#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ict h PRO 11 N 0.00 0.05 -5.99 0.00 0.11 -1.90 -3.43 132.00 120.85 1ict h PRO 11 Ca 0.00 -0.00 -0.68 0.00 0.11 0.00 0.00 66.00 65.43 1ict h PRO 11 Cb 0.00 -0.01 -0.22 0.00 0.11 0.00 0.00 31.00 30.88 1ict h PRO 11 CO 0.00 0.04 -0.72 -1.17 -0.21 0.00 0.00 178.00 175.93 1ict s LEU 12 N -10.20 2.98 -0.04 2.35 2.96 -1.26 -0.01 118.68 115.47 1ict s LEU 12 Ca -0.13 -0.13 -0.07 0.00 -0.22 0.00 0.00 54.13 53.58 1ict s LEU 12 Cb 0.07 -1.65 0.01 0.00 0.50 0.00 0.00 46.19 45.12 1ict s LEU 12 CO 0.67 0.31 0.17 -0.32 -1.32 0.00 0.00 176.35 175.85 1ict s MET 13 N -0.50 0.31 -0.10 1.98 -2.45 -0.61 -4.34 119.30 113.59 1ict s MET 13 Ca 0.07 0.03 0.03 0.00 -1.25 0.00 0.00 55.69 54.57 1ict s MET 13 Cb -0.12 0.14 0.01 0.00 1.25 0.00 0.00 34.83 36.10 1ict s MET 13 CO 0.02 -0.06 -0.20 0.08 1.05 0.00 0.00 175.02 175.92 1ict s VAL 14 N -0.41 1.77 -0.16 10.11 1.01 -1.25 -0.37 120.40 131.10 1ict s VAL 14 Ca -0.05 -0.84 0.02 0.00 0.00 0.00 0.00 61.98 61.11 1ict s VAL 14 Cb -0.03 -1.56 0.02 0.00 0.00 0.00 0.00 36.38 34.80 1ict s VAL 14 CO 0.01 0.49 -0.20 -0.75 0.00 0.00 0.00 175.10 174.65 1ict s LYS 15 N 0.58 2.94 -0.03 2.72 2.47 0.96 -0.64 119.74 128.73 1ict s LYS 15 Ca -0.14 -0.82 0.05 0.00 -1.56 0.00 0.00 55.97 53.50 1ict s LYS 15 Cb -0.17 -2.45 -0.01 0.00 -1.46 0.00 0.00 37.83 33.74 1ict s LYS 15 CO 0.05 -0.11 -0.18 0.08 0.16 0.00 0.00 175.35 175.34 1ict s VAL 16 N 1.06 1.50 0.10 4.02 1.01 0.60 -0.16 120.40 128.53 1ict s VAL 16 Ca -0.01 -0.78 0.05 0.00 0.00 0.00 0.00 61.98 61.24 1ict s VAL 16 Cb -0.14 -1.26 -0.04 0.00 0.00 0.00 0.00 36.38 34.94 1ict s VAL 16 CO -0.07 0.43 -0.12 -0.76 0.00 0.00 0.00 175.10 174.57 1ict s LEU 17 N -0.19 2.39 -0.28 3.92 1.43 -0.30 -2.01 118.68 123.63 1ict s LEU 17 Ca 0.01 -0.79 -0.08 0.00 -1.03 0.00 0.00 54.13 52.24 1ict s LEU 17 Cb -0.10 -0.42 -0.01 0.00 0.03 0.00 0.00 46.19 45.69 1ict s LEU 17 CO 0.01 -0.19 0.11 -0.62 0.23 0.00 0.00 176.35 175.88 1ict s ASP 18 N -2.36 5.32 0.31 2.29 -1.08 0.66 -0.40 116.67 121.41 1ict s ASP 18 Ca 0.06 -0.43 0.25 0.00 -0.52 0.00 0.00 52.55 51.90 1ict s ASP 18 Cb -0.05 -1.95 0.62 0.00 -1.46 0.00 0.00 42.92 40.08 1ict s ASP 18 CO 0.02 -0.13 1.71 0.00 0.52 0.00 0.00 175.17 177.28 1ict h ALA 19 N 8.29 1.00 0.04 3.66 0.00 -1.20 0.17 119.26 131.22 1ict h ALA 19 Ca -0.34 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.56 1ict h ALA 19 Cb 1.