -0.49 -1.70 116.25 118.67 3mys h VAL 254 Ca -0.01 -0.15 -0.01 0.00 0.82 0.00 0.00 66.70 67.35 3mys h VAL 254 Cb 0.77 0.57 0.00 0.00 -1.52 0.00 0.00 31.29 31.12 3mys h VAL 254 CO 0.03 0.08 -0.14 0.00 0.02 0.00 0.00 177.57 177.55 3mys h GLY 256 N -0.47 0.51 0.80 0.00 0.00 -1.08 -2.62 103.07 100.21 3mys h GLY 256 Ca -0.04 -0.04 -0.03 0.00 0.00 0.00 0.00 47.33 47.22 3mys h GLY 256 CO 0.07 -0.03 -0.02 -0.33 0.00 0.00 0.00 176.54 176.23 3mys h MET 257 N 0.24 0.33 -0.87 4.80 2.86 -1.25 -1.84 114.93 119.20 3mys h MET 257 Ca 0.20 -0.11 0.04 0.00 -2.06 0.00 0.00 59.70 57.77 3mys h MET 257 Cb 0.24 -0.03 -0.05 0.00 0.06 0.00 0.00 31.60 31.82 3mys h MET 257 CO -0.25 0.56 0.56 -0.07 1.06 0.00 0.00 176.91 178.77 3mys h LEU 258 N 0.07 0.92 -0.35 1.22 3.38 -1.21 -1.74 115.31 117.60 3mys h LEU 258 Ca 0.05 -0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.83 3mys h LEU 258 Cb 0.42 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.97 3mys h LEU 258 CO 0.01 0.63 -0.59 0.25 0.09 0.00 0.00 178.44 178.83 3mys h LEU 259 N 1.08 0.84 -1.10 1.67 5.85 -1.44 -3.07 115.31 119.14 3mys h LEU 259 Ca 0.35 -0.47 -0.06 0.00 0.84 0.00 0.00 57.88 58.55 3mys h LEU 259 Cb 0.03 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.80 3mys h LEU 259 CO -0.13 1.24 0.03 0.00 -0.34 0.00 0.00 178.44 179.25 3mys h ALA 260 N 0.77 1.26 0.00 1.25 0.00 -1.09 -3.47 119.26 117.98 3mys h ALA 260 Ca 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.69 3mys h ALA 260 Cb 1.18 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.79 3mys h ALA 260 CO 0.12 0.50 0.00 0.41 0.00 0.00 0.00 179.25 180.28 3mys n GLY 261 N -0.81 0.79 0.00 0.00 0.00 -0.68 -5.11 105.19 99.39 3mys n GLY 261 Ca 0.02 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.43 3mys n GLY 261 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 3mys n ILE 262 N 0.00 0.00 0.00 -0.61 3.06 -1.16 -5.02 119.36 115.62 3mys n ILE 262 Ca 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.25 3mys n ILE 262 Cb 0.00 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.18 3mys n ILE 262 CO 0.00 0.00 0.00 -0.90 -2.50 0.00 0.00 176.55 173.15 3mys n ASP 265 N 0.00 0.00 -4.89 9.51 5.75 -1.26 -4.58 116.55 121.08 3mys n ASP 265 Ca 0.00 0.00 -0.33 0.00 -0.01 0.00 0.00 54.79 54.45 3mys n ASP 265 Cb 0.00 0.00 -0.05 0.00 -1.03 0.00 0.00 41.12 40.04 3mys n ASP 265 CO 0.00 0.00 0.00 0.21 -0.11 0.00 0.00 177.20 177.30 3mys s ASN 266 N -4.00 6.48 0.33 -1.12 2.47 -1.26 -5.00 114.94 112.85 3mys s ASN 266 Ca 0.00 0.54 0.18 0.00 0.42 0.00 0.00 52.86 54.00 3mys s ASN 266 Cb 0.00 -2.08 0.98 0.00 -1.45 0.00 0.00 41.25 38.70 3mys s ASN 266 CO 0.00 0.14 1.50 0.00 -3.72 0.00 0.00 177.10 175.02 3mys n LEU 267 N 0.50 0.47 0.16 3.21 -0.00 -1.26 -2.34 117.00 117.74 3mys n LEU 267 Ca -0.06 0.67 0.01 0.00 -0.00 0.00 0.00 56.01 56.63 3mys n LEU 267 Cb 0.52 -0.68 0.30 0.00 -0.00 0.00 0.00 43.42 43.56 3mys n LEU 267 CO 0.46 -0.83 0.67 -0.29 -0.00 0.00 0.00 177.39 177.41 3mys h ILE 268 N 0.00 1.31 -0.41 1.47 2.10 -1.97 -3.20 117.51 116.80 3mys h ILE 268 Ca 0.00 -1.46 0.07 0.00 1.08 0.00 0.00 64.86 64.54 3mys h ILE 268 Cb 0.29 1.77 -0.06 0.00 -1.09 0.00 0.00 36.82 37.73 3mys h ILE 268 CO 0.00 0.42 0.06 1.88 -1.08 0.00 0.00 178.15 179.43 3mys h TYR 269 N 0.03 0.09 -0.91 2.19 0.05 -1.89 -0.16 116.97 116.36 3mys h TYR 269 Ca -0.00 0.03 0.06 0.00 0.05 0.00 0.00 58.73 58.86 3mys h TYR 269 Cb 0.76 0.02 -0.06 0.00 1.01 0.00 0.00 36.73 38.47 3mys h TYR 269 CO 0.00 -0.02 0.59 -0.22 -1.05 0.00 0.00 178.16 177.47 3mys h LYS 270 N 0.18 1.04 -0.46 4.88 1.63 -1.79 0.70 116.57 122.75 3mys h LYS 270 Ca 0.20 -0.06 -0.10 0.00 -0.85 0.00 0.00 60.65 59.84 3mys h LYS 270 Cb 0.26 -0.23 -0.02 0.00 -0.60 0.00 0.00 32.23 31.64 3mys h LYS 270 CO -0.29 0.69 -0.10 0.87 -3.45 0.00 0.00 179.45 177.17 3mys h LYS 271 N 1.07 0.83 -0.41 1.90 6.56 -1.38 -1.45 116.57 123.69 3mys h LYS 271 Ca 0.38 -0.28 -0.12 0.00 -1.06 0.00 0.00 60.65 59.58 3mys h LYS 271 Cb 0.14 -0.07 -0.01 0.00 -0.57 0.00 0.00 32.23 31.72 3mys h LYS 271 CO -0.14 0.90 -0.21 0.82 -2.06 0.00 0.00 179.45 178.76 3mys h ILE 272 N 0.75 1.27 -0.26 1.86 2.04 0.64 -2.15 117.51 121.66 3mys h ILE 272 Ca 0.13 -1.33 0.06 0.00 1.00 0.00 0.00 64.86 64.71 3mys h ILE 272 Cb 0.60 1.18 -0.06 0.00 -0.74 0.00 0.00 36.82 37.80 3mys h ILE 272 CO 0.04 0.45 -0.16 -0.08 0.00 0.00 0.00 178.15 178.40 3mys h GLU 273 N 0.71 -0.13 -0.11 2.37 4.81 0.78 -0.80 114.58 122.21 3mys h GLU 273 Ca 0.10 0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.35 3mys h GLU 273 Cb 0.73 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.13 3mys h GLU 273 CO 0.06 -0.08 0.01 -0.44 -0.73 0.00 0.00 179.01 177.83 3mys h ASP 274 N -0.13 -0.01 -0.48 1.04 3.32 -1.05 -1.59 116.42 117.52 3mys h ASP 274 Ca 0.14 0.02 