#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1eio h PHE 2 N 0.00 0.10 -4.10 0.00 -1.00 -2.00 -3.46 116.94 106.48 1eio h PHE 2 Ca 0.00 -0.03 -0.53 0.00 2.81 0.00 0.00 57.97 60.22 1eio h PHE 2 Cb 0.00 -0.02 0.11 0.00 3.61 0.00 0.00 35.95 39.65 1eio h PHE 2 CO 0.00 0.55 0.47 0.99 -1.61 0.00 0.00 178.31 178.71 1eio s THR 3 N -3.96 2.63 -3.66 -1.55 2.01 -1.26 -4.86 115.64 105.00 1eio s THR 3 Ca -0.03 0.39 0.00 0.00 0.31 0.00 0.00 61.69 62.36 1eio s THR 3 Cb 0.13 -3.16 0.00 0.00 0.01 0.00 0.00 72.50 69.49 1eio s THR 3 CO 0.76 -0.09 0.00 0.61 -0.69 0.00 0.00 174.62 175.21 1eio n GLY 4 N 0.50 0.83 3.87 4.40 0.00 0.14 -4.99 105.19 109.95 1eio n GLY 4 Ca 0.14 -2.03 -0.34 0.00 0.00 0.00 0.00 46.02 43.79 1eio n GLY 4 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1eio s LYS 5 N -1.36 3.72 0.17 1.61 2.20 -1.26 -0.55 119.74 124.27 1eio s LYS 5 Ca 0.00 0.12 -0.05 0.00 -0.36 0.00 0.00 55.97 55.68 1eio s LYS 5 Cb 0.00 -2.98 -0.02 0.00 -1.51 0.00 0.00 37.83 33.32 1eio s LYS 5 CO 0.00 0.55 0.20 0.71 -0.36 0.00 0.00 175.35 176.45 1eio s TYR 6 N -1.43 0.70 -0.16 4.03 1.51 0.32 -0.08 117.35 122.24 1eio s TYR 6 Ca 0.34 -1.04 -0.13 0.00 -1.01 0.00 0.00 57.07 55.23 1eio s TYR 6 Cb -0.14 -0.27 0.05 0.00 -0.11 0.00 0.00 41.96 41.49 1eio s TYR 6 CO 0.19 -0.67 0.42 -2.00 -1.11 0.00 0.00 175.55 172.39 1eio s GLU 7 N -4.04 0.46 0.03 -0.62 -6.30 0.84 -0.17 118.70 108.90 1eio s GLU 7 Ca 0.25 0.67 -0.23 0.00 -2.50 0.00 0.00 54.97 53.16 1eio s GLU 7 Cb 0.05 0.15 -0.06 0.00 0.00 0.00 0.00 34.13 34.27 1eio s GLU 7 CO 0.04 -0.10 0.68 0.42 0.02 0.00 0.00 175.26 176.33 1eio s ILE 8 N 0.66 4.80 -0.14 -3.70 1.01 -0.23 -0.83 121.20 122.77 1eio s ILE 8 Ca -0.04 1.45 -0.25 0.00 0.00 0.00 0.00 60.65 61.82 1eio s ILE 8 Cb -0.05 -4.03 -0.22 0.00 0.01 0.00 0.00 42.46 38.17 1eio s ILE 8 CO -0.04 0.40 0.63 -0.08 0.00 0.00 0.00 174.94 175.85 1eio h GLU 9 N 5.58 0.00 -2.26 2.79 4.57 -0.58 -3.40 114.58 121.28 1eio h GLU 9 Ca -0.45 0.00 0.19 0.00 -1.18 0.00 0.00 59.36 57.93 1eio h GLU 9 Cb 1.20 0.00 -0.08 0.00 -0.16 0.00 0.00 28.75 29.71 1eio h GLU 9 CO 0.70 0.87 0.53 0.45 -1.18 0.00 0.00 179.01 180.38 1eio s SER 10 N -6.18 -0.15 -0.43 1.04 0.15 -1.19 -4.94 113.70 102.01 1eio s SER 10 Ca -0.17 -0.40 0.02 0.00 0.70 0.00 0.00 55.95 56.09 1eio s SER 10 Cb -0.02 0.45 0.14 0.00 -1.71 0.00 0.00 66.02 64.88 1eio s SER 10 CO 0.60 -0.85 0.23 -1.61 1.20 0.00 0.00 173.24 172.82 1eio s GLU 11 N -3.09 1.21 -0.02 5.44 2.02 -1.26 -1.40 118.70 121.60 1eio s GLU 11 Ca 0.13 -1.94 -0.02 0.00 0.02 0.00 0.00 54.97 53.17 1eio s GLU 11 Cb -0.01 -2.24 -0.08 0.00 0.10 0.00 0.00 34.13 31.91 1eio s GLU 11 CO 0.02 -1.17 2.54 0.36 0.02 0.00 0.00 175.26 177.04 1eio n LYS 12 N 3.60 1.38 0.00 1.61 2.85 -0.00 -4.31 118.16 123.28 1eio n LYS 12 Ca 0.09 -0.43 0.00 0.00 -1.05 0.00 0.00 58.31 56.92 1eio n LYS 12 Cb 0.35 -1.37 0.00 0.00 -0.65 0.00 0.00 35.03 33.36 1eio n LYS 12 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 177.40 175.64 1eio n ASN 13 N 1.77 0.00 0.00 -5.58 2.85 -1.26 -4.64 115.26 108.40 1eio n ASN 13 Ca 0.16 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.63 1eio n ASN 13 Cb 0.64 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.66 1eio n ASN 13 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1eio n TYR 14 N -0.73 0.00 0.08 1.20 9.36 -1.26 -4.45 117.16 121.36 1eio n TYR 14 Ca 0.00 0.00 -0.12 0.00 3.32 0.00 0.00 57.90 61.10 1eio n TYR 14 Cb 0.00 0.00 -0.08 0.00 -0.63 0.00 0.00 39.34 38.63 1eio n TYR 14 CO 0.00 0.00 0.00 0.22 0.22 0.00 0.00 176.86 177.30 1eio h ASP 15 N 0.00 -0.21 0.40 2.98 1.82 -1.97 0.28 116.42 119.72 1eio h ASP 15 Ca 0.00 -0.31 0.00 0.00 -0.39 0.00 0.00 57.03 56.33 1eio h ASP 15 Cb 0.00 0.06 0.00 0.00 0.68 0.00 0.00 39.33 40.07 1eio h ASP 15 CO 0.00 0.25 0.00 -0.62 -1.61 0.00 0.00 179.24 177.26 1eio n GLU 16 N -4.99 0.37 -0.07 0.28 -0.58 -1.26 -0.94 120.64 113.45 1eio n GLU 16 Ca -0.09 0.06 -0.12 0.00 -0.42 0.00 0.00 57.16 56.60 1eio n GLU 16 Cb 0.26 -1.50 -0.11 0.00 -0.57 0.00 0.00 31.44 29.52 1eio n GLU 16 CO 0.00 0.00 0.00 0.35 -0.48 0.00 0.00 177.13 177.00 1eio h PHE 17 N 0.00 0.00 -0.02 -0.32 3.57 -1.72 -3.29 116.94 115.16 1eio h PHE 17 Ca 0.00 