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1ict h ALA 19 CO 0.60 0.00 -0.02 0.28 0.00 0.00 0.00 179.25 180.11 1ict h VAL 20 N 0.00 1.28 0.00 0.00 2.07 -1.94 -3.35 116.25 114.31 1ict h VAL 20 Ca 0.00 -1.68 -0.08 0.00 0.82 0.00 0.00 66.70 65.76 1ict h VAL 20 Cb 0.84 2.30 -0.01 0.00 -1.52 0.00 0.00 31.29 32.90 1ict h VAL 20 CO 0.00 0.39 -0.94 0.03 0.02 0.00 0.00 177.57 177.07 1ict h ARG 21 N -0.88 0.00 -3.14 1.57 -0.00 -1.95 -3.48 114.38 106.50 1ict h ARG 21 Ca -0.01 0.00 -0.13 0.00 -0.50 0.00 0.00 59.98 59.34 1ict h ARG 21 Cb 0.68 0.00 0.06 0.00 0.00 0.00 0.00 29.97 30.71 1ict h ARG 21 CO 0.01 0.21 -0.27 0.41 0.00 0.00 0.00 179.97 180.32 1ict n GLY 22 N 1.26 0.24 3.48 0.04 0.00 0.59 -5.06 105.19 105.75 1ict n GLY 22 Ca -0.03 -0.29 -0.13 0.00 0.00 0.00 0.00 46.02 45.57 1ict n GLY 22 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ict s SER 23 N -3.35 0.63 0.47 1.61 1.04 -1.11 -4.99 113.70 108.00 1ict s SER 23 Ca 0.09 -1.36 -0.23 0.00 0.48 0.00 0.00 55.95 54.93 1ict s SER 23 Cb -0.04 0.61 -0.07 0.00 0.10 0.00 0.00 66.02 66.63 1ict s SER 23 CO 0.27 -1.21 1.20 -2.84 0.98 0.00 0.00 173.24 171.65 1ict s PRO 24 N -3.39 3.65 -0.80 4.02 0.02 -1.26 -0.25 135.00 136.99 1ict s PRO 24 Ca 0.30 1.87 -0.21 0.00 0.02 0.00 0.00 61.00 62.98 1ict s PRO 24 Cb 0.00 -2.39 0.10 0.00 0.02 0.00 0.00 34.50 32.23 1ict s PRO 24 CO 0.17 -0.67 1.05 0.00 -0.33 0.00 0.00 177.00 177.23 1ict s ALA 25 N -1.49 3.22 0.52 -1.55 0.00 -0.85 -4.63 121.76 116.98 1ict s ALA 25 Ca 0.65 -2.30 -0.19 0.00 0.00 0.00 0.00 51.96 50.12 1ict s ALA 25 Cb -0.31 -3.97 -0.07 0.00 0.00 0.00 0.00 23.12 18.77 1ict s ALA 25 CO 0.37 -2.89 1.04 0.42 0.00 0.00 0.00 175.76 174.70 1ict s ILE 26 N 3.42 3.80 -1.45 0.00 1.09 -1.26 -4.12 121.20 122.68 1ict s ILE 26 Ca 0.28 1.03 -0.08 0.00 -1.10 0.00 0.00 60.65 60.78 1ict s ILE 26 Cb -0.11 -3.43 0.04 0.00 -1.06 0.00 0.00 42.46 37.90 1ict s ILE 26 CO 0.00 -0.33 0.70 0.59 -0.10 0.00 0.00 174.94 175.80 1ict n ASN 27 N -1.30 -5.25 -4.55 3.58 3.02 0.53 -4.91 115.26 106.38 1ict n ASN 27 Ca 0.09 -0.42 -0.41 0.00 -0.03 0.00 0.00 54.58 53.80 1ict n ASN 27 Cb 0.53 -4.24 -0.08 0.00 -0.61 0.00 0.00 39.78 35.37 1ict n ASN 27 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1ict s VAL 28 N -3.14 5.05 -0.28 2.41 1.01 -1.26 -4.75 120.40 119.45 1ict s VAL 28 Ca 0.42 0.22 -0.28 0.00 0.00 0.00 0.00 61.98 62.34 1ict s VAL 28 Cb -0.20 -3.94 -0.03 0.00 0.00 0.00 0.00 36.38 32.21 1ict s VAL 28 CO 0.52 -0.21 1.99 0.00 0.00 0.00 0.00 175.10 177.41 1ict s ALA 29 N 2.29 2.80 -0.17 5.51 0.00 -1.26 -2.63 121.76 128.30 1ict s ALA 29 Ca 0.17 0.49 -0.04 0.00 0.00 0.00 0.00 51.96 52.58 1ict s ALA 29 Cb -0.16 -4.04 -0.03 0.00 0.00 0.00 0.00 23.12 18.89 1ict s ALA 29 CO 0.13 -2.71 -0.02 0.08 0.00 0.00 0.00 175.76 173.24 1ict s VAL 30 N 7.55 3.97 -0.14 0.00 1.01 0.48 -1.43 120.40 131.82 1ict s VAL 30 Ca 0.89 -0.32 0.00 0.00 0.00 0.00 0.00 61.98 62.55 1ict