0.04 0.00 0.02 0.00 0.00 57.03 57.25 3mys h ASP 274 Cb 0.35 0.03 -0.04 0.00 0.22 0.00 0.00 39.33 39.89 3mys h ASP 274 CO -0.35 0.01 0.26 0.40 -1.72 0.00 0.00 179.24 177.84 3mys h ILE 275 N 0.06 0.99 -0.57 0.35 5.03 -1.26 -2.32 117.51 119.78 3mys h ILE 275 Ca 0.05 -0.17 0.11 0.00 -0.12 0.00 0.00 64.86 64.72 3mys h ILE 275 Cb 0.05 0.44 -0.09 0.00 -3.03 0.00 0.00 36.82 34.18 3mys h ILE 275 CO -0.07 0.09 0.06 0.28 -0.68 0.00 0.00 178.15 177.84 3mys h SER 276 N 0.50 -0.12 0.01 1.72 0.02 -0.72 0.78 113.55 115.75 3mys h SER 276 Ca 0.21 0.12 0.02 0.00 -0.84 0.00 0.00 61.79 61.30 3mys h SER 276 Cb 0.09 0.19 -0.03 0.00 0.14 0.00 0.00 62.40 62.80 3mys h SER 276 CO -0.13 -0.04 -0.13 0.24 -1.14 0.00 0.00 176.83 175.63 3mys h MET 277 N 0.18 -0.21 -0.06 3.45 2.07 -0.84 0.12 114.93 119.64 3mys h MET 277 Ca 0.29 0.01 -0.01 0.00 -2.07 0.00 0.00 59.70 57.93 3mys h MET 277 Cb 0.45 0.05 -0.00 0.00 -1.87 0.00 0.00 31.60 30.22 3mys h MET 277 CO -0.43 -0.14 -0.02 -0.07 1.07 0.00 0.00 176.91 177.32 3mys h LEU 278 N -0.22 0.08 0.00 1.22 4.07 -0.84 -1.33 115.31 118.29 3mys h LEU 278 Ca 0.04 -0.01 -0.21 0.00 0.08 0.00 0.00 57.88 57.79 3mys h LEU 278 Cb 0.28 -0.02 -0.03 0.00 1.08 0.00 0.00 40.66 41.97 3mys h LEU 278 CO -0.12 0.11 -1.01 0.24 -1.08 0.00 0.00 178.44 176.58 3mys h MET 279 N 0.09 0.00 0.56 1.13 2.86 -0.16 -2.15 114.93 117.26 3mys h MET 279 Ca 0.02 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.63 3mys h MET 279 Cb 0.10 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.76 3mys h MET 279 CO 0.00 0.94 -0.27 0.78 1.06 0.00 0.00 176.91 179.43 3mys h GLY 280 N 3.06 -0.79 -0.79 8.32 0.00 -0.22 0.69 103.07 113.34 3mys h GLY 280 Ca -0.03 0.29 0.17 0.00 0.00 0.00 0.00 47.33 47.76 3mys h GLY 280 CO 0.12 -0.29 -0.27 -2.09 0.00 0.00 0.00 176.54 174.02 3mys h GLU 281 N -1.07 -0.02 -0.50 4.80 4.81 -1.35 0.18 114.58 121.45 3mys h GLU 281 Ca -0.08 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.11 3mys h GLU 281 Cb 0.64 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.00 3mys h GLU 281 CO 0.13 -0.01 0.13 -0.92 -0.73 0.00 0.00 179.01 177.60 3mys h TYR 282 N -0.02 0.83 -0.65 0.92 5.03 -1.31 -2.18 116.97 119.59 3mys h TYR 282 Ca 0.39 -0.10 -0.04 0.00 2.58 0.00 0.00 58.73 61.57 3mys h TYR 282 Cb 0.63 -0.24 -0.03 0.00 1.55 0.00 0.00 36.73 38.65 3mys h TYR 282 CO -0.72 0.74 0.26 0.35 -1.32 0.00 0.00 178.16 177.46 3mys h PHE 283 N 0.68 1.00 0.19 -3.82 3.57 0.61 -2.99 116.94 116.19 3mys h PHE 283 Ca 0.16 -0.08 -0.30 0.00 3.53 0.00 0.00 57.97 61.28 3mys h PHE 283 Cb 0.32 -0.30 0.03 0.00 2.79 0.00 0.00 35.95 38.79 3mys h PHE 283 CO 0.02 0.78 -1.28 0.37 -2.23 0.00 0.00 178.31 175.97 3mys h GLN 284 N 0.92 0.53 -0.60 1.11 5.75 -0.91 -1.83 115.11 120.09 3mys h GLN 284 Ca 0.22 -0.83 0.10 0.00 -0.15 0.00 0.00 58.65 57.99 3mys h GLN 284 Cb 0.21 0.30 -0.08 0.00 1.07 0.00 0.00 27.48 28.98 3mys h GLN 284 CO -0.02 1.39 0.17 0.82 -2.65 0.00 0.00 178.83 178.54 3mys h ILE 285 N 0.09 0.70 -0.53 2.39 2.04 -1.48 0.46 117.51 121.19 3mys h ILE 285 Ca -0.22 -0.11 -0.00 0.00 1.00 0.00 0.00 64.86 65.53 3mys h ILE 285 Cb 1.99 0.35 -0.03 0.00 -0.74 0.00 0.00 36.82 38.40 3mys h ILE 285 CO 0.24 0.06 0.31 -0.74 0.00 0.00 0.00 178.15 178.02 3mys h HIS 286 N 0.32 0.69 -0.32 1.37 2.76 -1.41 0.22 115.15 118.78 3mys h HIS 286 Ca 0.31 0.00 -0.10 0.00 -2.20 0.00 0.00 60.37 58.38 3mys h HIS 286 Cb 0.42 -0.23 -0.01 0.00 1.55 0.00 0.00 27.41 29.15 3mys h HIS 286 CO -0.21 0.47 -0.18 0.22 -1.30 0.00 0.00 177.93 176.93 3mys h ASP 287 N 0.73 0.72 -0.23 3.26 1.82 -0.02 0.26 116.42 122.96 3mys h ASP 287 Ca 0.19 -0.42 0.04 0.00 -0.39 0.00 0.00 57.03 56.45 3mys h ASP 287 Cb -0.02 -0.20 -0.04 0.00 0.68 0.00 0.00 39.33 39.75 3mys h ASP 287 CO -0.04 0.98 -0.03 0.44 -1.61 0.00 0.00 179.24 178.99 3mys h ASP 288 N 0.46 -0.15 -0.52 2.28 3.45 0.43 -1.69 116.42 120.68 3mys h ASP 288 Ca 0.07 0.06 0.09 0.00 0.43 0.00 0.00 57.03 57.68 3mys h ASP 288 Cb 0.73 0.12 -0.11 0.00 -0.56 0.00 0.00 39.33 39.51 3mys h ASP 288 CO 0.05 -0.04 -0.33 0.22 -1.57 0.00 0.00 179.24 177.56 3mys h TYR 289 N 0.04 -0.93 -0.92 4.55 3.20 -0.18 -2.06 116.97 120.67 3mys h TYR 289 Ca 0.11 0.07 -0.01 0.00 3.14 0.00 0.00 58.73 62.04 3mys h TYR 289 Cb 0.16 0.48 -0.04 0.00 1.54 0.00 0.00 36.73 38.87 3mys h TYR 289 CO -0.21 -0.38 0.52 -0.07 -1.64 0.00 0.00 178.16 176.38 3mys h LEU 290 N -0.20 1.13 -0.70 2.82 3.38 -0.36 -0.57 115.31 120.82 3mys h LEU 290 Ca 0.21 -0.09 0.15 0.00 0.09 0.00 0.00 57.88 58.24 3mys h LEU 290 Cb 0.55 -0.29 -0.11 0.00 0.09 0.00 0.00 40.66 40.89 3mys h LEU 290 CO -0.63 0.90 0.06 -0.78 0.09 0.00 0.00 178.44 178.08 3mys h ASP 291 N 1.28 -0.20 0.23 -0.43 1.82 -0.58 0.23 116.42 118.77 3mys h ASP 291 Ca 0.33 0.16 -0.20 0.00 -0.39 0.00 0.00 57.03 56.93 3mys h ASP 291 