#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i0w s THR 2 N 0.00 5.29 -0.14 0.00 2.01 -1.26 0.16 115.64 121.70 2i0w s THR 2 Ca 0.00 0.52 0.02 0.00 0.31 0.00 0.00 61.69 62.54 2i0w s THR 2 Cb 0.00 -3.63 0.01 0.00 0.01 0.00 0.00 72.50 68.89 2i0w s THR 2 CO 0.00 0.35 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.46 2i0w s ILE 3 N 0.75 1.84 -0.23 1.82 1.01 -0.30 -1.22 121.20 124.86 2i0w s ILE 3 Ca 0.16 -0.84 -0.07 0.00 0.00 0.00 0.00 60.65 59.90 2i0w s ILE 3 Cb -0.13 -1.66 -0.03 0.00 0.01 0.00 0.00 42.46 40.65 2i0w s ILE 3 CO 0.05 0.51 0.07 -0.70 0.00 0.00 0.00 174.94 174.86 2i0w s GLU 4 N 1.02 3.74 -0.24 2.79 2.12 0.33 -1.12 118.70 127.33 2i0w s GLU 4 Ca -0.04 -0.45 -0.07 0.00 0.36 0.00 0.00 54.97 54.78 2i0w s GLU 4 Cb -0.15 -3.29 -0.03 0.00 0.26 0.00 0.00 34.13 30.93 2i0w s GLU 4 CO -0.05 -0.06 0.05 0.08 -0.54 0.00 0.00 175.26 174.74 2i0w s VAL 5 N 1.28 4.20 -0.11 3.70 1.01 0.16 0.18 120.40 130.83 2i0w s VAL 5 Ca 0.05 -0.21 0.02 0.00 0.00 0.00 0.00 61.98 61.84 2i0w s VAL 5 Cb -0.15 -2.95 0.01 0.00 0.00 0.00 0.00 36.38 33.30 2i0w s VAL 5 CO 0.03 0.36 -0.17 -0.60 0.00 0.00 0.00 175.10 174.73 2i0w s ARG 6 N 1.48 2.38 -0.50 2.72 3.52 0.24 0.10 118.95 128.89 2i0w s ARG 6 Ca 0.06 -0.62 -0.18 0.00 -0.13 0.00 0.00 55.73 54.85 2i0w s ARG 6 Cb -0.15 -1.97 0.06 0.00 -1.56 0.00 0.00 34.95 31.33 2i0w s ARG 6 CO 0.03 -0.03 0.59 1.21 -0.81 0.00 0.00 175.30 176.28 2i0w s ASN 7 N 0.88 6.21 -0.03 -2.12 2.47 -0.83 -0.86 114.94 120.66 2i0w s ASN 7 Ca -0.08 -1.01 0.20 0.00 0.42 0.00 0.00 52.86 52.38 2i0w s ASN 7 Cb -0.15 -2.27 0.60 0.00 -1.45 0.00 0.00 41.25 37.98 2i0w s ASN 7 CO -0.00 -0.86 1.51 -3.20 -3.72 0.00 0.00 177.10 170.83 2i0w n ASN 8 N 5.99 3.94 -4.82 -4.21 5.15 -0.44 0.47 115.26 121.34 2i0w n ASN 8 Ca -0.08 -2.11 -0.33 0.00 -0.60 0.00 0.00 54.58 51.47 2i0w n ASN 8 Cb 0.45 -0.46 -0.04 0.00 -0.53 0.00 0.00 39.78 39.19 2i0w n ASN 8 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2i0w n PRO 10 N -1.10 0.05 -4.32 0.00 -0.04 -1.26 -4.33 135.00 124.01 2i0w n PRO 10 Ca 0.08 0.27 -0.24 0.00 -0.04 0.00 0.00 63.50 63.57 2i0w n PRO 10 Cb 0.53 -1.59 -0.08 0.00 -0.04 0.00 0.00 33.50 32.32 2i0w n PRO 10 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 2i0w s TYR 11 N -3.08 2.57 0.40 0.54 -0.85 -1.26 -4.83 117.35 110.84 2i0w s TYR 11 Ca 0.07 -0.38 -0.25 0.00 -0.52 0.00 0.00 57.07 55.99 2i0w s TYR 11 Cb 0.10 -1.40 -0.08 0.00 0.38 0.00 0.00 41.96 40.95 2i0w s TYR 11 CO 0.32 0.51 1.16 0.99 -1.52 0.00 0.00 175.55 177.02 2i0w s THR 12 N -2.47 3.18 -0.03 -3.49 2.01 -1.26 -4.40 115.64 109.17 2i0w s THR 12 Ca 0.34 0.99 0.02 0.00 0.31 0.00 0.00 61.69 63.34 2i0w s THR 12 Cb -0.02 -3.55 0.01 0.00 0.01 0.00 0.00 72.50 68.95 2i0w s THR 12 CO 0.19 0.09 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.46 2i0w s VAL 13 N -1.42 0.61 -0.72 3.82 1.01 0.06 -4.71 120.40 119.06 2i0w s VAL 13 Ca 0.57 -0.23 -0.16 0.00 0.00 0.00 0.00 61.98 62.16 2i0w s VAL 13 Cb -0.30 -0.58 0.16 0.00 0.00 0.00 0.00 36.38 35.66 2i0w s VAL 13 CO 0.38 0.21 0.74 0.26 0.00 0.00 0.00 175.10 176.69 2i0w s TRP 14 N 0.47 3.38 0.47 5.22 0.51 -0.32 0.02 118.94 128.69 2i0w s TRP 14 Ca -0.06 -1.51 -0.24 0.00 -2.12 0.00 0.00 56.10 52.16 2i0w s TRP 14 Cb -0.10 -3.92 -0.07 0.00 -0.81 0.00 0.00 33.47 28.56 2i0w s TRP 14 CO 0.00 -1.13 1.32 0.00 -0.51 0.00 0.00 176.95 176.63 2i0w s ALA 15 N 1.41 3.05 0.03 0.98 0.00 -0.07 -1.29 121.76 125.88 2i0w s ALA 15 Ca 0.15 1.25 0.03 0.00 0.00 0.00 0.00 51.96 53.39 2i0w s ALA 15 Cb -0.17 -3.51 -0.02 0.00 0.00 0.00 0.00 23.12 19.41 2i0w s ALA 15 CO -0.03 -1.04 -0.10 0.00 0.00 0.00 0.00 175.76 174.59 2i0w s ALA 16 N -1.32 0.79 -0.17 0.00 0.00 0.29 -1.35 121.76 120.01 2i0w s ALA 16 Ca 0.64 -0.70 -0.08 0.00 0.00 0.00 0.00 51.96 51.81 2i0w s ALA 16 Cb -0.38 -0.07 0.07 0.00 0.00 0.00 0.00 23.12 22.74 2i0w s ALA 16 CO 0.47 0.10 0.40 0.45 0.00 0.00 0.00 175.76 177.18 2i0w s SER 17 N -1.17 -0.40 0.09 0.00 0.15 0.58 -1.79 113.70 111.16 2i0w s SER 17 Ca -0.03 0.89 0.04 0.00 0.70 0.00 0.00 55.95 57.55 2i0w s SER 17 Cb -0.08 0.89 -0.03 0.00 -1.71 0.00 0.00 66.02 65.09 2i0w s SER 17 CO 0.01 -0.20 -0.12 0.42 1.20 0.00 0.00 173.24 174.54 2i0w s THR 18 N 1.74 1.03 -1.79 6.45 -4.23 -0.62 -0.89 115.64 117.33 2i0w s THR 18 Ca -0.07 -1.50 0.29 0.00 -1.18 0.00 0.00 61.69 59.23 2i0w s THR 18 Cb -0.10 -1.23 0.55 0.00 1.34 0.00 0.00 72.50 73.07 2i0w s THR 18 CO -0.12 -0.41 1.93 -0.81 -0.54 0.00 0.00 174.62 174.67 2i0w n PRO 19 N 0.86 0.83 -4.71 3.99 -0.04 -1.26 -0.85 135.00 133.83 2i0w n PRO 19 Ca -0.18 -0.25 -0.29 0.00 -0.04 0.00 0.00 63.50 62.74 2i0w n PRO 19 Cb 0.56 -1.49 -0.14 0.00 -0.04 0.00 0.00 33.50 32.39 2i0w n PRO 19 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 2i0w s ILE 20 N -2.34 2.06 0.00 0.52 -5.25 -1.26 -4.84 121.20 110.09 2i0w s ILE 20 Ca 0.33 -1.45 0.00 0.00 -0.99 0.00 0.00 60.65 58.55 2i0w s ILE 20 Cb 0.21 -1.79 0.00 0.00 2.95 0.00 0.00 42.46 43.83 2i0w s ILE 20 CO 0.44 0.25 0.00 0.61 -1.79 0.00 0.00 174.94 174.45 2i0w n GLY 21 N 1.56 2.39 0.46 6.27 0.00 -1.26 -4.70 105.19 109.92 2i0w n GLY 21 Ca -0.17 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.05 2i0w n GLY 21 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2i0w n GLY 22 N 0.00 0.99 3.25 -0.02 0.00 -0.07 -4.91 105.19 104.43 2i0w n GLY 22 Ca 0.00 -1.05 -0.10 0.00 0.00 0.00 0.00 46.02 44.87 2i0w n GLY 22 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2i0w s GLY 23 N 0.00 -0.08 -0.28 -0.02 0.00 -1.25 -0.31 107.32 105.39 2i0w s GLY 23 Ca 0.00 -0.26 -0.21 0.00 0.00 0.00 0.00 44.72 44.26 2i0w s GLY 23 CO 0.00 -0.47 0.81 -1.60 0.00 0.00 0.00 173.10 171.83 2i0w s ARG 24 N -3.39 0.66 0.05 2.90 6.06 -0.45 -4.74 118.95 120.03 2i0w s ARG 24 Ca 0.01 0.95 -0.30 0.00 -2.50 0.00 0.00 55.73 53.89 2i0w s ARG 24 Cb 0.02 0.24 -0.05 0.00 0.06 0.00 0.00 34.95 35.22 2i0w s ARG 24 CO -0.09 -0.11 1.14 0.50 -2.50 0.00 0.00 175.30 174.24 2i0w s ARG 25 N 0.93 4.47 -0.20 5.12 3.52 -1.26 -0.89 118.95 130.65 2i0w s ARG 25 Ca -0.04 1.67 0.00 0.00 -0.13 0.00 0.00 55.73 57.23 2i0w s ARG 25 Cb -0.05 -3.38 0.05 0.00 -1.56 0.00 0.00 34.95 30.01 2i0w s ARG 25 CO -0.10 -0.19 -0.07 -0.51 -0.81 0.00 0.00 175.30 173.62 2i0w s LEU 26 N 1.02 2.11 0.65 -0.88 1.43 0.10 -4.93 118.68 118.18 2i0w s LEU 26 Ca 0.57 -0.89 -0.07 0.00 -1.03 0.00 0.00 54.13 52.70 2i0w s LEU 26 Cb -0.27 -1.09 0.03 0.00 