0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.41 1eio h PHE 17 Cb 0.20 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.93 1eio h PHE 17 CO 0.00 0.82 -0.41 0.52 -2.23 0.00 0.00 178.31 177.01 1eio h MET 18 N -1.00 0.04 -0.44 1.11 2.86 0.13 0.85 114.93 118.47 1eio h MET 18 Ca -0.00 -0.02 -0.13 0.00 -2.06 0.00 0.00 59.70 57.50 1eio h MET 18 Cb 0.82 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.47 1eio h MET 18 CO -0.00 0.44 -0.22 0.87 1.06 0.00 0.00 176.91 179.06 1eio h LYS 19 N 0.03 0.89 0.00 1.72 1.57 -1.23 -1.64 116.57 117.92 1eio h LYS 19 Ca 0.00 -0.37 -0.08 0.00 -1.87 0.00 0.00 60.65 58.32 1eio h LYS 19 Cb 0.74 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.00 1eio h LYS 19 CO 0.05 1.02 -0.39 -0.09 -0.57 0.00 0.00 179.45 179.48 1eio h ARG 20 N 0.77 0.00 0.00 3.15 9.65 -1.40 -2.98 114.38 123.57 1eio h ARG 20 Ca 0.10 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.98 1eio h ARG 20 Cb 0.77 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.35 1eio h ARG 20 CO 0.06 0.39 0.00 -0.07 2.80 0.00 0.00 179.97 183.15 1eio h LEU 21 N 0.00 0.00 -0.87 3.80 3.38 -0.57 -3.48 115.31 117.57 1eio h LEU 21 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1eio h LEU 21 Cb 0.78 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.53 1eio h LEU 21 CO 0.05 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.58 1eio n ALA 22 N -1.95 0.00 -2.85 1.53 0.00 -0.91 -5.08 120.51 111.24 1eio n ALA 22 Ca 0.04 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.24 1eio n ALA 22 Cb 0.42 -0.47 -0.04 0.00 0.00 0.00 0.00 19.45 19.36 1eio n ALA 22 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1eio s LEU 23 N -0.87 3.95 0.40 0.00 1.43 -0.66 -5.06 118.68 117.86 1eio s LEU 23 Ca 0.00 -0.11 -0.07 0.00 -1.03 0.00 0.00 54.13 52.92 1eio s LEU 23 Cb 0.00 -2.51 -0.05 0.00 0.03 0.00 0.00 46.19 43.65 1eio s LEU 23 CO 0.00 0.01 0.72 -2.16 0.23 0.00 0.00 176.35 175.15 1eio s PRO 24 N -3.49 3.66 -1.22 1.29 0.04 -1.26 -4.61 135.00 129.41 1eio s PRO 24 Ca 0.32 0.25 -0.08 0.00 0.04 0.00 0.00 61.00 61.53 1eio s PRO 24 Cb -0.09 -2.45 -0.09 0.00 0.04 0.00 0.00 34.50 31.91 1eio s PRO 24 CO 0.25 -0.03 3.00 -1.13 0.04 0.00 0.00 177.00 179.13 1eio n SER 25 N -1.55 7.90 0.00 6.66 3.41 -1.26 -1.93 113.62 126.84 1eio n SER 25 Ca 0.01 -2.67 0.00 0.00 -0.26 0.00 0.00 58.87 55.95 1eio n SER 25 Cb 0.54 -1.49 0.00 0.00 -0.26 0.00 0.00 64.21 63.01 1eio n SER 25 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1eio n ASP 26 N 2.97 0.06 0.03 4.04 2.03 -1.26 -4.66 116.55 119.77 1eio n ASP 26 Ca 0.68 0.00 -0.05 0.00 0.52 0.00 0.00 54.79 55.95 1eio n ASP 26 Cb 0.38 0.00 0.16 0.00 -0.72 0.00 0.00 41.12 40.94 1eio n ASP 26 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1eio h ALA 27 N 0.00 0.98 -0.16 -1.67 0.00 -1.79 0.31 119.26 116.93 1eio h ALA 27 Ca 0.00 -0.42 -0.11 0.00 0.00 0.00 0.00 54.91 54.38 1eio h ALA 27 Cb 0.05 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1eio h ALA 27 CO 0.00 0.61 -0.33 0.82 0.00 0.00 0.00 179.25 180.35 1eio h ILE 28 N 0.36 1.35 -0.02 0.00 2.04 -1.72 -3.27 117.51 116.25 1eio h ILE 28 Ca 0.04 -1.59 -0.14 0.00 1.00 0.00 0.00 64.86 64.17 1eio h ILE 28 Cb 0.84 1.97 -0.02 0.00 -0.74 0.00 0.00 36.82 38.87 1eio h ILE 28 CO 0.07 0.48 -0.65 0.44 0.00 0.00 0.00 178.15 178.49 1eio h ASP 29 N 0.14 0.08 1.68 1.72 5.19 -1.65 0.55 116.42 124.12 1eio h ASP 29 Ca 0.00 -0.05 0.00 0.00 -0.62 0.00 0.00 57.03 56.36 1eio h ASP 29 Cb 0.93 -0.02 0.00 0.00 0.18 0.00 0.00 39.33 40.42 1eio h ASP 29 CO 0.07 0.70 0.00 0.11 -3.12 0.00 0.00 179.24 177.01 1eio h LYS 30 N 0.05 0.00 0.00 3.56 1.57 -1.12 -3.36 116.57 117.27 1eio h LYS 30 Ca -0.01 0.00 -0.33 0.00 -1.87 0.00 0.00 60.65 58.44 1eio h LYS 30 Cb 1.15 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.40 1eio h LYS 30 CO 0.09 0.00 -2.22 0.00 -0.57 0.00 0.00 179.45 176.75 1eio n ALA 31 N -2.04 1.58 0.82 3.86 0.00 -0.49 -4.80 120.51 119.43 1eio n ALA 31 Ca 0.03 -1.17 0.00 0.00 0.00 0.00 0.00 53.44 52.30 1eio n ALA 31 Cb 0.46 -0.35 0.00 0.00 0.00 0.00 0.00 19.45 19.55 1eio n ALA 31 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1eio n ARG 32 N -2.78 0.82 -1.54 0.00 1.85 