Cb -0.00 0.27 -0.04 0.00 0.68 0.00 0.00 39.33 40.24 3mys h ASP 291 CO -0.06 -0.11 -1.96 0.00 -1.61 0.00 0.00 179.24 175.50 3mys n ILE 292 N -5.26 0.96 0.17 2.25 0.13 -1.05 -4.59 119.36 111.96 3mys n ILE 292 Ca 0.12 -0.71 0.05 0.00 -1.10 0.00 0.00 62.75 61.12 3mys n ILE 292 Cb 0.43 -0.44 0.09 0.00 -0.84 0.00 0.00 39.64 38.88 3mys n ILE 292 CO 0.00 0.00 0.00 0.49 2.80 0.00 0.00 176.55 179.84 3mys n PHE 293 N -2.67 0.19 -4.19 9.51 3.72 -0.25 -5.05 117.46 118.73 3mys n PHE 293 Ca -0.17 -0.22 -0.28 0.00 -0.05 0.00 0.00 57.45 56.73 3mys n PHE 293 Cb 0.90 -0.01 -0.08 0.00 -0.94 0.00 0.00 39.48 39.34 3mys n PHE 293 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 3mys s GLY 294 N -0.93 1.77 -0.09 1.37 0.00 0.79 -4.96 107.32 105.27 3mys s GLY 294 Ca 0.17 -1.30 -0.30 0.00 0.00 0.00 0.00 44.72 43.29 3mys s GLY 294 CO 0.14 -1.31 1.45 -0.35 0.00 0.00 0.00 173.10 173.03 3mys s ASP 295 N -2.73 6.82 0.54 1.64 3.68 -1.26 -4.90 116.67 120.45 3mys s ASP 295 Ca 0.26 1.98 0.25 0.00 2.13 0.00 0.00 52.55 57.17 3mys s ASP 295 Cb -0.10 -2.54 1.53 0.00 -1.45 0.00 0.00 42.92 40.36 3mys s ASP 295 CO 0.18 -0.82 2.15 0.77 0.13 0.00 0.00 175.17 177.58 3mys h SER 296 N 8.70 0.00 1.51 -0.34 4.64 -1.95 -0.55 113.55 125.56 3mys h SER 296 Ca -0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.99 3mys h SER 296 Cb 1.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 3mys h SER 296 CO 0.95 0.06 0.00 0.71 -0.87 0.00 0.00 176.83 177.69 3mys h THR 297 N 0.00 0.00 0.03 2.95 1.35 -1.90 -2.25 112.91 113.09 3mys h THR 297 Ca -0.00 -0.63 -0.34 0.00 -0.55 0.00 0.00 66.41 64.89 3mys h THR 297 Cb 0.15 1.60 -0.05 0.00 -1.73 0.00 0.00 68.15 68.11 3mys h THR 297 CO 0.01 0.00 -2.02 0.29 -0.25 0.00 0.00 175.52 173.54 3mys n LYS 298 N -2.64 0.68 -0.00 4.72 4.01 -0.30 -4.50 118.16 120.12 3mys n LYS 298 Ca 0.04 0.20 0.08 0.00 -0.51 0.00 0.00 58.31 58.12 3mys n LYS 298 Cb 0.43 -1.68 -0.10 0.00 -0.51 0.00 0.00 35.03 33.17 3mys n LYS 298 CO 0.00 0.00 0.00 0.25 -1.11 0.00 0.00 177.40 176.54 3mys n THR 299 N -3.12 0.00 -0.17 -0.18 -2.24 -0.68 -5.00 114.28 102.90 3mys n THR 299 Ca -0.28 -0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.39 3mys n THR 299 Cb 1.07 0.98 0.00 0.00 -2.10 0.00 0.00 70.33 70.27 3mys n THR 299 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3mys n GLY 300 N 1.40 1.22 3.07 3.38 0.00 -0.85 -4.49 105.19 108.92 3mys n GLY 300 Ca 0.03 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.97 3mys n GLY 300 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3mys s LYS 301 N -0.51 0.54 0.00 1.61 -2.85 -1.21 -0.92 119.74 116.39 3mys s LYS 301 Ca 0.00 -0.96 0.00 0.00 -1.00 0.00 0.00 55.97 54.01 3mys s LYS 301 Cb 0.00 0.19 0.00 0.00 -2.06 0.00 0.00 37.83 35.96 3mys s LYS 301 CO 0.00 -0.11 0.00 1.55 0.10 0.00 0.00 175.35 176.89 3mys n VAL 302 N 0.62 0.00 0.00 1.79 3.14 -1.26 -4.40 118.33 118.22 3mys n VAL 302 Ca -0.18 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.20 3mys n VAL 302 Cb 0.59 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.37 3mys n VAL 302 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 3mys n SER 304 N 0.00 0.00 -0.37 6.55 3.41 -1.26 -5.04 113.62 116.91 3mys n SER 304 Ca 0.00 0.00 -0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3mys n SER 304 Cb 0.00 0.00 0.14 0.00 -0.26 0.00 0.00 64.21 64.09 3mys n SER 304 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 3mys h ASP 305 N 0.44 1.11 -0.07 4.04 3.32 -1.95 0.45 116.42 123.76 3mys h ASP 305 Ca 0.00 -0.02 -0.02 0.00 0.02 0.00 0.00 57.03 57.01 3mys h ASP 305 Cb 0.00 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 39.29 3mys h ASP 305 CO 0.00 0.77 -0.05 0.40 -1.72 0.00 0.00 179.24 178.64 3mys h ILE 306 N 1.30 1.34 0.00 0.35 2.04 -1.97 0.13 117.51 120.70 3mys h ILE 306 Ca 0.39 -1.13 -0.02 0.00 1.00 0.00 0.00 64.86 65.11 3mys h ILE 306 Cb -0.05 1.94 -0.00 0.00 -0.74 0.00 0.00 36.82 37.97 3mys h ILE 306 CO -0.11 0.31 -0.08 0.06 0.00 0.00 0.00 178.15 178.33 3mys h GLN 307 N -0.24 0.00 -0.50 2.37 -0.00 -1.69 -2.13 115.11 112.93 3mys h GLN 307 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.66 3mys h GLN 307 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.00 3mys h GLN 307 CO 0.01 0.08 0.00 0.09 -0.00 0.00 0.00 178.83 179.01 3mys n ASN 308 N -3.19 2.63 -3.19 0.06 3.02 0.15 -3.99 115.26 110.76 3mys n ASN 308 Ca 0.01 -2.10 -0.21 0.00 -0.03 0.00 0.00 54.58 52.25 3mys n ASN 308 Cb 0.38 -0.35 0.07 0.00 -0.61 0.00 0.00 39.78 39.27 3mys n ASN 308 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3mys n ASN 309 N 0.72 -5.76 -4.81 6.41 5.15 -0.95 -4.98 115.26 111.05 3mys n ASN 309 Ca 0.15 -0.47 -0.38 0.00 -0.60 0.00 0.00 54.58 53.28 3mys n ASN 309 Cb 0.45 -4.44 -0.06 0.00 -0.53 0.00 0.00 39.78 35.21 3mys