#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3icc n ASN -1 N 0.00 0.00 -3.88 0.00 0.23 -0.08 -5.01 115.26 106.53 3icc n ASN -1 Ca 0.00 -1.00 -0.30 0.00 -0.53 0.00 0.00 54.58 52.75 3icc n ASN -1 Cb 0.00 0.00 -0.15 0.00 -2.08 0.00 0.00 39.78 37.55 3icc n ASN -1 CO 0.00 0.00 0.00 -0.94 -0.93 0.00 0.00 177.26 175.39 3icc s SER 0 N -1.00 4.35 0.00 0.53 1.04 -1.25 -3.09 113.70 114.28 3icc s SER 0 Ca 0.00 -2.06 0.00 0.00 0.48 0.00 0.00 55.95 54.37 3icc s SER 0 Cb 0.00 -1.28 0.00 0.00 0.10 0.00 0.00 66.02 64.84 3icc s SER 0 CO 0.00 -0.37 0.00 0.18 0.98 0.00 0.00 173.24 174.03 3icc n LEU 2 N 4.34 0.00 -4.73 2.42 4.77 0.11 -4.90 117.00 119.01 3icc n LEU 2 Ca 0.02 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.58 3icc n LEU 2 Cb 0.41 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.48 3icc n LEU 2 CO 0.19 0.00 1.20 1.17 -1.33 0.00 0.00 177.39 178.62 3icc n LYS 3 N 0.00 2.56 -0.33 3.23 4.81 -1.24 -1.30 118.16 125.89 3icc n LYS 3 Ca 0.00 0.91 0.00 0.00 -0.87 0.00 0.00 58.31 58.35 3icc n LYS 3 Cb 0.00 -2.67 0.00 0.00 0.02 0.00 0.00 35.03 32.38 3icc n LYS 3 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3icc n GLY 4 N 2.22 1.38 3.92 3.14 0.00 -1.26 -5.00 105.19 109.59 3icc n GLY 4 Ca 0.09 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.83 3icc n GLY 4 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3icc s LYS 5 N -0.35 3.37 -0.10 1.61 -0.14 -0.42 -5.00 119.74 118.72 3icc s LYS 5 Ca 0.00 -0.57 0.03 0.00 -1.36 0.00 0.00 55.97 54.06 3icc s LYS 5 Cb 0.00 -2.95 0.01 0.00 -1.68 0.00 0.00 37.83 33.21 3icc s LYS 5 CO 0.00 0.55 -0.18 0.08 -0.76 0.00 0.00 175.35 175.04 3icc s VAL 6 N -1.65 1.66 -0.00 3.17 1.01 -1.26 -1.27 120.40 122.05 3icc s VAL 6 Ca 0.34 -0.76 0.08 0.00 0.00 0.00 0.00 61.98 61.64 3icc s VAL 6 Cb -0.12 -1.48 -0.02 0.00 0.00 0.00 0.00 36.38 34.76 3icc s VAL 6 CO 0.28 0.47 -0.26 0.00 0.00 0.00 0.00 175.10 175.59 3icc s ALA 7 N 0.72 2.17 -0.17 5.51 0.00 0.20 -0.59 121.76 129.59 3icc s ALA 7 Ca -0.12 -1.15 -0.03 0.00 0.00 0.00 0.00 51.96 50.66 3icc s ALA 7 Cb -0.16 -0.52 -0.02 0.00 0.00 0.00 0.00 23.12 22.42 3icc s ALA 7 CO 0.02 0.53 -0.07 -1.17 0.00 0.00 0.00 175.76 175.07 3icc s LEU 8 N -0.78 2.92 -0.23 0.00 2.96 -0.33 -0.07 118.68 123.15 3icc s LEU 8 Ca 0.10 -0.31 0.00 0.00 -0.22 0.00 0.00 54.13 53.71 3icc s LEU 8 Cb -0.10 -1.71 0.03 0.00 0.50 0.00 0.00 46.19 44.92 3icc s LEU 8 CO -0.00 0.09 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.32 3icc s VAL 9 N 0.82 2.48 0.35 1.68 1.01 -0.76 -0.78 120.40 125.21 3icc s VAL 9 Ca -0.02 -1.15 -0.25 0.00 0.00 0.00 0.00 61.98 60.55 3icc s VAL 9 Cb -0.15 -2.26 -0.10 0.00 0.00 0.00 0.00 36.38 33.88 3icc s VAL 9 CO 0.01 0.23 0.96 0.42 0.00 0.00 0.00 175.10 176.73 3icc s THR 10 N 1.26 4.15 -1.21 3.92 -4.23 -0.64 -2.07 115.64 116.83 3icc s THR 10 Ca -0.01 1.71 -0.06 0.00 -1.18 0.00 0.00 61.69 62.15 3icc s THR 10 Cb -0.16 -3.91 0.01 0.00 1.34 0.00 0.00 72.50 69.77 3icc s THR 10 CO -0.07 0.07 1.04 0.61 -0.54 0.00 0.00 174.62 175.74 3icc n GLY 11 N 0.39 -0.39 0.98 3.99 0.00 -1.04 -2.84 105.19 106.29 3icc n GLY 11 Ca 0.03 0.15 0.06 0.00 0.00 0.00 0.00 46.02 46.26 3icc n GLY 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3icc n ALA 12 N -4.56 2.73 0.19 4.61 0.00 0.35 -4.01 120.51 119.81 3icc n ALA 12 Ca -0.06 -0.89 0.07 0.00 0.00 0.00 0.00 53.44 52.55 3icc n ALA 12 Cb 0.58 -1.00 0.28 0.00 0.00 0.00 0.00 19.45 19.31 3icc n ALA 12 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3icc h SER 13 N 2.51 0.00 -5.10 0.00 4.64 -1.87 -3.25 113.55 110.48 3icc h SER 13 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3icc h SER 13 Cb 0.85 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.88 3icc h SER 13 CO 0.10 0.33 0.11 0.00 -0.87 0.00 0.00 176.83 176.50 3icc s ARG 14 N -3.39 1.78 5.40 4.77 1.70 -1.26 -4.35 118.95 123.60 3icc s ARG 14 Ca 0.02 -1.17 0.00 0.00 -0.47 0.00 0.00 55.73 54.11 3icc s ARG 14 Cb 0.09 0.56 0.00 0.00 -0.57 0.00 0.00 34.95 35.03 3icc s ARG 14 CO 0.68 -0.80 0.00 0.41 -1.08 0.00 0.00 175.30 174.52 3icc n GLY 15 N -0.45 2.37 0.36 3.88 0.00 -1.26 -2.61 105.19 107.49 3icc n GLY 15 Ca -0.04 -0.46 -0.04 0.00 0.00 0.00 0.00 46.02 45.49 3icc n GLY 15 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3icc h ILE 16 N 0.00 1.26 -0.52 -0.61 2.04 -1.92 -2.32 117.51 115.45 3icc h ILE 16 Ca 0.00 -0.62 -0.09 0.00 1.00 0.00 0.00 64.86 65.16 3icc h ILE 16 Cb 0.00 0.01 -0.02 0.00 -0.74 0.00 0.00 36.82 36.07 3icc h ILE 16 CO 0.00 0.28 -0.02 1.23 0.00 0.00 0.00 178.15 179.64 3icc h GLY 17 N 1.26 0.96 0.99 5.37 0.00 -1.68 -0.36 103.07 109.62 3icc h GLY 17 Ca 0.32 -0.68 0.00 0.00 0.00 0.00 0.00 47.33 46.97 3icc h GLY 17 CO -0.05 0.63 0.27 -0.09 0.00 0.00 0.00 176.54 177.30 3icc h ARG 18 N 0.82 0.58 -0.55 4.80 2.43 -1.23 -0.68 114.38 120.55 3icc h ARG 18 Ca 0.15 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.27 3icc h ARG 18 Cb 0.52 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.92 3icc h ARG 18 CO 0.03 0.41 0.31 0.00 -1.51 0.00 0.00 179.97 179.20 3icc h ALA 19 N 1.14 0.70 0.16 2.80 0.00 -0.90 -0.92 119.26 122.23 3icc h ALA 19 Ca 0.16 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3icc h ALA 19 Cb -0.03 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.54 3icc h ALA 19 CO -0.03 0.21 -0.08 0.82 0.00 0.00 0.00 179.25 180.17 3icc h ILE 20 N 0.73 0.84 -0.39 0.00 2.04 -0.95 -1.36 117.51 118.42 3icc h ILE 20 Ca 0.19 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.11 3icc h ILE 20 Cb 0.03 0.84 -0.05 0.00 -0.74 0.00 0.00 36.82 36.90 3icc h ILE 20 CO -0.03 0.00 0.12 0.00 0.00 0.00 0.00 178.15 178.23 3icc h ALA 21 N 0.63 0.45 -0.77 1.87 0.00 -0.89 -0.40 119.26 120.15 3icc h ALA 21 Ca -0.02 0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.95 3icc h ALA 21 Cb 0.17 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 3icc h ALA 21 CO 0.03 -0.28 0.51 0.87 0.00 0.00 0.00 179.25 180.38 3icc h LYS 22 N 0.26 1.01 -0.20 0.00 1.57 -1.05 -1.46 116.57 116.70 3icc h LYS 22 Ca 0.18 -0.06 -0.08 0.00 -1.87 0.00 0.00 60.65 58.82 3icc h LYS 22 Cb 0.19 -0.23 -0.00 0.00 0.08 0.00 0.00 32.23 32.27 3icc h LYS 22 CO -0.21 0.67 -0.19 -0.09 -0.57 0.00 0.00 179.45 179.07 3icc h ARG 23 N 1.04 0.49 -0.69 3.15 9.65 -0.61 -0.68 114.38 126.73 3icc h ARG 23 Ca 0.28 -0.25 -0.00 0.00 -1.10 0.00 0.00 59.98 58.91 3icc h ARG 23 Cb -0.12 0.01 -0.03 0.00 -1.39 0.00 0.00 29.97 28.44 3icc h ARG 23 CO -0.06 0.82 0.43 -0.07 2.80 0.00 0.00 179.97 183.89 3icc h LEU 24 N 0.17 0.82 -0.63 3.80 3.38 -0.94 -1.99 115.31 119.93 3icc h LEU 24 Ca 0.03 -0.05 -0.08 0.00 0.09 0.00 0.00 57.88 57.87 3icc h LEU 24 Cb 0.72 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 3icc h LEU 24 CO 0.05 0.63 0.07 0.00 0.09 0.00 0.00 178.44 179.28 3icc h ALA 25 N 1.23 0.83 -0.76 1.53 0.00 -1.24 -1.85 119.26 119.00 3icc h ALA 25 Ca 0.25 -0.28 0.16 0.00 0.00 0.00 0.00 54.91 55.04 3icc h ALA 25 Cb -0.05 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.45 3icc h ALA 25 CO -0.05 0.62 0.51 -0.97 0.00 0.00 0.00 179.25 179.36 3icc h ASN 26 N 0.96 0.36 -0.37 0.00 -1.24 -0.73 -1.25 115.58 113.32 3icc h ASN 26 Ca 0.19 0.02 0.00 0.00 0.71 0.00 0.00 56.30 57.22 3icc h ASN 26 Cb 0.47 -0.05 0.00 0.00 0.73 0.00 0.00 38.32 39.47 3icc h ASN 26 CO 0.02 0.18 0.00 0.47 -1.29 0.00 0.00 177.43 176.81 3icc n ASP 27 N -4.47 2.04 0.00 1.15 8.00 -0.78 -0.90 116.55 121.59 3icc n ASP 27 Ca 0.15 -1.97 0.00 0.00 0.71 0.00 0.00 54.79 53.68 3icc n ASP 27 Cb 0.56 -0.24 0.00 0.00 -0.02 0.00 0.00 41.12 41.42 3icc n ASP 27 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3icc n GLY 28 N 1.12 0.56 3.79 0.44 0.00 -0.47 0.06 105.19 110.69 3icc n GLY 28 Ca 0.13 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.79 3icc n GLY 28 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3icc s ALA 29 N -2.00 3.14 -0.16 4.61 0.00 -0.76 -4.17 121.76 122.42 3icc s ALA 29 Ca 0.00 0.56 -0.29 0.00 0.00 0.00 0.00 51.96 52.22 3icc s ALA 29 Cb 0.00 -3.20 -0.02 0.00 0.00 0.00 0.00 23.12 19.90 3icc s ALA 29 CO 0.00 0.05 1.33 -1.17 0.00 0.00 0.00 175.76 175.96 3icc s LEU 30 N -2.45 4.17 -0.18 0.00 2.96 -0.40 -4.23 118.68 118.56 3icc s LEU 30 Ca 0.55 1.73 -0.02 0.00 -0.22 0.00 0.00 54.13 56.17 3icc s LEU 30 Cb -0.18 -3.54 -0.01 0.00 0.50 0.00 0.00 46.19 42.97 3icc s LEU 30 CO 0.23 -0.82 -0.08 -0.69 -1.32 0.00 0.00 176.35 173.67 3icc s VAL 31 N 3.67 3.19 -0.39 1.68 1.01 -0.73 -0.63 120.40 128.19 3icc s VAL 31 Ca 0.58 -0.58 -0.28 0.00 0.00 