0.07 -1.97 116.66 113.10 1eio n ARG 32 Ca -0.28 0.00 -0.05 0.00 -1.00 0.00 0.00 57.85 56.52 1eio n ARG 32 Cb 1.10 -1.12 -0.01 0.00 -1.05 0.00 0.00 32.46 31.38 1eio n ARG 32 CO 0.00 0.00 0.00 -1.71 -0.01 0.00 0.00 177.63 175.91 1eio n ASN 33 N 0.54 -0.90 -4.99 2.89 2.85 -1.26 -5.07 115.26 109.32 1eio n ASN 33 Ca 0.00 -2.06 -0.19 0.00 -0.11 0.00 0.00 54.58 52.22 1eio n ASN 33 Cb 0.39 0.34 0.01 0.00 1.24 0.00 0.00 39.78 41.76 1eio n ASN 33 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 1eio s LEU 34 N -1.22 3.67 -0.35 1.20 1.43 -0.83 -5.10 118.68 117.47 1eio s LEU 34 Ca 0.06 -0.24 -0.00 0.00 -1.03 0.00 0.00 54.13 52.92 1eio s LEU 34 Cb 0.16 -2.76 0.13 0.00 0.03 0.00 0.00 46.19 43.76 1eio s LEU 34 CO -0.05 -0.75 0.20 -1.59 0.23 0.00 0.00 176.35 174.40 1eio s LYS 35 N -4.40 0.56 0.49 1.70 -2.85 -1.26 -4.79 119.74 109.18 1eio s LYS 35 Ca 0.52 -1.28 -0.20 0.00 -1.00 0.00 0.00 55.97 54.01 1eio s LYS 35 Cb -0.10 -1.36 -0.08 0.00 -2.06 0.00 0.00 37.83 34.23 1eio s LYS 35 CO 0.34 -1.18 1.05 0.42 0.10 0.00 0.00 175.35 176.07 1eio s ILE 36 N 1.14 3.72 0.15 3.79 1.01 -1.26 -4.78 121.20 124.97 1eio s ILE 36 Ca 0.17 1.08 0.02 0.00 0.00 0.00 0.00 60.65 61.92 1eio s ILE 36 Cb -0.22 -3.44 -0.04 0.00 0.01 0.00 0.00 42.46 38.77 1eio s ILE 36 CO -0.03 -0.22 0.29 -0.63 0.00 0.00 0.00 174.94 174.34 1eio s ILE 37 N -1.94 5.32 -0.05 2.92 -1.09 -0.75 -1.07 121.20 124.53 1eio s ILE 37 Ca 0.67 -0.64 -0.16 0.00 -2.23 0.00 0.00 60.65 58.29 1eio s ILE 37 Cb -0.17 -3.73 0.03 0.00 -1.58 0.00 0.00 42.46 37.00 1eio s ILE 37 CO 0.21 -0.08 0.37 -0.55 -1.23 0.00 0.00 174.94 173.65 1eio s SER 38 N -3.18 -0.29 0.20 3.58 0.15 0.76 0.10 113.70 115.02 1eio s SER 38 Ca 0.35 0.33 0.10 0.00 0.70 0.00 0.00 55.95 57.43 1eio s SER 38 Cb -0.11 0.46 -0.04 0.00 -1.71 0.00 0.00 66.02 64.61 1eio s SER 38 CO 0.28 -0.38 -0.17 -1.61 1.20 0.00 0.00 173.24 172.56 1eio s GLU 39 N -0.92 1.77 -0.17 5.44 0.41 0.87 0.12 118.70 126.23 1eio s GLU 39 Ca -0.10 -1.46 -0.04 0.00 -0.41 0.00 0.00 54.97 52.96 1eio s GLU 39 Cb -0.04 -1.97 0.08 0.00 -1.78 0.00 0.00 34.13 30.42 1eio s GLU 39 CO 0.04 0.40 0.19 0.54 -0.49 0.00 0.00 175.26 175.94 1eio s VAL 40 N -1.82 -0.29 -0.09 2.63 0.11 0.29 -0.57 120.40 120.67 1eio s VAL 40 Ca 0.24 0.02 -0.05 0.00 -2.93 0.00 0.00 61.98 59.26 1eio s VAL 40 Cb -0.08 -0.56 -0.04 0.00 -1.53 0.00 0.00 36.38 34.17 1eio s VAL 40 CO 0.13 -0.11 0.11 -0.75 -3.33 0.00 0.00 175.10 171.15 1eio s LYS 41 N 2.30 3.31 0.09 1.54 2.20 -0.10 -0.69 119.74 128.41 1eio s LYS 41 Ca 0.05 -0.25 -0.11 0.00 -0.36 0.00 0.00 55.97 55.31 1eio s LYS 41 Cb -0.15 -3.07 -0.06 0.00 -1.51 0.00 0.00 37.83 33.05 1eio s LYS 41 CO -0.10 0.74 0.43 -1.14 -0.36 0.00 0.00 175.35 174.92 1eio s GLN 42 N -1.20 3.81 -0.11 4.03 0.74 -1.26 -0.07 119.66 125.59 1eio s GLN 42 Ca 0.17 0.24 0.05 0.00 0.05 0.00 0.00 55.36 55.88 1eio s GLN 42 Cb -0.12 -2.98 -0.11 0.00 1.10 0.00 0.00 33.01 30.90 1eio s GLN 42 CO 0.07 0.54 -0.03 -0.25 -0.55 0.00 0.00 175.29 175.07 1eio n ASP 43 N 0.88 2.74 0.00 6.67 8.00 0.14 -4.87 116.55 130.11 1eio n ASP 43 Ca -0.07 -0.03 0.00 0.00 0.71 0.00 0.00 54.79 55.39 1eio n ASP 43 Cb 0.52 0.31 0.00 0.00 -0.02 0.00 0.00 41.12 41.93 1eio n ASP 43 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1eio n GLY 44 N 2.61 -1.36 0.15 0.44 0.00 -1.26 -4.81 105.19 100.96 1eio n GLY 44 Ca -0.19 0.71 0.13 0.00 0.00 0.00 0.00 46.02 46.66 1eio n GLY 44 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1eio h GLN 45 N 0.00 0.00 -6.40 1.61 5.75 -1.96 -3.45 115.11 110.66 1eio h GLN 45 Ca 0.00 0.00 -0.53 0.00 -0.15 0.00 0.00 58.65 57.97 1eio h GLN 45 Cb 0.00 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 28.53 1eio h GLN 45 CO 0.00 0.00 -0.19 0.54 -2.65 0.00 0.00 178.83 176.53 1eio s ASN 46 N -5.20 6.45 0.16 -0.69 4.22 -1.26 -1.43 114.94 117.19 1eio s ASN 46 Ca 0.09 0.65 0.08 0.00 -2.14 0.00 0.00 52.86 51.54 1eio s ASN 46 Cb 0.09 -2.12 -0.04 0.00 1.28 0.00 0.00 41.25 40.47 1eio s ASN 46 CO 0.64 -0.13 -0.17 -0.36 -2.04 0.00 0.00 177.10 175.04 1eio s PHE 47 N -1.98 1.68 -0.30 1.54 0.40 0.64 0.27 117.98 120.23 1eio s PHE 47 Ca 0.43 -0.51 0.02 0.00 -0.60 0.00 0.00 56.93 56.27 1eio s PHE 47 Cb -0.11 -0.84 