#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k11 s GLU 2 N 0.00 0.92 0.35 1.97 2.12 -1.26 -5.18 118.70 117.62 2k11 s GLU 2 Ca 0.00 -0.50 0.04 0.00 0.36 0.00 0.00 54.97 54.86 2k11 s GLU 2 Cb 0.00 0.41 -0.04 0.00 0.26 0.00 0.00 34.13 34.76 2k11 s GLU 2 CO 0.00 -0.32 0.13 0.45 -0.54 0.00 0.00 175.26 174.98 2k11 s SER 3 N -2.24 2.22 -0.08 -1.70 0.15 -1.26 -5.10 113.70 105.69 2k11 s SER 3 Ca -0.03 -1.58 -0.01 0.00 0.70 0.00 0.00 55.95 55.03 2k11 s SER 3 Cb 0.00 0.37 -0.00 0.00 -1.71 0.00 0.00 66.02 64.67 2k11 s SER 3 CO -0.05 -0.87 -0.02 -0.09 1.20 0.00 0.00 173.24 173.42 2k11 h ARG 4 N 2.01 0.00 -1.12 5.44 2.43 -2.02 -3.34 114.38 117.78 2k11 h ARG 4 Ca -0.35 0.00 0.35 0.00 -0.81 0.00 0.00 59.98 59.17 2k11 h ARG 4 Cb 1.26 0.00 -0.13 0.00 -0.42 0.00 0.00 29.97 30.68 2k11 h ARG 4 CO 0.56 0.00 0.69 0.00 -1.51 0.00 0.00 179.97 179.71 2k11 h ALA 5 N -1.27 2.29 -0.96 2.80 0.00 -1.93 0.65 119.26 120.84 2k11 h ALA 5 Ca 0.00 0.13 0.11 0.00 0.00 0.00 0.00 54.91 55.16 2k11 h ALA 5 Cb 0.05 0.14 -0.08 0.00 0.00 0.00 0.00 17.79 17.91 2k11 h ALA 5 CO 0.00 -0.86 0.61 0.87 0.00 0.00 0.00 179.25 179.87 2k11 h LYS 6 N 0.26 0.90 -0.02 0.00 1.79 -1.89 0.18 116.57 117.78 2k11 h LYS 6 Ca 0.73 -0.05 0.01 0.00 -2.18 0.00 0.00 60.65 59.15 2k11 h LYS 6 Cb 1.95 -0.20 -0.00 0.00 -1.58 0.00 0.00 32.23 32.39 2k11 h LYS 6 CO -0.47 0.60 0.15 -0.22 -1.08 0.00 0.00 179.45 178.42 2k11 h LYS 7 N 0.93 0.00 0.00 3.15 3.64 0.20 -2.70 116.57 121.79 2k11 h LYS 7 Ca 0.46 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.84 2k11 h LYS 7 Cb 0.49 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.31 2k11 h LYS 7 CO -0.23 0.00 -0.30 0.35 -2.27 0.00 0.00 179.45 177.00 2k11 h PHE 8 N 0.00 0.00 0.00 1.91 3.04 -0.73 -3.32 116.94 117.85 2k11 h PHE 8 Ca 0.01 0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.96 2k11 h PHE 8 Cb 0.30 0.00 0.00 0.00 2.56 0.00 0.00 35.95 38.81 2k11 h PHE 8 CO 0.00 0.00 0.00 1.04 -2.02 0.00 0.00 178.31 177.33 2k11 n GLN 9 N -4.12 0.00 0.24 1.11 3.00 -1.04 0.15 117.38 116.72 2k11 n GLN 9 Ca -0.04 0.92 0.07 0.00 -0.01 0.00 0.00 57.00 57.94 2k11 n GLN 9 Cb 0.16 -1.46 0.38 0.00 0.00 0.00 0.00 30.24 29.32 2k11 n GLN 9 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.06 177.13 2k11 h ARG 10 N 0.00 0.00 0.00 -1.09 -0.00 -1.59 -1.88 114.38 109.82 2k11 h ARG 10 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.98 2k11 h ARG 10 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 29.97 2k11 h ARG 10 CO 0.00 0.00 0.00 0.94 -0.00 0.00 0.00 179.97 180.91 2k11 n GLN 11 N -2.31 0.00 -0.01 0.08 7.27 0.39 -4.85 117.38 117.96 2k11 n GLN 11 Ca -0.01 0.45 -0.01 0.00 0.07 0.00 0.00 57.00 57.50 2k11 n GLN 11 Cb 0.50 -1.06 -0.00 0.00 2.41 0.00 0.00 30.24 32.09 2k11 n GLN 11 CO 0.00 0.00 0.00 0.72 0.07 0.00 0.00 177.06 177.85 2k11 n HIS 12 N -1.85 0.02 -1.63 3.69 8.25 -0.66 -4.96 115.22 118.08 2k11 n HIS 12 Ca 0.00 0.01 -0.47 0.00 -0.26 0.00 0.00 57.72 56.99 2k11 n HIS 12 Cb 0.00 -0.10 -0.04 0.00 1.12 0.00 0.00 29.99 30.97 2k11 n HIS 12 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2k11 n MET 13 N -2.64 1.67 -3.19 -0.41 0.00 -0.76 -3.96 117.12 107.83 2k11 n MET 13 Ca -0.01 0.60 0.01 0.00 0.00 0.00 0.00 57.70 58.29 2k11 n MET 13 Cb 0.04 -2.24 -0.02 0.00 0.00 0.00 0.00 33.22 31.01 2k11 n MET 13 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 2k11 s ASP 14 N 0.41 -1.09 -0.04 3.17 2.15 -0.83 -3.88 116.67 116.56 2k11 s ASP 14 Ca 0.75 0.18 -0.12 0.00 0.43 0.00 0.00 52.55 53.79 2k11 s ASP 14 Cb -0.77 1.82 -0.32 0.00 -0.30 0.00 0.00 42.92 43.36 2k11 s ASP 14 CO 0.47 -0.31 0.72 0.77 -0.17 0.00 0.00 175.17 176.66 2k11 h SER 15 N 8.04 0.66 -0.71 -0.34 4.64 -1.60 -3.31 113.55 120.94 2k11 h SER 15 Ca -0.07 -0.94 0.11 0.00 -0.47 0.00 0.00 61.79 60.42 2k11 h SER 15 Cb 1.17 -0.22 -0.11 0.00 -0.31 0.00 0.00 62.40 62.93 2k11 h SER 15 CO 0.20 1.78 -0.29 0.47 -0.87 0.00 0.00 176.83 178.11 2k11 n ASP 16 N -3.63 -0.49 -4.10 4.97 8.00 -1.26 -4.42 116.55 115.62 2k11 n ASP 16 Ca -0.23 1.24 -0.29 