0.00 0.00 61.98 61.70 3icc s VAL 31 Cb -0.23 -2.40 0.02 0.00 0.00 0.00 0.00 36.38 33.77 3icc s VAL 31 CO 0.17 0.47 1.08 0.00 0.00 0.00 0.00 175.10 176.82 3icc s ALA 32 N 1.02 3.34 -0.71 5.51 0.00 0.90 -2.14 121.76 129.68 3icc s ALA 32 Ca -0.00 -0.30 -0.20 0.00 0.00 0.00 0.00 51.96 51.46 3icc s ALA 32 Cb -0.15 -3.74 0.10 0.00 0.00 0.00 0.00 23.12 19.33 3icc s ALA 32 CO -0.01 -1.83 0.90 0.42 0.00 0.00 0.00 175.76 175.24 3icc s ILE 33 N 3.95 4.66 0.27 0.00 -1.09 0.68 -1.82 121.20 127.84 3icc s ILE 33 Ca 0.45 -0.98 -0.29 0.00 -2.23 0.00 0.00 60.65 57.61 3icc s ILE 33 Cb -0.10 -4.63 -0.09 0.00 -1.58 0.00 0.00 42.46 36.06 3icc s ILE 33 CO 0.23 -1.33 0.96 -2.28 -1.23 0.00 0.00 174.94 171.28 3icc s HIS 34 N 3.06 3.86 0.06 3.97 5.65 -0.88 -1.72 115.29 129.29 3icc s HIS 34 Ca 0.21 1.86 0.04 0.00 0.25 0.00 0.00 55.06 57.42 3icc s HIS 34 Cb -0.16 -3.01 -0.03 0.00 -1.18 0.00 0.00 32.58 28.21 3icc s HIS 34 CO 0.03 0.27 -0.12 1.52 -0.65 0.00 0.00 174.74 175.79 3icc s TYR 35 N -1.28 1.07 -0.05 3.88 -0.85 -0.64 -0.50 117.35 118.98 3icc s TYR 35 Ca 0.44 -0.44 -0.16 0.00 -0.52 0.00 0.00 57.07 56.39 3icc s TYR 35 Cb -0.25 -0.62 -0.11 0.00 0.38 0.00 0.00 41.96 41.37 3icc s TYR 35 CO 0.31 0.02 0.67 0.78 -1.52 0.00 0.00 175.55 175.81 3icc h GLY 36 N 4.52 -0.39 0.00 5.49 0.00 -1.90 -1.08 103.07 109.72 3icc h GLY 36 Ca -0.39 0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.09 3icc h GLY 36 CO 0.41 -0.14 0.00 1.16 0.00 0.00 0.00 176.54 177.97 3icc n ASN 37 N -5.02 0.00 -4.15 0.19 6.94 -1.26 -3.88 115.26 108.07 3icc n ASN 37 Ca -0.07 0.00 -0.43 0.00 -0.02 0.00 0.00 54.58 54.06 3icc n ASN 37 Cb 0.22 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.64 3icc n ASN 37 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 3icc n ARG 38 N 0.00 3.32 -0.22 -3.83 1.74 -1.26 -4.83 116.66 111.58 3icc n ARG 38 Ca 0.00 -3.40 -0.02 0.00 -0.77 0.00 0.00 57.85 53.66 3icc n ARG 38 Cb 0.00 -3.13 0.18 0.00 -1.02 0.00 0.00 32.46 28.48 3icc n ARG 38 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 3icc h LYS 39 N 6.53 1.01 -0.05 5.56 3.64 -1.95 -1.93 116.57 129.38 3icc h LYS 39 Ca 0.42 -0.13 -0.16 0.00 -1.27 0.00 0.00 60.65 59.50 3icc h LYS 39 Cb 0.75 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.36 3icc h LYS 39 CO 1.53 0.77 -0.67 0.93 -2.27 0.00 0.00 179.45 179.74 3icc h GLU 40 N 1.01 0.24 -0.61 1.90 5.08 -1.99 -0.47 114.58 119.75 3icc h GLU 40 Ca 0.25 -0.19 -0.10 0.00 -1.00 0.00 0.00 59.36 58.32 3icc h GLU 40 Cb 0.09 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.35 3icc h GLU 40 CO -0.03 0.82 -0.01 0.93 -1.00 0.00 0.00 179.01 179.72 3icc h GLU 41 N 0.17 1.08 -0.90 2.33 5.08 -1.77 -0.82 114.58 119.76 3icc h GLU 41 Ca -0.02 -0.35 0.01 0.00 -1.00 0.00 0.00 59.36 58.01 3icc h GLU 41 Cb 1.21 -0.10 -0.05 0.00 0.50 0.00 0.00 28.75 30.32 3icc h GLU 41 CO 0.10 1.05 0.59 0.00 -1.00 0.00 0.00 179.01 179.76 3icc h ALA 42 N 0.99 1.14 -0.21 3.43 0.00 -1.10 -1.76 119.26 121.76 3icc h ALA 42 Ca 0.17 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 3icc h ALA 42 Cb 0.57 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 3icc h ALA 42 CO 0.03 0.52 -0.19 0.93 0.00 0.00 0.00 179.25 180.54 3icc h GLU 43 N 1.20 0.37 -0.50 0.00 5.08 -0.60 -1.69 114.58 118.44 3icc h GLU 43 Ca 0.33 -0.12 -0.08 0.00 -1.00 0.00 0.00 59.36 58.50 3icc h GLU 43 Cb -0.12 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.08 3icc h GLU 43 CO -0.08 0.56 0.00 1.49 -1.00 0.00 0.00 179.01 179.98 3icc h GLU 44 N 0.34 0.89 -0.70 2.33 4.57 -0.78 0.60 114.58 121.84 3icc h GLU 44 Ca 0.06 -0.28 0.05 0.00 -1.18 0.00 0.00 59.36 58.01 3icc h GLU 44 Cb 0.54 -0.08 -0.05 0.00 -0.16 0.00 0.00 28.75 28.99 3icc h GLU 44 CO 0.04 0.92 0.41 1.15 -1.18 0.00 0.00 179.01 180.34 3icc h THR 45 N 0.75 1.00 -0.11 0.32 2.02 -0.62 -1.12 112.91 115.15 3icc h THR 45 Ca 0.14 -0.26 -0.01 0.00 0.77 0.00 0.00 66.41 67.06 3icc h THR 45 Cb 0.52 0.18 -0.00 0.00 -1.74 0.00 0.00 68.15 67.10 3icc h THR 45 CO 0.03 0.14 0.04 0.58 0.37 0.00 0.00 175.52 176.67 3icc h VAL 46 N 0.76 1.16 -0.71 3.16 2.07 -1.03 -1.69 116.25 119.97 3icc h VAL 46 Ca 0.31 -0.50 0.11 0.00 0.82 0.00 0.00 66.70 67.43 3icc h VAL 46 Cb 0.16 1.30 -0.08 0.00 -1.52 0.00 0.00 31.29 31.15 3icc h VAL 46 CO -0.17 0.15 0.32 0.22 0.02 0.00 0.00 177.57 178.11 3icc h TYR 47 N -0.00 0.57 -0.57 1.57 3.20 -0.48 -0.51 116.97 120.75 3icc h TYR 47 Ca 0.04 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 61.89 3icc h TYR 47 Cb 0.20 -0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.30 3icc h TYR 47 CO -0.01 0.17 0.19 0.93 -1.64 0.00 0.00 178.16 177.79 3icc h GLU 48 N 0.53 0.89 -0.15 1.82 5.08 -1.03 -0.29 114.58 121.44 3icc h GLU 48 Ca 0.36 -0.19 -0.00 0.00 -1.00 0.00 0.00 59.36 58.53 3icc h GLU 48 Cb 0.44 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 3icc h GLU 48 CO -0.31 0.79 0.09 0.82 -1.00 0.00 0.00 179.01 179.40 3icc h ILE 49 N 0.80 1.07 -0.50 3.13 2.04 -0.75 -2.62 117.51 120.69 3icc h ILE 49 Ca 0.19 -0.17 -0.06 0.00 1.00 0.00 0.00 64.86 65.81 3icc h ILE 49 Cb 0.27 0.92 -0.02 0.00 -0.74 0.00 0.00 36.82 37.26 3icc h ILE 49 CO -0.01 0.06 0.07 1.56 0.00 0.00 0.00 178.15 179.83 3icc h GLN 50 N 0.16 0.78 -0.18 2.37 4.20 -0.84 -1.13 115.11 120.48 3icc h GLN 50 Ca 0.05 -0.18 0.00 0.00 0.06 0.00 0.00 58.65 58.58 3icc h GLN 50 Cb 0.03 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.69 3icc h GLN 50 CO -0.01 0.75 0.11 0.77 -0.67 0.00 0.00 178.83 179.78 3icc h SER 51 N 0.75 0.20 -0.79 1.46 0.02 -0.85 -1.26 113.55 113.08 3icc h SER 51 Ca 0.16 -0.01 -0.28 0.00 -0.84 0.00 0.00 61.79 60.82 3icc h SER 51 Cb 0.36 -0.05 -0.17 0.00 0.14 0.00 0.00 62.40 62.68 3icc h SER 51 CO 0.01 0.16 0.35 0.59 -1.14 0.00 0.00 176.83 176.79 3icc n ASN 52 N -4.50 4.56 0.00 3.07 3.02 -0.70 -4.92 115.26 115.78 3icc n ASN 52 Ca -0.00 -3.32 0.00 0.00 -0.03 0.00 0.00 54.58 51.22 3icc n ASN 52 Cb 0.08 -0.76 0.00 0.00 -0.61 0.00 0.00 39.78 38.49 3icc n ASN 52 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3icc n GLY 53 N -0.40 0.71 3.99 7.41 0.00 -0.48 -4.90 105.19 111.54 3icc n GLY 53 Ca 0.45 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.24 3icc n GLY 53 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3icc s GLY 54 N -1.95 1.76 -0.10 -0.02 0.00 -0.51 -4.98 107.32 101.52 3icc s GLY 54 Ca 0.00 -1.76 0.03 0.00 0.00 0.00 0.00 44.72 42.99 3icc s GLY 54 CO 0.00 -1.19 -0.20 -0.56 0.00 0.00 0.00 173.10 171.15 3icc s SER 55 N -4.74 2.70 0.20 1.64 0.01 -1.26 -3.99 113.70 108.26 3icc s SER 55 Ca 0.66 -0.49 -0.22 0.00 1.31 0.00 0.00 55.95 57.22 3icc s SER 55 Cb -0.05 -1.23 0.05 0.00 0.21 0.00 0.00 66.02 64.99 3icc s SER 55 CO 0.44 0.09 0.62 0.00 0.41 0.00 0.00 173.24 174.81 3icc s ALA 56 N 0.61 -1.39 0.05 1.44 0.00 -1.26 -1.78 121.76 119.43 3icc s ALA 56 Ca -0.14 0.15 -0.14 0.00 0.00 0.00 0.00 51.96 51.83 3icc s ALA 56 Cb -0.17 0.87 0.02 0.00 0.00 0.00 0.00 23.12 23.85 3icc s ALA 56 CO 0.04 -0.86 0.32 -0.59 0.00 0.00 0.00 175.76 174.68 3icc s PHE 57 N -3.82 -0.12 -0.08 0.00 -0.12 -0.91 -4.95 117.98 107.97 3icc s PHE 57 Ca 0.05 -0.03 -0.01 0.00 -0.05 0.00 0.00 56.93 56.89 3icc s PHE 57 Cb -0.02 0.12 -0.03 0.00 -0.63 0.00 0.00 43.02 42.45 3icc s PHE 57 CO -0.06 -0.53 -0.02 -1.54 -0.05 0.00 0.00 175.22 173.02 3icc s SER 58 N -2.16 5.02 -0.00 1.98 1.04 -1.26 -0.23 113.70 118.09 3icc s SER 58 Ca -0.04 0.08 -0.01 0.00 0.48 0.00 0.00 55.95 56.47 3icc s SER 58 Cb -0.00 -1.37 -0.00 0.00 0.10 0.00 0.00 66.02 64.75 3icc s SER 58 CO -0.04 0.37 0.02 0.27 0.98 0.00 0.00 173.24 174.84 3icc s ILE 59 N -0.85 0.01 0.13 -1.02 -4.36 -0.70 -4.95 121.20 109.46 3icc s ILE 59 Ca 0.13 -0.09 0.02 0.00 -0.26 0.00 0.00 60.65 60.45 3icc s ILE 59 Cb -0.11 -0.06 -0.04 0.00 1.25 0.00 0.00 42.46 43.50 3icc s ILE 59 CO 0.02 -0.05 0.25 -0.83 0.24 0.00 0.00 174.94 174.57 3icc s GLY 60 N -0.14 1.80 -0.29 6.27 0.00 -1.26 -1.63 107.32 112.07 3icc s GLY 60 Ca -0.02 -1.02 -0.15 0.00 0.00 0.00 0.00 44.72 43.54 3icc s GLY 60 CO -0.00 -1.01 0.93 0.00 0.00 0.00 0.00 173.10 173.02 3icc s ALA 61 N -1.69 -2.41 -0.40 3.20 0.00 -0.41 -4.59 121.76 115.46 3icc s ALA 61 Ca 0.34 2.17 -0.28 0.00 0.00 0.00 0.00 51.96 54.19 3icc s ALA 61 Cb -0.11 -1.84 0.02 0.00 0.00 0.00 0.00 23.12 21.19 3icc s ALA 61 CO 0.28 -0.64 1.06 1.21 0.00 0.00 0.00 175.76 177.66 3icc s ASN 62 N 1.94 6.72 0.00 0.00 3.84 -1.25 -4.27 114.94 121.92 3icc s ASN 62 Ca -0.06 0.64 0.13 0.00 0.21 0.00 0.00 52.86 53.78 3icc s ASN 62 Cb -0.05 -2.52 0.47 0.00 -0.55 