0.09 0.00 0.51 0.00 0.00 43.02 42.67 1eio s PHE 47 CO 0.29 0.28 0.02 0.99 0.70 0.00 0.00 175.22 177.49 1eio s THR 48 N -2.20 1.86 0.11 0.64 2.01 0.91 -0.11 115.64 118.85 1eio s THR 48 Ca 0.15 -1.87 -0.11 0.00 0.31 0.00 0.00 61.69 60.18 1eio s THR 48 Cb -0.05 -2.27 -0.06 0.00 0.01 0.00 0.00 72.50 70.13 1eio s THR 48 CO 0.05 -0.45 0.44 0.86 -0.69 0.00 0.00 174.62 174.84 1eio s TRP 49 N 1.16 3.57 -0.05 4.92 -0.11 -0.44 -0.92 118.94 127.07 1eio s TRP 49 Ca 0.05 0.84 -0.11 0.00 1.22 0.00 0.00 56.10 58.10 1eio s TRP 49 Cb -0.19 -2.20 0.02 0.00 -1.50 0.00 0.00 33.47 29.60 1eio s TRP 49 CO -0.11 0.48 0.26 0.45 -4.62 0.00 0.00 176.95 173.41 1eio s SER 50 N -1.83 -0.18 -0.05 5.86 0.15 0.27 -1.33 113.70 116.59 1eio s SER 50 Ca 0.35 0.21 0.02 0.00 0.70 0.00 0.00 55.95 57.24 1eio s SER 50 Cb -0.14 0.39 0.01 0.00 -1.71 0.00 0.00 66.02 64.58 1eio s SER 50 CO 0.19 -0.30 -0.10 -1.10 1.20 0.00 0.00 173.24 173.13 1eio s GLN 51 N -0.77 1.34 -0.29 5.44 -0.21 0.20 -0.09 119.66 125.28 1eio s GLN 51 Ca -0.09 -0.33 -0.14 0.00 0.02 0.00 0.00 55.36 54.82 1eio s GLN 51 Cb -0.04 -1.17 -0.03 0.00 1.00 0.00 0.00 33.01 32.76 1eio s GLN 51 CO 0.02 0.04 0.34 -0.65 -2.12 0.00 0.00 175.29 172.92 1eio s GLN 52 N 0.57 3.92 0.49 2.91 1.11 0.11 -0.44 119.66 128.32 1eio s GLN 52 Ca -0.11 -0.10 -0.19 0.00 0.01 0.00 0.00 55.36 54.97 1eio s GLN 52 Cb -0.14 -3.69 -0.08 0.00 -1.01 0.00 0.00 33.01 28.09 1eio s GLN 52 CO 0.02 -0.31 1.00 -0.47 0.01 0.00 0.00 175.29 175.54 1eio s TYR 53 N 2.02 3.17 -0.79 0.91 6.14 -0.13 -1.82 117.35 126.86 1eio s TYR 53 Ca 0.13 1.56 -0.25 0.00 0.64 0.00 0.00 57.07 59.15 1eio s TYR 53 Cb -0.16 -2.94 -0.02 0.00 0.42 0.00 0.00 41.96 39.26 1eio s TYR 53 CO 0.10 -0.56 1.77 -1.25 0.64 0.00 0.00 175.55 176.26 1eio s PRO 54 N -3.48 2.78 0.00 4.97 0.04 -1.26 -4.00 135.00 134.05 1eio s PRO 54 Ca 0.64 -0.04 0.00 0.00 0.04 0.00 0.00 61.00 61.63 1eio s PRO 54 Cb -0.13 -4.74 0.00 0.00 0.04 0.00 0.00 34.50 29.68 1eio s PRO 54 CO 0.22 -2.84 0.00 0.41 0.04 0.00 0.00 177.00 174.83 1eio n GLY 55 N 6.24 1.85 0.00 0.56 0.00 -1.26 -4.75 105.19 107.83 1eio n GLY 55 Ca 0.27 -0.19 0.13 0.00 0.00 0.00 0.00 46.02 46.23 1eio n GLY 55 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1eio n GLY 56 N 0.00 -1.38 3.64 -0.02 0.00 -1.26 -4.86 105.19 101.31 1eio n GLY 56 Ca 0.00 -0.10 -0.02 0.00 0.00 0.00 0.00 46.02 45.90 1eio n GLY 56 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1eio s HIS 57 N -2.92 -0.12 0.29 1.61 5.04 -1.26 -5.06 115.29 112.88 1eio s HIS 57 Ca 0.16 -0.04 0.09 0.00 -1.54 0.00 0.00 55.06 53.72 1eio s HIS 57 Cb 0.18 0.57 -0.04 0.00 0.04 0.00 0.00 32.58 33.32 1eio s HIS 57 CO 0.48 -0.47 0.03 -1.54 -2.34 0.00 0.00 174.74 170.90 1eio s SER 58 N -2.79 4.53 0.01 9.88 1.04 -1.26 -0.96 113.70 124.16 1eio s SER 58 Ca 0.12 -0.71 0.05 0.00 0.48 0.00 0.00 55.95 55.88 1eio s SER 58 Cb 0.01 -0.78 -0.01 0.00 0.10 0.00 0.00 66.02 65.34 1eio s SER 58 CO -0.03 -0.09 -0.14 -0.63 0.98 0.00 0.00 173.24 173.33 1eio s ILE 59 N -2.37 1.11 -0.13 -1.02 1.01 0.41 -4.89 121.20 115.33 1eio s ILE 59 Ca 0.33 -0.74 -0.30 0.00 0.00 0.00 0.00 60.65 59.95 1eio s ILE 59 Cb -0.05 -0.95 0.09 0.00 0.01 0.00 0.00 42.46 41.56 1eio s ILE 59 CO 0.20 0.20 0.82 -0.89 0.00 0.00 0.00 174.94 175.28 1eio s THR 60 N -0.51 0.00 -0.13 2.92 2.01 -1.26 0.61 115.64 119.28 1eio s THR 60 Ca 0.04 0.00 -0.22 0.00 0.31 0.00 0.00 61.69 61.82 1eio s THR 60 Cb -0.06 -1.00 0.05 0.00 0.01 0.00 0.00 72.50 71.50 1eio s THR 60 CO 0.00 0.00 0.55 0.21 -0.69 0.00 0.00 174.62 174.69 1eio s ASN 61 N -0.87 -0.53 0.29 3.53 2.47 -0.44 -5.01 114.94 114.38 1eio s ASN 61 Ca -0.06 0.83 -0.19 0.00 0.42 0.00 0.00 52.86 53.87 1eio s ASN 61 Cb -0.01 0.84 -0.09 0.00 -1.45 0.00 0.00 41.25 40.54 1eio s ASN 61 CO 0.05 -0.35 0.78 -0.89 -3.72 0.00 0.00 177.10 172.97 1eio s THR 62 N -0.39 4.54 0.11 -5.21 2.01 -1.26 -1.33 115.64 114.12 1eio s THR 62 Ca -0.05 1.27 -0.14 0.00 0.31 0.00 0.00 61.69 63.07 1eio s THR 62 Cb -0.03 -3.77 0.03 0.00 0.01 0.00 0.00 72.50 68.74 1eio s THR 62 CO 0.04 0.01 0.35 0.72 -0.69 0.00 0.00 174.62 175.05 1eio s PHE 63 N -1.76 -0.12 -0.04 4.92 -0.12 0.84 -4.99 117.98 116.71 1eio s PHE 63 Ca 0.50 -0.23 0.02 0.00 -0.05 0.00 0.00 56.93 57.17 1eio s PHE 63 Cb -0.14 0.18 0.01 0.00 -0.63 0.00 0.00 43.02 42.44 1eio s PHE 63 CO 0.19 -0.66 -0.07 0.99 -0.05 0.00 0.00 175.22 175.62 1eio s THR 64 N -3.80 0.73 -0.30 -4.49 2.01 -1.26 -0.26 115.64 108.27 1eio s THR 64 Ca 0.03 -0.27 -0.29 0.00 0.31 0.00 0.00 61.69 61.47 1eio s THR 64 Cb 0.03 -0.70 -0.00 0.00 0.01 0.00 0.00 72.50 71.84 1eio s THR 64 CO -0.12 0.26 1.36 -0.63 -0.69 0.00 0.00 174.62 174.80 1eio s ILE 65 N 0.62 4.04 0.00 1.82 -1.09 -0.52 -2.58 121.20 123.50 1eio s ILE 65 Ca -0.10 1.16 0.00 0.00 -2.23 0.00 0.00 60.65 59.48 1eio s ILE 65 Cb -0.13 -4.10 0.00 0.00 -1.58 0.00 0.00 42.46 36.65 1eio s ILE 65 CO 0.01 -0.49 0.00 0.61 -1.23 0.00 0.00 174.94 173.84 1eio n GLY 66 N 4.47 0.22 3.95 6.18 0.00 0.11 -4.92 105.19 115.19 1eio n GLY 66 Ca 0.16 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.97 1eio n GLY 66 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1eio s LYS 67 N -0.96 3.28 0.48 1.61 2.20 -1.06 -4.93 119.74 120.35 1eio s LYS 67 Ca 0.00 -0.87 -0.20 0.00 -0.36 0.00 0.00 55.97 54.54 1eio s LYS 67 Cb 0.00 -2.82 -0.09 0.00 -1.51 0.00 0.00 37.83 33.41 1eio s LYS 67 CO 0.00 0.33 1.01 -1.83 -0.36 0.00 0.00 175.35 174.50 1eio s GLU 68 N -4.01 3.91 0.09 4.03 4.04 -1.26 -0.82 118.70 124.68 1eio s GLU 68 Ca 0.37 1.24 0.02 0.00 0.04 0.00 0.00 54.97 56.64 1eio s GLU 68 Cb -0.09 -2.12 -0.04 0.00 0.02 0.00 0.00 34.13 31.90 1eio s GLU 68 CO 0.29 -0.32 -0.07 0.00 -1.84 0.00 0.00 175.26 173.32 1eio s ASP 70 N -2.80 6.77 -0.14 0.00 1.11 -1.26 -0.56 116.67 119.79 1eio s ASP 70 Ca 0.08 0.91 -0.09 0.00 0.18 0.00 0.00 52.55 53.63 1eio s ASP 70 Cb 0.03 -2.23 0.05 0.00 1.07 0.00 0.00 42.92 41.84 1eio s ASP 70 CO -0.04 0.33 0.36 -0.63 1.18 0.00 0.00 175.17 176.37 1eio s ILE 71 N -1.08 -0.02 0.22 0.77 -1.09 0.91 -4.95 121.20 115.96 1eio s ILE 71 Ca 0.23 0.08 -0.23 0.00 -2.23 0.00 0.00 60.65 58.51 1eio s ILE 71 Cb -0.16 -0.53 0.04 0.00 -1.58 0.00 0.00 42.46 40.23 1eio s ILE 71 CO 0.13 0.03 0.79 -0.70 -1.23 0.00 0.00 174.94 173.96 1eio s GLU 72 N 1.07 1.54 0.00 2.79 -6.30 -1.26 0.28 118.70 116.82 1eio s GLU 72 Ca -0.07 -0.83 0.00 0.00 -2.50 0.00 0.00 54.97 51.57 1eio s GLU 72 Cb -0.07 0.54 0.00 0.00 0.00 0.00 0.00 34.13 34.60 1eio s GLU 72 CO -0.08 -0.70 0.00 2.41 0.02 0.00 0.00 175.26 176.90 1eio n THR 73 N -0.45 0.00 -0.00 -1.70 -1.04 -1.26 -4.92 114.28 104.91 1eio n THR 73 Ca -0.06 0.00 -0.07 0.00 -2.04 0.00 0.00 64.05 61.88 1eio n THR 73 Cb 0.60 0.00 -0.13 0.00 -1.82 0.00 0.00 70.33 68.98 1eio n THR 73 CO 0.00 0.00 0.00 -0.29 -0.64 0.00 0.00 175.07 174.14 1eio h ILE 74 N 0.00 0.90 0.00 12.58 6.09 -2.01 -3.40 117.51 131.66 1eio h ILE 74 Ca 0.00 -2.69 0.00 0.00 -1.37 0.00 0.00 64.86 60.80 1eio h ILE 74 Cb 0.00 2.42 0.00 0.00 0.47 0.00 0.00 36.82 39.71 1eio h ILE 74 CO 0.00 0.51 0.00 0.61 -3.07 0.00 0.00 178.15 176.20 1eio n GLY 75 N 1.51 0.55 2.55 8.18 0.00 -1.26 -5.05 105.19 111.67 1eio n GLY 75 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.88 1eio n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1eio n GLY 76 N 0.40 2.54 1.20 -0.02 0.00 -1.26 -4.92 105.19 103.13 1eio n GLY 76 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 1eio n GLY 76 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1eio n LYS 77 N -2.00 1.73 -3.40 1.61 2.85 -1.26 -4.89 118.16 112.79 1eio n LYS 77 Ca 0.00 -0.96 -0.16 0.00 -1.05 0.00 0.00 58.31 56.14 1eio n LYS 77 Cb 0.00 -1.52 0.01 0.00 -0.65 0.00 0.00 35.03 32.87 1eio n LYS 77 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 177.40 178.52 1eio n LYS 78 N 0.07 -1.60 -2.09 -1.58 4.81 -1.26 -4.98 118.16 111.54 1eio n LYS 78 Ca 0.15 1.24 -0.32 0.00 -0.87 0.00 0.00 58.31 58.50 1eio n LYS 78 Cb 0.74 -3.84 0.00 0.00 0.02 0.00 0.00 35.03 31.95 1eio n LYS 78 CO 0.00 0.00 0.00 -0.06 1.17 0.00 0.00 177.40 178.51 1eio s PHE 79 N -2.78 3.19 0.35 5.64 0.40 0.14 -4.84 117.98 120.09 1eio s PHE 79 Ca 0.07 1.47 -0.05 0.00 -0.60 0.00 0.00 56.93 57.82 1eio s PHE 79 Cb -0.01 -2.91 -0.05 0.00 0.51 0.00 0.00 43.02 40.56 1eio s PHE 79 CO 0.83 -0.87 0.63 0.15 0.70 0.00 0.00 175.22 176.66 1eio s LYS 80 N -4.26 3.61 -0.16 0.44 -0.14 -1.26 -0.06 119.74 117.91 1eio s LYS 80 Ca 0.61 