n ASN 309 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 3mys s LYS 310 N -6.13 4.22 -0.70 1.20 -0.14 0.41 -4.88 119.74 113.72 3mys s LYS 310 Ca 0.50 0.76 -0.26 0.00 -1.36 0.00 0.00 55.97 55.61 3mys s LYS 310 Cb -0.22 -3.16 -0.00 0.00 -1.68 0.00 0.00 37.83 32.77 3mys s LYS 310 CO 0.63 0.58 1.63 -1.17 -0.76 0.00 0.00 175.35 176.26 3mys s LEU 311 N -1.33 3.24 0.34 3.17 2.96 -1.26 -4.85 118.68 120.95 3mys s LEU 311 Ca 0.33 -0.11 0.08 0.00 -0.22 0.00 0.00 54.13 54.21 3mys s LEU 311 Cb -0.19 -2.54 -0.05 0.00 0.50 0.00 0.00 46.19 43.91 3mys s LEU 311 CO 0.20 -2.16 0.10 0.42 -1.32 0.00 0.00 176.35 173.59 3mys s THR 312 N 7.69 2.89 0.07 3.68 -4.23 -1.26 -5.03 115.64 119.45 3mys s THR 312 Ca 0.54 -1.78 -0.21 0.00 -1.18 0.00 0.00 61.69 59.06 3mys s THR 312 Cb -0.10 -2.92 -0.12 0.00 1.34 0.00 0.00 72.50 70.70 3mys s THR 312 CO 0.16 -0.19 1.54 -0.25 -0.54 0.00 0.00 174.62 175.34 3mys h TRP 313 N 1.63 0.26 -0.85 3.99 7.01 -1.94 -1.38 115.95 124.68 3mys h TRP 313 Ca -0.43 -0.03 0.19 0.00 2.11 0.00 0.00 58.89 60.72 3mys h TRP 313 Cb 1.25 -0.07 -0.06 0.00 -2.10 0.00 0.00 29.16 28.18 3mys h TRP 313 CO 0.65 0.41 0.57 -1.35 -2.79 0.00 0.00 178.44 175.93 3mys h PRO 314 N 0.03 0.35 -0.10 2.65 0.11 -1.93 0.67 132.00 133.78 3mys h PRO 314 Ca 0.05 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 66.07 3mys h PRO 314 Cb 0.29 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.32 3mys h PRO 314 CO 0.00 0.23 -0.20 1.25 -0.21 0.00 0.00 178.00 179.07 3mys h LEU 315 N 0.36 0.34 -0.87 2.35 5.85 -1.85 -1.85 115.31 119.64 3mys h LEU 315 Ca 0.43 -0.56 -0.09 0.00 0.84 0.00 0.00 57.88 58.50 3mys h LEU 315 Cb 1.13 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 42.04 3mys h LEU 315 CO -0.14 0.84 -0.08 0.40 -0.34 0.00 0.00 178.44 179.12 3mys h ILE 316 N -0.15 1.25 0.19 4.05 2.04 -0.67 -1.82 117.51 122.40 3mys h ILE 316 Ca 0.00 -1.11 -0.01 0.00 1.00 0.00 0.00 64.86 64.74 3mys h ILE 316 Cb 0.78 1.01 0.00 0.00 -0.74 0.00 0.00 36.82 37.88 3mys h ILE 316 CO 0.04 0.38 -0.09 0.50 0.00 0.00 0.00 178.15 178.98 3mys h LYS 317 N 0.69 -0.24 -0.89 2.37 1.63 -0.90 -2.47 116.57 116.75 3mys h LYS 317 Ca 0.12 0.02 0.13 0.00 -0.85 0.00 0.00 60.65 60.07 3mys h LYS 317 Cb 0.54 0.06 -0.09 0.00 -0.60 0.00 0.00 32.23 32.14 3mys h LYS 317 CO 0.03 0.06 0.51 1.15 -3.45 0.00 0.00 179.45 177.75 3mys h THR 318 N -0.56 0.83 -0.01 1.00 2.02 -1.33 -2.35 112.91 112.51 3mys h THR 318 Ca -0.03 -0.27 -0.09 0.00 0.77 0.00 0.00 66.41 66.80 3mys h THR 318 Cb 0.42 -0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 66.80 3mys h THR 318 CO 0.04 0.14 -0.42 0.15 0.37 0.00 0.00 175.52 175.81 3mys h PHE 319 N 0.78 0.04 0.00 3.16 3.57 -1.11 -0.55 116.94 122.83 3mys h PHE 319 Ca 0.46 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.95 3mys h PHE 319 Cb 0.54 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.28 3mys h PHE 319 CO -0.05 0.45 -0.44 -0.85 -2.23 0.00 0.00 178.31 175.18 3mys n GLU 320 N -4.04 0.05 -0.00 1.11 0.28 -0.91 -4.03 120.64 113.10 3mys n GLU 320 Ca -0.02 0.02 0.06 0.00 -0.16 0.00 0.00 57.16 57.06 3mys n GLU 320 Cb 0.45 -1.53 -0.09 0.00 1.43 0.00 0.00 31.44 31.70 3mys n GLU 320 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 3mys n LEU 321 N -1.61 0.08 -4.95 -1.84 4.32 -0.92 -5.05 117.00 107.02 3mys n LEU 321 Ca 0.05 -0.08 -0.23 0.00 -0.02 0.00 0.00 56.01 55.74 3mys n LEU 321 Cb 0.35 0.00 -0.01 0.00 -1.62 0.00 0.00 43.42 42.14 3mys n LEU 321 CO 0.34 0.02 0.12 0.00 -1.22 0.00 0.00 177.39 176.65 3mys s SER 323 N -4.04 2.41 0.16 0.00 1.04 -1.26 -4.85 113.70 107.16 3mys s SER 323 Ca 0.39 1.22 -0.16 0.00 0.48 0.00 0.00 55.95 57.88 3mys s SER 323 Cb -0.09 -1.90 0.03 0.00 0.10 0.00 0.00 66.02 64.16 3mys s SER 323 CO 0.34 -3.27 1.81 -0.33 0.98 0.00 0.00 173.24 172.78 3mys h GLU 324 N -1.99 0.54 -0.13 4.02 4.39 -1.99 -2.07 114.58 117.35 3mys h GLU 324 Ca -0.55 -0.03 -0.05 0.00 0.34 0.00 0.00 59.36 59.06 3mys h GLU 324 Cb 1.33 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 29.85 3mys h GLU 324 CO 0.57 0.35 -0.17 -1.35 -1.16 0.00 0.00 179.01 177.26 3mys h PRO 325 N 0.55 0.21 -0.05 2.33 0.11 -2.01 -2.88 132.00 130.26 3mys h PRO 325 Ca 0.16 -0.05 -0.12 0.00 0.11 0.00 0.00 66.00 66.09 3mys h PRO 325 Cb -0.05 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 31.02 3mys h PRO 325 CO -0.05 0.38 -0.54 -0.44 -0.21 0.00 0.00 178.00 177.14 3mys h ASP 326 N 0.20 0.16 0.74 -2.05 3.32 -1.85 -2.36 116.42 114.57 3mys h ASP 326 Ca 0.04 -0.08 -0.03 0.00 0.02 0.00 0.00 57.03 56.97 3mys h ASP 326 Cb 0.41 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 39.92 3mys h ASP 326 CO 0.03 0.67 -0.45 0.11 -1.72 0.00 0.00 179.24 177.88 3mys h LYS 327 N 0.11 -1.07 -0.79 3.56 1.57 -1.18 -2.13 116.57 116.65 3mys h LYS 327 Ca -0.00 