0.00 0.71 0.00 0.00 54.79 56.21 2k11 n ASP 16 Cb 1.08 -0.27 0.20 0.00 -0.02 0.00 0.00 41.12 42.11 2k11 n ASP 16 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2k11 n SER 17 N -5.03 -2.58 -4.40 -2.24 7.64 -1.26 -5.04 113.62 100.72 2k11 n SER 17 Ca 0.07 -0.27 -0.20 0.00 1.01 0.00 0.00 58.87 59.47 2k11 n SER 17 Cb 0.27 -0.99 -0.10 0.00 -1.01 0.00 0.00 64.21 62.39 2k11 n SER 17 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2k11 s SER 18 N -2.10 2.82 1.14 6.43 0.01 -1.26 -4.95 113.70 115.78 2k11 s SER 18 Ca 0.57 -1.09 -0.11 0.00 1.31 0.00 0.00 55.95 56.63 2k11 s SER 18 Cb -0.14 -0.18 0.17 0.00 0.21 0.00 0.00 66.02 66.09 2k11 s SER 18 CO 0.60 -0.20 0.60 -0.81 0.41 0.00 0.00 173.24 173.84 2k11 n PRO 19 N -0.50 -2.21 -3.34 12.44 -0.04 -1.26 -4.48 135.00 135.62 2k11 n PRO 19 Ca -0.07 -0.97 -0.17 0.00 -0.04 0.00 0.00 63.50 62.26 2k11 n PRO 19 Cb 0.61 -0.91 0.08 0.00 -0.04 0.00 0.00 33.50 33.25 2k11 n PRO 19 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2k11 n SER 20 N -4.04 -2.83 -4.26 3.54 2.88 -1.26 -4.99 113.62 102.66 2k11 n SER 20 Ca 0.08 -0.55 -0.38 0.00 -1.33 0.00 0.00 58.87 56.69 2k11 n SER 20 Cb 0.33 -4.69 -0.12 0.00 -0.75 0.00 0.00 64.21 58.98 2k11 n SER 20 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2k11 s SER 21 N -4.04 5.41 -0.02 -3.46 0.01 -1.26 -4.88 113.70 105.45 2k11 s SER 21 Ca 0.11 -1.32 0.01 0.00 1.31 0.00 0.00 55.95 56.06 2k11 s SER 21 Cb -0.05 -1.90 -0.02 0.00 0.21 0.00 0.00 66.02 64.26 2k11 s SER 21 CO 0.66 -0.41 -0.02 -0.24 0.41 0.00 0.00 173.24 173.65 2k11 n SER 22 N 4.83 3.94 -3.03 2.44 2.88 -1.26 -4.19 113.62 119.23 2k11 n SER 22 Ca -0.11 -0.01 0.00 0.00 -1.33 0.00 0.00 58.87 57.42 2k11 n SER 22 Cb 0.44 0.08 0.00 0.00 -0.75 0.00 0.00 64.21 63.98 2k11 n SER 22 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2k11 n SER 23 N -2.47 -1.83 -0.06 -3.46 7.64 -1.26 -4.27 113.62 107.91 2k11 n SER 23 Ca -0.04 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.84 2k11 n SER 23 Cb 0.55 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.75 2k11 n SER 23 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2k11 n THR 24 N -2.88 0.00 -0.22 0.44 -2.24 -1.26 -4.03 114.28 104.09 2k11 n THR 24 Ca 0.00 0.00 0.04 0.00 -2.27 0.00 0.00 64.05 61.82 2k11 n THR 24 Cb 0.00 -0.40 0.09 0.00 -2.10 0.00 0.00 70.33 67.92 2k11 n THR 24 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2k11 n TYR 25 N -0.38 0.23 0.22 4.78 4.19 -1.26 0.04 117.16 124.97 2k11 n TYR 25 Ca 0.00 0.73 -0.11 0.00 3.31 0.00 0.00 57.90 61.83 2k11 n TYR 25 Cb 0.00 -0.86 -0.06 0.00 0.49 0.00 0.00 39.34 38.92 2k11 n TYR 25 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 2k11 n ASN 27 N -5.19 -0.18 -0.06 0.00 2.85 0.11 -0.92 115.26 111.86 2k11 n ASN 27 Ca -0.09 1.04 -0.04 0.00 -0.11 0.00 0.00 54.58 55.38 2k11 n ASN 27 Cb 0.27 -0.33 -0.02 0.00 1.24 0.00 0.00 39.78 40.94 2k11 n ASN 27 CO 0.00 0.00 0.00 1.56 -2.11 0.00 0.00 177.26 176.71 2k11 h GLN 28 N 0.00 0.00 -0.49 1.20 4.20 -1.38 -3.31 115.11 115.33 2k11 h GLN 28 Ca 0.31 0.00 0.04 0.00 0.06 0.00 0.00 58.65 59.06 2k11 h GLN 28 Cb 0.51 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.24 2k11 h GLN 28 CO -0.61 0.11 -0.29 -1.33 -0.67 0.00 0.00 178.83 176.04 2k11 n MET 29 N -4.68 -0.21 -0.33 1.46 2.81 0.88 0.25 117.12 117.31 2k11 n MET 29 Ca -0.06 0.85 0.09 0.00 -1.81 0.00 0.00 57.70 56.77 2k11 n MET 29 Cb 0.18 -1.25 0.26 0.00 -0.71 0.00 0.00 33.22 31.70 2k11 n MET 29 CO 0.00 0.00 0.00 0.52 1.51 0.00 0.00 175.97 178.00 2k11 h MET 30 N 0.00 0.74 -0.01 0.03 2.86 -1.23 -1.75 114.93 115.57 2k11 h MET 30 Ca 0.08 -0.04 -0.00 0.00 -2.06 0.00 0.00 59.70 57.67 2k11 h MET 30 Cb 0.20 -0.17 -0.00 0.00 0.06 0.00 0.00 31.60 31.69 2k11 h MET 30 CO -0.46 0.49 0.00 -0.09 1.06 0.00 0.00 176.91 177.91 2k11 h ARG 31 N 0.76 0.02 -1.04 1.72 2.43 0.33 -2.67 114.38 115.93 2k11 h ARG 31 Ca 0.51 -0.01 0.30 0.00 -0.81 0.00 0.00 59.98 59.98 2k11 h ARG 31 Cb 0.69 -0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.20 2k11 h ARG 31 CO -0.34 