0.05 -0.18 0.00 -1.36 0.00 0.00 55.97 55.10 1eio s LYS 80 Cb -0.14 -2.56 0.05 0.00 -1.68 0.00 0.00 37.83 33.50 1eio s LYS 80 CO 0.38 0.09 0.48 0.00 -0.76 0.00 0.00 175.35 175.54 1eio s ALA 81 N -2.28 -1.19 -0.36 5.17 0.00 0.28 -4.31 121.76 119.06 1eio s ALA 81 Ca 0.45 1.25 -0.19 0.00 0.00 0.00 0.00 51.96 53.47 1eio s ALA 81 Cb -0.10 -0.65 0.00 0.00 0.00 0.00 0.00 23.12 22.37 1eio s ALA 81 CO 0.34 -0.24 0.57 0.99 0.00 0.00 0.00 175.76 177.42 1eio s THR 82 N -0.01 4.95 -0.12 0.00 2.01 0.16 0.18 115.64 122.82 1eio s THR 82 Ca -0.02 0.40 -0.09 0.00 0.31 0.00 0.00 61.69 62.30 1eio s THR 82 Cb -0.03 -4.03 -0.04 0.00 0.01 0.00 0.00 72.50 68.40 1eio s THR 82 CO 0.02 -0.29 0.17 -0.69 -0.69 0.00 0.00 174.62 173.14 1eio s VAL 83 N 2.55 5.43 0.24 3.82 1.01 0.00 -0.33 120.40 133.12 1eio s VAL 83 Ca 0.21 0.29 -0.18 0.00 0.00 0.00 0.00 61.98 62.30 1eio s VAL 83 Cb -0.15 -3.45 0.02 0.00 0.00 0.00 0.00 36.38 32.80 1eio s VAL 83 CO 0.14 0.58 0.60 -1.10 0.00 0.00 0.00 175.10 175.32 1eio s GLN 84 N -0.79 1.57 -0.13 2.72 -0.21 0.80 0.04 119.66 123.66 1eio s GLN 84 Ca 0.15 -0.96 -0.05 0.00 0.02 0.00 0.00 55.36 54.53 1eio s GLN 84 Cb -0.12 0.55 -0.04 0.00 1.00 0.00 0.00 33.01 34.40 1eio s GLN 84 CO 0.04 -0.69 0.03 -1.64 -2.12 0.00 0.00 175.29 170.92 1eio s MET 85 N -3.91 3.47 0.00 2.91 -1.94 -1.26 -0.22 119.30 118.35 1eio s MET 85 Ca 0.12 -0.37 0.18 0.00 -1.71 0.00 0.00 55.69 53.90 1eio s MET 85 Cb -0.03 -3.00 0.27 0.00 2.01 0.00 0.00 34.83 34.09 1eio s MET 85 CO 0.03 0.50 1.19 -1.91 -0.01 0.00 0.00 175.02 174.82 1eio n GLU 86 N 2.79 1.97 0.00 2.03 2.13 0.26 -4.89 120.64 124.93 1eio n GLU 86 Ca -0.18 -1.87 0.00 0.00 0.66 0.00 0.00 57.16 55.77 1eio n GLU 86 Cb 0.53 -1.37 0.00 0.00 0.27 0.00 0.00 31.44 30.87 1eio n GLU 86 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1eio n GLY 87 N 1.05 0.38 1.62 8.31 0.00 -1.26 -4.86 105.19 110.42 1eio n GLY 87 Ca 0.13 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.46 1eio n GLY 87 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1eio n GLY 88 N 0.00 0.54 3.15 -0.02 0.00 -1.26 -4.94 105.19 102.66 1eio n GLY 88 Ca 0.00 -0.47 0.05 0.00 0.00 0.00 0.00 46.02 45.60 1eio n GLY 88 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1eio s LYS 89 N -0.94 0.18 0.53 1.61 2.20 -1.26 -4.40 119.74 117.65 1eio s LYS 89 Ca 0.00 0.20 -0.13 0.00 -0.36 0.00 0.00 55.97 55.68 1eio s LYS 89 Cb 0.00 0.10 -0.06 0.00 -1.51 0.00 0.00 37.83 36.36 1eio s LYS 89 CO 0.00 -0.31 0.95 0.08 -0.36 0.00 0.00 175.35 175.72 1eio s VAL 90 N 2.95 4.66 -0.13 4.02 1.01 -0.59 0.91 120.40 133.23 1eio s VAL 90 Ca 0.21 0.95 -0.12 0.00 0.00 0.00 0.00 61.98 63.02 1eio s VAL 90 Cb -0.04 -3.78 0.03 0.00 0.00 0.00 0.00 36.38 32.59 1eio s VAL 90 CO -0.21 -0.83 0.34 0.54 0.00 0.00 0.00 175.10 174.95 1eio s VAL 91 N -2.78 -0.00 -0.39 2.92 0.11 0.69 -0.07 120.40 120.89 1eio s VAL 91 Ca 0.56 0.00 -0.04 0.00 -2.93 0.00 0.00 61.98 59.57 1eio s VAL 91 Cb -0.10 -0.48 0.09 0.00 -1.53 0.00 0.00 36.38 34.36 1eio s VAL 91 CO 0.40 0.00 0.17 -0.69 -3.33 0.00 0.00 175.10 171.64 1eio s VAL 92 N 0.19 3.39 0.26 2.04 1.01 0.10 -0.14 120.40 127.24 1eio s VAL 92 Ca -0.00 -1.79 -0.03 0.00 0.00 0.00 0.00 61.98 60.16 1eio s VAL 92 Cb -0.02 -3.19 -0.05 0.00 0.00 0.00 0.00 36.38 33.12 1eio s VAL 92 CO 0.00 -0.53 0.49 0.21 0.00 0.00 0.00 175.10 175.28 1eio s ASN 93 N 1.74 6.41 0.10 3.32 2.47 0.55 -0.30 114.94 129.24 1eio s ASN 93 Ca 0.04 0.57 -0.26 0.00 0.42 0.00 0.00 52.86 53.63 1eio s ASN 93 Cb -0.22 -2.08 0.08 0.00 -1.45 0.00 0.00 41.25 37.58 1eio s ASN 93 CO -0.02 -0.14 1.07 -0.94 -3.72 0.00 0.00 177.10 173.34 1eio s SER 94 N -3.21 -0.12 -0.41 -4.21 1.04 0.66 0.41 113.70 107.84 1eio s SER 94 Ca 0.41 -0.34 -0.27 0.00 0.48 0.00 0.00 55.95 56.23 1eio s SER 94 Cb -0.11 0.39 -0.05 0.00 0.10 0.00 0.00 66.02 66.35 1eio s SER 94 CO 0.30 -0.72 2.22 -2.84 0.98 0.00 0.00 173.24 173.18 1eio s PRO 95 N -2.94 2.58 -1.06 4.02 0.02 -1.26 -2.06 135.00 134.30 1eio s PRO 95 Ca 0.14 1.48 -0.02 0.00 0.02 0.00 0.00 61.00 62.62 1eio s PRO 95 Cb 0.00 -4.46 0.00 0.00 0.02 0.00 0.00 34.50 30.07 1eio s PRO 95 CO 0.01 -2.73 0.20 0.09 -0.33 0.00 0.00 177.00 174.23 1eio n ASN 96 N 13.75 -4.31 -3.64 