0.07 0.10 0.00 -1.87 0.00 0.00 60.65 58.95 3mys h LYS 327 Cb 0.99 0.24 -0.05 0.00 0.08 0.00 0.00 32.23 33.49 3mys h LYS 327 CO 0.08 -0.71 0.52 0.82 -0.57 0.00 0.00 179.45 179.58 3mys h ILE 328 N -1.11 0.94 0.00 1.86 2.04 -1.44 0.49 117.51 120.29 3mys h ILE 328 Ca -0.10 -0.24 -0.03 0.00 1.00 0.00 0.00 64.86 65.49 3mys h ILE 328 Cb 0.89 0.17 -0.00 0.00 -0.74 0.00 0.00 36.82 37.13 3mys h ILE 328 CO 0.10 0.13 -0.13 0.50 0.00 0.00 0.00 178.15 178.76 3mys h LYS 329 N 0.71 0.00 0.15 2.37 3.64 -1.26 -1.47 116.57 120.72 3mys h LYS 329 Ca 0.37 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.74 3mys h LYS 329 Cb 0.47 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.29 3mys h LYS 329 CO -0.14 0.13 -0.07 0.82 -2.27 0.00 0.00 179.45 177.91 3mys h ILE 330 N 0.00 0.49 -0.89 2.00 5.03 0.63 -2.99 117.51 121.78 3mys h ILE 330 Ca -0.00 -1.11 0.20 0.00 -0.12 0.00 0.00 64.86 63.84 3mys h ILE 330 Cb 0.30 0.87 -0.17 0.00 -3.03 0.00 0.00 36.82 34.80 3mys h ILE 330 CO 0.02 0.15 -0.10 0.58 -0.68 0.00 0.00 178.15 178.11 3mys h VAL 331 N -0.99 0.13 0.00 1.67 2.07 -1.20 0.49 116.25 118.42 3mys h VAL 331 Ca -0.02 -0.01 -0.04 0.00 0.82 0.00 0.00 66.70 67.45 3mys h VAL 331 Cb 0.40 0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 30.26 3mys h VAL 331 CO 0.03 0.00 -0.20 0.50 0.02 0.00 0.00 177.57 177.93 3mys h LYS 332 N 0.03 0.00 0.00 1.57 3.64 -1.36 -3.36 116.57 117.09 3mys h LYS 332 Ca 0.48 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.82 3mys h LYS 332 Cb 0.84 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.65 3mys h LYS 332 CO -0.87 0.20 -1.26 0.09 -2.27 0.00 0.00 179.45 175.35 3mys n ASN 333 N -3.34 3.93 -4.70 4.20 3.02 -0.36 -5.01 115.26 112.99 3mys n ASN 333 Ca 0.00 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.13 3mys n ASN 333 Cb 0.43 0.92 -0.03 0.00 -0.61 0.00 0.00 39.78 40.49 3mys n ASN 333 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 3mys s TYR 334 N -2.22 3.19 0.00 3.10 5.04 0.16 -3.69 117.35 122.93 3mys s TYR 334 Ca -0.02 1.13 0.00 0.00 -2.44 0.00 0.00 57.07 55.74 3mys s TYR 334 Cb 0.02 -3.49 0.00 0.00 0.35 0.00 0.00 41.96 38.84 3mys s TYR 334 CO 0.19 -1.64 0.00 0.41 -1.34 0.00 0.00 175.55 173.17 3mys n GLY 335 N 3.39 1.15 3.49 8.97 0.00 -0.84 -4.65 105.19 116.70 3mys n GLY 335 Ca 0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.81 3mys n GLY 335 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mys s LYS 336 N -0.20 2.32 0.39 1.61 1.02 -1.24 -4.62 119.74 119.01 3mys s LYS 336 Ca 0.00 -0.83 0.20 0.00 0.02 0.00 0.00 55.97 55.36 3mys s LYS 336 Cb 0.00 -2.31 0.25 0.00 -0.52 0.00 0.00 37.83 35.25 3mys s LYS 336 CO 0.00 0.58 1.56 -0.91 -0.92 0.00 0.00 175.35 175.66 3mys h ASN 337 N 4.81 0.00 -2.82 2.83 2.35 -1.94 -3.41 115.58 117.40 3mys h ASN 337 Ca -0.47 0.00 -0.52 0.00 -0.55 0.00 0.00 56.30 54.75 3mys h ASN 337 Cb 1.16 0.00 0.06 0.00 0.05 0.00 0.00 38.32 39.59 3mys h ASN 337 CO 0.50 0.16 0.98 0.21 -1.65 0.00 0.00 177.43 177.63 3mys s ASN 338 N -6.29 6.38 0.43 5.81 3.84 -1.26 -4.92 114.94 118.92 3mys s ASN 338 Ca 0.06 2.89 0.17 0.00 0.21 0.00 0.00 52.86 56.19 3mys s ASN 338 Cb 0.06 -2.61 0.96 0.00 -0.55 0.00 0.00 41.25 39.11 3mys s ASN 338 CO 0.69 -0.96 1.91 -0.07 -2.79 0.00 0.00 177.10 175.89 3mys h LEU 339 N 6.34 0.00 -1.24 3.21 4.07 -2.00 -2.67 115.31 123.02 3mys h LEU 339 Ca -0.44 0.00 -0.08 0.00 0.08 0.00 0.00 57.88 57.44 3mys h LEU 339 Cb 1.21 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.93 3mys h LEU 339 CO 0.92 0.27 -0.36 0.00 -1.08 0.00 0.00 178.44 178.18 3mys h ALA 340 N 1.73 1.26 0.09 1.53 0.00 -1.96 -1.60 119.26 120.31 3mys h ALA 340 Ca -0.00 -0.33 -0.26 0.00 0.00 0.00 0.00 54.91 54.32 3mys h ALA 340 Cb 0.53 -0.06 0.03 0.00 0.00 0.00 0.00 17.79 18.29 3mys h ALA 340 CO 0.03 0.45 -1.08 0.00 0.00 0.00 0.00 179.25 178.65 3mys h VAL 342 N 0.17 1.24 -0.81 0.00 -1.51 -1.32 -2.55 116.25 111.47 3mys h VAL 342 Ca -0.16 -0.84 0.19 0.00 -1.23 0.00 0.00 66.70 64.66 3mys h VAL 342 Cb 1.77 0.91 -0.12 0.00 -2.13 0.00 0.00 31.29 31.72 3mys h VAL 342 CO 0.21 0.30 0.21 0.11 -1.23 0.00 0.00 177.57 177.17 3mys h LYS 343 N 0.61 0.24 -0.51 5.19 6.56 -1.39 0.40 116.57 127.68 3mys h LYS 343 Ca 0.14 -0.01 0.03 0.00 -1.06 0.00 0.00 60.65 59.74 3mys h LYS 343 Cb 0.34 -0.06 -0.04 0.00 -0.57 0.00 0.00 32.23 31.91 3mys h LYS 343 CO 0.00 0.16 0.30 0.28 -2.06 0.00 0.00 179.45 178.13 3mys h VAL 344 N 0.25 1.04 -0.15 0.50 2.07 -1.33 0.74 116.25 119.37 3mys h VAL 344 Ca 0.48 -0.20 -0.02 0.00 0.82 0.00 0.00 66.70 67.78 3mys h VAL 344 Cb 0.89 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 3mys h VAL 344 CO -0.58 0.11 0.03 0.40 0.02 0.00 0.00 177.57 177.55 3mys h ILE 345 N 0.59 1.21 -0.13 4.57 1.08 -1.05 -1.25 117.51 122.53 3mys h ILE 345 Ca 0.21 -0.67 