0.03 0.00 0.00 46.19 44.89 2i0w s LEU 26 CO 0.29 -0.19 0.97 0.20 0.23 0.00 0.00 176.35 177.85 2i0w s ASN 27 N 1.49 5.22 -0.06 2.29 0.01 -1.26 -0.76 114.94 121.88 2i0w s ASN 27 Ca -0.02 0.64 -0.39 0.00 -0.71 0.00 0.00 52.86 52.38 2i0w s ASN 27 Cb -0.17 -1.46 -0.17 0.00 0.41 0.00 0.00 41.25 39.86 2i0w s ASN 27 CO -0.07 -1.33 1.40 -1.14 -1.51 0.00 0.00 177.10 174.44 2i0w n ARG 28 N -2.78 0.84 0.00 -0.60 0.63 -1.26 -1.08 116.66 112.41 2i0w n ARG 28 Ca 0.06 0.31 0.00 0.00 -0.92 0.00 0.00 57.85 57.30 2i0w n ARG 28 Cb 0.59 -1.92 0.00 0.00 0.45 0.00 0.00 32.46 31.58 2i0w n ARG 28 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2i0w n GLY 29 N 2.83 2.34 3.81 5.14 0.00 0.18 -5.03 105.19 114.46 2i0w n GLY 29 Ca 0.22 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.90 2i0w n GLY 29 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2i0w s GLN 30 N -0.26 4.10 0.14 1.61 -0.21 -0.24 -4.81 119.66 119.99 2i0w s GLN 30 Ca 0.00 1.22 0.09 0.00 0.02 0.00 0.00 55.36 56.70 2i0w s GLN 30 Cb 0.00 -2.19 -0.04 0.00 1.00 0.00 0.00 33.01 31.78 2i0w s GLN 30 CO 0.00 -0.16 -0.21 0.99 -2.12 0.00 0.00 175.29 173.79 2i0w s THR 31 N -2.07 1.93 -0.07 -0.19 2.01 -1.26 -1.97 115.64 114.02 2i0w s THR 31 Ca 0.63 -1.77 -0.01 0.00 0.31 0.00 0.00 61.69 60.85 2i0w s THR 31 Cb -0.12 -1.80 0.03 0.00 0.01 0.00 0.00 72.50 70.61 2i0w s THR 31 CO 0.16 -0.13 -0.01 0.86 -0.69 0.00 0.00 174.62 174.82 2i0w s TRP 32 N -1.50 0.72 -0.20 4.92 -0.00 0.11 -4.97 118.94 118.01 2i0w s TRP 32 Ca 0.13 -0.20 -0.04 0.00 -0.00 0.00 0.00 56.10 55.99 2i0w s TRP 32 Cb -0.08 -0.80 -0.01 0.00 -0.00 0.00 0.00 33.47 32.57 2i0w s TRP 32 CO 0.06 -0.32 -0.04 0.08 -0.00 0.00 0.00 176.95 176.73 2i0w s VAL 33 N 1.80 3.49 0.11 5.86 1.01 -1.26 0.40 120.40 131.81 2i0w s VAL 33 Ca 0.03 -0.47 0.09 0.00 0.00 0.00 0.00 61.98 61.63 2i0w s VAL 33 Cb -0.13 -2.57 -0.04 0.00 0.00 0.00 0.00 36.38 33.65 2i0w s VAL 33 CO -0.05 0.44 -0.22 0.27 0.00 0.00 0.00 175.10 175.54 2i0w s ILE 34 N 1.22 1.86 -0.18 2.22 -4.36 -0.28 -4.99 121.20 116.69 2i0w s ILE 34 Ca 0.03 -1.61 -0.13 0.00 -0.26 0.00 0.00 60.65 58.68 2i0w s ILE 34 Cb -0.14 -1.68 -0.05 0.00 1.25 0.00 0.00 42.46 41.84 2i0w s ILE 34 CO -0.01 -0.02 0.26 0.21 0.24 0.00 0.00 174.94 175.62 2i0w s ASN 35 N -1.96 6.35 -0.26 4.36 2.47 -1.26 -1.15 114.94 123.49 2i0w s ASN 35 Ca 0.09 0.41 0.02 0.00 0.42 0.00 0.00 52.86 53.79 2i0w s ASN 35 Cb -0.10 -2.16 0.05 0.00 -1.45 0.00 0.00 41.25 37.59 2i0w s ASN 35 CO 0.05 0.08 -0.10 0.00 -3.72 0.00 0.00 177.10 173.41 2i0w s ALA 36 N 0.65 2.60 0.70 1.71 0.00 0.41 -4.93 121.76 122.90 2i0w s ALA 36 Ca 0.14 -1.69 -0.14 0.00 0.00 0.00 0.00 51.96 50.27 2i0w s ALA 36 Cb -0.13 -1.62 0.02 0.00 0.00 0.00 0.00 23.12 21.40 2i0w s ALA 36 CO 0.03 -1.10 1.13 -2.14 0.00 0.00 0.00 175.76 173.68 2i0w s PRO 37 N 1.16 2.49 0.40 0.00 0.02 -1.26 -4.31 135.00 133.50 2i0w s PRO 37 Ca -0.06 1.44 -0.27 0.00 0.02 0.00 0.00 61.00 62.12 2i0w s PRO 37 Cb -0.19 -1.91 -0.10 0.00 0.02 0.00 0.00 34.50 32.32 2i0w s PRO 37 CO -0.05 -1.50 1.48 0.50 -0.33 0.00 0.00 177.00 177.10 2i0w s ARG 38 N -4.21 3.99 0.00 5.54 6.06 -1.26 -2.10 118.95 126.96 2i0w s ARG 38 Ca 0.67 2.55 0.00 0.00 -2.50 0.00 0.00 55.73 56.45 2i0w s ARG 38 Cb -0.22 -2.88 0.00 0.00 0.06 0.00 0.00 34.95 31.91 2i0w s ARG 38 CO 0.45 -0.62 0.00 0.41 -2.50 0.00 0.00 175.30 173.04 2i0w n GLY 39 N 0.48 0.50 3.65 8.12 0.00 0.14 -4.96 105.19 113.12 2i0w n GLY 39 Ca 0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.61 2i0w n GLY 39 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2i0w s THR 40 N -2.21 4.05 0.30 2.61 2.01 -0.89 -4.85 115.64 116.66 2i0w s THR 40 Ca 0.00 1.25 0.08 0.00 0.31 0.00 0.00 61.69 63.33 2i0w s THR 40 Cb 0.00 -3.88 -0.06 0.00 0.01 0.00 0.00 72.50 68.57 2i0w s THR 40 CO 0.00 -0.19 -0.07 -1.59 -0.69 0.00 0.00 174.62 172.08 2i0w s LYS 41 N 3.85 1.65 -1.63 4.92 -2.85 -1.26 -0.47 119.74 123.95 2i0w s LYS 41 Ca 0.61 -1.84 -0.15 0.00 -1.00 0.00 0.00 55.97 53.58 2i0w s LYS 41 Cb -0.24 -1.35 0.12 0.00 -2.06 0.00 0.00 37.83 34.30 2i0w s LYS 41 CO 0.21 0.07 0.77 -1.33 0.10 0.00 0.00 175.35 175.17 2i0w n MET 42 N -0.66 -3.62 -3.63 1.78 2.81 -1.24 -4.82 117.12 107.73 2i0w n MET 42 Ca -0.05 0.42 -0.29 0.00 -1.81 0.00 0.00 57.70 55.96 2i0w n MET 42 Cb 0.63 -5.08 -0.04 0.00 -0.71 0.00 0.00 33.22 28.02 2i0w n MET 42 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2i0w s ALA 43 N -3.39 3.78 -0.04 3.04 0.00 -1.03 -4.66 121.76 119.46 2i0w s ALA 43 Ca 0.61 -0.67 -0.15 0.00 0.00 0.00 0.00 51.96 51.75 2i0w s ALA 43 Cb -0.33 -2.10 0.03 0.00 0.00 0.00 0.00 23.12 20.72 2i0w s ALA 43 CO 0.90 0.50 0.33 -0.98 0.00 0.00 0.00 175.76 176.52 2i0w s ARG 44 N -3.08 0.63 -0.02 0.00 1.70 -0.02 -2.34 118.95 115.82 2i0w s ARG 44 Ca 0.40 -0.04 0.05 0.00 -0.47 0.00 0.00 55.73 55.68 2i0w s ARG 44 Cb -0.11 0.29 -0.01 0.00 -0.57 0.00 0.00 34.95 34.54 2i0w s ARG 44 CO 0.27 -0.16 -0.18 0.42 -1.08 0.00 0.00 175.30 174.57 2i0w s ILE 45 N -1.02 1.41 0.30 4.99 1.01 -0.41 -1.59 121.20 125.88 2i0w s ILE 45 Ca -0.11 -0.75 -0.13 0.00 0.00 0.00 0.00 60.65 59.67 2i0w s ILE 45 Cb -0.05 -1.18 0.01 0.00 0.01 0.00 0.00 42.46 41.26 2i0w s ILE 45 CO 0.04 0.40 0.59 -1.66 0.00 0.00 0.00 174.94 174.31 2i0w s TRP 46 N -0.29 0.35 0.17 3.97 -2.14 -0.74 -1.37 118.94 118.89 2i0w s TRP 46 Ca 0.04 -0.77 0.11 0.00 2.66 0.00 0.00 56.10 58.14 2i0w s TRP 46 Cb -0.08 0.37 -0.04 0.00 -3.10 0.00 0.00 33.47 30.62 2i0w s TRP 46 CO 0.00 -1.19 -0.23 0.20 -2.66 0.00 0.00 176.95 173.07 2i0w s GLY 47 N -3.05 1.68 -0.03 3.67 0.00 -1.26 -0.55 107.32 107.78 2i0w s GLY 47 Ca 0.20 -1.57 0.07 0.00 0.00 0.00 0.00 44.72 43.42 2i0w s GLY 47 CO 0.11 -1.58 -0.23 0.50 0.00 0.00 0.00 173.10 171.90 2i0w s ARG 48 N -2.52 2.06 0.21 2.90 0.52 -0.41 -4.64 118.95 117.06 2i0w s ARG 48 Ca 0.20 -0.84 0.09 0.00 -0.52 0.00 0.00 55.73 54.65 2i0w s ARG 48 Cb -0.09 -1.91 -0.04 0.00 0.52 0.00 0.00 34.95 33.44 2i0w s ARG 48 CO 0.10 0.46 -0.05 0.95 0.02 0.00 0.00 175.30 176.77 2i0w s THR 49 N -0.42 3.33 -1.21 0.02 -4.23 -1.23 -1.18 115.64 110.73 2i0w s THR 49 Ca 0.05 -1.73 -0.11 0.00 -1.18 0.00 0.00 61.69 58.72 2i0w s THR 49 Cb -0.10 -2.70 -0.01 0.00 1.34 0.00 0.00 72.50 71.02 2i0w s THR 49 CO 0.00 -0.21 0.73 0.61 -0.54 0.00 0.00 174.62 175.22 2i0w n GLY 50 N -0.31 -0.73 3.94 3.99 0.00 -1.26 -1.10 105.19 109.72 2i0w n GLY 50 Ca -0.09 0.35 -0.26 0.00 0.00 0.00 0.00 