2.53 3.02 -1.26 -4.97 115.26 120.37 1eio n ASN 96 Ca 0.31 -0.10 -0.07 0.00 -0.03 0.00 0.00 54.58 54.70 1eio n ASN 96 Cb 0.51 -3.33 -0.07 0.00 -0.61 0.00 0.00 39.78 36.28 1eio n ASN 96 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1eio s TYR 97 N -2.81 -0.89 -0.06 3.10 6.14 -0.87 -4.28 117.35 117.67 1eio s TYR 97 Ca 0.10 1.83 -0.04 0.00 0.64 0.00 0.00 57.07 59.59 1eio s TYR 97 Cb -0.04 0.52 0.03 0.00 0.42 0.00 0.00 41.96 42.88 1eio s TYR 97 CO 0.12 -0.44 0.15 -1.58 0.64 0.00 0.00 175.55 174.45 1eio s HIS 98 N 1.39 -0.17 -0.17 4.97 2.46 -0.54 -0.25 115.29 122.98 1eio s HIS 98 Ca -0.08 0.45 -0.04 0.00 0.47 0.00 0.00 55.06 55.86 1eio s HIS 98 Cb -0.05 0.01 0.07 0.00 -0.13 0.00 0.00 32.58 32.48 1eio s HIS 98 CO -0.16 -0.12 0.16 -1.58 -2.47 0.00 0.00 174.74 170.56 1eio s HIS 99 N 0.55 -0.07 0.33 3.88 5.04 0.59 0.05 115.29 125.67 1eio s HIS 99 Ca -0.04 0.08 0.03 0.00 -1.54 0.00 0.00 55.06 53.58 1eio s HIS 99 Cb -0.05 -0.48 -0.02 0.00 0.04 0.00 0.00 32.58 32.06 1eio s HIS 99 CO -0.03 -0.50 0.50 0.95 -2.34 0.00 0.00 174.74 173.33 1eio s THR 100 N 2.24 4.83 0.12 0.89 -4.23 0.81 0.02 115.64 120.33 1eio s THR 100 Ca 0.04 -0.69 0.05 0.00 -1.18 0.00 0.00 61.69 59.91 1eio s THR 100 Cb -0.15 -3.74 -0.04 0.00 1.34 0.00 0.00 72.50 69.91 1eio s THR 100 CO -0.10 -0.40 -0.13 0.00 -0.54 0.00 0.00 174.62 173.45 1eio s ALA 101 N -2.24 1.43 0.06 3.99 0.00 0.90 -1.52 121.76 124.38 1eio s ALA 101 Ca 0.40 -1.29 -0.11 0.00 0.00 0.00 0.00 51.96 50.96 1eio s ALA 101 Cb -0.09 -0.05 0.01 0.00 0.00 0.00 0.00 23.12 22.99 1eio s ALA 101 CO 0.34 0.06 0.24 -1.21 0.00 0.00 0.00 175.76 175.19 1eio s GLU 102 N -2.79 0.79 -0.35 0.00 0.41 0.14 -1.54 118.70 115.36 1eio s GLU 102 Ca 0.09 -0.67 0.04 0.00 -0.41 0.00 0.00 54.97 54.02 1eio s GLU 102 Cb -0.04 0.33 0.10 0.00 -1.78 0.00 0.00 34.13 32.75 1eio s GLU 102 CO 0.02 -0.25 0.07 0.42 -0.49 0.00 0.00 175.26 175.03 1eio s ILE 103 N -2.95 2.22 0.00 -1.63 -1.09 -1.26 -0.40 121.20 116.09 1eio s ILE 103 Ca -0.02 -2.36 0.00 0.00 -2.23 0.00 0.00 60.65 56.04 1eio s ILE 103 Cb 0.01 -2.64 0.00 0.00 -1.58 0.00 0.00 42.46 38.25 1eio s ILE 103 CO -0.06 -0.62 0.00 0.52 -1.23 0.00 0.00 174.94 173.55 1eio n VAL 104 N 4.21 0.00 -1.69 2.92 0.31 0.73 -4.85 118.33 119.95 1eio n VAL 104 Ca 0.04 0.00 -0.26 0.00 -0.01 0.00 0.00 64.34 64.11 1eio n VAL 104 Cb 0.41 -1.83 -0.09 0.00 -0.91 0.00 0.00 33.84 31.43 1eio n VAL 104 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1eio n ASP 105 N -0.54 2.26 0.00 4.52 2.03 -1.26 -2.35 116.55 121.21 1eio n ASP 105 Ca 0.00 -2.61 0.00 0.00 0.52 0.00 0.00 54.79 52.70 1eio n ASP 105 Cb 0.00 -1.59 0.00 0.00 -0.72 0.00 0.00 41.12 38.81 1eio n ASP 105 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1eio n GLY 106 N 5.73 0.30 3.68 0.27 0.00 -1.26 -4.97 105.19 108.95 1eio n GLY 106 Ca 0.44 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 46.08 1eio n GLY 106 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1eio s LYS 107 N -0.86 4.23 -0.53 1.61 -0.14 -0.99 -3.94 119.74 119.12 1eio s LYS 107 Ca 0.00 0.38 -0.20 0.00 -1.36 0.00 0.00 55.97 54.79 1eio s LYS 107 Cb 0.00 -3.52 0.06 0.00 -1.68 0.00 0.00 37.83 32.68 1eio s LYS 107 CO 0.00 -0.05 0.72 -1.17 -0.76 0.00 0.00 175.35 174.09 1eio s LEU 108 N 1.31 4.76 0.28 3.17 2.96 0.55 -0.20 118.68 131.51 1eio s LEU 108 Ca 0.24 -0.81 -0.07 0.00 -0.22 0.00 0.00 54.13 53.27 1eio s LEU 108 Cb -0.15 -2.53 -0.06 0.00 0.50 0.00 0.00 46.19 43.95 1eio s LEU 108 CO 0.09 -1.00 0.57 -0.69 -1.32 0.00 0.00 176.35 174.00 1eio s VAL 109 N 3.00 4.98 0.11 1.68 1.01 0.46 0.12 120.40 131.75 1eio s VAL 109 Ca 0.19 0.23 0.04 0.00 0.00 0.00 0.00 61.98 62.43 1eio s VAL 109 Cb -0.18 -3.70 -0.04 0.00 0.00 0.00 0.00 36.38 32.47 1eio s VAL 109 CO 0.13 -0.26 -0.10 -1.61 0.00 0.00 0.00 175.10 173.26 1eio s GLU 110 N -3.34 0.89 -0.03 2.72 2.02 0.59 0.28 118.70 121.83 1eio s GLU 110 Ca 0.46 -1.23 -0.01 0.00 0.02 0.00 0.00 54.97 54.20 1eio s GLU 110 Cb -0.11 -0.54 0.03 0.00 0.10 0.00 0.00 34.13 33.61 1eio s GLU 110 CO 0.27 0.08 0.07 0.08 0.02 0.00 0.00 175.26 175.78 1eio s VAL 111 N -2.70 -0.04 0.17 2.63 1.01 -0.57 -0.33 120.40 120.56 1eio s VAL 111 Ca 0.08 0.15 0.06 0.00 0.00 0.00 