0.26 0.81 -0.09 -1.51 0.00 0.00 179.97 179.10 2k11 h ARG 32 N -0.22 0.00 -0.75 0.20 2.43 0.54 1.11 114.38 117.69 2k11 h ARG 32 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2k11 h ARG 32 Cb 0.25 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.80 2k11 h ARG 32 CO 0.00 0.00 0.00 0.54 -1.51 0.00 0.00 179.97 179.00 2k11 n ARG 33 N -4.04 1.31 -3.59 0.20 5.12 -1.01 -4.85 116.66 109.80 2k11 n ARG 33 Ca 0.22 -0.27 -0.20 0.00 -1.93 0.00 0.00 57.85 55.66 2k11 n ARG 33 Cb 1.16 -1.45 0.06 0.00 -1.16 0.00 0.00 32.46 31.08 2k11 n ARG 33 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 2k11 n ASN 34 N -0.03 -2.46 -0.00 0.55 3.02 0.38 -4.90 115.26 111.83 2k11 n ASN 34 Ca 0.02 -0.70 0.03 0.00 -0.03 0.00 0.00 54.58 53.91 2k11 n ASN 34 Cb 0.27 -4.62 -0.03 0.00 -0.61 0.00 0.00 39.78 34.78 2k11 n ASN 34 CO 0.00 0.00 0.00 0.80 -2.62 0.00 0.00 177.26 175.44 2k11 n MET 35 N -4.33 4.59 -0.13 3.52 1.56 -1.17 -4.56 117.12 116.59 2k11 n MET 35 Ca -0.23 -0.01 0.08 0.00 -0.27 0.00 0.00 57.70 57.27 2k11 n MET 35 Cb 0.65 -0.81 0.14 0.00 2.15 0.00 0.00 33.22 35.35 2k11 n MET 35 CO 0.00 0.00 0.00 0.25 -0.73 0.00 0.00 175.97 175.49 2k11 n THR 36 N -1.19 1.79 0.17 1.12 -2.24 -1.25 -4.17 114.28 108.50 2k11 n THR 36 Ca 0.01 -1.94 -0.14 0.00 -2.27 0.00 0.00 64.05 59.70 2k11 n THR 36 Cb 0.10 -0.09 -0.08 0.00 -2.10 0.00 0.00 70.33 68.15 2k11 n THR 36 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 2k11 h GLN 37 N 0.42 -0.70 0.00 -0.78 1.08 -1.87 -3.40 115.11 109.87 2k11 h GLN 37 Ca 0.00 0.05 -0.00 0.00 -1.45 0.00 0.00 58.65 57.25 2k11 h GLN 37 Cb 0.99 0.16 -0.00 0.00 -0.05 0.00 0.00 27.48 28.58 2k11 h GLN 37 CO 0.04 -0.46 -1.01 0.41 -0.95 0.00 0.00 178.83 176.86 2k11 n GLY 38 N -1.43 -0.00 3.78 3.46 0.00 -1.26 -5.06 105.19 104.67 2k11 n GLY 38 Ca -0.08 -0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.69 2k11 n GLY 38 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2k11 s ARG 39 N -2.00 2.81 -0.22 1.61 1.70 -1.26 -4.98 118.95 116.61 2k11 s ARG 39 Ca -0.00 -0.99 -0.10 0.00 -0.47 0.00 0.00 55.73 54.17 2k11 s ARG 39 Cb 0.00 -2.56 -0.05 0.00 -0.57 0.00 0.00 34.95 31.77 2k11 s ARG 39 CO 0.00 0.45 0.15 0.00 -1.08 0.00 0.00 175.30 174.82 2k11 s LYS 41 N 0.72 4.31 0.05 0.00 2.36 -1.26 -4.94 119.74 120.99 2k11 s LYS 41 Ca 0.08 2.00 -0.19 0.00 -2.55 0.00 0.00 55.97 55.31 2k11 s LYS 41 Cb -0.12 -3.40 -0.13 0.00 -1.05 0.00 0.00 37.83 33.12 2k11 s LYS 41 CO 0.01 -0.48 1.36 -1.00 1.55 0.00 0.00 175.35 176.79 2k11 h PRO 42 N 7.26 0.43 -2.75 4.03 0.13 -1.96 -3.42 132.00 135.72 2k11 h PRO 42 Ca -0.40 -0.23 -0.03 0.00 -0.87 0.00 0.00 66.00 64.47 2k11 h PRO 42 Cb 1.20 0.01 -0.14 0.00 0.13 0.00 0.00 31.00 32.20 2k11 h PRO 42 CO 0.88 0.80 0.20 0.08 -0.23 0.00 0.00 178.00 179.72 2k11 s VAL 43 N -4.31 0.00 0.07 1.56 1.01 -1.26 -3.37 120.40 114.10 2k11 s VAL 43 Ca -0.14 -0.01 -0.26 0.00 0.00 0.00 0.00 61.98 61.57 2k11 s VAL 43 Cb 0.06 -1.00 0.07 0.00 0.00 0.00 0.00 36.38 35.51 2k11 s VAL 43 CO 0.77 -0.00 0.64 0.21 0.00 0.00 0.00 175.10 176.72 2k11 s ASN 44 N -2.35 -0.60 -0.21 3.32 3.84 0.32 -4.99 114.94 114.28 2k11 s ASN 44 Ca -0.02 0.28 -0.05 0.00 0.21 0.00 0.00 52.86 53.28 2k11 s ASN 44 Cb -0.01 0.57 0.07 0.00 -0.55 0.00 0.00 41.25 41.33 2k11 s ASN 44 CO -0.07 -0.82 0.10 -0.89 -2.79 0.00 0.00 177.10 172.63 2k11 s THR 45 N -2.74 -0.07 1.14 -5.21 2.01 -1.26 0.61 115.64 110.12 2k11 s THR 45 Ca -0.03 -0.34 -0.19 0.00 0.31 0.00 0.00 61.69 61.43 2k11 s THR 45 Cb -0.01 -0.70 0.28 0.00 0.01 0.00 0.00 72.50 72.08 2k11 s THR 45 CO -0.04 -0.41 1.19 0.49 -0.69 0.00 0.00 174.62 175.16 2k11 n PHE 46 N 5.26 -3.94 -3.66 4.92 3.01 -0.68 -4.25 117.46 118.12 2k11 n PHE 46 Ca -0.07 -1.07 -0.07 0.00 1.01 0.00 0.00 57.45 57.25 2k11 n PHE 46 Cb 0.47 -1.10 -0.09 0.00 -0.01 0.00 0.00 39.48 38.75 2k11 n PHE 46 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 2k11 s VAL 47 N -3.35 -0.68 -1.01 -4.37 1.01 -1.25 -2.84 120.40 107.91 2k11 s VAL 47 Ca 0.73 0.14 0.05 0.00 0.00 0.00 0.00 61.98 62.90 2k11 s VAL 47 Cb -0.05 -0.72 0.26 0.00 0.00 0.00 0.00 36.38 35.87 2k11 s VAL 47 CO 0.54 0.06 0.97 1.41 0.00 0.00 0.00 175.10 178.08 2k11 n HIS 48 N 5.37 0.61 -4.32 5.22 8.25 0.19 -1.89 115.22 128.64 2k11 n HIS 48 Ca -0.09 -0.22 -0.32 0.00 -0.26 0.00 0.00 57.72 56.83 2k11 n HIS 48 Cb 0.50 -0.19 -0.09 0.00 1.12 0.00 0.00 29.99 31.32 2k11 n HIS 48 CO 0.00 0.00 0.00 -2.00 0.64 0.00 0.00 176.34 174.98 2k11 s GLU 49 N -1.60 2.57 0.14 -0.41 -6.30 -1.24 -4.80 118.70 107.05 2k11 s GLU 49 Ca 0.18 -0.75 -0.31 0.00 -2.50 0.00 0.00 54.97 51.59 2k11 s GLU 49 Cb 0.13 -2.53 -0.08 0.00 0.00 0.00 0.00 34.13 31.64 2k11 s GLU 49 CO 0.06 0.59 1.34 -1.25 0.02 0.00 0.00 175.26 176.02 2k11 s PRO 50 N -1.71 4.36 0.14 4.30 0.04 -1.26 -4.47 135.00 136.39 2k11 s PRO 50 Ca 0.20 2.04 -0.28 0.00 0.04 0.00 0.00 61.00 63.00 2k11 s PRO 50 Cb -0.11 -3.24 -0.06 0.00 0.04 0.00 0.00 34.50 31.13 2k11 s PRO 50 CO 0.11 -0.35 1.42 -0.11 0.04 0.00 0.00 177.00 178.10 2k11 n LEU 51 N 3.49 -0.95 -0.28 -3.56 7.94 -1.26 0.77 117.00 123.15 2k11 n LEU 51 Ca 0.09 1.63 0.24 0.00 -1.11 0.00 0.00 56.01 56.86 2k11 n LEU 51 Cb 0.43 -0.22 0.41 0.00 0.53 0.00 0.00 43.42 44.56 2k11 n LEU 51 CO 0.58 -1.32 0.73 0.55 -1.11 0.00 0.00 177.39 176.83 2k11 n VAL 52 N -5.08 -0.16 0.20 1.96 3.14 -1.26 0.14 118.33 117.27 2k11 n VAL 52 Ca 0.02 1.11 -0.12 0.00 -2.96 0.00 0.00 64.34 62.39 2k11 n VAL 52 Cb 0.23 -1.82 -0.07 0.00 -1.06 0.00 0.00 33.84 31.13 2k11 n VAL 52 CO 0.00 0.00 0.00 -0.78 -6.46 0.00 0.00 176.83 169.59 2k11 h ASP 53 N 0.00 -0.48 -0.77 6.55 1.82 -0.01 -2.95 116.42 120.58 2k11 h ASP 53 Ca 0.53 -0.10 0.05 0.00 -0.39 0.00 0.00 57.03 57.12 2k11 h ASP 53 Cb 1.69 0.12 -0.05 0.00 0.68 0.00 0.00 39.33 41.77 2k11 h ASP 53 CO -0.30 -0.06 0.47 0.58 -1.61 0.00 0.00 179.24 178.31 2k11 h VAL 54 N -1.00 1.05 -0.99 2.25 2.07 0.12 -1.83 116.25 117.92 2k11 h VAL 54 Ca -0.06 -0.30 0.16 0.00 0.82 0.00 0.00 66.70 67.32 2k11 h VAL 54 Cb 0.55 0.09 -0.09 0.00 -1.52 0.00 0.00 31.29 30.32 2k11 h VAL 54 CO 0.09 0.16 0.62 1.56 0.02 0.00 0.00 177.57 180.02 2k11 h GLN 55 N 0.88 0.79 -0.01 1.57 4.20 -0.97 0.30 115.11 121.87 2k11 h GLN 55 Ca 0.33 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.99 2k11 h GLN 55 Cb 0.11 -0.18 -0.00 0.00 0.30 0.00 0.00 27.48 27.71 2k11 h GLN 55 CO -0.15 0.52 0.01 -0.91 -0.67 0.00 0.00 178.83 177.64 2k11 h ASN 56 N 0.82 0.00 0.16 1.46 2.35 -1.14 -0.94 115.58 118.28 2k11 h ASN 56 Ca 0.53 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 56.23 2k11 h ASN 56 Cb 0.76 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.12 2k11 h ASN 56 CO -0.31 0.00 -0.20 0.58 -1.65 0.00 0.00 177.43 175.85 2k11 h VAL 57 N 0.00 1.18 0.00 2.81 2.07 -0.42 -1.51 116.25 120.39 2k11 h VAL 57 Ca 0.00 -0.83 0.00 0.00 0.82 0.00 0.00 66.70 66.70 2k11 h VAL 57 Cb 0.02 1.37 0.00 0.00 -1.52 0.00 0.00 31.29 31.16 2k11 h VAL 57 CO -0.00 0.24 0.00 0.00 0.02 0.00 0.00 177.57 177.83 2k11 n PHE 59 N -3.06 0.00 -0.01 0.00 3.72 -0.67 -4.72 117.46 112.72 2k11 n PHE 59 Ca -0.01 0.00 -0.01 0.00 -0.05 0.00 0.00 57.45 57.39 2k11 n PHE 59 Cb 0.21 0.00 -0.00 0.00 -0.94 0.00 0.00 39.48 38.75 2k11 n PHE 59 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 176.76 178.67 2k11 h GLN 60 N 2.09 0.00 -5.05 -1.08 1.08 -0.51 -3.50 115.11 108.14 2k11 h GLN 60 Ca 0.00 0.00 -0.56 0.00 -1.45 0.00 0.00 58.65 56.64 2k11 h GLN 60 Cb 0.48 0.00 -0.13 0.00 -0.05 0.00 0.00 27.48 27.78 2k11 h GLN 60 CO 0.00 0.00 -0.52 -2.00 -0.95 0.00 0.00 178.83 175.36 2k11 s GLU 61 N -1.17 1.94 0.04 1.46 2.12 -1.10 -5.10 118.70 116.89 2k11 s GLU 61 Ca -0.02 -2.18 0.01 0.00 0.36 0.00 0.00 54.97 53.14 2k11 s GLU 61 Cb 0.00 -0.65 -0.03 0.00 0.26 0.00 0.00 34.13 33.72 2k11 s GLU 61 CO 0.03 -0.47 -0.05 0.15 -0.54 0.00 0.00 175.26 174.38 2k11 s LYS 62 N -3.72 0.48 0.32 4.30 1.02 -1.26 -4.51 119.74 116.37 2k11 s LYS 62 Ca 0.23 -0.82 0.04 0.00 0.02 0.00 0.00 55.97 55.44 2k11 s LYS 62 Cb 0.03 -0.05 -0.02 0.00 -0.52 0.00 0.00 37.83 37.26 2k11 s LYS 62 CO 0.14 -0.02 0.32 0.14 -0.92 0.00 0.00 175.35 175.01 2k11 s VAL 63 