46.02 46.01 2i0w n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2i0w s ASN 52 N -3.25 2.84 0.05 0.00 3.84 0.05 -4.98 114.94 113.50 2i0w s ASN 52 Ca 0.35 -1.95 0.01 0.00 0.21 0.00 0.00 52.86 51.48 2i0w s ASN 52 Cb -0.11 -0.27 -0.04 0.00 -0.55 0.00 0.00 41.25 40.28 2i0w s ASN 52 CO 0.29 -0.33 0.11 -0.36 -2.79 0.00 0.00 177.10 174.02 2i0w s PHE 53 N 1.30 3.29 0.36 0.43 0.08 -1.26 -2.93 117.98 119.25 2i0w s PHE 53 Ca 0.16 0.15 0.07 0.00 0.12 0.00 0.00 56.93 57.44 2i0w s PHE 53 Cb -0.21 -1.69 -0.02 0.00 -0.57 0.00 0.00 43.02 40.53 2i0w s PHE 53 CO -0.06 0.55 0.35 0.54 -0.10 0.00 0.00 175.22 176.50 2i0w s ASN 54 N -2.24 5.35 0.29 1.36 6.03 0.40 -4.93 114.94 121.20 2i0w s ASN 54 Ca 0.29 -0.51 0.20 0.00 -1.03 0.00 0.00 52.86 51.81 2i0w s ASN 54 Cb -0.12 -0.89 1.02 0.00 -3.03 0.00 0.00 41.25 38.22 2i0w s ASN 54 CO 0.21 -0.46 1.11 0.00 -2.03 0.00 0.00 177.10 175.93 2i0w n ALA 55 N -1.48 0.88 1.92 3.54 0.00 -1.26 -0.22 120.51 123.89 2i0w n ALA 55 Ca 0.00 0.65 0.15 0.00 0.00 0.00 0.00 53.44 54.24 2i0w n ALA 55 Cb 0.60 -0.74 0.82 0.00 0.00 0.00 0.00 19.45 20.13 2i0w n ALA 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2i0w n ALA 56 N -2.52 2.66 -1.10 0.00 0.00 -1.26 -4.88 120.51 113.40 2i0w n ALA 56 Ca 0.28 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.50 2i0w n ALA 56 Cb 1.04 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 19.05 2i0w n ALA 56 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2i0w n GLY 57 N 0.99 0.57 3.38 0.00 0.00 0.69 -4.95 105.19 105.87 2i0w n GLY 57 Ca 0.22 -0.82 -0.31 0.00 0.00 0.00 0.00 46.02 45.10 2i0w n GLY 57 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2i0w s ARG 58 N -2.27 2.15 0.00 1.61 0.52 -1.24 -0.63 118.95 119.08 2i0w s ARG 58 Ca 0.00 -0.91 0.00 0.00 -0.52 0.00 0.00 55.73 54.30 2i0w s ARG 58 Cb 0.00 -2.14 0.00 0.00 0.52 0.00 0.00 34.95 33.33 2i0w s ARG 58 CO 0.00 0.56 0.00 0.41 0.02 0.00 0.00 175.30 176.29 2i0w n GLY 59 N 2.14 -0.62 3.29 -3.53 0.00 -0.71 -0.45 105.19 105.31 2i0w n GLY 59 Ca -0.16 -0.58 -0.12 0.00 0.00 0.00 0.00 46.02 45.16 2i0w n GLY 59 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2i0w s THR 60 N -3.97 0.07 0.16 2.61 -1.32 -1.15 -4.21 115.64 107.82 2i0w s THR 60 Ca 0.00 -0.56 0.09 0.00 -1.21 0.00 0.00 61.69 60.01 2i0w s THR 60 Cb 0.00 -0.93 -0.04 0.00 -1.51 0.00 0.00 72.50 70.02 2i0w s THR 60 CO 0.00 -0.31 -0.21 0.00 -2.21 0.00 0.00 174.62 171.89 2i0w h GLN 62 N 3.43 0.43 -4.07 0.00 4.15 -0.43 -3.42 115.11 115.21 2i0w h GLN 62 Ca -0.45 -0.33 -0.22 0.00 0.77 0.00 0.00 58.65 58.42 2i0w h GLN 62 Cb 1.20 0.06 -0.23 0.00 0.21 0.00 0.00 27.48 28.72 2i0w h GLN 62 CO 0.47 0.96 -0.72 0.95 -1.93 0.00 0.00 178.83 178.56 2i0w s THR 63 N -3.72 0.20 -1.71 2.39 -4.23 -1.18 -4.88 115.64 102.51 2i0w s THR 63 Ca -0.06 -0.66 0.00 0.00 -1.18 0.00 0.00 61.69 59.79 2i0w s THR 63 Cb 0.11 -0.28 0.00 0.00 1.34 0.00 0.00 72.50 73.67 2i0w s THR 63 CO 0.84 -0.30 0.00 0.61 -0.54 0.00 0.00 174.62 175.23 2i0w n GLY 64 N 2.06 1.33 3.75 3.99 0.00 -0.04 -3.47 105.19 112.81 2i0w n GLY 64 Ca -0.20 -0.22 -0.41 0.00 0.00 0.00 0.00 46.02 45.19 2i0w n GLY 64 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2i0w s ASP 65 N -2.73 6.49 -0.61 1.61 2.15 -1.25 -3.91 116.67 118.42 2i0w s ASP 65 Ca 0.00 2.83 0.03 0.00 0.43 0.00 0.00 52.55 55.84 2i0w s ASP 65 Cb 0.00 -2.63 0.38 0.00 -0.30 0.00 0.00 42.92 40.37 2i0w s ASP 65 CO 0.00 -0.82 1.34 0.00 -0.17 0.00 0.00 175.17 175.52 2i0w n GLY 67 N -0.41 1.35 2.61 0.00 0.00 -1.26 -4.28 105.19 103.19 2i0w n GLY 67 Ca 0.41 -0.35 -0.19 0.00 0.00 0.00 0.00 46.02 45.90 2i0w n GLY 67 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2i0w n GLY 68 N -0.99 -0.50 3.20 -0.02 0.00 -1.26 -4.98 105.19 100.64 2i0w n GLY 68 Ca 0.00 0.03 -0.22 0.00 0.00 0.00 0.00 46.02 45.84 2i0w n GLY 68 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2i0w s VAL 69 N -2.92 1.34 0.07 1.61 -7.23 -1.26 -1.73 120.40 110.28 2i0w s VAL 69 Ca 0.09 -1.21 -0.17 0.00 -1.81 0.00 0.00 61.98 58.88 2i0w s VAL 69 Cb -0.04 -1.22 -0.11 0.00 0.56 0.00 0.00 36.38 35.57 2i0w s VAL 69 CO 0.11 -0.02 1.39 0.25 -0.31 0.00 0.00 175.10 176.52 2i0w h LEU 70 N 4.62 0.58 -7.94 1.32 7.12 -1.24 -3.39 115.31 116.37 2i0w h LEU 70 Ca -0.41 -0.47 -0.77 0.00 0.13 0.00 0.00 57.88 56.36 2i0w h LEU 70 Cb 1.18 -0.16 -0.26 0.00 -0.53 0.00 0.00 40.66 40.89 2i0w h LEU 70 CO 0.42 0.93 -0.08 -1.10 -0.13 0.00 0.00 178.44 178.48 2i0w s GLN 71 N -4.35 3.25 0.61 1.25 -0.21 -1.26 -3.86 119.66 115.08 2i0w s GLN 71 Ca -0.13 -2.10 -0.19 0.00 0.02 0.00 0.00 55.36 52.96 2i0w s GLN 71 Cb 0.07 -4.33 -0.03 0.00 1.00 0.00 0.00 33.01 29.72 2i0w s GLN 71 CO 0.79 -1.30 1.19 0.00 -2.12 0.00 0.00 175.29 173.85 2i0w n THR 73 N -1.66 0.00 -4.69 0.00 -2.24 -1.26 -4.32 114.28 100.12 2i0w n THR 73 Ca 0.14 -0.02 -0.30 0.00 -2.27 0.00 0.00 64.05 61.60 2i0w n THR 73 Cb 0.47 0.28 -0.06 0.00 -2.10 0.00 0.00 70.33 68.91 2i0w n THR 73 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2i0w n GLY 74 N 0.56 3.56 3.84 3.38 0.00 -1.26 -5.01 105.19 110.26 2i0w n GLY 74 Ca 0.00 -2.33 -0.32 0.00 0.00 0.00 0.00 46.02 43.37 2i0w n GLY 74 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2i0w s TRP 75 N -2.77 3.45 0.53 1.61 0.51 -1.26 -4.90 118.94 116.11 2i0w s TRP 75 Ca 0.03 1.47 -0.16 0.00 -2.12 0.00 0.00 56.10 55.31 2i0w s TRP 75 Cb 0.00 -2.80 -0.07 0.00 -0.81 0.00 0.00 33.47 29.80 2i0w s TRP 75 CO 0.02 -0.37 1.00 0.20 -0.51 0.00 0.00 176.95 177.30 2i0w s GLY 76 N -3.04 2.08 -0.14 0.98 0.00 -1.26 -4.50 107.32 101.44 2i0w s GLY 76 Ca 0.59 0.24 -0.29 0.00 0.00 0.00 0.00 44.72 45.25 2i0w s GLY 76 CO 0.31 0.53 1.04 1.25 0.00 0.00 0.00 173.10 176.22 2i0w s LYS 77 N -4.07 4.36 0.90 2.90 2.20 0.13 -4.83 119.74 121.33 2i0w s LYS 77 Ca 0.60 1.41 -0.10 0.00 -0.36 0.00 0.00 55.97 57.52 2i0w s LYS 77 Cb -0.12 -3.58 0.14 0.00 -1.51 0.00 0.00 37.83 32.76 2i0w s LYS 77 CO 0.33 -0.44 1.15 -1.25 -0.36 0.00 0.00 175.35 174.78 2i0w s PRO 78 N 2.46 1.11 0.18 4.03 0.04 -1.26 -0.86 135.00 140.70 2i0w s PRO 78 Ca 0.48 1.56 -0.26 0.00 0.04 0.00 0.00 61.00 62.82 2i0w s PRO 78 Cb -0.18 -1.74 -0.08 0.00 0.04 0.00 0.00 34.50 32.54 2i0w s PRO 78 CO 0.14 -2.57 0.80 -1.25 0.04 0.00 0.00 177.00 174.17 2i0w s PRO 79 N -4.61 4.60 -0.28 0.56 0.04 -1.26 -4.67 135.00 129.39 2i0w s PRO 79 Ca 0.67 1.20 -0.14 0.00 0.04 0.00 0.00 61.00 62.78 2i0w s PRO 79 Cb -0.23 -3.24 0.10 0.00 0.04 0.00 0.00 34.50 31.16 2i0w s PRO 79 CO 0.57 0.55 0.66 0.54 0.04 0.00 0.00 177.00 179.36 2i0w s ASN 80 N -1.18 -0.98 0.06 6.66 2.20 -0.69 -3.52 114.94 117.50 2i0w s ASN 80 Ca 0.37 1.50 -0.31 0.00 -0.94 0.00 0.00 52.86 53.48 2i0w s ASN 80 Cb -0.23 1.66 -0.07 0.00 -2.00 0.00 0.00 41.25 40.60 2i0w s ASN 80 CO 0.27 -0.23 1.50 -0.89 -2.94 0.00 0.00 177.10 174.81 2i0w s THR 81 N 2.06 3.28 0.04 0.54 2.01 -1.25 -4.36 115.64 117.96 2i0w s THR 81 Ca -0.08 0.78 0.02 0.00 0.31 0.00 0.00 61.69 62.72 2i0w s THR 81 Cb -0.08 -3.50 -0.04 0.00 0.01 0.00 0.00 72.50 68.89 2i0w s THR 81 CO -0.19 0.02 0.04 -0.76 -0.69 0.00 0.00 174.62 173.03 2i0w s LEU 82 N 2.09 3.65 -0.31 4.42 1.43 -0.71 -4.41 118.68 124.84 2i0w s LEU 82 Ca 0.68 -0.02 0.04 0.00 -1.03 0.00 0.00 54.13 53.79 2i0w s LEU 82 Cb -0.37 -2.24 0.09 0.00 0.03 0.00 0.00 46.19 43.70 2i0w s LEU 82 CO 0.30 0.22 0.00 0.00 0.23 0.00 0.00 176.35 177.10 2i0w s ALA 83 N -1.25 2.77 0.12 4.21 0.00 -0.47 -0.99 121.76 126.16 2i0w s ALA 83 Ca 0.24 -2.28 0.03 0.00 0.00 0.00 0.00 51.96 49.95 2i0w s ALA 83 Cb -0.12 -1.85 -0.04 0.00 0.00 0.00 0.00 23.12 21.12 2i0w s ALA 83 CO 0.16 -1.54 0.16 -1.21 0.00 0.00 0.00 175.76 173.34 2i0w s GLU 84 N 0.98 3.08 0.08 0.00 2.02 -0.09 -1.29 118.70 123.47 2i0w s GLU 84 Ca 0.05 -0.71 -0.26 0.00 0.02 0.00 0.00 54.97 54.07 2i0w s GLU 84 Cb -0.19 -2.79 0.08 0.00 0.10 0.00 0.00 34.13 31.33 2i0w s GLU 84 CO -0.07 0.53 0.72 1.52 0.02 0.00 0.00 175.26 177.98 2i0w s TYR 85 N -1.62 -0.47 -0.12 1.61 -0.85 -0.99 -0.92 117.35 113.99 2i0w s TYR 85 Ca 0.32 0.32 -0.05 0.00 -0.52 0.00 0.00 57.07 57.13 2i0w s TYR 85 Cb -0.11 0.54 0.06 0.00 0.38 0.00 0.00 41.96 42.83 2i0w s TYR 85 CO 0.25 -0.71 0.27 0.00 -1.52 0.00 0.00 175.55 173.83 2i0w s ALA 86 N -3.36 -0.60 -1.13 9.51 0.00 0.19 -2.46 121.76 123.90 2i0w s ALA 86 Ca 0.02 1.01 -0.09 0.00 0.00 0.00 0.00 51.96 52.91 2i0w s ALA 86 Cb -0.01 -0.87 0.27 0.00 0.00 0.00 0.00 23.12 22.51 2i0w s ALA 86 CO -0.10 -0.45 1.24 1.28 0.00 0.00 0.00 175.76 177.72 2i0w n LEU 87 N 4.85 5.66 -4.69 0.00 4.77 0.38 -1.01 117.00 126.95 2i0w n LEU 87 Ca -0.15 -4.98 -0.42 0.00 -0.03 0.00 0.00 56.01 50.43 2i0w n LEU 87 Cb 0.51 -1.47 -0.03 0.00 -2.33 0.00 0.00 43.42 40.11 2i0w n LEU 87 CO 0.07 1.32 1.45 -0.62 -1.33 0.00 0.00 177.39 178.29 2i0w s ASP 88 N 1.03 6.45 0.04 -1.43 2.15 -1.00 0.26 116.67 124.16 2i0w s ASP 88 Ca 0.33 2.72 0.26 0.00 0.43 0.00 0.00 52.55 56.29 2i0w s ASP 88 Cb -0.06 -2.57 0.66 0.00 -0.30 0.00 0.00 42.92 40.65 2i0w s ASP 88 CO -0.04 -0.99 1.53 0.00 -0.17 0.00 0.00 175.17 175.51 2i0w n GLN 89 N 5.66 0.08 -0.02 4.34 0.00 -1.26 -2.33 117.38 123.85 2i0w n GLN 89 Ca 0.17 0.03 -0.20 0.00 0.00 0.00 0.00 57.00 57.00 2i0w n GLN 89 Cb 0.38 -1.56 -0.13 0.00 0.00 0.00 0.00 30.24 28.93 2i0w n GLN 89 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.06 177.80 2i0w h PHE 90 N 0.00 0.30 0.00 2.61 0.04 -1.95 -3.37 116.94 114.57 2i0w h PHE 90 Ca 0.00 -0.22 0.00 0.00 2.80 0.00 0.00 57.97 60.55 2i0w h PHE 90 Cb 0.57 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.71 2i0w h PHE 90 CO 0.00 1.46 -1.04 -1.13 -0.60 0.00 0.00 178.31 177.00 2i0w n SER 91 N -4.12 0.62 -3.55 2.17 3.41 -1.26 -4.96 113.62 105.93 2i0w n SER 91 Ca -0.24 -0.26 -0.21 0.00 -0.26 0.00 0.00 58.87 57.90 2i0w n SER 91 Cb 0.80 0.83 0.08 0.00 -0.26 0.00 0.00 64.21 65.65 2i0w n SER 91 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2i0w n ASN 92 N -1.93 -4.33 -4.24 4.04 5.15 -0.98 -4.96 115.26 108.01 2i0w n ASN 92 Ca 0.02 -0.59 -0.20 0.00 -0.60 0.00 0.00 54.58 53.21 2i0w n ASN 92 Cb 0.43 -4.99 -0.12 0.00 -0.53 0.00 0.00 39.78 34.57 2i0w n ASN 92 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2i0w s LEU 93 N -6.89 2.36 -0.22 1.20 1.43 -1.21 -1.79 118.68 113.55 2i0w s LEU 93 Ca 0.33 -0.75 -0.09 0.00 -1.03 0.00 0.00 54.13 52.59 2i0w s LEU 93 Cb -0.15 -0.63 -0.04 0.00 0.03 0.00 0.00 46.19 45.40 2i0w s LEU 93 CO 0.74 -0.08 0.11 -1.81 0.23 0.00 0.00 176.35 175.53 2i0w s ASP 94 N -2.22 5.72 -0.21 2.29 1.01 0.78 -2.38 116.67 121.65 2i0w s ASP 94 Ca 0.07 0.03 -0.04 0.00 0.71 0.00 0.00 52.55 53.31 2i0w s ASP 94 Cb -0.07 -2.01 -0.01 0.00 1.01 0.00 0.00 42.92 41.83 2i0w s ASP 94 CO 0.03 0.08 -0.04 -0.36 0.21 0.00 0.00 175.17 175.10 2i0w s PHE 95 N 0.95 2.97 0.12 4.23 0.08 -0.18 -1.94 117.98 124.20 2i0w s PHE 95 Ca 0.05 -0.78 -0.07 0.00 0.12 0.00 0.00 56.93 56.25 2i0w s PHE 95 Cb -0.14 -2.08 -0.01 0.00 -0.57 0.00 0.00 43.02 40.22 2i0w s PHE 95 CO 0.03 -0.44 0.18 1.67 -0.10 0.00 0.00 175.22 176.56 2i0w s TRP 96 N 1.28 0.37 0.13 0.36 1.48 -0.11 0.53 118.94 122.98 2i0w s TRP 96 Ca 0.03 -0.79 -0.26 0.00 -1.06 0.00 0.00 56.10 54.03 2i0w s TRP 96 Cb -0.14 -0.15 0.07 0.00 -1.16 0.00 0.00 33.47 32.09 2i0w s TRP 96 CO -0.01 -0.58 1.02 0.16 -4.06 0.00 0.00 176.95 173.48 2i0w s ASP 97 N -2.93 -0.14 -0.13 -2.66 -4.77 -0.10 -1.49 116.67 104.45 2i0w s ASP 97 Ca 0.12 -0.39 -0.01 0.00 -3.30 0.00 0.00 52.55 48.97 2i0w s ASP 97 Cb 0.05 0.44 -0.02 0.00 -1.09 0.00 0.00 42.92 42.30 2i0w s ASP 97 CO -0.05 -0.81 -0.10 -0.63 0.70 0.00 0.00 175.17 174.27 2i0w s ILE 98 N -3.03 3.30 -0.02 2.11 1.01 -1.26 -0.91 121.20 122.39 2i0w s ILE 98 Ca 0.14 -0.58 0.06 0.00 0.00 0.00 0.00 60.65 60.27 2i0w s ILE 98 Cb -0.00 -2.40 -0.01 0.00 0.01 0.00 0.00 42.46 40.05 2i0w s ILE 98 CO 0.02 0.52 -0.22 -0.55 0.00 0.00 0.00 174.94 174.71 2i0w s SER 99 N 0.22 2.61 0.00 3.58 0.15 -0.16 -1.52 113.70 118.59 2i0w s SER 99 Ca -0.07 -0.41 0.03 0.00 0.70 0.00 0.00 55.95 56.21 2i0w s SER 99 Cb -0.15 -0.39 0.09 0.00 -1.71 0.00 0.00 66.02 63.87 2i0w s SER 99 CO 0.04 0.26 1.07 0.18 1.20 0.00 0.00 173.24 175.99 2i0w n LEU 100 N 2.65 2.27 -0.06 3.45 4.32 -0.59 -1.73 117.00 127.31 2i0w n LEU 100 Ca -0.16 -1.99 0.05 0.00 -0.02 0.00 0.00 56.01 53.90 2i0w n LEU 100 Cb 0.52 -0.07 0.41 0.00 -1.62 0.00 0.00 43.42 42.66 2i0w n LEU 100 CO 0.24 0.57 1.18 0.58 -1.22 0.00 0.00 177.39 178.74 2i0w h VAL 101 N 0.62 1.07 -0.80 4.08 2.07 -1.79 0.28 116.25 121.78 2i0w h VAL 101 Ca 0.00 -0.21 -0.32 0.00 0.82 0.00 0.00 66.70 66.99 2i0w h VAL 101 Cb 0.56 0.41 -0.19 0.00 -1.52 0.00 0.00 31.29 30.55 2i0w h VAL 101 CO 0.00 0.11 0.38 0.47 0.02 0.00 0.00 177.57 178.56 2i0w n ASP 102 N -4.47 4.26 0.00 0.57 9.92 -1.26 -4.58 116.55 120.99 2i0w n ASP 102 Ca 0.06 -3.40 0.00 0.00 -0.53 0.00 0.00 54.79 50.91 2i0w n ASP 102 Cb 0.13 -0.77 0.00 