0.00 61.98 62.28 1eio s VAL 111 Cb -0.01 -0.13 -0.04 0.00 0.00 0.00 0.00 36.38 36.20 1eio s VAL 111 CO -0.00 0.06 0.05 -0.44 0.00 0.00 0.00 175.10 174.77 1eio s SER 112 N 0.84 5.06 -0.08 3.32 0.01 0.16 -0.13 113.70 122.88 1eio s SER 112 Ca -0.07 -0.29 -0.03 0.00 1.31 0.00 0.00 55.95 56.87 1eio s SER 112 Cb -0.09 -1.18 0.04 0.00 0.21 0.00 0.00 66.02 65.00 1eio s SER 112 CO -0.03 0.09 0.17 -0.89 0.41 0.00 0.00 173.24 172.99 1eio s THR 113 N -1.72 -0.08 -0.38 1.44 2.01 0.11 -0.19 115.64 116.83 1eio s THR 113 Ca 0.29 0.20 0.10 0.00 0.31 0.00 0.00 61.69 62.58 1eio s THR 113 Cb -0.10 -0.28 0.44 0.00 0.01 0.00 0.00 72.50 72.57 1eio s THR 113 CO 0.20 0.08 1.08 0.55 -0.69 0.00 0.00 174.62 175.85 1eio n VAL 114 N 4.37 2.00 0.00 3.82 3.14 -0.03 -1.47 118.33 130.16 1eio n VAL 114 Ca -0.23 -4.25 0.00 0.00 -2.96 0.00 0.00 64.34 56.90 1eio n VAL 114 Cb 0.52 -0.62 0.00 0.00 -1.06 0.00 0.00 33.84 32.67 1eio n VAL 114 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1eio n GLY 115 N -0.42 2.41 0.80 7.55 0.00 -1.26 -3.95 105.19 110.32 1eio n GLY 115 Ca 0.31 0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.46 1eio n GLY 115 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1eio n GLY 116 N 0.00 0.74 3.08 -0.02 0.00 -1.26 -4.90 105.19 102.83 1eio n GLY 116 Ca 0.00 -0.59 -0.11 0.00 0.00 0.00 0.00 46.02 45.32 1eio n GLY 116 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1eio s VAL 117 N -1.89 0.07 0.37 1.61 1.01 -1.25 -5.17 120.40 115.14 1eio s VAL 117 Ca 0.33 -0.58 0.08 0.00 0.00 0.00 0.00 61.98 61.81 1eio s VAL 117 Cb 0.20 -0.37 -0.05 0.00 0.00 0.00 0.00 36.38 36.16 1eio s VAL 117 CO 0.31 -0.32 0.16 -0.94 0.00 0.00 0.00 175.10 174.31 1eio s SER 118 N -1.12 4.56 -0.31 3.32 1.04 -1.26 -0.85 113.70 119.08 1eio s SER 118 Ca -0.12 -0.91 0.06 0.00 0.48 0.00 0.00 55.95 55.46 1eio s SER 118 Cb -0.07 -0.60 0.19 0.00 0.10 0.00 0.00 66.02 65.65 1eio s SER 118 CO 0.01 -0.42 0.57 -0.47 0.98 0.00 0.00 173.24 173.92 1eio s TYR 119 N -2.51 -1.72 0.21 5.02 5.04 0.73 -4.82 117.35 119.30 1eio s TYR 119 Ca 0.40 0.83 0.00 0.00 -2.44 0.00 0.00 57.07 55.86 1eio s TYR 119 Cb 0.00 0.25 -0.04 0.00 0.35 0.00 0.00 41.96 42.52 1eio s TYR 119 CO 0.23 -1.09 0.39 -1.21 -1.34 0.00 0.00 175.55 172.52 1eio s GLU 120 N 2.61 3.50 -0.10 4.97 8.01 -1.26 0.41 118.70 136.83 1eio s GLU 120 Ca 0.11 -0.41 -0.16 0.00 0.01 0.00 0.00 54.97 54.52 1eio s GLU 120 Cb -0.09 -2.84 0.04 0.00 -4.31 0.00 0.00 34.13 26.92 1eio s GLU 120 CO -0.23 0.40 0.40 0.50 0.01 0.00 0.00 175.26 176.34 1eio s ARG 121 N -3.46 0.58 -0.03 1.61 3.52 0.55 -0.82 118.95 120.90 1eio s ARG 121 Ca 0.38 0.31 0.04 0.00 -0.13 0.00 0.00 55.73 56.33 1eio s ARG 121 Cb -0.11 0.27 -0.00 0.00 -1.56 0.00 0.00 34.95 33.55 1eio s ARG 121 CO 0.30 -0.12 -0.15 0.08 -0.81 0.00 0.00 175.30 174.60 1eio s VAL 122 N -0.37 1.25 0.14 7.11 1.01 -0.49 -0.30 120.40 128.75 1eio s VAL 122 Ca -0.05 -0.63 -0.01 0.00 0.00 0.00 0.00 61.98 61.29 1eio s VAL 122 Cb -0.03 -1.07 -0.04 0.00 0.00 0.00 0.00 36.38 35.24 1eio s VAL 122 CO 0.02 0.36 0.07 -0.44 0.00 0.00 0.00 175.10 175.12 1eio s SER 123 N -0.03 0.28 0.11 3.32 0.01 0.12 0.20 113.70 117.71 1eio s SER 123 Ca -0.01 -1.24 -0.04 0.00 1.31 0.00 0.00 55.95 55.97 1eio s SER 123 Cb -0.10 0.31 -0.03 0.00 0.21 0.00 0.00 66.02 66.42 1eio s SER 123 CO 0.01 -0.75 0.10 -1.59 0.41 0.00 0.00 173.24 171.42 1eio s LYS 124 N -4.07 0.87 0.09 12.44 0.00 -0.01 -0.33 119.74 128.73 1eio s LYS 124 Ca 0.27 -1.26 -0.23 0.00 0.00 0.00 0.00 55.97 54.75 1eio s LYS 124 Cb 0.07 0.27 -0.07 0.00 0.00 0.00 0.00 37.83 38.11 1eio s LYS 124 CO 0.04 -0.25 0.69 0.21 0.00 0.00 0.00 175.35 176.04 1eio s LYS 125 N -3.97 4.41 -0.81 1.78 2.20 -1.25 -0.11 119.74 121.98 1eio s LYS 125 Ca 0.15 0.96 -0.01 0.00 -0.36 0.00 0.00 55.97 56.71 1eio s LYS 125 Cb 0.06 -3.28 0.36 0.00 -1.51 0.00 0.00 37.83 33.46 1eio s LYS 125 CO -0.04 0.51 1.96 1.28 -0.36 0.00 0.00 175.35 178.71 1eio n LEU 126 N 2.00 7.32 0.00 5.43 4.77 0.88 -4.89 117.00 132.51 1eio n LEU 126 Ca -0.07 -4.85 0.00 0.00 -0.03 0.00 0.00 56.01 51.06 1eio n LEU 126 Cb 0.50 -1.02 0.00 0.00 -2.33 0.00 0.00 43.42 40.57 1eio n LEU 126 CO 0.45 1.79 0.00 0.00 -1.33 0.00 0.00 177.39 178.29