0.03 0.00 -0.39 0.00 0.00 64.86 64.04 3mys h ILE 345 Cb 0.04 1.38 -0.03 0.00 -3.07 0.00 0.00 36.82 35.14 3mys h ILE 345 CO -0.10 0.20 -0.07 -0.78 -0.69 0.00 0.00 178.15 176.70 3mys h ASP 346 N 0.03 -0.24 -0.55 1.72 1.82 0.50 -0.24 116.42 119.46 3mys h ASP 346 Ca 0.05 0.06 -0.00 0.00 -0.39 0.00 0.00 57.03 56.74 3mys h ASP 346 Cb 0.28 0.13 -0.03 0.00 0.68 0.00 0.00 39.33 40.40 3mys h ASP 346 CO 0.00 -0.10 0.34 0.28 -1.61 0.00 0.00 179.24 178.15 3mys h SER 347 N -0.07 0.66 0.44 2.28 0.02 0.49 -1.12 113.55 116.25 3mys h SER 347 Ca 0.08 -0.03 -0.07 0.00 -0.84 0.00 0.00 61.79 60.92 3mys h SER 347 Cb 0.18 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.55 3mys h SER 347 CO -0.18 0.51 -0.35 -0.07 -1.14 0.00 0.00 176.83 175.60 3mys h LEU 348 N 0.77 0.00 -0.26 5.07 3.38 -0.34 0.61 115.31 124.53 3mys h LEU 348 Ca 0.20 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.97 3mys h LEU 348 Cb -0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.72 3mys h LEU 348 CO -0.04 0.35 -0.71 1.88 0.09 0.00 0.00 178.44 180.01 3mys h TYR 349 N 0.00 0.96 0.45 1.13 0.05 0.10 -2.07 116.97 117.58 3mys h TYR 349 Ca -0.00 -0.40 -0.02 0.00 0.05 0.00 0.00 58.73 58.35 3mys h TYR 349 Cb 0.66 -0.16 0.00 0.00 1.01 0.00 0.00 36.73 38.25 3mys h TYR 349 CO 0.00 1.21 -0.21 1.49 -1.05 0.00 0.00 178.16 179.60 3mys h GLU 350 N 0.51 -0.58 -0.65 4.88 4.57 -0.91 0.53 114.58 122.94 3mys h GLU 350 Ca -0.03 0.04 0.12 0.00 -1.18 0.00 0.00 59.36 58.31 3mys h GLU 350 Cb 1.32 0.13 -0.12 0.00 -0.16 0.00 0.00 28.75 29.92 3mys h GLU 350 CO 0.14 -0.31 -0.24 0.37 -1.18 0.00 0.00 179.01 177.79 3mys h GLN 351 N -0.75 -0.07 -0.56 1.92 4.15 0.23 0.30 115.11 120.33 3mys h GLN 351 Ca -0.06 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.36 3mys h GLN 351 Cb 0.53 0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.24 3mys h GLN 351 CO 0.10 -0.04 0.00 0.66 -1.93 0.00 0.00 178.83 177.62 3mys n TYR 352 N -5.45 0.66 -3.88 3.99 4.01 -0.78 -4.95 117.16 110.75 3mys n TYR 352 Ca 0.07 -0.26 -0.32 0.00 -0.16 0.00 0.00 57.90 57.23 3mys n TYR 352 Cb 0.36 -0.13 0.01 0.00 -0.31 0.00 0.00 39.34 39.26 3mys n TYR 352 CO 0.00 0.00 0.00 0.36 -0.46 0.00 0.00 176.86 176.76 3mys n LYS 353 N 0.36 -1.14 -0.15 -0.72 2.85 0.10 -4.88 118.16 114.59 3mys n LYS 353 Ca 0.11 0.54 -0.10 0.00 -1.05 0.00 0.00 58.31 57.82 3mys n LYS 353 Cb 0.46 -2.36 0.03 0.00 -0.65 0.00 0.00 35.03 32.52 3mys n LYS 353 CO 0.00 0.00 0.00 0.82 -0.05 0.00 0.00 177.40 178.17 3mys h ILE 354 N -1.02 1.27 -0.95 0.58 1.08 -1.15 -3.06 117.51 114.25 3mys h ILE 354 Ca -0.66 -1.33 0.19 0.00 -0.39 0.00 0.00 64.86 62.67 3mys h ILE 354 Cb 1.40 1.09 -0.18 0.00 -3.07 0.00 0.00 36.82 36.06 3mys h ILE 354 CO 0.41 0.46 -0.24 0.03 -0.69 0.00 0.00 178.15 178.12 3mys h ARG 355 N 0.83 -0.00 0.00 2.37 3.08 -1.90 0.03 114.38 118.79 3mys h ARG 355 Ca 0.12 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.10 3mys h ARG 355 Cb 0.73 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.77 3mys h ARG 355 CO 0.06 -0.00 -0.31 0.87 -1.07 0.00 0.00 179.97 179.52 3mys h LYS 356 N -0.00 0.00 -0.02 0.04 1.57 -1.91 -1.24 116.57 115.01 3mys h LYS 356 Ca 0.46 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 59.09 3mys h LYS 356 Cb 0.70 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.99 3mys h LYS 356 CO -0.98 0.31 -0.65 0.45 -0.57 0.00 0.00 179.45 178.01 3mys h HIS 357 N 0.00 0.10 0.65 -1.35 3.86 -1.09 -2.44 115.15 114.88 3mys h HIS 357 Ca -0.00 -0.04 -0.03 0.00 -1.16 0.00 0.00 60.37 59.13 3mys h HIS 357 Cb 0.94 -0.02 0.01 0.00 1.06 0.00 0.00 27.41 29.40 3mys h HIS 357 CO 0.00 0.71 -0.31 -0.92 0.86 0.00 0.00 177.93 178.27 3mys h TYR 358 N 0.05 -0.81 -0.99 2.45 3.20 -0.51 -1.36 116.97 119.00 3mys h TYR 358 Ca -0.01 -0.02 0.37 0.00 3.14 0.00 0.00 58.73 62.21 3mys h TYR 358 Cb 1.16 0.27 -0.17 0.00 1.54 0.00 0.00 36.73 39.53 3mys h TYR 358 CO 0.01 -0.50 0.46 1.49 -1.64 0.00 0.00 178.16 177.98 3mys h GLU 359 N -1.19 0.09 0.00 1.82 4.81 -1.30 0.82 114.58 119.62 3mys h GLU 359 Ca -0.09 -0.01 -0.14 0.00 -0.13 0.00 0.00 59.36 59.00 3mys h GLU 359 Cb 0.67 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.01 3mys h GLU 359 CO 0.15 0.06 -0.65 1.03 -0.73 0.00 0.00 179.01 178.86 3mys h SER 360 N 0.09 0.00 -0.16 1.04 0.87 -1.39 -2.91 113.55 111.09 3mys h SER 360 Ca 0.77 0.00 -0.18 0.00 -1.23 0.00 0.00 61.79 61.15 3mys h SER 360 Cb 1.92 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 63.89 3mys h SER 360 CO -0.75 0.65 -0.61 0.22 -0.53 0.00 0.00 176.83 175.82 3mys h TYR 361 N 0.00 0.93 -0.36 2.24 3.20 0.17 -2.83 116.97 120.31 3mys h TYR 361 Ca -0.01 -0.39 0.02 0.00 3.14 0.00 0.00 58.73 61.49 3mys h TYR 361 Cb 1.28 -0.15 -0.02 0.00 1.54 0.00 0.00 36.73 39.38 3mys h TYR 361 CO 0.00 1.19 0.21 1.49 -1.64 0.00 0.00 