0.00 -0.64 0.00 0.00 41.12 39.84 2i0w n ASP 102 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2i0w n GLY 103 N -0.60 -1.81 2.99 0.44 0.00 0.09 -1.70 105.19 104.60 2i0w n GLY 103 Ca 0.47 -1.86 -0.11 0.00 0.00 0.00 0.00 46.02 44.52 2i0w n GLY 103 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2i0w s PHE 104 N 0.00 0.01 0.00 1.61 2.19 -0.55 -3.83 117.98 117.42 2i0w s PHE 104 Ca 0.00 -0.01 0.00 0.00 0.33 0.00 0.00 56.93 57.25 2i0w s PHE 104 Cb 0.00 -0.03 0.00 0.00 -1.31 0.00 0.00 43.02 41.68 2i0w s PHE 104 CO 0.00 -0.12 0.00 0.27 1.83 0.00 0.00 175.22 177.20 2i0w n ASN 105 N 2.41 0.00 -4.01 6.13 6.94 -1.26 -0.84 115.26 124.63 2i0w n ASN 105 Ca -0.17 0.00 -0.21 0.00 -0.02 0.00 0.00 54.58 54.18 2i0w n ASN 105 Cb 0.58 0.00 -0.16 0.00 -2.36 0.00 0.00 39.78 37.84 2i0w n ASN 105 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 2i0w s ILE 106 N -1.00 0.87 0.51 1.53 1.01 -1.26 -4.80 121.20 118.06 2i0w s ILE 106 Ca 0.00 -0.39 -0.20 0.00 0.00 0.00 0.00 60.65 60.06 2i0w s ILE 106 Cb 0.00 -0.78 -0.07 0.00 0.01 0.00 0.00 42.46 41.62 2i0w s ILE 106 CO 0.00 0.27 1.12 -2.16 0.00 0.00 0.00 174.94 174.17 2i0w s PRO 107 N 0.29 3.54 0.20 2.79 0.04 -1.26 -4.70 135.00 135.90 2i0w s PRO 107 Ca -0.05 1.60 -0.16 0.00 0.04 0.00 0.00 61.00 62.43 2i0w s PRO 107 Cb -0.10 -2.11 0.02 0.00 0.04 0.00 0.00 34.50 32.34 2i0w s PRO 107 CO 0.01 -0.69 0.49 0.00 0.04 0.00 0.00 177.00 176.85 2i0w s MET 108 N -3.14 1.39 -0.07 4.56 0.23 -0.96 -0.39 119.30 120.92 2i0w s MET 108 Ca 0.70 -0.97 0.03 0.00 -1.03 0.00 0.00 55.69 54.41 2i0w s MET 108 Cb -0.23 0.50 0.01 0.00 -1.53 0.00 0.00 34.83 33.57 2i0w s MET 108 CO 0.27 -0.58 -0.17 0.99 -2.03 0.00 0.00 175.02 173.50 2i0w s THR 109 N -3.91 1.51 -0.19 3.16 2.01 -0.64 -1.82 115.64 115.76 2i0w s THR 109 Ca 0.12 -0.71 -0.00 0.00 0.31 0.00 0.00 61.69 61.42 2i0w s THR 109 Cb -0.01 -1.33 0.01 0.00 0.01 0.00 0.00 72.50 71.18 2i0w s THR 109 CO -0.00 0.44 -0.16 0.12 -0.69 0.00 0.00 174.62 174.33 2i0w s PHE 110 N 0.47 2.82 0.01 4.92 2.19 -0.67 -1.67 117.98 126.05 2i0w s PHE 110 Ca -0.15 -1.44 -0.13 0.00 0.33 0.00 0.00 56.93 55.54 2i0w s PHE 110 Cb -0.16 -1.96 0.02 0.00 -1.31 0.00 0.00 43.02 39.60 2i0w s PHE 110 CO 0.05 -0.73 0.28 0.00 1.83 0.00 0.00 175.22 176.66 2i0w s ALA 111 N 1.31 -0.66 0.22 11.12 0.00 -0.42 -1.26 121.76 132.07 2i0w s ALA 111 Ca 0.05 0.13 -0.30 0.00 0.00 0.00 0.00 51.96 51.84 2i0w s ALA 111 Cb -0.13 0.16 -0.09 0.00 0.00 0.00 0.00 23.12 23.06 2i0w s ALA 111 CO -0.10 -0.30 0.96 -2.14 0.00 0.00 0.00 175.76 174.18 2i0w s PRO 112 N -1.77 4.81 0.35 0.00 0.02 -1.26 -0.32 135.00 136.83 2i0w s PRO 112 Ca -0.11 1.52 0.27 0.00 0.02 0.00 0.00 61.00 62.70 2i0w s PRO 112 Cb -0.04 -3.29 0.92 0.00 0.02 0.00 0.00 34.50 32.11 2i0w s PRO 112 CO 0.01 0.44 1.78 1.79 -0.33 0.00 0.00 177.00 180.68 2i0w h THR 113 N 3.29 0.00 -2.11 0.99 1.35 -1.03 -3.34 112.91 112.06 2i0w h THR 113 Ca -0.45 -0.49 -0.57 0.00 -0.55 0.00 0.00 66.41 64.34 2i0w h THR 113 Cb 1.20 1.41 -0.39 0.00 -1.73 0.00 0.00 68.15 68.64 2i0w h THR 113 CO 0.69 0.00 -0.99 0.29 -0.25 0.00 0.00 175.52 175.25 2i0w n LYS 114 N -2.59 0.97 -1.73 4.72 5.02 -1.26 -4.93 118.16 118.37 2i0w n LYS 114 Ca 0.03 -3.49 -0.42 0.00 -2.02 0.00 0.00 58.31 52.41 2i0w n LYS 114 Cb 0.35 -1.48 -0.01 0.00 -0.02 0.00 0.00 35.03 33.88 2i0w n LYS 114 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 2i0w n PRO 115 N 1.52 2.37 -0.87 1.97 -0.04 -1.26 -4.76 135.00 133.94 2i0w n PRO 115 Ca 0.24 0.84 0.05 0.00 -0.04 0.00 0.00 63.50 64.59 2i0w n PRO 115 Cb 0.50 -2.50 0.15 0.00 -0.04 0.00 0.00 33.50 31.60 2i0w n PRO 115 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2i0w n SER 116 N 1.07 1.48 -0.17 3.54 3.41 -1.09 -5.04 113.62 116.82 2i0w n SER 116 Ca 0.05 -3.27 0.02 0.00 -0.26 0.00 0.00 58.87 55.40 2i0w n SER 116 Cb 0.36 -0.45 -0.00 0.00 -0.26 0.00 0.00 64.21 63.86 2i0w n SER 116 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2i0w n GLY 117 N -0.60 -2.11 7.00 5.00 0.00 -1.22 -4.90 105.19 108.36 2i0w n GLY 117 Ca 0.15 -1.44 0.00 0.00 0.00 0.00 0.00 46.02 44.73 2i0w n GLY 117 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2i0w n GLY 118 N -0.83 2.29 1.57 -0.02 0.00 -1.26 -1.53 105.19 105.42 2i0w n GLY 118 Ca 0.00 -0.40 0.08 0.00 0.00 0.00 0.00 46.02 45.70 2i0w n GLY 118 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2i0w n LYS 119 N 13.28 3.79 -3.33 1.61 5.02 -1.26 -4.68 118.16 132.59 2i0w n LYS 119 Ca 0.00 -2.71 -0.45 0.00 -2.02 0.00 0.00 58.31 53.13 2i0w n LYS 119 Cb 0.00 -1.94 -0.00 0.00 -0.02 0.00 0.00 35.03 33.07 2i0w n LYS 119 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2i0w s HIS 121 N -1.23 -0.17 0.54 0.00 -3.43 -1.26 -2.68 115.29 107.05 2i0w s HIS 121 Ca 0.31 -0.15 -0.22 0.00 -0.80 0.00 0.00 55.06 54.21 2i0w s HIS 121 Cb -0.10 0.33 -0.06 0.00 -1.43 0.00 0.00 32.58 31.33 2i0w s HIS 121 CO -0.08 -0.81 1.29 0.00 -2.00 0.00 0.00 174.74 173.14 2i0w n ALA 122 N -0.29 1.32 -2.78 -1.38 0.00 -1.26 -4.71 120.51 111.41 2i0w n ALA 122 Ca -0.13 0.13 -0.16 0.00 0.00 0.00 0.00 53.44 53.28 2i0w n ALA 122 Cb 0.63 -2.31 -0.12 0.00 0.00 0.00 0.00 19.45 17.66 2i0w n ALA 122 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 2i0w s ILE 123 N -1.31 0.84 0.20 0.00 -4.36 -0.39 -5.01 121.20 111.17 2i0w s ILE 123 Ca 0.71 -1.20 0.03 0.00 -0.26 0.00 0.00 60.65 59.92 2i0w s ILE 123 Cb -0.43 -0.85 -0.05 0.00 1.25 0.00 0.00 42.46 42.38 2i0w s ILE 123 CO 0.50 -0.30 -0.00 -1.00 0.24 0.00 0.00 174.94 174.38 2i0w s HIS 124 N -1.33 1.36 -0.49 1.37 3.76 -1.26 -1.67 115.29 117.02 2i0w s HIS 124 Ca -0.06 -0.98 0.06 0.00 -0.15 0.00 0.00 55.06 53.94 2i0w s HIS 124 Cb -0.10 -0.78 0.19 0.00 1.11 0.00 0.00 32.58 33.01 2i0w s HIS 124 CO 0.01 -0.14 0.65 0.00 -0.85 0.00 0.00 174.74 174.41 2i0w n THR 126 N 2.78 0.76 -1.02 0.00 -2.24 -1.26 -2.27 114.28 111.04 2i0w n THR 126 Ca 0.20 -0.88 -0.33 0.00 -2.27 0.00 0.00 64.05 60.77 2i0w n THR 126 Cb 0.55 0.67 0.14 0.00 -2.10 0.00 0.00 70.33 69.58 2i0w n THR 126 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2i0w s ALA 127 N -0.95 1.76 -1.48 6.98 0.00 -1.26 -4.85 121.76 121.96 2i0w s ALA 127 Ca 0.17 0.77 -0.11 0.00 0.00 0.00 0.00 51.96 52.79 2i0w s ALA 127 Cb 0.10 -3.48 0.02 0.00 0.00 0.00 0.00 23.12 19.76 2i0w s ALA 127 CO 0.13 -2.40 2.44 -1.71 0.00 0.00 0.00 175.76 174.22 2i0w n ASN 128 N -3.54 6.06 -0.27 0.00 4.05 -1.26 -4.73 