N -2.00 0.00 0.56 3.17 -7.23 -0.05 -4.77 120.40 110.08 2k11 s VAL 63 Ca -0.08 -1.88 0.07 0.00 -1.81 0.00 0.00 61.98 58.28 2k11 s VAL 63 Cb -0.06 -2.53 0.06 0.00 0.56 0.00 0.00 36.38 34.40 2k11 s VAL 63 CO -0.02 0.00 0.55 -0.89 -0.31 0.00 0.00 175.10 174.43 2k11 s THR 64 N -3.42 1.82 0.08 5.32 2.01 -1.26 -4.09 115.64 116.10 2k11 s THR 64 Ca 0.38 -1.31 -0.07 0.00 0.31 0.00 0.00 61.69 61.00 2k11 s THR 64 Cb 0.02 -2.12 -0.01 0.00 0.01 0.00 0.00 72.50 70.39 2k11 s THR 64 CO 0.24 0.00 0.13 0.00 -0.69 0.00 0.00 174.62 174.30 2k11 n LYS 66 N 0.03 -0.09 0.20 0.00 0.00 -1.26 0.24 118.16 117.28 2k11 n LYS 66 Ca -0.15 1.54 0.03 0.00 0.00 0.00 0.00 58.31 59.73 2k11 n LYS 66 Cb 0.62 -2.33 0.40 0.00 0.00 0.00 0.00 35.03 33.72 2k11 n LYS 66 CO 0.00 0.00 0.00 -2.95 0.00 0.00 0.00 177.40 174.45 2k11 h ASN 67 N 0.00 0.00 0.00 3.14 7.08 -2.05 -3.46 115.58 120.28 2k11 h ASN 67 Ca 0.51 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.73 2k11 h ASN 67 Cb 0.85 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.09 2k11 h ASN 67 CO -1.00 0.33 0.00 0.61 -2.08 0.00 0.00 177.43 175.28 2k11 n GLY 68 N -0.57 1.59 3.92 9.14 0.00 0.65 -5.10 105.19 114.82 2k11 n GLY 68 Ca -0.02 -0.06 -0.26 0.00 0.00 0.00 0.00 46.02 45.67 2k11 n GLY 68 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2k11 s GLN 69 N -0.86 3.34 -0.08 1.61 -1.52 -1.26 -4.80 119.66 116.09 2k11 s GLN 69 Ca 0.00 -0.02 0.17 0.00 -1.95 0.00 0.00 55.36 53.57 2k11 s GLN 69 Cb 0.00 -2.42 0.62 0.00 -0.22 0.00 0.00 33.01 30.99 2k11 s GLN 69 CO 0.00 -0.27 1.53 0.41 -0.25 0.00 0.00 175.29 176.71 2k11 n GLY 70 N -2.24 2.87 0.67 3.09 0.00 -1.26 -3.60 105.19 104.72 2k11 n GLY 70 Ca 0.01 -0.78 0.04 0.00 0.00 0.00 0.00 46.02 45.28 2k11 n GLY 70 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2k11 n ASN 71 N 0.92 1.88 -4.70 1.61 2.04 -1.26 -4.81 115.26 110.94 2k11 n ASN 71 Ca 0.23 -2.11 -0.30 0.00 -0.44 0.00 0.00 54.58 51.95 2k11 n ASN 71 Cb 0.77 -0.31 -0.08 0.00 -2.53 0.00 0.00 39.78 37.63 2k11 n ASN 71 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 2k11 s TYR 73 N -1.31 -0.39 0.01 0.00 1.51 -0.94 -0.87 117.35 115.36 2k11 s TYR 73 Ca 0.26 0.35 0.08 0.00 -1.01 0.00 0.00 57.07 56.74 2k11 s TYR 73 Cb -0.12 0.35 -0.02 0.00 -0.11 0.00 0.00 41.96 42.06 2k11 s TYR 73 CO 0.18 -0.67 -0.24 0.15 -1.11 0.00 0.00 175.55 173.86 2k11 s LYS 74 N -2.83 2.03 0.03 -0.62 1.02 -1.26 -2.43 119.74 115.68 2k11 s LYS 74 Ca -0.03 -0.98 -0.30 0.00 0.02 0.00 0.00 55.97 54.68 2k11 s LYS 74 Cb -0.00 -2.06 -0.06 0.00 -0.52 0.00 0.00 37.83 35.19 2k11 s LYS 74 CO -0.05 0.55 1.29 -1.54 -0.92 0.00 0.00 175.35 174.68 2k11 s SER 75 N -0.93 6.96 0.15 2.83 1.04 -0.69 -4.53 113.70 118.54 2k11 s SER 75 Ca 0.11 2.06 0.24 0.00 0.48 0.00 0.00 55.95 58.84 2k11 s SER 75 Cb -0.10 -2.57 0.91 0.00 0.10 0.00 0.00 66.02 64.36 2k11 s SER 75 CO 0.01 -0.59 1.73 0.59 0.98 0.00 0.00 173.24 175.96 2k11 n ASN 76 N 4.57 0.47 -4.10 7.02 4.13 -1.26 -4.59 115.26 121.50 2k11 n ASN 76 Ca 0.11 0.58 -0.26 0.00 1.68 0.00 0.00 54.58 56.68 2k11 n ASN 76 Cb 0.45 -0.69 -0.16 0.00 -1.54 0.00 0.00 39.78 37.83 2k11 n ASN 76 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 2k11 s SER 77 N -3.88 2.14 0.81 6.41 0.01 -1.26 -5.05 113.70 112.88 2k11 s SER 77 Ca 0.09 -0.36 -0.15 0.00 1.31 0.00 0.00 55.95 56.84 2k11 s SER 77 Cb 0.12 -0.84 -0.01 0.00 0.21 0.00 0.00 66.02 65.51 2k11 s SER 77 CO 0.46 0.10 0.51 -1.54 0.41 0.00 0.00 173.24 173.18 2k11 n SER 78 N 3.51 -1.44 -3.77 2.44 3.41 -1.26 -4.52 113.62 111.98 2k11 n SER 78 Ca -0.20 0.49 -0.13 0.00 -0.26 0.00 0.00 58.87 58.78 2k11 n SER 78 Cb 0.52 -1.22 -0.12 0.00 -0.26 0.00 0.00 64.21 63.13 2k11 n SER 78 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 2k11 s MET 79 N -3.13 0.23 0.10 4.33 -1.94 -0.96 -4.76 119.30 113.17 2k11 s MET 79 Ca 0.63 0.38 -0.31 0.00 -1.71 0.00 0.00 55.69 54.67 2k11 s MET 79 Cb -0.30 0.03 -0.10 0.00 2.01 0.00 0.00 34.83 36.48 2k11 s MET 79 CO 0.61 -0.08 1.79 -1.01 -0.01 0.00 0.00 175.02 176.32 2k11 s HIS 80 N 0.54 2.16 0.21 -0.03 3.76 -1.26 -1.31 115.29 119.36 2k11 s HIS 80 Ca -0.03 0.04 -0.01 0.00 -0.15 0.00 0.00 55.06 54.91 2k11 s HIS 80 Cb -0.05 -4.12 -0.04 0.00 1.11 0.00 0.00 32.58 29.48 2k11 s HIS 80 CO -0.03 -4.63 0.13 0.96 -0.85 0.00 0.00 174.74 170.32 2k11 s ILE 81 N 2.85 0.06 -0.28 0.60 -0.00 0.97 0.54 121.20 125.94 2k11 s ILE 81 Ca 0.79 -2.00 -0.02 0.00 -0.00 0.00 0.00 60.65 59.42 2k11 s ILE 81 Cb -0.44 -2.51 0.09 0.00 -0.00 0.00 0.00 42.46 39.60 2k11 s ILE 81 CO 0.35 0.00 0.09 -0.89 -0.00 0.00 0.00 174.94 174.50 2k11 s THR 82 N -4.10 0.60 0.18 8.37 2.01 -1.13 -2.00 115.64 119.56 2k11 s THR 82 Ca 0.39 -1.08 -0.32 0.00 0.31 0.00 0.00 61.69 60.99 2k11 s THR 82 Cb 0.07 -1.39 -0.11 0.00 0.01 0.00 0.00 72.50 71.08 2k11 s THR 82 CO 0.13 -0.59 1.69 -1.81 -0.69 0.00 0.00 174.62 173.35 2k11 s ASP 83 N 1.77 6.45 -0.29 3.53 1.11 -0.17 -1.69 116.67 127.38 2k11 s ASP 83 Ca 0.07 2.77 -0.00 0.00 0.18 0.00 0.00 52.55 55.57 2k11 s ASP 83 Cb -0.17 -2.59 0.09 0.00 1.07 0.00 0.00 42.92 41.32 2k11 s ASP 83 CO -0.24 -0.93 0.07 0.00 1.18 0.00 0.00 175.17 175.24 2k11 s ARG 85 N 1.55 0.88 0.55 0.00 3.52 -1.22 0.12 118.95 124.35 2k11 s ARG 85 Ca 0.07 -0.69 -0.19 0.00 -0.13 0.00 0.00 55.73 54.79 2k11 s ARG 85 Cb -0.18 -0.87 -0.07 0.00 -1.56 0.00 0.00 34.95 32.27 2k11 s ARG 85 CO -0.20 0.22 0.80 1.28 -0.81 0.00 0.00 175.30 176.58 2k11 n LEU 86 N 2.02 2.32 -4.18 -0.88 4.77 -1.22 0.17 117.00 120.00 2k11 n LEU 86 Ca -0.18 0.82 -0.32 0.00 -0.03 0.00 0.00 56.01 56.30 2k11 n LEU 86 Cb 0.55 -1.29 -0.17 0.00 -2.33 0.00 0.00 43.42 40.18 2k11 n LEU 86 CO 0.23 -2.27 -0.55 0.28 -1.33 0.00 0.00 177.39 173.76 2k11 s THR 87 N -1.55 2.04 -0.77 -5.08 -1.32 -0.57 -4.64 115.64 103.76 2k11 s THR 87 Ca 0.71 -0.98 -0.03 0.00 -1.21 0.00 0.00 61.69 60.18 2k11 s THR 87 Cb -0.46 -1.79 0.00 0.00 -1.51 0.00 0.00 72.50 68.74 2k11 s THR 87 CO 0.52 0.55 0.66 -3.20 -2.21 0.00 0.00 174.62 170.93 2k11 n ASN 88 N 3.92 -3.36 -2.11 8.08 2.85 -1.26 -2.72 115.26 120.66 2k11 n ASN 88 Ca -0.20 -0.35 -0.10 0.00 -0.11 0.00 0.00 54.58 53.83 2k11 n ASN 88 Cb 0.52 -3.25 -0.02 0.00 1.24 0.00 0.00 39.78 38.28 2k11 n ASN 88 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2k11 n GLY 89 N -1.25 -0.07 3.63 8.20 0.00 -1.26 -4.83 105.19 109.62 2k11 n GLY 89 Ca -0.08 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.47 2k11 n GLY 89 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2k11 n SER 90 N -1.27 2.25 -4.23 1.61 7.64 -1.10 -4.99 113.62 113.53 2k11 n SER 90 Ca -0.11 1.13 -0.13 0.00 1.01 0.00 0.00 58.87 60.76 2k11 n SER 90 Cb 0.51 -1.33 -0.10 0.00 -1.01 0.00 0.00 64.21 62.28 2k11 n SER 90 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2k11 s ARG 91 N -0.02 1.04 0.26 1.43 1.81 0.17 -4.75 118.95 118.89 2k11 s ARG 91 Ca 0.74 -1.46 -0.30 0.00 -1.72 0.00 0.00 55.73 52.99 2k11 s ARG 91 Cb -0.76 -0.42 -0.14 0.00 -0.45 0.00 0.00 34.95 33.18 2k11 s ARG 91 CO 0.48 -0.02 1.21 0.98 -0.68 0.00 0.00 175.30 177.27 2k11 n TYR 92 N -0.19 1.71 0.25 -0.53 4.19 -1.26 0.28 117.16 121.60 2k11 n TYR 92 Ca -0.09 0.59 0.13 0.00 3.31 0.00 0.00 57.90 61.84 2k11 n TYR 92 Cb 0.62 -2.35 0.58 0.00 0.49 0.00 0.00 39.34 38.69 2k11 n TYR 92 CO 0.00 0.00 0.00 -1.00 0.91 0.00 0.00 176.86 176.77 2k11 h PRO 93 N 3.06 0.00 -5.63 2.98 0.13 -1.98 -3.49 132.00 127.08 2k11 h PRO 93 Ca -0.43 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.21 2k11 h PRO 93 Cb 1.31 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.44 2k11 h PRO 93 CO 0.68 0.14 1.62 0.09 -0.23 0.00 0.00 178.00 180.30 2k11 n ASN 94 N -3.34 2.25 -0.23 1.44 4.13 0.80 -4.74 115.26 115.57 2k11 n ASN 94 Ca -0.00 -0.30 0.08 0.00 1.68 0.00 0.00 54.58 56.04 2k11 n ASN 94 Cb 0.36 -1.50 0.14 0.00 -1.54 0.00 0.00 39.78 37.23 2k11 n ASN 94 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2k11 n ALA 96 N -1.05 0.64 -3.43 0.00 0.00 -1.26 -4.57 120.51 110.84 2k11 n ALA 96 Ca 0.14 0.21 -0.26 0.00 0.00 0.00 0.00 53.44 53.53 2k11 n ALA 96 Cb 0.62 -2.44 0.04 0.00 0.00 0.00 0.00 19.45 17.66 2k11 n ALA 96 