178.16 179.42 3mys h GLU 362 N 0.39 0.42 -0.38 1.82 4.22 -0.56 0.36 114.58 120.86 3mys h GLU 362 Ca -0.03 -0.03 -0.09 0.00 0.08 0.00 0.00 59.36 59.30 3mys h GLU 362 Cb 1.24 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.38 3mys h GLU 362 CO 0.13 0.28 -0.10 0.87 -2.18 0.00 0.00 179.01 178.01 3mys h LYS 363 N 0.43 0.74 -0.95 1.92 1.79 -1.62 -1.27 116.57 117.62 3mys h LYS 363 Ca 0.14 -0.29 0.01 0.00 -2.18 0.00 0.00 60.65 58.34 3mys h LYS 363 Cb 0.00 -0.04 -0.05 0.00 -1.58 0.00 0.00 32.23 30.56 3mys h LYS 363 CO -0.07 0.89 0.63 0.00 -1.08 0.00 0.00 179.45 179.82 3mys h ALA 364 N 0.83 1.34 0.11 3.86 0.00 -1.07 -2.56 119.26 121.77 3mys h ALA 364 Ca 0.10 -0.06 -0.24 0.00 0.00 0.00 0.00 54.91 54.71 3mys h ALA 364 Cb 0.62 -0.38 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3mys h ALA 364 CO 0.04 0.61 -1.18 0.37 0.00 0.00 0.00 179.25 179.08 3mys h GLN 365 N 1.27 0.23 -0.44 0.00 5.75 -0.92 -2.31 115.11 118.69 3mys h GLN 365 Ca 0.35 -0.39 0.07 0.00 -0.15 0.00 0.00 58.65 58.53 3mys h GLN 365 Cb -0.12 0.15 -0.09 0.00 1.07 0.00 0.00 27.48 28.49 3mys h GLN 365 CO -0.08 1.19 -0.44 -0.22 -2.65 0.00 0.00 178.83 176.63 3mys h LYS 366 N -0.40 -0.30 -0.69 1.69 3.64 -1.28 0.15 116.57 119.38 3mys h LYS 366 Ca -0.25 0.02 0.13 0.00 -1.27 0.00 0.00 60.65 59.28 3mys h LYS 366 Cb 1.67 0.07 -0.09 0.00 -0.41 0.00 0.00 32.23 33.46 3mys h LYS 366 CO 0.06 -0.20 0.23 0.00 -2.27 0.00 0.00 179.45 177.27 3mys h ALA 367 N 0.45 0.92 -0.84 5.00 0.00 -1.53 0.01 119.26 123.27 3mys h ALA 367 Ca 0.14 0.12 0.01 0.00 0.00 0.00 0.00 54.91 55.19 3mys h ALA 367 Cb 0.58 0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.46 3mys h ALA 367 CO -0.60 -0.25 0.56 1.57 0.00 0.00 0.00 179.25 180.53 3mys h LYS 368 N 0.37 1.08 0.01 0.00 2.10 -0.50 -2.54 116.57 117.09 3mys h LYS 368 Ca 0.38 -0.07 -0.03 0.00 -2.00 0.00 0.00 60.65 58.93 3mys h LYS 368 Cb 0.57 -0.24 0.00 0.00 -0.90 0.00 0.00 32.23 31.65 3mys h LYS 368 CO -0.41 0.72 -0.12 -0.84 -2.00 0.00 0.00 179.45 176.80 3mys h ILE 369 N 1.12 1.64 -0.87 0.07 3.07 0.97 -2.97 117.51 120.54 3mys h ILE 369 Ca 0.31 -2.04 0.21 0.00 1.55 0.00 0.00 64.86 64.89 3mys h ILE 369 Cb -0.10 3.00 -0.16 0.00 -0.27 0.00 0.00 36.82 39.29 3mys h ILE 369 CO -0.07 0.54 -0.02 -0.07 -1.05 0.00 0.00 178.15 177.47 3mys h LEU 370 N -0.73 -0.48 -0.84 0.16 3.38 -1.09 -1.68 115.31 114.02 3mys h LEU 370 Ca -0.02 0.24 0.02 0.00 0.09 0.00 0.00 57.88 58.21 3mys h LEU 370 Cb 0.95 0.43 -0.05 0.00 0.09 0.00 0.00 40.66 42.09 3mys h LEU 370 CO 0.02 -0.26 0.55 -1.28 0.09 0.00 0.00 178.44 177.56 3mys h SER 371 N 0.06 0.93 1.60 -0.43 0.87 -1.38 -1.75 113.55 113.44 3mys h SER 371 Ca 0.48 -0.02 -0.05 0.00 -1.23 0.00 0.00 61.79 60.98 3mys h SER 371 Cb 0.90 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 62.63 3mys h SER 371 CO -0.81 0.66 -0.41 0.00 -0.53 0.00 0.00 176.83 175.74 3mys h ALA 372 N 1.33 0.79 -0.53 6.23 0.00 -1.23 -3.11 119.26 122.74 3mys h ALA 372 Ca 0.32 -0.24 -0.12 0.00 0.00 0.00 0.00 54.91 54.87 3mys h ALA 372 Cb -0.07 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 3mys h ALA 372 CO -0.09 0.31 -0.14 0.82 0.00 0.00 0.00 179.25 180.15 3mys h ILE 373 N 0.00 1.27 0.00 0.00 2.04 -1.02 -3.01 117.51 116.79 3mys h ILE 373 Ca -0.01 -1.30 -0.02 0.00 1.00 0.00 0.00 64.86 64.52 3mys h ILE 373 Cb 1.19 1.01 -0.00 0.00 -0.74 0.00 0.00 36.82 38.28 3mys h ILE 373 CO 0.03 0.46 -0.11 0.78 0.00 0.00 0.00 178.15 179.30 3mys h ASN 374 N 0.89 0.00 -0.24 1.72 2.35 -1.26 -1.03 115.58 118.00 3mys h ASN 374 Ca 0.13 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.88 3mys h ASN 374 Cb 0.71 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.08 3mys h ASN 374 CO 0.05 0.11 0.00 -0.62 -1.65 0.00 0.00 177.43 175.33 3mys n GLU 375 N -3.29 2.29 0.10 0.81 4.71 -1.14 -4.15 120.64 119.97 3mys n GLU 375 Ca -0.00 -1.17 -0.23 0.00 -0.01 0.00 0.00 57.16 55.75 3mys n GLU 375 Cb 0.34 -1.65 -0.14 0.00 -1.01 0.00 0.00 31.44 28.98 3mys n GLU 375 CO 0.00 0.00 0.00 -0.07 0.09 0.00 0.00 177.13 177.15 3mys h LEU 376 N 1.58 0.80 -1.50 -4.62 3.38 -1.21 -3.49 115.31 110.25 3mys h LEU 376 Ca 0.00 -0.87 -0.21 0.00 0.09 0.00 0.00 57.88 56.88 3mys h LEU 376 Cb 0.89 -0.26 0.10 0.00 0.09 0.00 0.00 40.66 41.48 3mys h LEU 376 CO 0.14 1.61 -0.45 1.41 0.09 0.00 0.00 178.44 181.24 3mys n HIS 377 N -3.83 -1.46 -3.24 1.13 8.25 -1.26 -5.04 115.22 109.77 3mys n HIS 377 Ca -0.15 0.58 -0.02 0.00 -0.26 0.00 0.00 57.72 57.87 3mys n HIS 377 Cb 0.99 -3.72 -0.04 0.00 1.12 0.00 0.00 29.99 28.34 3mys n HIS 377 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 3mys s HIS 378 N -3.21 -1.29 0.30 4.41 5.04 -1.26 -5.07 115.29 114.21 3mys s HIS 378 Ca 0.12 1.11 0.07 0.00 -1.54 0.00 0.00 55.06 54.81 3mys s HIS 378 Cb -0.05 0.23 0.48 0.00 0.04 0.00 0.00 