0.00 0.00 41.25 38.60 3icc s ASN 62 CO -0.17 -1.04 1.35 0.18 -2.79 0.00 0.00 177.10 174.63 3icc n LEU 63 N 7.26 1.32 0.00 3.21 4.77 -1.26 -3.91 117.00 128.39 3icc n LEU 63 Ca 0.10 -0.62 0.07 0.00 -0.03 0.00 0.00 56.01 55.53 3icc n LEU 63 Cb 0.48 -0.14 0.33 0.00 -2.33 0.00 0.00 43.42 41.77 3icc n LEU 63 CO 0.64 0.31 0.71 -0.62 -1.33 0.00 0.00 177.39 177.11 3icc n GLU 64 N 0.17 0.09 -4.09 3.23 1.02 -1.26 -4.60 120.64 115.19 3icc n GLU 64 Ca 0.11 0.21 -0.08 0.00 -0.02 0.00 0.00 57.16 57.38 3icc n GLU 64 Cb 0.23 -1.50 -0.10 0.00 -0.02 0.00 0.00 31.44 30.06 3icc n GLU 64 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 3icc s SER 65 N -2.82 0.39 0.55 1.62 1.04 -1.25 -4.83 113.70 108.40 3icc s SER 65 Ca 0.10 -1.06 0.33 0.00 0.48 0.00 0.00 55.95 55.81 3icc s SER 65 Cb 0.10 0.25 1.34 0.00 0.10 0.00 0.00 66.02 67.81 3icc s SER 65 CO 0.24 -0.67 1.98 -0.07 0.98 0.00 0.00 173.24 175.71 3icc h LEU 66 N 3.00 0.00 -1.42 2.42 3.38 -1.91 -1.64 115.31 119.14 3icc h LEU 66 Ca -0.34 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.61 3icc h LEU 66 Cb 1.17 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.90 3icc h LEU 66 CO 0.62 0.00 0.15 -0.74 0.09 0.00 0.00 178.44 178.57 3icc h HIS 67 N 0.00 0.54 -0.96 1.13 2.76 -1.96 -1.23 115.15 115.43 3icc h HIS 67 Ca -0.00 -0.02 0.05 0.00 -2.20 0.00 0.00 60.37 58.21 3icc h HIS 67 Cb 0.52 -0.17 -0.06 0.00 1.55 0.00 0.00 27.41 29.25 3icc h HIS 67 CO 0.00 0.43 0.62 0.78 -1.30 0.00 0.00 177.93 178.45 3icc h GLY 68 N 0.70 1.43 0.92 5.26 0.00 -1.41 -1.33 103.07 108.64 3icc h GLY 68 Ca 0.13 -0.46 -0.03 0.00 0.00 0.00 0.00 47.33 46.98 3icc h GLY 68 CO -0.01 0.35 0.12 -2.08 0.00 0.00 0.00 176.54 174.91 3icc h VAL 69 N 1.15 1.20 -0.85 4.60 2.07 -1.24 -0.01 116.25 123.17 3icc h VAL 69 Ca 0.40 -0.66 0.02 0.00 0.82 0.00 0.00 66.70 67.28 3icc h VAL 69 Cb 0.10 0.98 -0.05 0.00 -1.52 0.00 0.00 31.29 30.80 3icc h VAL 69 CO -0.15 0.23 0.56 -0.08 0.02 0.00 0.00 177.57 178.14 3icc h GLU 70 N 0.42 1.08 -0.40 1.57 4.81 -1.12 -2.48 114.58 118.45 3icc h GLU 70 Ca 0.11 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.26 3icc h GLU 70 Cb 0.24 -0.24 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 3icc h GLU 70 CO -0.00 0.71 0.17 0.00 -0.73 0.00 0.00 179.01 179.16 3icc h ALA 71 N 1.33 0.52 -0.60 2.92 0.00 -1.04 -1.32 119.26 121.07 3icc h ALA 71 Ca 0.32 -0.13 0.10 0.00 0.00 0.00 0.00 54.91 55.21 3icc h ALA 71 Cb -0.07 -0.16 -0.11 0.00 0.00 0.00 0.00 17.79 17.45 3icc h ALA 71 CO -0.09 0.11 -0.36 1.25 0.00 0.00 0.00 179.25 180.16 3icc h LEU 72 N 0.50 -1.24 -0.73 0.00 5.85 -0.75 -1.57 115.31 117.37 3icc h LEU 72 Ca 0.14 0.23 -0.11 0.00 0.84 0.00 0.00 57.88 58.97 3icc h LEU 72 Cb 0.16 0.60 -0.02 0.00 0.37 0.00 0.00 40.66 41.78 3icc h LEU 72 CO -0.01 -0.31 -0.55 1.88 -0.34 0.00 0.00 178.44 179.11 3icc h TYR 73 N -0.17 0.00 -0.16 1.25 0.05 -1.22 -0.09 116.97 116.63 3icc h TYR 73 Ca 0.22 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 59.00 3icc h TYR 73 Cb 0.56 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.29 3icc h TYR 73 CO -0.66 0.55 0.07 1.03 -1.05 0.00 0.00 178.16 178.10 3icc h SER 74 N 0.00 0.21 -0.20 3.88 0.87 -0.93 0.24 113.55 117.62 3icc h SER 74 Ca -0.01 -0.14 -0.05 0.00 -1.23 0.00 0.00 61.79 60.36 3icc h SER 74 Cb 1.08 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 62.98 3icc h SER 74 CO 0.07 0.30 -0.07 0.28 -0.53 0.00 0.00 176.83 176.88 3icc h SER 75 N 0.12 0.41 -0.37 6.23 0.02 -1.14 -2.01 113.55 116.81 3icc h SER 75 Ca 0.05 -0.39 0.07 0.00 -0.84 0.00 0.00 61.79 60.68 3icc h SER 75 Cb 0.15 -0.11 -0.06 0.00 0.14 0.00 0.00 62.40 62.51 3icc h SER 75 CO -0.01 0.71 -0.01 0.25 -1.14 0.00 0.00 176.83 176.63 3icc h LEU 76 N 0.11 -0.18 -0.44 5.07 5.85 -1.02 -0.59 115.31 124.11 3icc h LEU 76 Ca 0.05 0.09 0.05 0.00 0.84 0.00 0.00 57.88 58.91 3icc h LEU 76 Cb 0.54 0.16 -0.05 0.00 0.37 0.00 0.00 40.66 41.68 3icc h LEU 76 CO 0.02 -0.05 0.16 0.44 -0.34 0.00 0.00 178.44 178.67 3icc h ASP 77 N 0.08 0.18 -0.13 1.25 5.19 -0.91 0.42 116.42 122.50 3icc h ASP 77 Ca 0.18 0.05 -0.00 0.00 -0.62 0.00 0.00 57.03 56.63 3icc h ASP 77 Cb 0.25 0.03 -0.01 0.00 0.18 0.00 0.00 39.33 39.78 3icc h ASP 77 CO -0.31 0.14 0.07 0.78 -3.12 0.00 0.00 179.24 176.80 3icc h ASN 78 N 0.34 0.16 -0.30 6.45 2.35 -0.80 0.08 115.58 123.85 3icc h ASN 78 Ca 0.20 -0.07 -0.07 0.00 -0.55 0.00 0.00 56.30 55.81 3icc h ASN 78 Cb 0.19 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 38.51 3icc h ASN 78 CO -0.20 0.19 -0.10 -0.33 -1.65 0.00 0.00 177.43 175.34 3icc h GLU 79 N 0.12 0.60 -0.44 0.81 4.39 -0.90 -2.12 114.58 117.04 3icc h GLU 79 Ca 0.05 -0.24 -0.12 0.00 0.34 0.00 0.00 59.36 59.38 3icc h GLU 79 Cb 0.06 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.67 3icc h GLU 79 CO -0.01 0.81 -0.19 -0.07 -1.16 0.00 0.00 179.01 178.39 3icc h LEU 80 N 0.37 0.93 -0.59 1.33 3.38 -0.90 -1.28 115.31 118.54 3icc h LEU 80 Ca 0.07 -0.40 0.05 0.00 0.09 0.00 0.00 57.88 57.70 3icc h LEU 80 Cb 0.60 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 41.05 3icc h LEU 80 CO 0.04 1.12 0.31 -0.61 0.09 0.00 0.00 178.44 179.39 3icc h GLN 81 N 0.74 0.58 -0.70 1.13 5.75 -0.74 0.31 115.11 122.17 3icc h GLN 81 Ca 0.10 -0.03 -0.06 0.00 -0.15 0.00 0.00 58.65 58.51 3icc h GLN 81 Cb 0.76 -0.13 -0.03 0.00 1.07 0.00 0.00 27.48 29.15 3icc h GLN 81 CO 0.06 0.38 0.22 -0.91 -2.65 0.00 0.00 178.83 175.93 3icc h ASN 82 N 0.59 1.02 0.75 -0.69 2.35 -1.15 -1.22 115.58 117.23 3icc h ASN 82 Ca 0.26 -0.21 -0.22 0.00 -0.55 0.00 0.00 56.30 55.58 3icc h ASN 82 Cb 0.16 -0.27 -0.04 0.00 0.05 0.00 0.00 38.32 38.23 3icc h ASN 82 CO -0.17 0.95 -1.37 0.03 -1.65 0.00 0.00 177.43 175.22 3icc h ARG 83 N 1.02 0.00 0.00 0.81 3.08 -0.89 -3.42 114.38 114.99 3icc h ARG 83 Ca 0.23 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.28 3icc h ARG 83 Cb 0.30 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.35 3icc h ARG 83 CO -0.01 0.53 -0.06 0.25 -1.07 0.00 0.00 179.97 179.61 3icc n THR 84 N -3.07 0.00 -0.74 2.04 -2.24 0.11 -5.03 114.28 105.35 3icc n THR 84 Ca -0.10 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.44 3icc n THR 84 Cb 0.94 0.92 0.00 0.00 -2.10 0.00 0.00 70.33 70.09 3icc n THR 84 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3icc n GLY 85 N 0.62 1.16 3.48 3.38 0.00 -0.46 -5.01 105.19 108.36 3icc n GLY 85 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 3icc n GLY 85 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3icc s SER 86 N -3.10 0.24 -0.05 1.61 1.04 -1.26 -4.93 113.70 107.25 3icc s SER 86 Ca 0.00 -1.18 0.16 0.00 0.48 0.00 0.00 55.95 55.41 3icc s SER 86 Cb 0.00 0.57 0.52 0.00 0.10 0.00 0.00 66.02 67.21 3icc s SER 86 CO 0.00 -1.12 1.44 0.35 0.98 0.00 0.00 173.24 174.89 3icc n THR 87 N -0.41 1.38 -2.71 2.02 -2.24 -1.26 -2.66 114.28 108.40 3icc n THR 87 Ca -0.00 -1.16 -0.35 0.00 -2.27 0.00 0.00 64.05 60.27 3icc n THR 87 Cb 0.63 0.31 -0.06 0.00 -2.10 0.00 0.00 70.33 69.11 3icc n THR 87 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3icc s LYS 88 N -1.45 4.19 0.35 -0.78 -0.14 -1.26 -4.83 119.74 115.83 3icc s LYS 88 Ca 0.39 1.27 0.01 0.00 -1.36 0.00 0.00 55.97 56.28 3icc s LYS 88 Cb 0.23 -2.34 -0.00 0.00 -1.68 0.00 0.00 37.83 34.05 3icc s LYS 88 CO 0.21 -0.08 0.44 1.97 -0.76 0.00 0.00 175.35 177.14 3icc n PHE 89 N -0.39 -1.29 0.00 3.18 1.16 -0.50 -4.93 117.46 114.68 3icc n PHE 89 Ca 0.06 -2.53 0.00 0.00 -1.87 0.00 0.00 57.45 53.11 3icc n PHE 89 Cb 0.52 0.49 0.00 0.00 -1.61 0.00 0.00 39.48 38.88 3icc n PHE 89 CO 0.00 0.00 0.00 -0.25 -1.87 0.00 0.00 176.76 174.64 3icc n ASP 90 N -1.63 3.79 -3.73 5.98 8.00 0.24 -1.86 116.55 127.34 3icc n ASP 90 Ca 0.03 0.00 -0.17 0.00 0.71 0.00 0.00 54.79 55.36 3icc n ASP 90 Cb 0.60 0.56 -0.17 0.00 -0.02 0.00 0.00 41.12 42.10 3icc n ASP 90 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3icc s ILE 91 N -1.65 -0.09 -0.16 0.53 1.01 -0.95 -1.03 121.20 118.86 3icc s ILE 91 Ca 0.00 0.30 0.01 0.00 0.00 0.00 0.00 60.65 60.96 3icc s ILE 91 Cb 0.00 -0.13 0.02 0.00 0.01 0.00 0.00 42.46 42.36 3icc s ILE 91 CO 0.00 0.12 -0.18 -0.22 0.00 0.00 0.00 174.94 174.66 3icc s LEU 92 N 1.53 1.94 -0.35 2.97 2.96 0.13 -1.18 118.68 126.69 3icc s LEU 92 Ca -0.04 -0.57 -0.06 0.00 -0.22 0.00 0.00 54.13 53.24 3icc s LEU 92 Cb -0.12 -1.35 0.05 0.00 0.50 0.00 0.00 46.19 45.27 3icc s LEU 92 CO -0.03 -0.01 0.11 -0.63 -1.32 0.00 0.00 176.35 174.47 3icc s ILE 93 N 1.30 3.70 -0.95 6.68 -1.09 0.04 -1.18 121.20 129.70 3icc s ILE 93 Ca 0.03 -1.24 -0.21 0.00 -2.23 0.00 0.00 60.65 57.00 3icc s ILE 93 Cb -0.13 -3.14 0.08 0.00 -1.58 0.00 0.00 42.46 37.69 3icc s ILE 93 CO -0.11 -0.23 1.29 0.20 -1.23 0.00 0.00 174.94 174.86 3icc s ASN 94 N 1.48 6.52 -0.09 3.58 0.01 0.01 -1.61 114.94 124.84 3icc s ASN 94 Ca -0.01 -1.63 0.05 0.00 -0.71 0.00 0.00 52.86 50.56 3icc s ASN 94 Cb -0.20 -2.49 -0.09 0.00 0.41 0.00 0.00 41.25 38.87 3icc s ASN 94 CO 0.02 -1.34 -0.02 -3.20 -1.51 0.00 0.00 177.10 171.05 3icc n ASN 95 N 7.89 2.99 -4.77 -1.22 5.15 -1.25 -0.90 115.26 123.15 3icc n ASN 95 Ca 0.26 -0.02 -0.41 0.00 -0.60 0.00 0.00 54.58 53.81 3icc n ASN 95 Cb 0.50 0.39 -0.00 0.00 -0.53 0.00 0.00 39.78 40.13 3icc n ASN 95 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3icc s ALA 96 N -2.21 3.63 0.02 5.20 0.00 -1.13 -4.90 121.76 122.37 3icc s ALA 96 Ca -0.08 1.59 -0.29 0.00 0.00 0.00 0.00 51.96 53.18 3icc s ALA 96 Cb 0.03 -3.63 0.11 0.00 0.00 0.00 0.00 23.12 19.63 3icc s ALA 96 CO 0.31 -1.05 1.23 0.20 0.00 0.00 0.00 175.76 176.45 3icc s GLY 97 N 0.06 -0.33 0.26 0.00 0.00 -1.26 -4.83 107.32 101.21 3icc s GLY 97 Ca 0.56 0.49 0.08 0.00 0.00 0.00 0.00 44.72 45.85 3icc s GLY 97 CO 0.59 0.88 -0.11 -0.26 0.00 0.00 0.00 173.10 174.20 3icc s ILE 98 N -2.47 1.85 -0.35 0.90 -4.36 -1.26 -5.08 121.20 110.42 3icc s ILE 98 Ca 0.16 -2.20 0.14 0.00 -0.26 0.00 0.00 60.65 58.48 3icc s ILE 98 Cb 0.03 -2.30 0.42 0.00 1.25 0.00 0.00 42.46 41.87 3icc s ILE 98 CO -0.02 -0.41 1.25 0.61 0.24 0.00 0.00 174.94 176.60 3icc n GLY 99 N -0.53 1.54 3.78 6.27 0.00 -1.26 -4.96 105.19 110.03 3icc n GLY 99 Ca -0.06 -0.55 -0.34 0.00 0.00 0.00 0.00 46.02 45.07 3icc n GLY 99 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3icc s PRO 100 N -1.14 3.23 0.25 1.61 0.04 -1.26 -5.02 135.00 132.70 3icc s PRO 100 Ca 0.22 1.41 -0.06 0.00 0.04 0.00 0.00 61.00 62.61 3icc s PRO 100 Cb 0.42 -2.01 -0.06 0.00 0.04 0.00 0.00 34.50 32.90 3icc s PRO 100 CO -0.05 -0.91 0.51 0.20 0.04 0.00 0.00 177.00 176.78 3icc s GLY 101 N -2.30 2.00 -0.28 0.56 0.00 -1.26 -4.77 107.32 101.26 3icc s GLY 101 Ca 0.68 -0.52 -0.22 0.00 0.00 0.00 0.00 44.72 44.66 3icc s GLY 101 CO 0.33 -0.41 0.98 0.00 0.00 0.00 0.00 173.10 173.99 3icc s ALA 102 N -1.95 -2.05 0.82 3.20 0.00 -0.15 -5.00 121.76 116.63 3icc s ALA 102 Ca 0.44 2.03 -0.11 0.00 0.00 0.00 0.00 51.96 54.32 3icc s ALA 102 Cb -0.11 -1.51 0.08 0.00 0.00 0.00 0.00 23.12 21.58 3icc s ALA 102 CO 0.27 -0.28 1.09 -0.06 0.00 0.00 0.00 175.76 176.78 3icc s PHE 103 N 0.68 2.45 0.29 0.00 0.08 -1.25 -3.27 117.98 116.96 3icc s PHE 103 Ca -0.02 1.47 0.03 0.00 0.12 0.00 0.00 56.93 58.54 3icc s PHE 103 Cb -0.05 -3.09 0.66 0.00 -0.57 0.00 0.00 43.02 39.97 3icc s PHE 103 CO -0.10 -2.03 1.78 0.97 -0.10 0.00 0.00 175.22 175.74 3icc h ILE 104 N -1.29 0.73 0.00 0.64 2.10 -1.95 -0.99 117.51 116.75 3icc h ILE 104 Ca -0.45 -0.26 0.00 0.00 1.08 0.00 0.00 64.86 65.23 3icc h ILE 104 Cb 1.25 -0.08 0.00 0.00 -1.09 0.00 0.00 36.82 36.90 3icc h ILE 104 CO 0.52 0.14 0.00 -0.33 -1.08 0.00 0.00 178.15 177.39 3icc h GLU 105 N 0.75 0.00 -0.02 2.19 3.07 -1.96 -2.56 114.58 116.04 3icc h GLU 105 Ca 0.54 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.40 3icc h GLU 105 Cb 0.78 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.69 3icc h GLU 105 CO -0.37 0.00 -0.25 0.39 -1.40 0.00 0.00 179.01 177.38 3icc n GLU 106 N -2.81 1.67 -3.00 2.33 1.02 -0.42 -4.95 120.64 114.48 3icc n GLU 106 Ca 0.01 -1.35 -0.41 0.00 -0.02 0.00 0.00 57.16 55.38 3icc n GLU 106 Cb 0.26 -1.43 -0.05 0.00 -0.02 0.00 0.00 31.44 30.20 3icc n GLU 106 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 3icc s THR 107 N -2.14 4.88 0.54 2.62 2.01 -0.91 -4.89 115.64 117.75 3icc s THR 107 Ca 0.21 1.24 -0.05 0.00 0.31 0.00 0.00 61.69 63.40 3icc s THR 107 Cb 0.18 -4.06 -0.01 0.00 0.01 0.00 0.00 72.50 68.62 3icc s THR 107 CO 0.42 -0.10 0.84 0.42 -0.69 0.00 0.00 174.62 175.51 3icc s THR 108 N 2.75 4.22 0.19 -0.82 -4.23 -1.26 -4.93 115.64 111.55 3icc s THR 108 Ca 0.30 0.06 -0.12 0.00 -1.18 0.00 0.00 61.69 60.75 3icc s THR 108 Cb -0.15 -3.63 0.10 0.00 1.34 0.00 0.00 72.50 70.16 3icc s THR 108 CO 0.10 -0.63 1.74 -0.08 -0.54 0.00 0.00 174.62 175.21 3icc h GLU 109 N 0.03 0.32 -0.67 3.99 4.81 -1.99 -1.26 114.58 119.81 3icc h GLU 109 Ca -0.46 -0.02 0.02 0.00 -0.13 0.00 0.00 59.36 58.77 3icc h GLU 109 Cb 1.23 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 30.50 3icc h GLU 109 CO 0.61 0.21 0.42 0.37 -0.73 0.00 0.00 179.01 179.89 3icc h GLN 110 N 0.32 0.81 -0.12 1.92 4.15 -1.99 -0.11 115.11 120.09 3icc h GLN 110 Ca 0.25 -0.05 -0.01 0.00 0.77 0.00 0.00 58.65 59.61 3icc h GLN 110 Cb 0.29 -0.18 -0.01 0.00 0.21 0.00 0.00 27.48 27.80 3icc h GLN 110 CO -0.28 0.53 0.05 0.35 -1.93 0.00 0.00 178.83 177.56 3icc h PHE 111 N 0.83 0.19 0.05 3.99 3.57 -1.85 -2.10 116.94 121.63 3icc h PHE 111 Ca 0.26 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.76 3icc h PHE 111 Cb -0.01 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 38.66 3icc h PHE 111 CO -0.04 0.27 -0.11 0.35 -2.23 0.00 0.00 178.31 176.56 3icc h PHE 112 N 0.05 -0.27 -0.88 0.41 3.57 -0.96 -2.81 116.94 116.04 3icc h PHE 112 Ca 0.04 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.57 3icc h PHE 112 Cb 0.17 0.11 -0.05 0.00 2.79 0.00 0.00 35.95 38.97 3icc h PHE 112 CO -0.02 -0.16 0.58 -0.44 -2.23 0.00 0.00 178.31 176.04 3icc h ASP 113 N -0.21 0.98 0.00 0.41 3.32 -0.94 -2.13 116.42 117.85 3icc h ASP 113 Ca 0.02 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3icc h ASP 113 Cb 0.23 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.54 3icc h ASP 113 CO -0.07 0.69 0.00 -1.14 -1.72 0.00 0.00 179.24 177.00 3icc n ARG 114 N -4.42 0.47 0.00 3.56 0.63 -0.80 -1.10 116.66 115.00 3icc n ARG 114 Ca 0.11 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.04 3icc n ARG 114 Cb 0.06 -1.26 0.00 0.00 0.45 0.00 0.00 32.46 31.71 3icc n ARG 114 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 3icc n VAL 116 N 0.70 0.00 -0.12 5.15 0.31 -0.80 -1.76 118.33 121.81 3icc n VAL 116 Ca 0.00 0.00 -0.04 0.00 -0.01 0.00 0.00 64.34 64.29 3icc n VAL 116 Cb 0.22 0.00 0.03 0.00 -0.91 0.00 0.00 33.84 33.18 3icc n VAL 116 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 3icc h SER 117 N 0.00 -0.05 0.09 4.52 0.02 -1.38 0.20 113.55 116.95 3icc h SER 117 Ca 0.00 0.08 -0.18 0.00 -0.84 0.00 0.00 61.79 60.85 3icc h SER 117 Cb 0.00 0.12 0.02 0.00 0.14 0.00 0.00 62.40 62.68 3icc h SER 117 CO 0.00 0.01 -0.76 0.58 -1.14 0.00 0.00 176.83 175.52 3icc h VAL 118 N 0.17 1.47 0.00 2.27 2.07 -1.60 -1.51 116.25 119.12 3icc h VAL 118 Ca 0.20 -2.37 -0.00 0.00 0.82 0.00 0.00 66.70 65.34 3icc h VAL 118 Cb 0.26 2.97 -0.00 0.00 -1.52 0.00 0.00 31.29 32.99 3icc h VAL 118 CO -0.28 0.68 -1.38 0.59 0.02 0.00 0.00 177.57 177.20 3icc n ASN 119 N -4.14 0.54 0.00 0.57 4.13 -1.21 -4.28 115.26 110.86 3icc n ASN 119 Ca -0.13 0.21 0.00 0.00 1.68 0.00 0.00 54.58 56.34 3icc n ASN 119 Cb 0.78 1.01 0.00 0.00 -1.54 0.00 0.00 39.78 40.03 3icc n ASN 119 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3icc n ALA 120 N -2.21 3.00 0.05 5.41 0.00 -0.42 -4.66 120.51 121.68 3icc n ALA 120 Ca -0.02 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.29 3icc n ALA 120 Cb 0.56 0.44 -0.09 0.00 0.00 0.00 0.00 19.45 20.36 3icc n ALA 120 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 3icc h LYS 121 N 0.00 -0.11 -0.05 0.00 3.64 -1.13 -2.62 116.57 116.30 3icc h LYS 121 Ca 0.00 0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.39 3icc h LYS 121 Cb 0.87 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.71 3icc h LYS 121 CO 0.00 0.20 0.01 0.00 -2.27 0.00 0.00 179.45 177.39 3icc h ALA 122 N 0.44 0.05 -0.84 5.00 0.00 -1.45 -1.14 119.26 121.31 3icc h ALA 122 Ca -0.01 0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.96 3icc h ALA 122 Cb 0.37 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.12 3icc h ALA 122 CO 0.02 -0.47 0.55 -1.35 0.00 0.00 0.00 179.25 178.00 3icc h PRO 123 N 0.03 0.94 0.04 0.00 0.11 -1.76 0.18 132.00 131.53 3icc h PRO 123 Ca 0.02 -0.06 -0.00 0.00 0.11 0.00 0.00 66.00 66.07 3icc h PRO 123 Cb 0.02 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 30.92 3icc h PRO 123 CO -0.03 0.62 -0.02 0.35 -0.21 0.00 0.00 178.00 178.71 3icc h PHE 124 N 0.97 -0.05 0.00 0.65 3.57 -1.06 -0.81 116.94 120.21 3icc h PHE 124 Ca 0.35 -0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.76 3icc h PHE 124 Cb 0.15 0.02 -0.01 0.00 2.79 0.00 0.00 35.95 38.90 3icc h PHE 124 CO -0.00 -0.03 -0.45 0.74 -2.23 0.00 0.00 178.31 176.35 3icc h PHE 125 N -0.05 0.00 -0.45 0.41 0.04 -0.79 0.29 116.94 116.38 3icc h PHE 125 Ca -0.01 0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.70 3icc h PHE 125 Cb 0.04 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.17 3icc h PHE 125 CO -0.08 0.45 0.05 0.82 -0.60 0.00 0.00 178.31 178.95 3icc h ILE 126 N 0.00 1.25 -0.33 -0.55 2.04 -0.51 -2.17 117.51 117.25 3icc h ILE 126 Ca -0.00 -0.96 -0.04 0.00 1.00 0.00 0.00 64.86 64.86 3icc h ILE 126 Cb 0.91 0.99 -0.01 0.00 -0.74 0.00 0.00 36.82 37.97 3icc h ILE 126 CO 0.06 0.33 0.05 0.40 0.00 0.00 0.00 178.15 178.99 3icc h ILE 127 N 0.62 1.24 -0.62 -0.67 2.04 -0.93 -0.78 117.51 118.42 3icc h ILE 127 Ca 0.13 -0.84 0.13 0.00 1.00 0.00 0.00 64.86 65.28 3icc h ILE 127 Cb 0.43 1.15 -0.10 0.00 -0.74 0.00 0.00 36.82 37.56 3icc h ILE 127 CO 0.01 0.28 0.07 -0.61 0.00 0.00 0.00 178.15 177.90 3icc h GLN 128 N 0.38 0.18 0.00 2.37 4.15 -0.77 -1.74 115.11 119.67 3icc h GLN 128 Ca 0.10 -0.01 -0.12 0.00 0.77 0.00 0.00 58.65 59.39 3icc h GLN 128 Cb 0.36 -0.04 -0.02 0.00 0.21 0.00 0.00 27.48 27.99 3icc h GLN 128 CO 0.01 0.12 -0.56 1.96 -1.93 0.00 0.00 178.83 178.42 3icc h GLN 129 N 0.19 0.00 0.00 1.69 1.08 -1.31 -3.00 115.11 113.75 3icc h GLN 129 Ca 0.33 0.00 -0.05 0.00 -1.45 0.00 0.00 58.65 57.48 3icc h GLN 129 Cb 0.52 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.95 3icc h GLN 129 CO -0.48 0.56 -0.22 0.00 -0.95 0.00 0.00 178.83 177.75 3icc h ALA 130 N 1.44 1.37 -0.28 3.87 0.00 -0.27 -3.28 119.26 122.09 3icc h ALA 130 Ca -0.01 -0.20 0.02 0.00 0.00 0.00 0.00 54.91 54.72 3icc h ALA 130 Cb 1.27 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 3icc h ALA 130 CO 0.07 0.27 0.19 -0.07 0.00 0.00 0.00 179.25 179.72 3icc h LEU 131 N 0.00 0.27 -0.08 0.00 3.38 -1.26 0.19 115.31 117.81 3icc h LEU 131 Ca -0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3icc h LEU 131 Cb 0.47 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.15 3icc h LEU 131 CO 0.03 0.19 0.00 -1.54 0.09 0.00 0.00 178.44 177.21 3icc n SER 132 N -4.49 0.61 -0.03 -0.43 3.41 -1.24 -3.83 113.62 107.62 3icc n SER 132 Ca 0.02 0.57 0.02 0.00 -0.26 0.00 0.00 58.87 59.21 3icc n SER 132 Cb 0.12 -0.73 -0.10 0.00 -0.26 0.00 0.00 64.21 63.24 3icc n SER 132 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3icc n ARG 133 N -2.08 1.00 -2.60 4.33 1.74 -0.19 -5.00 116.66 113.86 3icc n ARG 133 Ca 0.05 -0.08 -0.40 0.00 -0.77 0.00 0.00 57.85 56.65 3icc n ARG 133 Cb 0.38 -1.32 -0.05 0.00 -1.02 0.00 0.00 32.46 30.46 3icc n ARG 133 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3icc s LEU 134 N -4.29 4.57 0.72 0.55 1.43 -0.12 -1.41 118.68 120.12 3icc s LEU 134 Ca -0.05 2.09 -0.11 0.00 -1.03 0.00 0.00 54.13 55.02 3icc s LEU 134 Cb 0.07 -3.61 0.02 0.00 0.03 0.00 0.00 46.19 42.69 3icc s LEU 134 CO 0.53 -0.05 1.08 -0.13 0.23 0.00 0.00 176.35 178.01 3icc s ARG 135 N -1.03 2.75 0.59 1.70 0.52 -0.78 -4.92 118.95 117.79 3icc s ARG 135 Ca 0.44 0.70 -0.18 0.00 -0.52 0.00 0.00 55.73 56.17 3icc s ARG 135 Cb -0.29 -1.99 -0.06 0.00 0.52 0.00 0.00 34.95 33.14 3icc s ARG 135 CO 0.36 -1.17 0.88 -0.25 0.02 0.00 0.00 175.30 175.14 3icc n ASP 136 N -3.14 0.40 -1.19 0.23 9.92 -1.26 -2.75 116.55 118.75 3icc n ASP 136 Ca 0.07 0.79 -0.13 0.00 -0.53 0.00 0.00 54.79 54.99 3icc n ASP 136 Cb 0.55 -1.34 -0.04 0.00 -0.64 0.00 0.00 41.12 39.65 3icc n ASP 136 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 3icc n ASN 137 N -0.52 -4.46 -3.94 -2.24 3.02 -0.61 -4.97 115.26 101.54 3icc n ASN 137 Ca 0.13 0.22 -0.30 0.00 -0.03 0.00 0.00 54.58 54.60 3icc n ASN 137 Cb 0.47 -3.30 0.21 0.00 -0.61 0.00 0.00 39.78 36.55 3icc n ASN 137 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 3icc s SER 138 N -2.70 2.19 -0.03 6.41 0.01 -1.11 -4.85 113.70 113.61 3icc s SER 138 Ca 0.00 0.35 0.00 0.00 1.31 0.00 0.00 55.95 57.61 3icc s SER 138 Cb 0.00 -0.42 0.03 0.00 0.21 0.00 0.00 66.02 65.84 3icc s SER 138 CO 0.00 -3.32 -0.00 -0.13 0.41 0.00 0.00 173.24 170.20 3icc s ARG 139 N -5.76 0.35 -0.16 12.44 1.81 -0.20 -2.08 118.95 125.36 3icc s ARG 139 Ca 0.74 0.08 0.01 0.00 -1.72 0.00 0.00 55.73 54.84 3icc s ARG 139 Cb -0.05 -0.55 0.00 0.00 -0.45 0.00 0.00 34.95 33.90 3icc s ARG 139 CO 0.54 -0.15 -0.18 0.42 -0.68 0.00 0.00 175.30 175.25 3icc s ILE 140 N 1.14 2.41 -0.11 1.52 1.01 -0.27 -0.69 121.20 126.21 3icc s ILE 140 Ca -0.08 -0.85 0.01 0.00 0.00 0.00 0.00 60.65 59.73 3icc s ILE 140 Cb -0.13 -2.00 0.02 0.00 0.01 0.00 0.00 42.46 40.35 3icc s ILE 140 CO -0.02 0.53 -0.13 -0.63 0.00 0.00 0.00 174.94 174.69 3icc s ILE 141 N 0.90 1.34 -0.15 2.92 1.01 -0.33 -1.58 121.20 125.32 3icc s ILE 141 Ca -0.04 -0.53 -0.04 0.00 0.00 0.00 0.00 60.65 60.03 3icc s ILE 141 Cb -0.15 -1.26 -0.03 0.00 0.01 0.00 0.00 42.46 41.03 3icc s ILE 141 CO -0.02 0.41 -0.01 0.20 0.00 0.00 0.00 174.94 175.52 3icc s ASN 142 N 1.19 5.09 -0.31 3.58 0.01 -0.30 -0.81 114.94 123.39 3icc s ASN 142 Ca -0.03 -0.03 -0.22 0.00 -0.71 0.00 0.00 52.86 51.87 3icc s ASN 142 Cb -0.14 -1.78 -0.00 0.00 0.41 0.00 0.00 41.25 39.73 3icc s ASN 142 CO -0.04 0.20 0.69 -0.63 -1.51 0.00 0.00 177.10 175.82 3icc s ILE 143 N 0.18 4.87 0.00 0.60 -1.09 -0.07 -1.41 121.20 124.28 3icc s ILE 143 Ca 0.00 0.96 0.00 0.00 -2.23 0.00 0.00 60.65 59.39 3icc s ILE 143 Cb -0.13 -4.06 0.00 0.00 -1.58 0.00 0.00 42.46 36.68 3icc s ILE 143 CO 0.02 -0.20 0.00 -0.24 -1.23 0.00 0.00 174.94 173.29 3icc n SER 144 N 6.03 0.00 -3.60 3.58 2.88 0.93 -4.87 113.62 118.56 3icc n SER 144 Ca 0.01 0.00 -0.14 0.00 -1.33 0.00 0.00 58.87 57.41 3icc n SER 144 Cb 0.49 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.88 3icc n SER 144 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 3icc s SER 145 N -0.62 -0.64 0.00 -3.46 0.15 -1.26 -4.39 113.70 103.48 3icc s SER 145 Ca 0.00 1.05 0.08 0.00 0.70 0.00 0.00 55.95 57.78 3icc s SER 145 Cb 0.00 1.00 0.36 0.00 -1.71 0.00 0.00 66.02 65.67 3icc s SER 145 CO 0.00 -0.34 1.22 0.00 1.20 0.00 0.00 173.24 175.32 3icc n ALA 146 N 1.93 1.41 0.18 5.45 0.00 -0.24 -1.86 120.51 127.38 3icc n ALA 146 Ca -0.15 -0.03 0.10 0.00 0.00 0.00 0.00 53.44 53.36 3icc n ALA 146 Cb 0.56 -1.13 0.50 0.00 0.00 0.00 0.00 19.45 19.38 3icc n ALA 146 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3icc n ALA 147 N -1.44 1.14 1.17 0.00 0.00 -1.26 -0.72 120.51 119.39 3icc n ALA 147 Ca 0.02 0.16 0.13 0.00 0.00 0.00 0.00 53.44 53.75 3icc n ALA 147 Cb 0.09 -1.29 0.65 0.00 0.00 0.00 0.00 19.45 18.90 3icc n ALA 147 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3icc n THR 148 N -2.15 0.12 0.00 0.00 -2.24 -0.78 -3.88 114.28 105.34 3icc n THR 148 Ca -0.01 0.03 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 3icc n THR 148 Cb 0.06 -0.57 0.00 0.00 -2.10 0.00 0.00 70.33 67.72 3icc n THR 148 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 3icc n ARG 149 N -1.37 3.07 -4.34 -0.78 0.63 -0.09 -5.00 116.66 108.77 3icc n ARG 149 Ca 0.11 0.00 -0.33 0.00 -0.92 0.00 0.00 57.85 56.70 3icc n ARG 149 Cb 0.26 -0.96 -0.15 0.00 0.45 0.00 0.00 32.46 32.05 3icc n ARG 149 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 3icc s ILE 150 N -1.91 2.57 -0.07 5.15 1.01 0.10 -5.09 121.20 122.98 3icc s ILE 150 Ca 0.00 -0.79 -0.30 0.00 0.00 0.00 0.00 60.65 59.57 3icc s ILE 150 Cb 0.00 -2.10 -0.04 0.00 0.01 0.00 0.00 42.46 40.33 3icc s ILE 150 CO 0.00 0.51 1.42 -0.55 0.00 0.00 0.00 174.94 176.32 3icc s SER 151 N 1.03 6.83 -0.55 3.58 0.15 -1.26 -4.42 113.70 119.07 3icc s SER 151 Ca -0.01 2.01 0.04 0.00 0.70 0.00 0.00 55.95 58.69 3icc s SER 151 Cb -0.15 -2.55 0.16 0.00 -1.71 0.00 0.00 66.02 61.78 3icc s SER 151 CO -0.04 -0.79 0.39 -0.76 1.20 0.00 0.00 173.24 173.24 3icc s LEU 152 N 3.20 3.25 0.57 3.45 1.43 -1.26 -4.97 118.68 124.35 3icc s LEU 152 Ca 0.63 -3.33 0.26 0.00 -1.03 0.00 0.00 54.13 50.67 3icc s LEU 152 Cb -0.29 -1.12 1.66 0.00 0.03 0.00 0.00 46.19 46.47 3icc s LEU 152 CO 0.23 -0.15 2.20 -0.65 0.23 0.00 0.00 176.35 178.21 3icc h PRO 153 N 5.77 0.00 0.00 1.29 0.11 -1.96 -0.32 132.00 136.89 3icc h PRO 153 Ca 0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.26 3icc h PRO 153 Cb 0.84 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.95 3icc h PRO 153 CO 0.55 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.94 3icc n ASP 154 N -4.01 0.00 -2.15 -2.05 5.75 -1.26 -2.86 116.55 109.97 3icc n ASP 154 Ca -0.02 -0.36 -0.08 0.00 -0.01 0.00 0.00 54.79 54.32 3icc n ASP 154 Cb 0.15 -0.12 0.05 0.00 -1.03 0.00 0.00 41.12 40.17 