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2k11 n TYR 97 N 7.29 -1.51 -3.94 0.00 4.01 -1.26 -1.50 117.16 120.24 2k11 n TYR 97 Ca 0.29 -2.22 -0.34 0.00 -0.16 0.00 0.00 57.90 55.47 2k11 n TYR 97 Cb 0.23 -0.51 -0.14 0.00 -0.31 0.00 0.00 39.34 38.62 2k11 n TYR 97 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 2k11 s ARG 98 N -4.47 2.15 -0.46 -0.72 1.81 0.44 -4.47 118.95 113.23 2k11 s ARG 98 Ca 0.48 -1.49 -0.28 0.00 -1.72 0.00 0.00 55.73 52.71 2k11 s ARG 98 Cb -0.04 -3.20 0.01 0.00 -0.45 0.00 0.00 34.95 31.27 2k11 s ARG 98 CO 0.30 -0.75 1.47 0.99 -0.68 0.00 0.00 175.30 176.63 2k11 s THR 99 N 1.14 3.80 -0.40 0.02 2.01 -1.26 -3.43 115.64 117.53 2k11 s THR 99 Ca -0.01 0.77 -0.02 0.00 0.31 0.00 0.00 61.69 62.75 2k11 s THR 99 Cb -0.20 -4.21 0.11 0.00 0.01 0.00 0.00 72.50 68.20 2k11 s THR 99 CO -0.04 -0.86 0.17 -0.44 -0.69 0.00 0.00 174.62 172.77 2k11 s SER 100 N 4.48 5.16 0.03 3.53 0.01 0.33 -4.47 113.70 122.78 2k11 s SER 100 Ca 0.61 -2.06 -0.30 0.00 1.31 0.00 0.00 55.95 55.50 2k11 s SER 100 Cb -0.13 -1.79 -0.06 0.00 0.21 0.00 0.00 66.02 64.24 2k11 s SER 100 CO 0.30 -0.51 1.43 -2.16 0.41 0.00 0.00 173.24 172.70 2k11 s PRO 101 N 1.09 4.28 0.18 12.44 0.04 -1.26 -1.00 135.00 150.78 2k11 s PRO 101 Ca 0.09 2.03 -0.23 0.00 0.04 0.00 0.00 61.00 62.92 2k11 s PRO 101 Cb -0.22 -3.51 0.05 0.00 0.04 0.00 0.00 34.50 30.86 2k11 s PRO 101 CO -0.05 -0.56 0.75 0.15 0.04 0.00 0.00 177.00 177.33 2k11 s LYS 102 N 2.16 1.40 -0.22 4.56 1.02 -0.85 -4.98 119.74 122.83 2k11 s LYS 102 Ca 0.65 -0.68 -0.04 0.00 0.02 0.00 0.00 55.97 55.92 2k11 s LYS 102 Cb -0.33 0.54 0.07 0.00 -0.52 0.00 0.00 37.83 37.58 2k11 s LYS 102 CO 0.28 -0.63 0.08 -1.83 -0.92 0.00 0.00 175.35 172.33 2k11 s GLU 103 N -3.64 0.38 0.21 1.68 -1.05 -1.26 -0.02 118.70 114.99 2k11 s GLU 103 Ca 0.07 -0.41 -0.18 0.00 -0.15 0.00 0.00 54.97 54.31 2k11 s GLU 103 Cb -0.03 -1.83 0.03 0.00 -0.44 0.00 0.00 34.13 31.86 2k11 s GLU 103 CO -0.02 -0.76 0.55 0.50 0.95 0.00 0.00 175.26 176.48 2k11 s ARG 104 N 1.97 1.44 1.12 -4.83 6.06 -0.42 -4.63 118.95 119.65 2k11 s ARG 104 Ca 0.03 -0.90 -0.19 0.00 -2.50 0.00 0.00 55.73 52.18 2k11 s ARG 104 Cb -0.17 0.53 0.10 0.00 0.06 0.00 0.00 34.95 35.48 2k11 s ARG 104 CO -0.16 -0.62 0.01 0.72 -2.50 0.00 0.00 175.30 172.76 2k11 n HIS 105 N -0.36 -1.42 -3.86 5.12 8.25 -1.26 -2.26 115.22 119.44 2k11 n HIS 105 Ca -0.09 0.14 -0.11 0.00 -0.26 0.00 0.00 57.72 57.41 2k11 n HIS 105 Cb 0.62 -1.57 -0.09 0.00 1.12 0.00 0.00 29.99 30.07 2k11 n HIS 105 CO 0.00 0.00 0.00 0.96 0.64 0.00 0.00 176.34 177.94 2k11 s ILE 106 N -2.24 0.10 -0.22 1.59 -4.36 -1.26 -0.94 121.20 113.87 2k11 s ILE 106 Ca 0.56 -0.84 0.01 0.00 -0.26 0.00 0.00 60.65 60.12 2k11 s ILE 106 Cb -0.12 -0.76 0.03 0.00 1.25 0.00 0.00 42.46 42.87 2k11 s ILE 106 CO 0.66 -0.46 -0.14 -0.63 0.24 0.00 0.00 174.94 174.61 2k11 s ILE 107 N -2.16 2.31 0.20 8.37 1.01 -0.02 -1.70 121.20 129.22 2k11 s ILE 107 Ca -0.08 -1.15 0.07 0.00 0.00 0.00 0.00 60.65 59.48 2k11 s ILE 107 Cb -0.03 -2.14 -0.05 0.00 0.01 0.00 0.00 42.46 40.25 2k11 s ILE 107 CO -0.02 0.29 -0.11 0.68 0.00 0.00 0.00 174.94 175.78 2k11 s VAL 108 N 1.25 1.54 -0.43 2.92 -7.23 -1.02 -1.68 120.40 115.75 2k11 s VAL 108 Ca -0.00 -2.15 -0.07 0.00 -1.81 0.00 0.00 61.98 57.94 2k11 s VAL 108 Cb -0.16 -2.07 0.10 0.00 0.56 0.00 0.00 36.38 34.81 2k11 s VAL 108 CO -0.08 -0.57 0.27 0.00 -0.31 0.00 0.00 175.10 174.40 2k11 s ALA 109 N -3.09 3.28 0.27 1.32 0.00 0.91 -2.22 121.76 122.23 2k11 s ALA 109 Ca 0.22 -2.39 0.00 0.00 0.00 0.00 0.00 51.96 49.80 2k11 s ALA 109 Cb 0.01 -2.63 -0.04 0.00 0.00 0.00 0.00 23.12 20.46 2k11 s ALA 109 CO 0.06 -1.77 0.46 0.00 0.00 0.00 0.00 175.76 174.51 2k11 s GLU 111 N -3.80 1.12 0.13 0.00 -6.30 0.01 -4.73 118.70 105.12 2k11 s GLU 111 Ca 0.39 -0.64 0.00 0.00 -2.50 0.00 0.00 54.97 52.22 2k11 s GLU 111 Cb -0.10 0.36 0.00 0.00 0.00 0.00 0.00 34.13 34.39 2k11 s GLU 111 CO 0.32 -0.51 0.00 0.41 0.02 0.00 0.00 175.26 175.49 2k11 n GLY 112 N -0.52 -2.18 3.38 -1.50 0.00 -1.26 -3.62 105.19 99.49 2k11 n GLY 112 