32.58 33.28 3mys s HIS 378 CO 0.44 -0.87 1.72 1.49 -2.34 0.00 0.00 174.74 175.17 3mys h GLU 379 N 8.09 0.25 0.67 2.88 4.57 -1.96 -1.84 114.58 127.24 3mys h GLU 379 Ca -0.16 -0.11 -0.03 0.00 -1.18 0.00 0.00 59.36 57.87 3mys h GLU 379 Cb 1.16 -0.01 0.01 0.00 -0.16 0.00 0.00 28.75 29.75 3mys h GLU 379 CO 0.25 0.60 -0.32 0.78 -1.18 0.00 0.00 179.01 179.14 3mys h GLY 380 N 1.17 -0.94 0.90 1.92 0.00 -1.89 -1.83 103.07 102.42 3mys h GLY 380 Ca 0.02 0.35 0.02 0.00 0.00 0.00 0.00 47.33 47.72 3mys h GLY 380 CO 0.06 -0.34 0.43 -2.22 0.00 0.00 0.00 176.54 174.47 3mys h ILE 381 N -1.21 1.11 -0.74 2.60 2.04 -1.66 -1.77 117.51 117.88 3mys h ILE 381 Ca -0.09 -0.29 0.14 0.00 1.00 0.00 0.00 64.86 65.61 3mys h ILE 381 Cb 0.70 0.19 -0.09 0.00 -0.74 0.00 0.00 36.82 36.88 3mys h ILE 381 CO 0.15 0.15 0.29 -0.33 0.00 0.00 0.00 178.15 178.42 3mys h GLU 382 N 0.84 0.43 -0.47 2.37 5.08 -1.40 -0.57 114.58 120.87 3mys h GLU 382 Ca 0.27 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.57 3mys h GLU 382 Cb -0.01 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.12 3mys h GLU 382 CO -0.09 0.29 0.15 -0.92 -1.00 0.00 0.00 179.01 177.43 3mys h TYR 383 N 0.44 0.69 0.07 4.33 3.20 -0.45 -2.37 116.97 122.89 3mys h TYR 383 Ca 0.40 -0.04 -0.00 0.00 3.14 0.00 0.00 58.73 62.23 3mys h TYR 383 Cb 0.60 -0.21 0.00 0.00 1.54 0.00 0.00 36.73 38.66 3mys h TYR 383 CO -0.17 0.57 -0.03 0.28 -1.64 0.00 0.00 178.16 177.17 3mys h VAL 384 N 0.67 1.22 -0.74 1.81 2.07 -0.85 -2.25 116.25 118.19 3mys h VAL 384 Ca 0.16 -1.23 0.06 0.00 0.82 0.00 0.00 66.70 66.51 3mys h VAL 384 Cb 0.20 1.99 -0.06 0.00 -1.52 0.00 0.00 31.29 31.90 3mys h VAL 384 CO -0.01 0.29 0.44 -0.07 0.02 0.00 0.00 177.57 178.25 3mys h LEU 385 N -0.67 0.68 -0.55 2.57 3.38 -1.10 0.42 115.31 120.04 3mys h LEU 385 Ca -0.01 0.02 -0.08 0.00 0.09 0.00 0.00 57.88 57.91 3mys h LEU 385 Cb 0.56 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 3mys h LEU 385 CO 0.02 0.44 0.05 0.11 0.09 0.00 0.00 178.44 179.15 3mys h LYS 386 N 0.82 0.94 -0.45 1.13 1.57 -1.50 0.34 116.57 119.42 3mys h LYS 386 Ca 0.32 -0.27 -0.02 0.00 -1.87 0.00 0.00 60.65 58.82 3mys h LYS 386 Cb 0.16 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.35 3mys h LYS 386 CO -0.17 0.93 0.22 -0.92 -0.57 0.00 0.00 179.45 178.94 3mys h TYR 387 N 0.83 0.64 0.09 -1.35 3.20 -0.75 -2.61 116.97 117.02 3mys h TYR 387 Ca 0.16 -0.03 0.01 0.00 3.14 0.00 0.00 58.73 62.01 3mys h TYR 387 Cb 0.47 -0.20 -0.01 0.00 1.54 0.00 0.00 36.73 38.52 3mys h TYR 387 CO 0.03 0.51 -0.12 1.25 -1.64 0.00 0.00 178.16 178.20 3mys h LEU 388 N 0.58 -0.31 -1.44 2.82 5.85 0.31 -2.24 115.31 120.89 3mys h LEU 388 Ca 0.15 0.03 0.21 0.00 0.84 0.00 0.00 57.88 59.12 3mys h LEU 388 Cb 0.11 0.11 -0.07 0.00 0.37 0.00 0.00 40.66 41.18 3mys h LEU 388 CO -0.02 -0.17 0.61 0.25 -0.34 0.00 0.00 178.44 178.77 3mys h LEU 389 N -0.24 0.45 -0.63 2.25 5.85 -0.31 0.63 115.31 123.32 3mys h LEU 389 Ca 0.01 0.05 -0.15 0.00 0.84 0.00 0.00 57.88 58.64 3mys h LEU 389 Cb 0.25 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.23 3mys h LEU 389 CO -0.05 0.17 -0.67 -0.33 -0.34 0.00 0.00 178.44 177.22 3mys h GLU 390 N 0.45 0.10 -0.02 1.25 4.39 -1.01 -3.32 114.58 116.41 3mys h GLU 390 Ca 0.50 -0.08 0.00 0.00 0.34 0.00 0.00 59.36 60.12 3mys h GLU 390 Cb 1.19 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.85 3mys h GLU 390 CO -0.21 0.73 -0.00 1.51 -1.16 0.00 0.00 179.01 179.87 3mys n ILE 391 N -3.78 0.00 -0.13 3.13 0.13 0.03 -4.69 119.36 114.05 3mys n ILE 391 Ca -0.02 -0.50 -0.05 0.00 -1.10 0.00 0.00 62.75 61.08 3mys n ILE 391 Cb 0.66 1.30 0.01 0.00 -0.84 0.00 0.00 39.64 40.77 3mys n ILE 391 CO 0.00 0.00 0.00 -0.07 2.80 0.00 0.00 176.55 179.28 3mys h LEU 392 N 2.84 -0.72 0.00 9.51 3.38 -1.18 0.33 115.31 129.49 3mys h LEU 392 Ca 0.00 0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.13 3mys h LEU 392 Cb 0.61 0.39 0.00 0.00 0.09 0.00 0.00 40.66 41.74 3mys h LEU 392 CO 0.00 -0.24 -0.17 0.49 0.09 0.00 0.00 178.44 178.61 3mys n PHE 393 N -5.39 0.40 -0.07 1.13 0.99 -1.26 -3.94 117.46 109.33 3mys n PHE 393 Ca 0.03 0.12 -0.09 0.00 -0.00 0.00 0.00 57.45 57.51 3mys n PHE 393 Cb 0.30 -0.64 -0.07 0.00 -1.00 0.00 0.00 39.48 38.07 3mys n PHE 393 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.76 177.01 3mys n THR 394 N -1.86 0.79 0.00 4.37 -2.24 -1.10 -5.14 114.28 109.11 3mys n THR 394 Ca 0.06 -0.34 0.00 0.00 -2.27 0.00 0.00 64.05 61.49 3mys n THR 394 Cb 0.39 -0.93 0.00 0.00 -2.10 0.00 0.00 70.33 67.68 3mys n THR 394 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3mys n GLY 395 N 2.72 -0.12 3.39 3.38 0.00 0.09 -4.94 105.19 109.71 3mys n GLY 395 Ca -0.23 -1.89 0.00 0.00 0.00 0.00 0.00 46.02 43.89 3mys n GLY 395 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70