3icc n ASP 154 CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 3icc n PHE 155 N -1.12 1.59 -0.06 2.11 3.72 -0.13 -0.98 117.46 122.58 3icc n PHE 155 Ca 0.13 -1.94 -0.09 0.00 -0.05 0.00 0.00 57.45 55.50 3icc n PHE 155 Cb 0.11 -0.27 -0.02 0.00 -0.94 0.00 0.00 39.48 38.35 3icc n PHE 155 CO 0.00 0.00 0.00 0.97 -0.05 0.00 0.00 176.76 177.68 3icc h ILE 156 N 3.94 1.06 -0.57 4.37 2.10 -1.50 -0.83 117.51 126.07 3icc h ILE 156 Ca 0.07 -0.11 0.02 0.00 1.08 0.00 0.00 64.86 65.91 3icc h ILE 156 Cb 1.41 0.70 -0.04 0.00 -1.09 0.00 0.00 36.82 37.80 3icc h ILE 156 CO 0.38 0.06 0.35 0.00 -1.08 0.00 0.00 178.15 177.87 3icc h ALA 157 N 1.10 0.74 -0.07 0.18 0.00 -1.90 -2.80 119.26 116.50 3icc h ALA 157 Ca 0.09 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.02 3icc h ALA 157 Cb -0.03 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.54 3icc h ALA 157 CO -0.02 0.09 -0.16 -0.92 0.00 0.00 0.00 179.25 178.24 3icc h TYR 158 N 0.70 -0.40 0.00 0.00 3.20 -1.75 -1.54 116.97 117.18 3icc h TYR 158 Ca 0.23 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.12 3icc h TYR 158 Cb 0.00 0.19 0.00 0.00 1.54 0.00 0.00 36.73 38.46 3icc h TYR 158 CO -0.05 -0.23 0.00 0.43 -1.64 0.00 0.00 178.16 176.67 3icc n SER 159 N -5.29 0.00 0.00 -2.11 7.64 -0.36 -1.83 113.62 111.67 3icc n SER 159 Ca -0.04 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.84 3icc n SER 159 Cb 0.21 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.41 3icc n SER 159 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 3icc n THR 161 N 0.70 0.00 0.11 0.44 -2.24 -0.58 -0.31 114.28 112.40 3icc n THR 161 Ca 0.00 0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 61.74 3icc n THR 161 Cb 0.00 0.00 0.13 0.00 -2.10 0.00 0.00 70.33 68.36 3icc n THR 161 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 3icc h LYS 162 N 0.00 0.14 -0.86 -0.78 1.79 -1.64 -2.18 116.57 113.04 3icc h LYS 162 Ca 0.00 -0.10 0.03 0.00 -2.18 0.00 0.00 60.65 58.40 3icc h LYS 162 Cb 0.00 0.02 -0.05 0.00 -1.58 0.00 0.00 32.23 30.62 3icc h LYS 162 CO 0.00 0.72 0.57 0.78 -1.08 0.00 0.00 179.45 180.43 3icc h GLY 163 N 1.64 1.22 1.03 3.86 0.00 -0.94 -1.18 103.07 108.70 3icc h GLY 163 Ca -0.01 -0.43 -0.07 0.00 0.00 0.00 0.00 47.33 46.83 3icc h GLY 163 CO 0.09 0.38 0.12 0.00 0.00 0.00 0.00 176.54 177.13 3icc h ALA 164 N 1.49 0.80 -0.41 3.60 0.00 -1.75 -2.04 119.26 120.96 3icc h ALA 164 Ca 0.34 -0.25 0.02 0.00 0.00 0.00 0.00 54.91 55.02 3icc h ALA 164 Cb -0.01 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 3icc h ALA 164 CO -0.09 0.54 0.23 0.82 0.00 0.00 0.00 179.25 180.74 3icc h ILE 165 N 0.90 1.02 -0.25 0.00 1.08 -1.06 -3.03 117.51 116.17 3icc h ILE 165 Ca 0.19 -0.16 0.03 0.00 -0.39 0.00 0.00 64.86 64.53 3icc h ILE 165 Cb 0.39 0.52 -0.03 0.00 -3.07 0.00 0.00 36.82 34.64 3icc h ILE 165 CO 0.01 0.08 0.07 0.78 -0.69 0.00 0.00 178.15 178.40 3icc h ASN 166 N 0.46 0.07 0.00 1.72 2.35 -0.99 -1.01 115.58 118.17 3icc h ASN 166 Ca 0.17 0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.94 3icc h ASN 166 Cb 0.03 0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.43 3icc h ASN 166 CO -0.09 0.07 0.00 0.41 -1.65 0.00 0.00 177.43 176.17 3icc n THR 167 N -5.05 0.33 0.00 2.81 -1.04 -0.79 -2.11 114.28 108.42 3icc n THR 167 Ca -0.02 -0.03 0.00 0.00 -2.04 0.00 0.00 64.05 61.97 3icc n THR 167 Cb 0.09 -0.75 0.00 0.00 -1.82 0.00 0.00 70.33 67.86 3icc n THR 167 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 3icc n THR 169 N 1.09 0.00 -0.08 12.58 -1.04 -0.39 -1.30 114.28 125.15 3icc n THR 169 Ca 0.00 0.00 -0.05 0.00 -2.04 0.00 0.00 64.05 61.96 3icc n THR 169 Cb 0.13 0.00 0.16 0.00 -1.82 0.00 0.00 70.33 68.81 3icc n THR 169 CO 0.00 0.00 0.00 0.15 -0.64 0.00 0.00 175.07 174.58 3icc h PHE 170 N 0.00 0.78 -0.02 -1.42 3.57 -1.63 -1.63 116.94 116.58 3icc h PHE 170 Ca 0.00 -0.13 -0.02 0.00 3.53 0.00 0.00 57.97 61.35 3icc h PHE 170 Cb 0.00 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 38.53 3icc h PHE 170 CO 0.00 0.78 -0.06 1.15 -2.23 0.00 0.00 178.31 177.95 3icc h THR 171 N 0.66 1.47 -0.02 4.41 2.02 -1.46 -3.20 112.91 116.80 3icc h THR 171 Ca 0.12 -1.48 -0.07 0.00 0.77 0.00 0.00 66.41 65.75 3icc h THR 171 Cb 0.53 2.41 -0.01 0.00 -1.74 0.00 0.00 68.15 69.34 3icc h THR 171 CO 0.03 0.40 -0.32 -0.07 0.37 0.00 0.00 175.52 175.93 3icc h LEU 172 N -0.50 0.03 -1.21 2.58 3.38 -1.76 -2.83 115.31 115.00 3icc h LEU 172 Ca -0.00 -0.01 0.14 0.00 0.09 0.00 0.00 57.88 58.10 3icc h LEU 172 Cb 0.68 -0.01 -0.08 0.00 0.09 0.00 0.00 40.66 41.34 3icc h LEU 172 CO 0.01 0.34 0.59 0.00 0.09 0.00 0.00 178.44 179.48 3icc h ALA 173 N 1.66 1.76 -0.53 1.53 0.00 -1.29 -0.71 119.26 121.69 3icc h ALA 173 Ca 0.00 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 3icc h ALA 173 Cb 0.57 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 3icc h ALA 173 CO 0.04 -0.01 0.03 -0.22 0.00 0.00 0.00 179.25 179.09 3icc h LYS 174 N 0.76 0.91 -0.06 0.00 3.64 -1.58 -2.29 116.57 117.94 3icc h LYS 174 Ca 0.47 -0.27 -0.07 0.00 -1.27 0.00 0.00 60.65 59.51 3icc h LYS 174 Cb 0.69 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.42 3icc h LYS 174 CO -0.23 0.91 -0.22 0.37 -2.27 0.00 0.00 179.45 178.02 3icc h GLN 175 N 0.79 0.26 0.00 1.90 4.15 -1.39 -3.33 115.11 117.49 3icc h GLN 175 Ca 0.15 -0.19 0.00 0.00 0.77 0.00 0.00 58.65 59.38 3icc h GLN 175 Cb 0.48 0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.21 3icc h GLN 175 CO 0.02 0.82 0.00 1.28 -1.93 0.00 0.00 178.83 179.02 3icc n LEU 176 N -4.53 0.19 0.25 -2.39 4.77 -0.37 -3.01 117.00 111.91 3icc n LEU 176 Ca -0.08 0.53 0.10 0.00 -0.03 0.00 0.00 56.01 56.53 3icc n LEU 176 Cb 0.44 -0.48 0.68 0.00 -2.33 0.00 0.00 43.42 41.72 3icc n LEU 176 CO 0.39 -0.14 0.97 1.23 -1.33 0.00 0.00 177.39 178.51 3icc h GLY 177 N 4.04 0.00 1.74 -0.72 0.00 -1.43 -1.87 103.07 104.83 3icc h GLY 177 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 47.33 47.36 3icc h GLY 177 CO 0.00 0.00 0.10 0.00 0.00 0.00 0.00 176.54 176.64 3icc h ALA 178 N 1.88 1.85 -0.44 3.60 0.00 -1.75 -0.28 119.26 124.12 3icc h ALA 178 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3icc h ALA 178 Cb 0.28 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.08 3icc h ALA 178 CO 0.02 -0.15 0.00 0.54 0.00 0.00 0.00 179.25 179.65 3icc n ARG 179 N -4.09 2.52 -0.95 0.00 1.74 -0.83 -4.95 116.66 110.11 3icc n ARG 179 Ca -0.00 -2.33 0.00 0.00 -0.77 0.00 0.00 57.85 54.75 3icc n ARG 179 Cb 0.21 -1.51 0.00 0.00 -1.02 0.00 0.00 32.46 30.14 3icc n ARG 179 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3icc n GLY 180 N 1.49 0.61 3.71 -0.13 0.00 -0.12 -1.58 105.19 109.17 3icc n GLY 180 Ca 0.20 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.83 3icc n GLY 180 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3icc s ILE 181 N -2.36 5.12 0.20 -0.61 1.01 -0.77 -3.65 121.20 120.14 3icc s ILE 181 Ca 0.00 1.12 -0.02 0.00 0.00 0.00 0.00 60.65 61.74 3icc s ILE 181 Cb 0.00 -3.90 -0.05 0.00 0.01 0.00 0.00 42.46 38.53 3icc s ILE 181 CO 0.00 0.26 0.42 0.42 0.00 0.00 0.00 174.94 176.03 3icc s THR 182 N 0.97 5.17 -0.12 2.92 -4.23 -0.88 -3.42 115.64 116.04 3icc s THR 182 Ca 0.29 -0.21 -0.03 0.00 -1.18 0.00 0.00 61.69 60.56 3icc s THR 182 Cb -0.16 -3.71 0.05 0.00 1.34 0.00 0.00 72.50 70.02 3icc s THR 182 CO 0.12 -0.15 0.06 -0.69 -0.54 0.00 0.00 174.62 173.42 3icc s VAL 183 N -1.86 0.04 0.16 2.29 1.01 -1.26 -1.12 120.40 119.67 3icc s VAL 183 Ca 0.40 0.00 0.01 0.00 0.00 0.00 0.00 61.98 62.39 3icc s VAL 183 Cb -0.11 -0.50 -0.04 0.00 0.00 0.00 0.00 36.38 35.73 3icc s VAL 183 CO 0.28 -0.06 0.03 0.20 0.00 0.00 0.00 175.10 175.55 3icc s ASN 184 N 2.09 0.87 0.06 3.32 0.01 -0.61 0.20 114.94 120.88 3icc s ASN 184 Ca 0.03 -1.20 0.06 0.00 -0.71 0.00 0.00 52.86 51.04 3icc s ASN 184 Cb -0.14 0.19 -0.03 0.00 0.41 0.00 0.00 41.25 41.68 3icc s ASN 184 CO -0.07 -0.64 -0.18 0.00 -1.51 0.00 0.00 177.10 174.71 3icc s ALA 185 N -3.81 1.49 -0.16 0.60 0.00 -0.18 -1.15 121.76 118.55 3icc s ALA 185 Ca 0.25 -1.03 -0.04 0.00 0.00 0.00 0.00 51.96 51.14 3icc s ALA 185 Cb 0.07 -0.23 -0.03 0.00 0.00 0.00 0.00 23.12 22.93 3icc s ALA 185 CO 0.04 0.29 -0.02 0.42 0.00 0.00 0.00 175.76 176.49 3icc s ILE 186 N -0.99 3.98 -0.61 0.00 1.01 -0.50 -0.94 121.20 123.15 3icc s ILE 186 Ca 0.04 -0.32 -0.05 0.00 0.00 0.00 0.00 60.65 60.32 3icc s ILE 186 Cb -0.09 -2.75 0.16 0.00 0.01 0.00 0.00 42.46 39.78 3icc s ILE 186 CO 0.02 0.49 0.44 -0.76 0.00 0.00 0.00 174.94 175.13 3icc s LEU 187 N 0.41 5.46 0.58 