Ca -0.06 -1.39 -0.34 0.00 0.00 0.00 0.00 46.02 44.23 2k11 n GLY 112 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2k11 s SER 113 N -5.51 4.34 1.12 1.61 0.15 -1.26 -2.12 113.70 112.03 2k11 s SER 113 Ca 0.00 -0.29 -0.16 0.00 0.70 0.00 0.00 55.95 56.19 2k11 s SER 113 Cb 0.00 -1.71 0.25 0.00 -1.71 0.00 0.00 66.02 62.85 2k11 s SER 113 CO 0.00 0.10 1.10 -2.16 1.20 0.00 0.00 173.24 173.48 2k11 s PRO 114 N 0.78 -0.54 -0.66 5.44 0.04 -1.26 -5.05 135.00 133.75 2k11 s PRO 114 Ca -0.03 0.17 -0.27 0.00 0.04 0.00 0.00 61.00 60.91 2k11 s PRO 114 Cb -0.15 -1.65 0.02 0.00 0.04 0.00 0.00 34.50 32.76 2k11 s PRO 114 CO 0.02 -3.31 1.37 -0.47 0.04 0.00 0.00 177.00 174.65 2k11 s TYR 115 N -2.99 2.25 0.11 0.56 5.04 -0.90 -4.82 117.35 116.59 2k11 s TYR 115 Ca 0.69 0.24 0.04 0.00 -2.44 0.00 0.00 57.07 55.60 2k11 s TYR 115 Cb -0.14 -4.49 -0.04 0.00 0.35 0.00 0.00 41.96 37.64 2k11 s TYR 115 CO 0.57 -2.02 -0.10 0.14 -1.34 0.00 0.00 175.55 172.80 2k11 s VAL 116 N 6.13 1.02 -0.04 3.14 -7.23 -1.24 -4.89 120.40 117.28 2k11 s VAL 116 Ca 0.44 -1.81 -0.30 0.00 -1.81 0.00 0.00 61.98 58.50 2k11 s VAL 116 Cb -0.09 -1.56 -0.05 0.00 0.56 0.00 0.00 36.38 35.24 2k11 s VAL 116 CO 0.19 -0.64 1.48 -2.16 -0.31 0.00 0.00 175.10 173.67 2k11 s PRO 117 N -3.19 4.23 0.00 4.82 0.04 -1.26 -0.81 135.00 138.83 2k11 s PRO 117 Ca 0.10 2.01 0.02 0.00 0.04 0.00 0.00 61.00 63.18 2k11 s PRO 117 Cb -0.00 -3.75 0.04 0.00 0.04 0.00 0.00 34.50 30.82 2k11 s PRO 117 CO -0.00 -0.70 0.76 1.33 0.04 0.00 0.00 177.00 178.42 2k11 n VAL 118 N 5.08 0.38 -3.65 -0.36 0.24 -0.70 -4.55 118.33 114.77 2k11 n VAL 118 Ca 0.15 -0.69 -0.12 0.00 -2.04 0.00 0.00 64.34 61.63 2k11 n VAL 118 Cb 0.43 0.84 -0.08 0.00 -1.47 0.00 0.00 33.84 33.56 2k11 n VAL 118 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 2k11 s HIS 119 N -0.51 -0.78 -0.16 6.34 5.65 -0.98 -4.60 115.29 120.26 2k11 s HIS 119 Ca 0.04 1.79 -0.06 0.00 0.25 0.00 0.00 55.06 57.08 2k11 s HIS 119 Cb 0.02 0.32 -0.04 0.00 -1.18 0.00 0.00 32.58 31.71 2k11 s HIS 119 CO 0.03 -0.38 0.03 0.12 -0.65 0.00 0.00 174.74 173.89 2k11 s PHE 120 N 0.67 3.19 0.00 3.88 2.19 -1.26 -0.06 117.98 126.59 2k11 s PHE 120 Ca -0.03 0.01 0.00 0.00 0.33 0.00 0.00 56.93 57.24 2k11 s PHE 120 Cb -0.05 -2.00 0.00 0.00 -1.31 0.00 0.00 43.02 39.66 2k11 s PHE 120 CO -0.04 0.17 0.00 -3.47 1.83 0.00 0.00 175.22 173.71 2k11 n ASP 121 N 3.28 0.00 -3.64 6.13 -0.08 -0.67 -4.95 116.55 116.63 2k11 n ASP 121 Ca -0.17 0.03 -0.02 0.00 -1.51 0.00 0.00 54.79 53.11 2k11 n ASP 121 Cb 0.53 -0.25 -0.01 0.00 2.34 0.00 0.00 41.12 43.72 2k11 n ASP 121 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2k11 s ALA 122 N -3.94 -2.01 0.50 -1.67 0.00 -1.12 -5.03 121.76 108.49 2k11 s ALA 122 Ca 0.00 0.76 -0.09 0.00 0.00 0.00 0.00 51.96 52.63 2k11 s ALA 122 Cb 0.00 0.35 -0.05 0.00 0.00 0.00 0.00 23.12 23.42 2k11 s ALA 122 CO 0.00 -0.92 0.86 -1.54 0.00 0.00 0.00 175.76 174.16 2k11 s SER 123 N -2.76 6.34 0.43 0.00 1.04 -1.26 -0.84 113.70 116.65 2k11 s SER 123 Ca 0.12 1.16 0.08 0.00 0.48 0.00 0.00 55.95 57.78 2k11 s SER 123 Cb 0.01 -2.34 -0.01 0.00 0.10 0.00 0.00 66.02 63.78 2k11 s SER 123 CO -0.03 -0.62 0.40 -0.69 0.98 0.00 0.00 173.24 173.28 2k11 s VAL 124 N -2.77 2.58 -0.03 5.02 1.01 -0.11 -4.85 120.40 121.25 2k11 s VAL 124 Ca 0.51 -1.33 -0.03 0.00 0.00 0.00 0.00 61.98 61.13 2k11 s VAL 124 Cb -0.10 -2.91 -0.01 0.00 0.00 0.00 0.00 36.38 33.35 2k11 s VAL 124 CO 0.43 0.00 -0.05 -0.62 0.00 0.00 0.00 175.10 174.86 2k11 n GLU 125 N -1.59 0.08 -4.37 2.72 4.71 -1.26 -4.22 120.64 116.70 2k11 n GLU 125 Ca 0.04 0.09 -0.21 0.00 -0.01 0.00 0.00 57.16 57.06 2k11 n GLU 125 Cb 0.62 -0.71 -0.08 0.00 -1.01 0.00 0.00 31.44 30.26 2k11 n GLU 125 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 2k11 s ASP 126 N -4.22 2.00 0.00 1.62 1.01 -1.26 -4.71 116.67 111.10 2k11 s ASP 126 Ca -0.04 -1.68 0.00 0.00 0.71 0.00 0.00 52.55 51.53 2k11 s ASP 126 Cb 0.01 0.51 0.00 0.00 1.01 0.00 0.00 42.92 44.44 2k11 s ASP 126 CO 0.06 -0.98 0.44 -0.24 0.21 0.00 0.00 175.17 174.66