115.26 115.57 2i0w n ASN 128 Ca 0.13 -2.82 -0.06 0.00 0.45 0.00 0.00 54.58 52.28 2i0w n ASN 128 Cb 0.51 -1.57 0.06 0.00 1.23 0.00 0.00 39.78 40.00 2i0w n ASN 128 CO 0.00 0.00 0.00 0.40 -3.05 0.00 0.00 177.26 174.61 2i0w h ILE 129 N 3.50 1.26 -0.11 -1.44 2.04 -1.97 -2.32 117.51 118.47 2i0w h ILE 129 Ca 0.66 -0.84 -0.06 0.00 1.00 0.00 0.00 64.86 65.62 2i0w h ILE 129 Cb 0.49 0.40 -0.01 0.00 -0.74 0.00 0.00 36.82 36.95 2i0w h ILE 129 CO 1.78 0.34 -0.20 0.78 0.00 0.00 0.00 178.15 180.85 2i0w h ASN 130 N 1.09 0.18 0.60 1.72 2.35 -1.91 -1.06 115.58 118.55 2i0w h ASN 130 Ca 0.25 -0.04 -0.20 0.00 -0.55 0.00 0.00 56.30 55.76 2i0w h ASN 130 Cb 0.25 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 38.56 2i0w h ASN 130 CO -0.02 0.39 -0.89 1.23 -1.65 0.00 0.00 177.43 176.50 2i0w h GLY 131 N 0.82 0.21 -1.77 2.83 0.00 -1.85 -3.29 103.07 100.02 2i0w h GLY 131 Ca 0.03 -0.38 0.00 0.00 0.00 0.00 0.00 47.33 46.98 2i0w h GLY 131 CO 0.03 0.34 0.00 1.18 0.00 0.00 0.00 176.54 178.09 2i0w n GLU 132 N -3.65 2.66 -1.68 4.80 1.02 -0.91 -5.01 120.64 117.87 2i0w n GLU 132 Ca -0.04 -2.20 -0.45 0.00 -0.02 0.00 0.00 57.16 54.45 2i0w n GLU 132 Cb 0.81 -1.38 -0.04 0.00 -0.02 0.00 0.00 31.44 30.82 2i0w n GLU 132 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2i0w n PRO 134 N 4.95 1.35 0.13 0.00 -0.02 -1.26 -4.70 135.00 135.45 2i0w n PRO 134 Ca 0.19 0.48 0.13 0.00 -2.02 0.00 0.00 63.50 62.28 2i0w n PRO 134 Cb 0.32 -1.94 0.65 0.00 -0.02 0.00 0.00 33.50 32.51 2i0w n PRO 134 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2i0w h ARG 135 N 1.76 0.03 0.00 -0.52 3.08 -1.96 -1.46 114.38 115.31 2i0w h ARG 135 Ca -0.42 -0.00 -0.03 0.00 0.07 0.00 0.00 59.98 59.60 2i0w h ARG 135 Cb 1.34 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 31.38 2i0w h ARG 135 CO 0.58 0.02 -0.15 0.00 -1.07 0.00 0.00 179.97 179.35 2i0w h ALA 136 N 1.87 1.01 0.00 0.04 0.00 -2.02 -3.19 119.26 116.97 2i0w h ALA 136 Ca 0.12 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2i0w h ALA 136 Cb 0.45 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2i0w h ALA 136 CO -0.01 0.19 -0.81 1.28 0.00 0.00 0.00 179.25 179.90 2i0w n LEU 137 N -3.29 0.61 -4.73 0.00 4.77 -0.62 -5.01 117.00 108.73 2i0w n LEU 137 Ca 0.00 -0.44 -0.42 0.00 -0.03 0.00 0.00 56.01 55.13 2i0w n LEU 137 Cb 0.40 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.46 2i0w n LEU 137 CO 0.32 0.15 0.96 -0.75 -1.33 0.00 0.00 177.39 176.74 2i0w s LYS 138 N -2.47 4.41 0.17 3.23 2.20 -0.75 -1.29 119.74 125.24 2i0w s LYS 138 Ca 0.04 1.96 0.00 0.00 -0.36 0.00 0.00 55.97 57.61 2i0w s LYS 138 Cb 0.11 -3.24 -0.04 0.00 -1.51 0.00 0.00 37.83 33.14 2i0w s LYS 138 CO 0.61 -0.25 0.05 0.14 -0.36 0.00 0.00 175.35 175.54 2i0w s VAL 139 N 0.45 0.32 0.00 4.02 -7.23 -0.98 -4.95 120.40 112.04 2i0w s VAL 139 Ca 0.58 -1.95 -0.30 0.00 -1.81 0.00 0.00 61.98 58.50 2i0w s VAL 139 Cb -0.34 -2.19 -0.08 0.00 0.56 0.00 0.00 36.38 34.32 2i0w s VAL 139 CO 0.34 -0.36 1.98 -2.84 -0.31 0.00 0.00 175.10 173.92 2i0w s PRO 140 N -4.02 4.03 0.00 4.82 0.02 -1.26 -2.04 135.00 136.55 2i0w s PRO 140 Ca 0.27 2.53 0.00 0.00 0.02 0.00 0.00 61.00 63.82 2i0w s PRO 140 Cb 0.07 -4.18 0.00 0.00 0.02 0.00 0.00 34.50 30.41 2i0w s PRO 140 CO 0.05 -1.08 0.00 0.41 -0.33 0.00 0.00 177.00 176.05 2i0w n GLY 141 N 4.66 1.66 1.00 0.52 0.00 -1.26 -4.78 105.19 106.99 2i0w n GLY 141 Ca 0.21 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.20 2i0w n GLY 141 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2i0w n GLY 142 N -2.00 1.80 2.64 -0.02 0.00 -0.87 -4.57 105.19 102.17 2i0w n GLY 142 Ca 0.00 -1.10 -0.25 0.00 0.00 0.00 0.00 46.02 44.67 2i0w n GLY 142 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2i0w s ASN 144 N 2.11 5.63 0.11 0.00 0.02 -0.41 -1.48 114.94 120.93 2i0w s ASN 144 Ca 0.02 1.76 -0.19 0.00 -1.02 0.00 0.00 52.86 53.43 2i0w s ASN 144 Cb -0.15 -2.52 -0.07 0.00 0.02 0.00 0.00 41.25 38.53 2i0w s ASN 144 CO -0.08 -1.27 0.59 0.21 0.02 0.00 0.00 177.10 176.58 2i0w s ASN 145 N -3.10 7.03 0.44 -1.22 3.84 -1.26 -4.83 114.94 115.84 2i0w s ASN 145 Ca 0.62 1.26 0.29 0.00 0.21 0.00 0.00 52.86 55.24 2i0w s ASN 145 Cb -0.15 -2.36 1.38 0.00 -0.55 0.00 0.00 41.25 39.57 2i0w s ASN 145 CO 0.43 0.21 1.66 1.55 -2.79 0.00 0.00 177.10 178.16 2i0w h PRO 146 N 4.20 0.13 -0.67 0.43 0.13 -1.90 0.14 132.00 134.46 2i0w h PRO 146 Ca -0.49 -0.01 -0.03 0.00 -0.87 0.00 0.00 66.00 64.60 2i0w h PRO 146 Cb 1.21 -0.03 -0.03 0.00 0.13 0.00 0.00 31.00 32.28 2i0w h PRO 146 CO 0.64 0.09 0.28 0.00 -0.23 0.00 0.00 178.00 178.78 2i0w h THR 148 N 0.96 1.39 0.48 0.00 2.02 -1.01 -1.48 112.91 115.28 2i0w h THR 148 Ca 0.23 -1.27 -0.02 0.00 0.77 0.00 0.00 66.41 66.11 2i0w h THR 148 Cb 0.16 2.13 0.00 0.00 -1.74 0.00 0.00 68.15 68.71 2i0w h THR 148 CO -0.02 0.35 -0.23 0.74 0.37 0.00 0.00 175.52 176.72 2i0w h THR 149 N -0.34 0.38 0.05 3.16 2.02 -1.35 -3.39 112.91 113.44 2i0w h THR 149 Ca 0.01 -0.45 -0.35 0.00 0.77 0.00 0.00 66.41 66.39 2i0w h THR 149 Cb 0.59 0.53 -0.05 0.00 -1.74 0.00 0.00 68.15 67.49 2i0w h THR 149 CO 0.02 0.06 -2.07 0.49 0.37 0.00 0.00 175.52 174.38 2i0w n PHE 150 N -5.25 0.74 -1.96 3.16 3.72 0.39 -5.10 117.46 113.16 2i0w n PHE 150 Ca -0.10 0.20 0.02 0.00 -0.05 0.00 0.00 57.45 57.52 2i0w n PHE 150 Cb 0.31 -1.11 -0.01 0.00 -0.94 0.00 0.00 39.48 37.73 2i0w n PHE 150 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2i0w n GLY 151 N 1.88 -2.07 0.00 1.37 0.00 -0.56 -5.04 105.19 100.79 2i0w n GLY 151 Ca -0.31 -1.42 0.00 0.00 0.00 0.00 0.00 46.02 44.30 2i0w n GLY 151 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2i0w n GLY 152 N -0.92 0.56 0.27 -0.02 0.00 -1.26 -4.48 105.19 99.34 2i0w n GLY 152 Ca 0.00 -1.66 0.06 0.00 0.00 0.00 0.00 46.02 44.42 2i0w n GLY 152 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2i0w h GLN 153 N 0.00 0.19 -0.87 1.61 5.75 -1.97 0.22 115.11 120.04 2i0w h GLN 153 Ca 0.00 -0.01 0.23 0.00 -0.15 0.00 0.00 58.65 58.72 2i0w h GLN 153 Cb 0.00 -0.04 -0.14 0.00 1.07 0.00 0.00 27.48 28.36 2i0w h GLN 153 CO 0.00 0.13 0.17 0.37 -2.65 0.00 0.00 178.83 176.85 2i0w h GLN 154 N 0.20 0.16 0.00 1.69 4.15 -1.99 0.22 115.11 119.54 2i0w h GLN 154 Ca 0.43 -0.01 -0.38 0.00 0.77 0.00 0.00 58.65 59.46 2i0w h GLN 154 Cb 0.75 -0.04 -0.07 0.00 0.21 0.00 0.00 27.48 28.34 2i0w h GLN 154 CO -0.58 0.10 -2.42 0.66 -1.93 0.00 0.00 178.83 174.67 2i0w n TYR 155 N -5.28 0.00 0.81 3.99 4.01 -0.84 -4.60 117.16 115.25 2i0w n TYR 155 Ca 0.20 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 58.05 2i0w n TYR 155 Cb 0.66 -0.99 0.04 0.00 -0.31 0.00 0.00 39.34 38.74 2i0w n TYR 155 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2i0w h THR 158 N -1.93 1.58 0.00 0.00 1.35 -1.86 -3.36 112.91 108.69 2i0w h THR 158 Ca -0.58 -3.07 -0.01 0.00 -0.55 0.00 0.00 66.41 62.20 2i0w h THR 158 Cb 1.38 2.77 -0.00 0.00 -1.73 0.00 0.00 68.15 70.57 2i0w h THR 158 CO 0.70 0.89 -1.10 0.00 -0.25 0.00 0.00 175.52 175.76 2i0w n GLN 159 N -3.50 0.61 -3.74 4.72 6.02 -1.26 -5.07 117.38 115.15 2i0w n GLN 159 Ca -0.04 0.11 0.00 0.00 -0.01 0.00 0.00 57.00 57.06 2i0w n GLN 159 Cb 0.93 -1.81 0.00 0.00 1.02 0.00 0.00 30.24 30.38 2i0w n GLN 159 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2i0w n GLY 160 N 1.20 -1.32 3.53 1.08 0.00 -1.26 -5.13 105.19 103.30 2i0w n GLY 160 Ca -0.01 -1.11 -0.47 0.00 0.00 0.00 0.00 46.02 44.42 2i0w n GLY 160 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2i0w n PRO 161 N 0.00 0.89 -4.25 1.61 -0.04 -1.26 -4.78 135.00 127.16 2i0w n PRO 161 Ca 0.00 0.31 -0.15 0.00 -0.04 0.00 0.00 63.50 63.62 2i0w n PRO 161 Cb 0.00 -1.64 -0.10 0.00 -0.04 0.00 0.00 33.50 31.73 2i0w n PRO 161 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2i0w n GLY 163 N -0.41 3.17 3.74 0.00 0.00 -1.26 -4.92 105.19 105.50 2i0w n GLY 163 Ca 0.02 -2.02 -0.31 0.00 0.00 0.00 0.00 46.02 43.71 2i0w n GLY 163 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2i0w s PRO 164 N -3.41 1.89 0.28 1.61 0.04 -1.26 -4.98 135.00 129.18 2i0w s PRO 164 Ca 0.26 1.30 0.03 0.00 0.04 0.00 0.00 61.00 62.64 2i0w s PRO 164 Cb 0.01 -1.85 -0.06 0.00 0.04 0.00 0.00 34.50 32.65 2i0w s PRO 164 CO 0.19 -1.94 0.04 0.95 0.04 0.00 0.00 177.00 176.28 2i0w s THR 165 N -2.80 1.04 0.38 1.26 -4.23 -1.26 -5.00 115.64 105.02 2i0w s THR 165 Ca 0.63 -2.02 0.04 0.00 -1.18 0.00 0.00 61.69 59.17 2i0w s THR 165 Cb -0.19 -2.61 0.26 0.00 1.34 0.00 0.00 72.50 71.30 2i0w s THR 165 CO 0.56 -0.11 2.03 -0.08 -0.54 0.00 0.00 174.62 176.48 2i0w h GLU 166 N 2.28 0.71 0.00 3.99 4.81 -1.98 0.19 114.58 124.58 2i0w h GLU 166 Ca -0.39 -0.04 -0.18 0.00 -0.13 0.00 0.00 59.36 58.61 2i0w h GLU 166 Cb 1.24 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 30.44 2i0w h GLU 166 CO 0.66 0.47 -0.84 -0.07 -0.73 0.00 0.00 179.01 178.50 2i0w h LEU 167 N 0.73 0.07 -0.29 1.64 3.38 -2.01 -3.07 115.31 115.77 2i0w h LEU 167 Ca 0.20 -0.06 -0.20 0.00 0.09 0.00 0.00 57.88 57.91 2i0w h LEU 167 Cb -0.08 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.65 2i0w h LEU 167 CO -0.04 0.87 -0.71 0.77 0.09 0.00 0.00 178.44 179.42 2i0w h SER 168 N 0.03 0.79 0.14 -0.43 4.64 -1.63 -2.73 113.55 114.36 2i0w h SER 168 Ca -0.02 -0.49 0.00 0.00 -0.47 0.00 0.00 61.79 60.81 2i0w h SER 168 Cb 1.47 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 2i0w h SER 168 CO 0.11 1.27 0.00 0.11 -0.87 0.00 0.00 176.83 177.45 2i0w h LYS 169 N 0.47 0.00 -0.28 4.77 1.57 -0.61 -0.78 116.57 121.72 2i0w h LYS 169 Ca -0.03 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.65 2i0w h LYS 169 Cb 1.31 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.61 2i0w h LYS 169 CO 0.14 0.00 -0.25 0.35 -0.57 0.00 0.00 179.45 179.12 2i0w h PHE 170 N 0.00 0.60 0.08 -1.35 3.57 -1.39 -1.36 116.94 117.09 2i0w h PHE 170 Ca 0.00 -0.13 -0.20 0.00 3.53 0.00 0.00 57.97 61.17 2i0w h PHE 170 Cb 0.07 -0.15 -0.00 0.00 2.79 0.00 0.00 35.95 38.66 2i0w h PHE 170 CO 0.00 0.74 -1.00 0.74 -2.23 0.00 0.00 178.31 176.55 2i0w h PHE 171 N 0.47 0.30 -0.77 0.41 -1.00 -1.28 -3.26 116.94 111.82 2i0w h PHE 171 Ca 0.07 -0.22 0.03 0.00 2.81 0.00 0.00 57.97 60.66 2i0w h PHE 171 Cb 0.68 -0.01 -0.04 0.00 3.61 0.00 0.00 35.95 40.19 2i0w h PHE 171 CO 0.02 1.39 0.51 -0.22 -1.61 0.00 0.00 178.31 178.40 2i0w h LYS 172 N -0.57 0.92 -0.38 1.51 1.63 -1.51 0.44 116.57 118.62 2i0w h LYS 172 Ca -0.22 -0.06 0.05 0.00 -0.85 0.00 0.00 60.65 59.57 2i0w h LYS 172 Cb 1.52 -0.21 -0.05 0.00 -0.60 0.00 0.00 32.23 32.89 2i0w h LYS 172 CO 0.02 0.61 0.10 -0.22 -3.45 0.00 0.00 179.45 176.52 2i0w h LYS 173 N 0.95 0.24 0.00 1.90 1.63 -1.36 -2.16 116.57 117.76 2i0w h LYS 173 Ca 0.31 -0.01 -0.12 0.00 -0.85 0.00 0.00 60.65 59.97 2i0w h LYS 173 Cb 0.04 -0.05 -0.02 0.00 -0.60 0.00 0.00 32.23 31.59 2i0w h LYS 173 CO -0.09 0.16 -0.97 0.00 -3.45 0.00 0.00 179.45 175.09 2i0w h ARG 174 N 0.24 0.00 -2.30 1.90 3.08 -1.31 -3.40 114.38 112.59 2i0w h ARG 174 Ca 0.18 0.00 -0.58 0.00 0.07 0.00 0.00 59.98 59.64 2i0w h ARG 174 Cb 0.18 0.00 -0.39 0.00 0.08 0.00 0.00 29.97 29.84 2i0w h ARG 174 CO -0.21 0.32 -0.97 0.00 -1.07 0.00 0.00 179.97 178.05 2i0w h PRO 176 N 5.05 0.23 -0.00 0.00 0.13 -1.60 -1.80 132.00 134.00 2i0w h PRO 176 Ca 0.20 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 2i0w h PRO 176 Cb 0.88 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 31.96 2i0w h PRO 176 CO 0.45 0.15 -0.16 -0.25 -0.23 0.00 0.00 178.00 177.96 2i0w n ASP 177 N -4.42 0.39 -4.96 1.44 8.00 -1.26 -4.82 116.55 110.91 2i0w n ASP 177 Ca 0.17 -0.31 -0.22 0.00 0.71 0.00 0.00 54.79 55.15 2i0w n ASP 177 Cb 0.74 -0.10 -0.02 0.00 -0.02 0.00 0.00 41.12 41.72 2i0w n ASP 177 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2i0w s ALA 178 N -2.67 3.88 0.02 2.24 0.00 -0.68 -4.44 121.76 120.11 2i0w s ALA 178 Ca 0.23 -1.16 -0.30 0.00 0.00 0.00 0.00 51.96 50.73 2i0w s ALA 178 Cb 0.19 -1.83 -0.06 0.00 0.00 0.00 0.00 23.12 21.43 2i0w s ALA 178 CO 0.52 0.16 1.42 0.71 0.00 0.00 0.00 175.76 178.57 2i0w s TYR 179 N -2.08 2.86 -0.14 0.00 1.51 -0.58 -4.82 117.35 114.10 2i0w s TYR 179 Ca 0.36 0.80 0.15 0.00 -1.01 0.00 0.00 57.07 57.37 2i0w s TYR 179 Cb -0.09 -3.68 -0.24 0.00 -0.11 0.00 0.00 41.96 37.83 2i0w s TYR 179 CO 0.31 -2.54 0.29 -1.13 -1.11 0.00 0.00 175.55 171.37 2i0w n SER 180 N 5.25 0.42 -3.93 2.29 3.41 -1.26 -1.54 113.62 118.27 2i0w n SER 180 Ca 0.13 0.16 -0.09 0.00 -0.26 0.00 0.00 58.87 58.80 2i0w n SER 180 Cb 0.43 0.53 -0.07 0.00 -0.26 0.00 0.00 64.21 64.84 2i0w n SER 180 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 2i0w s TYR 181 N -2.53 0.34 0.30 7.33 1.13 -1.26 -4.52 117.35 118.13 2i0w s TYR 181 Ca -0.09 -0.70 0.04 0.00 -1.41 0.00 0.00 57.07 54.91 2i0w s TYR 181 Cb 0.07 -0.02 0.81 0.00 -1.10 0.00 0.00 41.96 41.71 2i0w s TYR 181 CO 0.82 -0.72 1.49 -2.30 -2.51 0.00 0.00 175.55 172.33 