2.97 1.02 0.05 -0.05 118.68 129.11 3icc s LEU 187 Ca -0.03 -2.66 -0.17 0.00 0.02 0.00 0.00 54.13 51.29 3icc s LEU 187 Cb -0.14 -1.91 -0.04 0.00 0.02 0.00 0.00 46.19 44.12 3icc s LEU 187 CO 0.03 -0.44 1.06 -2.84 0.02 0.00 0.00 176.35 174.17 3icc s PRO 188 N 0.22 3.38 0.00 1.29 0.02 -1.26 -1.47 135.00 137.19 3icc s PRO 188 Ca 0.15 1.25 0.00 0.00 0.02 0.00 0.00 61.00 62.42 3icc s PRO 188 Cb -0.20 -2.04 0.00 0.00 0.02 0.00 0.00 34.50 32.28 3icc s PRO 188 CO -0.04 -0.76 0.00 0.41 -0.33 0.00 0.00 177.00 176.28 3icc n GLY 189 N -0.80 1.06 3.73 0.52 0.00 -1.09 -1.08 105.19 107.53 3icc n GLY 189 Ca 0.09 -1.64 -0.42 0.00 0.00 0.00 0.00 46.02 44.05 3icc n GLY 189 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3icc s PHE 190 N 0.91 3.08 -0.04 1.61 0.08 -1.26 -4.90 117.98 117.45 3icc s PHE 190 Ca 0.00 0.87 0.01 0.00 0.12 0.00 0.00 56.93 57.93 3icc s PHE 190 Cb 0.00 -3.83 0.02 0.00 -0.57 0.00 0.00 43.02 38.64 3icc s PHE 190 CO 0.00 -2.87 -0.02 0.08 -0.10 0.00 0.00 175.22 172.30 3icc s VAL 191 N 0.59 0.38 -0.52 -0.44 1.01 -1.26 -2.01 120.40 118.15 3icc s VAL 191 Ca 0.64 -0.02 -0.26 0.00 0.00 0.00 0.00 61.98 62.33 3icc s VAL 191 Cb -0.42 -0.44 -0.06 0.00 0.00 0.00 0.00 36.38 35.47 3icc s VAL 191 CO 0.37 0.19 2.25 -0.54 0.00 0.00 0.00 175.10 177.37 3icc s LYS 192 N 1.01 2.27 0.37 2.72 1.02 -0.81 -4.83 119.74 121.49 3icc s LYS 192 Ca -0.10 1.20 -0.03 0.00 0.02 0.00 0.00 55.97 57.07 3icc s LYS 192 Cb -0.14 -4.52 0.01 0.00 -0.52 0.00 0.00 37.83 32.66 3icc s LYS 192 CO -0.01 -3.10 0.53 0.95 -0.92 0.00 0.00 175.35 172.80 3icc s THR 193 N 11.24 0.00 -1.12 2.17 -4.23 -1.26 -4.62 115.64 117.83 3icc s THR 193 Ca 0.89 -1.53 -0.06 0.00 -1.18 0.00 0.00 61.69 59.80 3icc s THR 193 Cb -0.16 -2.73 0.28 0.00 1.34 0.00 0.00 72.50 71.23 3icc s THR 193 CO 0.25 0.00 1.45 0.47 -0.54 0.00 0.00 174.62 176.25 3icc n ASP 194 N -1.60 6.03 -0.07 3.99 8.00 -1.26 -2.01 116.55 129.63 3icc n ASP 194 Ca 0.00 -3.28 0.00 0.00 0.71 0.00 0.00 54.79 52.22 3icc n ASP 194 Cb 0.61 -1.33 0.00 0.00 -0.02 0.00 0.00 41.12 40.38 3icc n ASP 194 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 3icc n ASN 196 N 2.09 0.00 -0.26 -2.24 0.23 -1.26 -4.79 115.26 109.03 3icc n ASN 196 Ca 0.28 0.00 0.01 0.00 -0.53 0.00 0.00 54.58 54.34 3icc n ASN 196 Cb 0.35 0.00 0.14 0.00 -2.08 0.00 0.00 39.78 38.19 3icc n ASN 196 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3icc h ALA 197 N 0.00 1.03 0.22 -2.53 0.00 -1.79 0.20 119.26 116.39 3icc h ALA 197 Ca 0.00 0.03 -0.32 0.00 0.00 0.00 0.00 54.91 54.62 3icc h ALA 197 Cb 0.00 -0.11 0.03 0.00 0.00 0.00 0.00 17.79 17.71 3icc h ALA 197 CO 0.00 0.05 -1.44 1.05 0.00 0.00 0.00 179.25 178.91 3icc h GLU 198 N 0.71 0.47 -0.49 0.00 9.09 -1.89 -2.63 114.58 119.83 3icc h GLU 198 Ca 0.35 -0.80 0.00 0.00 0.05 0.00 0.00 59.36 58.97 3icc h GLU 198 Cb 0.30 0.30 -0.02 0.00 -1.65 0.00 0.00 28.75 27.67 3icc h GLU 198 CO -0.23 1.38 0.31 1.25 0.05 0.00 0.00 179.01 181.77 3icc h LEU 199 N 0.13 0.58 -0.20 3.06 5.85 -1.94 -2.43 115.31 120.35 3icc h LEU 199 Ca -0.23 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.45 3icc h LEU 199 Cb 2.12 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 43.01 3icc h LEU 199 CO 0.25 0.44 0.00 0.18 -0.34 0.00 0.00 178.44 178.97 3icc n LEU 200 N -4.72 0.64 0.29 2.25 4.77 0.04 -3.39 117.00 116.88 3icc n LEU 200 Ca 0.02 0.59 0.16 0.00 -0.03 0.00 0.00 56.01 56.75 3icc n LEU 200 Cb 0.04 -0.42 0.89 0.00 -2.33 0.00 0.00 43.42 41.60 3icc n LEU 200 CO 0.35 -0.27 1.08 0.77 -1.33 0.00 0.00 177.39 177.99 3icc h SER 201 N 0.00 0.00 -3.14 -1.43 4.64 -1.04 -3.39 113.55 109.20 3icc h SER 201 Ca 0.00 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.75 3icc h SER 201 Cb 0.58 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.62 3icc h SER 201 CO 0.00 0.04 0.90 -0.62 -0.87 0.00 0.00 176.83 176.29 3icc s ASP 202 N -5.95 6.85 -0.95 4.97 2.15 -1.22 -5.01 116.67 117.51 3icc s ASP 202 Ca -0.04 1.28 -0.26 0.00 0.43 0.00 0.00 52.55 53.97 3icc s ASP 202 Cb 0.14 -2.54 -0.23 0.00 -0.30 0.00 0.00 42.92 39.98 3icc s ASP 202 CO 0.54 -0.91 2.01 -0.81 -0.17 0.00 0.00 175.17 175.82 3icc n PRO 203 N 6.94 0.08 0.00 4.34 -0.04 -1.26 -4.70 135.00 140.36 3icc n PRO 203 Ca 0.13 -1.56 0.00 0.00 -0.04 0.00 0.00 63.50 62.04 3icc n PRO 203 Cb 0.46 -3.68 0.00 0.00 -0.04 0.00 0.00 33.50 30.24 3icc n PRO 203 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 3icc n LYS 206 N 7.90 0.00 -0.10 0.54 4.81 -1.26 -4.67 118.16 125.38 3icc n LYS 206 Ca 0.39 0.00 -0.06 0.00 -0.87 0.00 0.00 58.31 57.77 3icc n LYS 206 Cb 0.47 0.00 0.01 0.00 0.02 0.00 0.00 35.03 35.53 3icc n LYS 206 CO 0.00 0.00 0.00 0.37 1.17 0.00 0.00 177.40 178.94 3icc h GLN 207 N 0.00 0.06 -0.44 1.64 4.15 -1.94 0.58 115.11 119.16 3icc h GLN 207 Ca 0.00 -0.00 0.06 0.00 0.77 0.00 0.00 58.65 59.48 3icc h GLN 207 Cb 0.00 -0.01 -0.05 0.00 0.21 0.00 0.00 27.48 27.62 3icc h GLN 207 CO 0.00 0.04 0.12 -0.92 -1.93 0.00 0.00 178.83 176.14 3icc h TYR 208 N 0.06 0.21 -0.53 3.99 3.20 -1.96 -0.60 116.97 121.35 3icc h TYR 208 Ca 0.17 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 62.00 3icc h TYR 208 Cb 0.25 -0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.46 3icc h TYR 208 CO -0.28 0.06 0.05 0.00 -1.64 0.00 0.00 178.16 176.35 3icc h ALA 209 N 1.31 1.11 0.03 1.82 0.00 -1.33 -2.79 119.26 119.41 3icc h ALA 209 Ca 0.21 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 3icc h ALA 209 Cb 0.23 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.81 3icc h ALA 209 CO -0.24 0.58 -0.02 1.15 0.00 0.00 0.00 179.25 180.72 3icc h THR 210 N 0.80 1.37 0.00 0.00 2.02 0.30 -3.37 112.91 114.03 3icc h THR 210 Ca 0.16 -1.41 0.00 0.00 0.77 0.00 0.00 66.41 65.93 3icc h THR 210 Cb 0.40 2.30 0.00 0.00 -1.74 0.00 0.00 68.15 69.11 3icc h THR 210 CO 0.01 0.35 0.00 0.71 0.37 0.00 0.00 175.52 176.96 3icc h THR 211 N -0.68 0.00 0.00 3.16 1.35 -1.09 -3.04 112.91 112.61 3icc h THR 211 Ca -0.00 -0.57 -0.04 0.00 -0.55 0.00 0.00 66.41 65.25 3icc h THR 211 Cb 0.61 1.52 -0.01 0.00 -1.73 0.00 0.00 68.15 68.54 3icc h THR 211 CO 0.01 0.00 -0.17 0.16 -0.25 0.00 0.00 175.52 175.26 3icc h ILE 212 N 0.00 0.49 -3.76 6.82 3.07 -1.66 -3.44 117.51 119.03 3icc h ILE 212 Ca 0.00 -0.89 -0.51 0.00 1.55 0.00 0.00 64.86 65.01 3icc h ILE 212 Cb 0.70 1.61 0.02 0.00 -0.27 0.00 0.00 36.82 38.89 3icc h ILE 212 CO 0.00 0.17 0.51 -0.55 -1.05 0.00 0.00 178.15 177.23 3icc s SER 213 N -6.11 7.17 0.64 2.16 0.15 -1.15 -1.33 113.70 115.22 3icc s SER 213 Ca -0.00 2.32 0.36 0.00 0.70 0.00 0.00 55.95 59.33 3icc s SER 213 Cb 0.11 -2.63 2.00 0.00 -1.71 0.00 0.00 66.02 63.80 3icc s SER 213 CO 0.61 -0.24 2.21 0.00 1.20 0.00 0.00 173.24 177.02 3icc h ALA 214 N 4.00 1.35 -0.11 5.45 0.00 -0.01 -2.02 119.26 127.92 3icc h ALA 214 Ca -0.47 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.44 3icc h ALA 214 Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.01 3icc h ALA 214 CO 0.68 -0.13 0.00 1.19 0.00 0.00 0.00 179.25 180.99 3icc n PHE 215 N -3.35 0.12 -3.90 0.00 3.72 -1.24 -4.98 117.46 107.83 3icc n PHE 215 Ca -0.02 -0.06 -0.30 0.00 -0.05 0.00 0.00 57.45 57.03 3icc n PHE 215 Cb 0.19 0.00 0.03 0.00 -0.94 0.00 0.00 39.48 38.76 3icc n PHE 215 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 3icc n ASN 216 N 1.04 -4.66 -3.94 4.37 5.15 -0.76 -5.00 115.26 111.46 3icc n ASN 216 Ca 0.16 -0.78 -0.08 0.00 -0.60 0.00 0.00 54.58 53.28 3icc n ASN 216 Cb 0.53 -3.92 -0.08 0.00 -0.53 0.00 0.00 39.78 35.78 3icc n ASN 216 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3icc s ARG 217 N -6.59 0.74 0.60 1.20 1.70 -1.22 -4.86 118.95 110.53 3icc s ARG 217 Ca 0.63 -1.03 -0.18 0.00 -0.47 0.00 0.00 55.73 54.68 3icc s ARG 217 Cb -0.31 0.29 -0.03 0.00 -0.57 0.00 0.00 34.95 34.32 3icc s ARG 217 CO 0.83 -0.20 1.16 -0.51 -1.08 0.00 0.00 175.30 175.49 3icc s LEU 218 N -2.82 3.62 0.60 -1.89 1.43 -1.26 -4.77 118.68 113.59 3icc s LEU 218 Ca 0.05 2.23 -0.16 0.00 -1.03 0.00 0.00 54.13 55.23 3icc s LEU 218 Cb 0.05 -4.58 -0.03 0.00 0.03 0.00 0.00 46.19 41.66 3icc s LEU 218 CO -0.10 -1.51 1.07 -0.83 0.23 0.00 0.00 176.35 175.21 3icc s GLY 219 N -1.87 2.15 0.20 -3.19 0.00 -0.85 -4.94 107.32 98.81 3icc s GLY 219 Ca 0.73 0.43 0.10 0.00 0.00 0.00 0.00 44.72 45.99 3icc s GLY 219 CO 0.33 0.76 -0.16 -0.54 0.00 0.00 0.00 173.10 173.49 3icc s GLU 220 N -4.05 1.82 0.39 2.90 0.41 -1.26 -1.93 118.70 116.98 3icc s GLU 220 Ca 0.64 -1.44 0.12 0.00 -0.41 0.00 0.00 54.97 53.88 3icc s GLU 220 Cb -0.17 -1.99 0.93 0.00 -1.78 0.00 0.00 34.13 31.12 3icc s GLU 220 CO 0.37 0.40 1.91 -0.39 -0.49 0.00 0.00 175.26 177.06 3icc h VAL 221 N 2.81 0.84 -0.29 2.63 -1.51 -1.94 -1.49 116.25 117.31 3icc h VAL 221 Ca -0.46 -0.19 -0.01 0.00 -1.23 0.00 0.00 66.70 64.81 3icc h VAL 221 Cb 1.22 0.24 -0.02 0.00 -2.13 0.00 0.00 31.29 30.60 3icc h VAL 221 CO 0.53 0.10 0.12 -0.33 -1.23 0.00 0.00 177.57 176.76 3icc h GLU 222 N 0.56 0.40 -0.74 5.19 3.07 -1.95 -1.41 114.58 119.69 3icc h GLU 222 Ca 0.39 -0.04 -0.00 0.00 -0.50 0.00 0.00 59.36 59.20 3icc h GLU 222 Cb 0.71 -0.08 -0.04 0.00 -0.84 0.00 0.00 28.75 28.51 3icc h GLU 222 CO -0.15 0.33 0.46 -0.44 -1.40 0.00 0.00 179.01 177.82 3icc h ASP 223 N 0.40 0.87 0.01 1.42 3.32 -1.68 -0.38 116.42 120.39 3icc h ASP 223 Ca 0.10 -0.04 -0.10 0.00 0.02 0.00 0.00 57.03 57.01 3icc h ASP 223 Cb 0.08 -0.22 0.01 0.00 0.22 0.00 0.00 39.33 39.42 3icc h ASP 223 CO -0.01 0.66 -0.41 0.40 -1.72 0.00 0.00 179.24 178.16 3icc h ILE 224 N 1.01 1.51 -0.80 0.35 1.08 -1.40 -3.21 117.51 116.06 3icc h ILE 224 Ca 0.27 -2.06 0.03 0.00 -0.39 0.00 0.00 64.86 62.70 3icc h ILE 224 Cb -0.06 2.78 -0.04 0.00 -3.07 0.00 0.00 36.82 36.42 3icc h ILE 224 CO -0.05 0.58 0.53 0.00 -0.69 0.00 0.00 178.15 178.51 3icc h ALA 225 N 0.25 1.49 -0.14 1.87 0.00 -1.07 -1.20 119.26 120.46 3icc h ALA 225 Ca -0.05 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.70 3icc h ALA 225 Cb 1.17 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 3icc h ALA 225 CO 0.08 0.44 -0.41 -0.44 0.00 0.00 0.00 179.25 178.92 3icc h ASP 226 N 1.01 0.34 -0.18 0.00 3.32 -1.14 0.16 116.42 119.93 3icc h ASP 226 Ca 0.31 -0.15 -0.13 0.00 0.02 0.00 0.00 57.03 57.08 3icc h ASP 226 Cb -0.01 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.44 3icc h ASP 226 CO -0.08 0.72 -0.40 0.74 -1.72 0.00 0.00 179.24 178.50 3icc h THR 227 N 0.27 1.34 -0.89 0.35 2.02 -1.46 -3.22 112.91 111.32 3icc h THR 227 Ca 0.02 -1.65 0.11 0.00 0.77 0.00 0.00 66.41 65.67 3icc h THR 227 Cb 0.84 1.92 -0.07 0.00 -1.74 0.00 0.00 68.15 69.11 3icc h THR 227 CO 0.07 0.51 0.57 0.00 0.37 0.00 0.00 175.52 177.04 3icc h ALA 228 N 0.58 1.70 -0.93 6.16 0.00 -0.95 -2.21 119.26 123.61 3icc h ALA 228 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.92 3icc h ALA 228 Cb 1.01 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 18.57 3icc h ALA 228 CO 0.09 0.10 0.61 0.00 0.00 0.00 0.00 179.25 180.05 3icc h ALA 229 N 1.57 1.34 -0.01 0.00 0.00 -0.98 0.67 119.26 121.85 3icc h ALA 229 Ca 0.42 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.27 3icc h ALA 229 Cb 0.51 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 3icc h ALA 229 CO -0.19 0.61 0.00 0.35 0.00 0.00 0.00 179.25 180.02 3icc h PHE 230 N 1.25 0.03 -0.19 0.00 3.57 -1.44 -2.72 116.94 117.43 3icc h PHE 230 Ca 0.34 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.81 3icc h PHE 230 Cb -0.14 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.58 3icc h PHE 230 CO -0.00 0.27 0.01 -0.07 -2.23 0.00 0.00 178.31 176.29 3icc h LEU 231 N -0.23 0.25 -0.60 0.59 3.38 -1.11 -1.97 115.31 115.62 3icc h LEU 231 Ca 0.00 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.95 3icc h LEU 231 Cb 0.26 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.95 3icc h LEU 231 CO 0.00 0.30 0.00 0.00 0.09 0.00 0.00 178.44 178.83 3icc h ALA 232 N 1.74 1.00 -2.19 1.53 0.00 -0.82 -3.46 119.26 117.07 3icc h ALA 232 Ca 0.07 0.00 -0.47 0.00 0.00 0.00 0.00 54.91 54.50 3icc h ALA 232 Cb 0.17 0.00 0.02 0.00 0.00 0.00 0.00 17.79 17.99 3icc h ALA 232 CO 0.00 0.00 -0.08 -1.54 0.00 0.00 0.00 179.25 177.63 3icc s SER 233 N -4.66 6.08 0.51 0.00 1.04 -0.74 -4.90 113.70 111.03 3icc s SER 233 Ca 0.05 0.50 0.19 0.00 0.48 0.00 0.00 55.95 57.17 3icc s SER 233 Cb 0.10 -1.87 1.31 0.00 0.10 0.00 0.00 66.02 65.65 3icc s SER 233 CO 0.48 -0.54 2.12 -0.65 0.98 0.00 0.00 173.24 175.64 3icc h PRO 234 N 0.47 0.00 -0.47 4.02 0.11 -1.91 -2.85 132.00 131.37 3icc h PRO 234 Ca -0.48 0.00 0.14 0.00 0.11 0.00 0.00 66.00 65.77 3icc h PRO 234 Cb 1.23 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.32 3icc h PRO 234 CO 0.60 0.06 0.50 -0.44 -0.21 0.00 0.00 178.00 178.51 3icc h ASP 235 N 0.00 0.00 -0.52 -2.05 3.32 -1.95 -2.53 116.42 112.69 3icc h ASP 235 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3icc h ASP 235 Cb 0.12 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.67 3icc h ASP 235 CO 0.01 0.00 0.00 -1.54 -1.72 0.00 0.00 179.24 175.99 3icc n SER 236 N -3.71 5.05 0.33 6.45 3.41 -1.08 -4.64 113.62 119.43 3icc n SER 236 Ca 0.09 -2.76 0.21 0.00 -0.26 0.00 0.00 58.87 56.16 3icc n SER 236 Cb 0.69 -0.65 1.16 0.00 -0.26 0.00 0.00 64.21 65.15 3icc n SER 236 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 175.04 174.96 3icc h ARG 237 N 3.54 0.00 -0.39 4.33 0.11 -1.66 -1.70 114.38 118.61 3icc h ARG 237 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3icc h ARG 237 Cb 1.74 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.82 3icc h ARG 237 CO 0.40 0.00 0.00 1.87 0.10 0.00 0.00 179.97 182.34 3icc n TRP 238 N -3.21 0.51 -3.76 4.08 -0.00 -1.26 -4.80 117.44 109.00 3icc n TRP 238 Ca -0.03 -0.30 -0.38 0.00 -0.00 0.00 0.00 57.50 56.80 3icc n TRP 238 Cb 0.09 -0.00 -0.12 0.00 -0.00 0.00 0.00 31.31 31.27 3icc n TRP 238 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 177.69 177.77 3icc s VAL 239 N -1.29 3.82 0.04 5.87 1.01 -0.64 -5.08 120.40 124.13 3icc s VAL 239 Ca 0.35 -0.99 -0.07 0.00 0.00 0.00 0.00 61.98 61.28 3icc s VAL 239 Cb 0.20 -3.10 -0.01 0.00 0.00 0.00 0.00 36.38 33.48 3icc s VAL 239 CO 0.28 -0.09 0.13 0.28 0.00 0.00 0.00 175.10 175.70 3icc s THR 240 N 1.43 0.12 -0.18 3.92 -1.32 -1.26 -4.71 115.64 113.65 3icc s THR 240 Ca -0.00 -1.01 0.00 0.00 -1.21 0.00 0.00 61.69 59.46 3icc s THR 240 Cb -0.19 -0.88 0.00 0.00 -1.51 0.00 0.00 72.50 69.93 3icc s THR 240 CO 0.03 -0.56 0.00 0.61 -2.21 0.00 0.00 174.62 172.49 3icc n GLY 241 N 0.78 0.50 3.88 6.08 0.00 0.13 -4.96 105.19 111.60 3icc n GLY 241 Ca -0.19 -0.24 -0.32 0.00 0.00 0.00 0.00 46.02 45.27 3icc n GLY 241 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3icc s GLN 242 N -1.11 3.74 -0.37 1.61 -1.52 -1.25 -4.41 119.66 116.35 3icc s GLN 242 Ca 0.00 0.17 0.00 0.00 -1.95 0.00 0.00 55.36 53.58 3icc s GLN 242 Cb 0.00 -2.69 0.10 0.00 -0.22 0.00 0.00 33.01 30.20 3icc s GLN 242 CO 0.00 0.34 0.13 -0.51 -0.25 0.00 0.00 175.29 175.00 3icc s LEU 243 N -2.85 4.97 -0.30 2.90 1.43 -1.26 -1.01 118.68 122.55 3icc s LEU 243 Ca 0.46 -2.04 -0.16 0.00 -1.03 0.00 0.00 54.13 51.35 3icc s LEU 243 Cb -0.11 -1.74 -0.02 0.00 0.03 0.00 0.00 46.19 44.35 3icc s LEU 243 CO 0.23 -0.46 0.43 -0.63 0.23 0.00 0.00 176.35 176.15 3icc s ILE 244 N 1.04 5.11 -0.01 -0.59 -1.09 -0.12 -4.93 121.20 120.62 3icc s ILE 244 Ca 0.09 0.46 -0.30 0.00 -2.23 0.00 0.00 60.65 58.67 3icc s ILE 244 Cb -0.21 -3.81 -0.04 0.00 -1.58 0.00 0.00 42.46 36.81 3icc s ILE 244 CO -0.06 -0.00 1.22 -0.62 -1.23 0.00 0.00 174.94 174.25 3icc s ASP 245 N 1.68 7.05 -0.51 3.58 2.15 -1.26 -0.77 116.67 128.58 3icc s ASP 245 Ca 0.16 1.90 0.07 0.00 0.43 0.00 0.00 52.55 55.12 3icc s ASP 245 Cb -0.16 -2.57 0.28 0.00 -0.30 0.00 0.00 42.92 40.18 3icc s ASP 245 CO 0.11 -0.55 0.71 0.52 -0.17 0.00 0.00 175.17 175.78 3icc n VAL 246 N 4.39 1.13 -0.04 1.11 0.31 -0.54 -4.84 118.33 119.85 3icc n VAL 246 Ca 0.10 -4.80 0.00 0.00 -0.01 0.00 0.00 64.34 59.63 3icc n VAL 246 Cb 0.46 -1.67 0.00 0.00 -0.91 0.00 0.00 33.84 31.72 3icc n VAL 246 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 3icc n SER 247 N 0.76 1.63 -3.17 4.52 3.41 -1.26 -2.67 113.62 116.84 3icc n SER 247 Ca 0.27 -1.67 -0.18 0.00 -0.26 0.00 0.00 58.87 57.02 3icc n SER 247 Cb 0.48 0.00 0.07 0.00 -0.26 0.00 0.00 64.21 64.51 3icc n SER 247 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3icc n GLY 248 N -0.34 -0.31 3.75 5.00 0.00 -1.26 -3.08 105.19 108.95 3icc n GLY 248 Ca 0.00 0.09 -0.22 0.00 0.00 0.00 0.00 46.02 45.89 3icc n GLY 248 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3icc n GLY 249 N -1.51 -0.29 3.72 -0.02 0.00 -1.26 -0.79 105.19 105.04 3icc n GLY 249 Ca -0.11 0.13 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 3icc n GLY 249 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3icc s SER 250 N -4.29 7.16 -1.37 1.61 0.01 -1.18 -1.65 113.70 113.98 3icc s SER 250 Ca 0.05 2.03 -0.05 0.00 1.31 0.00 0.00 55.95 59.29 3icc s SER 250 Cb -0.02 -2.59 0.03 0.00 0.21 0.00 0.00 66.02 63.64 3icc s SER 250 CO 0.82 -0.37 0.82 0.00 0.41 0.00 0.00 173.24 174.93