2i0w n PRO 182 N -0.21 -0.07 -1.15 -3.49 -0.02 -1.26 -1.64 135.00 127.16 2i0w n PRO 182 Ca -0.08 1.41 -0.20 0.00 -2.02 0.00 0.00 63.50 62.61 2i0w n PRO 182 Cb 0.63 -2.28 0.17 0.00 -0.02 0.00 0.00 33.50 32.00 2i0w n PRO 182 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2i0w n GLN 183 N -5.38 2.20 -0.90 -0.52 6.02 -1.26 -4.61 117.38 112.93 2i0w n GLN 183 Ca 0.24 -3.11 -0.17 0.00 -0.01 0.00 0.00 57.00 53.95 2i0w n GLN 183 Cb 0.80 -2.09 0.04 0.00 1.02 0.00 0.00 30.24 30.01 2i0w n GLN 183 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 2i0w n ASP 184 N -1.12 6.43 0.18 1.08 2.03 -0.65 -4.71 116.55 119.80 2i0w n ASP 184 Ca 0.53 -3.09 -0.15 0.00 0.52 0.00 0.00 54.79 52.60 2i0w n ASP 184 Cb 1.41 -1.04 -0.08 0.00 -0.72 0.00 0.00 41.12 40.69 2i0w n ASP 184 CO 0.00 0.00 0.00 0.44 -1.92 0.00 0.00 177.20 175.72 2i0w h ASP 185 N 1.47 -0.36 -0.84 1.67 3.32 -1.85 -3.25 116.42 116.58 2i0w h ASP 185 Ca 0.30 -0.05 0.16 0.00 0.02 0.00 0.00 57.03 57.47 2i0w h ASP 185 Cb 0.94 0.09 -0.16 0.00 0.22 0.00 0.00 39.33 40.42 2i0w h ASP 185 CO 0.79 -0.18 -0.23 -0.65 -1.72 0.00 0.00 179.24 177.25 2i0w h PRO 186 N -0.52 -0.01 -0.48 3.56 0.11 -1.96 -1.89 132.00 130.80 2i0w h PRO 186 Ca -0.04 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.06 2i0w h PRO 186 Cb 0.39 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.50 2i0w h PRO 186 CO 0.07 -0.01 0.00 0.25 -0.21 0.00 0.00 178.00 178.11 2i0w n THR 187 N -5.53 2.64 -0.39 -1.15 -2.24 -1.26 -4.37 114.28 101.97 2i0w n THR 187 Ca 0.12 -1.56 0.00 0.00 -2.27 0.00 0.00 64.05 60.33 2i0w n THR 187 Cb 0.42 -0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.38 2i0w n THR 187 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2i0w n SER 188 N 0.26 0.44 -4.64 3.42 7.64 -0.76 -4.58 113.62 115.41 2i0w n SER 188 Ca 0.26 -0.88 -0.34 0.00 1.01 0.00 0.00 58.87 58.92 2i0w n SER 188 Cb 1.11 0.09 -0.10 0.00 -1.01 0.00 0.00 64.21 64.30 2i0w n SER 188 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2i0w s THR 189 N -0.09 4.76 0.09 0.44 2.01 -0.92 -4.54 115.64 117.40 2i0w s THR 189 Ca 0.00 -0.04 0.08 0.00 0.31 0.00 0.00 61.69 62.03 2i0w s THR 189 Cb 0.00 -3.14 -0.03 0.00 0.01 0.00 0.00 72.50 69.34 2i0w s THR 189 CO 0.00 0.47 -0.20 -0.36 -0.69 0.00 0.00 174.62 173.84 2i0w s PHE 190 N 0.32 1.72 0.05 4.92 0.40 -0.55 -5.01 117.98 119.82 2i0w s PHE 190 Ca 0.03 -0.41 -0.00 0.00 -0.60 0.00 0.00 56.93 55.95 2i0w s PHE 190 Cb -0.12 -0.95 -0.03 0.00 0.51 0.00 0.00 43.02 42.42 2i0w s PHE 190 CO 0.00 0.17 -0.04 0.95 0.70 0.00 0.00 175.22 177.01 2i0w s THR 191 N -1.12 0.28 0.03 0.64 -4.23 -1.21 -0.93 115.64 109.09 2i0w s THR 191 Ca 0.06 -1.51 -0.03 0.00 -1.18 0.00 0.00 61.69 59.03 2i0w s THR 191 Cb -0.10 -1.10 -0.02 0.00 1.34 0.00 0.00 72.50 72.62 2i0w s THR 191 CO 0.04 -0.79 0.03 0.00 -0.54 0.00 0.00 174.62 173.36 2i0w s PRO 193 N -2.09 4.22 0.33 0.00 0.02 -1.26 -0.16 135.00 136.06 2i0w s PRO 193 Ca -0.10 2.28 -0.29 0.00 0.02 0.00 0.00 61.00 62.91 2i0w s PRO 193 Cb -0.05 -3.44 -0.12 0.00 0.02 0.00 0.00 34.50 30.91 2i0w s PRO 193 CO -0.03 -0.65 1.44 0.41 -0.33 0.00 0.00 177.00 177.84 2i0w n GLY 194 N 3.84 0.99 2.63 0.52 0.00 -0.74 -1.99 105.19 110.44 2i0w n GLY 194 Ca 0.15 0.38 0.00 0.00 0.00 0.00 0.00 46.02 46.54 2i0w n GLY 194 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2i0w n GLY 195 N 1.21 2.42 0.02 -0.02 0.00 -1.26 -4.85 105.19 102.71 2i0w n GLY 195 Ca 0.05 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.19 2i0w n GLY 195 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2i0w n SER 196 N 0.00 0.67 -3.84 1.61 3.41 -0.84 -4.98 113.62 109.64 2i0w n SER 196 Ca 0.00 -0.48 -0.09 0.00 -0.26 0.00 0.00 58.87 58.04 2i0w n SER 196 Cb 0.00 0.42 -0.03 0.00 -0.26 0.00 0.00 64.21 64.34 2i0w n SER 196 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2i0w s THR 197 N -2.96 0.01 0.52 6.66 -1.32 -1.26 -4.82 115.64 112.46 2i0w s THR 197 Ca 0.11 -1.01 0.03 0.00 -1.21 0.00 0.00 61.69 59.61 2i0w s THR 197 Cb 0.17 -1.89 0.00 0.00 -1.51 0.00 0.00 72.50 69.28 2i0w s THR 197 CO 0.73 -0.04 0.16 0.20 -2.21 0.00 0.00 174.62 173.45 2i0w s ASN 198 N -2.93 4.32 0.06 8.08 0.02 -1.26 -3.94 114.94 119.30 2i0w s ASN 198 Ca 0.13 -1.48 0.05 0.00 -1.02 0.00 0.00 52.86 50.55 2i0w s ASN 198 Cb -0.03 0.43 -0.03 0.00 0.02 0.00 0.00 41.25 41.64 2i0w s ASN 198 CO 0.04 -0.92 -0.15 -0.31 0.02 0.00 0.00 177.10 175.78 2i0w s TYR 199 N -2.82 1.25 -0.08 2.20 2.02 -0.36 -0.35 117.35 119.21 2i0w s TYR 199 Ca 0.18 -0.43 0.00 0.00 -0.37 0.00 0.00 57.07 56.45 2i0w s TYR 199 Cb 0.00 -0.71 0.02 0.00 -0.40 0.00 0.00 41.96 40.87 2i0w s TYR 199 CO 0.11 0.06 -0.06 1.03 -1.57 0.00 0.00 175.55 175.11 2i0w s ARG 200 N -1.57 1.24 -0.25 -0.62 0.52 0.57 -0.51 118.95 118.31 2i0w s ARG 200 Ca -0.00 -0.18 -0.04 0.00 -0.52 0.00 0.00 55.73 54.99 2i0w s ARG 200 Cb -0.09 -1.28 0.01 0.00 0.52 0.00 0.00 34.95 34.10 2i0w s ARG 200 CO 0.02 -0.18 -0.01 0.08 0.02 0.00 0.00 175.30 175.22 2i0w s VAL 201 N 1.41 3.38 -0.07 3.52 1.01 0.13 -1.30 120.40 128.48 2i0w s VAL 201 Ca -0.02 -0.73 0.04 0.00 0.00 0.00 0.00 61.98 61.27 2i0w s VAL 201 Cb -0.13 -2.66 -0.00 0.00 0.00 0.00 0.00 36.38 33.59 2i0w s VAL 201 CO -0.04 0.24 -0.21 0.54 0.00 0.00 0.00 175.10 175.64 2i0w s VAL 202 N 1.43 1.75 -0.01 2.92 0.11 -0.67 -0.59 120.40 125.34 2i0w s VAL 202 Ca 0.03 -0.87 -0.23 0.00 -2.93 0.00 0.00 61.98 57.98 2i0w s VAL 202 Cb -0.16 -1.51 -0.05 0.00 -1.53 0.00 0.00 36.38 33.13 2i0w s VAL 202 CO -0.02 0.49 0.69 -0.36 -3.33 0.00 0.00 175.10 172.58 2i0w s PHE 203 N 0.18 3.66 -1.00 1.54 0.08 -0.04 -1.62 117.98 120.79 2i0w s PHE 203 Ca -0.10 1.31 -0.08 0.00 0.12 0.00 0.00 56.93 58.18 2i0w s PHE 203 Cb -0.15 -2.76 -0.04 0.00 -0.57 0.00 0.00 43.02 39.50 2i0w s PHE 203 CO 0.05 0.22 0.84 0.00 -0.10 0.00 0.00 175.22 176.23 2i0w h PRO 205 N -0.95 0.00 -0.62 0.00 0.13 -1.78 0.11 132.00 128.90 2i0w h PRO 205 Ca -0.51 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 2i0w h PRO 205 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 2i0w h PRO 205 CO 0.42 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.28 2i0w n ASN 206 N -4.20 3.73 0.00 1.44 5.03 -1.26 -5.09 115.26 114.92 2i0w n ASN 206 Ca 0.05 -2.31 0.00 0.00 0.87 0.00 0.00 54.58 53.20 2i0w n ASN 206 Cb 0.46 -0.49 0.00 0.00 -1.02 0.00 0.00 39.78 38.72 2i0w n ASN 206 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04