s VAL 30 Cb -0.27 -2.76 -0.00 0.00 0.00 0.00 0.00 36.38 33.35 1ict s VAL 30 CO 0.34 0.47 -0.16 -1.00 0.00 0.00 0.00 175.10 174.76 1ict s HIS 31 N 0.56 2.77 -0.24 5.22 3.76 0.26 -1.87 115.29 125.76 1ict s HIS 31 Ca -0.02 -0.95 -0.06 0.00 -0.15 0.00 0.00 55.06 53.88 1ict s HIS 31 Cb -0.14 -1.86 -0.02 0.00 1.11 0.00 0.00 32.58 31.67 1ict s HIS 31 CO 0.02 -0.41 0.01 0.08 -0.85 0.00 0.00 174.74 173.60 1ict s VAL 32 N 0.67 3.83 0.29 -0.90 1.01 -0.04 -0.28 120.40 124.97 1ict s VAL 32 Ca -0.08 -0.36 0.09 0.00 0.00 0.00 0.00 61.98 61.64 1ict s VAL 32 Cb -0.16 -2.78 -0.04 0.00 0.00 0.00 0.00 36.38 33.40 1ict s VAL 32 CO 0.02 0.37 0.03 -0.36 0.00 0.00 0.00 175.10 175.16 1ict s PHE 33 N 1.54 2.70 0.00 5.22 2.99 0.20 -0.22 117.98 130.41 1ict s PHE 33 Ca 0.06 -0.27 0.03 0.00 0.00 0.00 0.00 56.93 56.75 1ict s PHE 33 Cb -0.15 -1.31 -0.01 0.00 0.00 0.00 0.00 43.02 41.55 1ict s PHE 33 CO 0.00 0.55 -0.10 0.50 -0.00 0.00 0.00 175.22 176.17 1ict s ARG 34 N -3.72 0.79 1.16 0.44 3.52 0.11 -1.63 118.95 119.62 1ict s ARG 34 Ca 0.33 -0.42 -0.14 0.00 -0.13 0.00 0.00 55.73 55.36 1ict s ARG 34 Cb -0.05 -0.76 0.27 0.00 -1.56 0.00 0.00 34.95 32.85 1ict s ARG 34 CO 0.21 0.20 1.04 0.21 -0.81 0.00 0.00 175.30 176.15 1ict s LYS 35 N -0.41 -0.85 0.07 5.12 2.20 -0.17 -0.20 119.74 125.49 1ict s LYS 35 Ca 0.03 0.54 0.01 0.00 -0.36 0.00 0.00 55.97 56.19 1ict s LYS 35 Cb -0.05 -1.59 -0.04 0.00 -1.51 0.00 0.00 37.83 34.65 1ict s LYS 35 CO -0.00 -3.60 -0.05 0.00 -0.36 0.00 0.00 175.35 171.33 1ict s ALA 36 N -2.65 0.76 0.56 3.13 0.00 -0.59 -4.61 121.76 118.37 1ict s ALA 36 Ca 0.68 -1.22 0.25 0.00 0.00 0.00 0.00 51.96 51.66 1ict s ALA 36 Cb -0.20 0.18 1.59 0.00 0.00 0.00 0.00 23.12 24.69 1ict s ALA 36 CO 0.61 -0.26 2.17 0.00 0.00 0.00 0.00 175.76 178.28 1ict h ALA 37 N 3.22 1.81 0.00 0.00 0.00 -1.98 0.68 119.26 123.00 1ict h ALA 37 Ca -0.35 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1ict h ALA 37 Cb 1.16 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1ict h ALA 37 CO 0.62 -0.13 0.00 -3.47 0.00 0.00 0.00 179.25 176.27 1ict n ASP 38 N -4.08 0.00 -1.08 0.00 2.03 -1.26 -4.88 116.55 107.28 1ict n ASP 38 Ca -0.01 -0.26 -0.13 0.00 0.52 0.00 0.00 54.79 54.91 1ict n ASP 38 Cb 0.19 -0.24 -0.04 0.00 -0.72 0.00 0.00 41.12 40.31 1ict n ASP 38 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1ict n ASP 39 N -1.24 -4.40 -4.99 1.67 8.00 0.24 -5.02 116.55 110.81 1ict n ASP 39 Ca 0.15 0.24 -0.18 0.00 0.71 0.00 0.00 54.79 55.71 1ict n ASP 39 Cb 0.21 -3.15 0.00 0.00 -0.02 0.00 0.00 41.12 38.16 1ict n ASP 39 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1ict s THR 40 N -2.51 3.09 -0.19 -3.53 -4.23 -1.26 -4.82 115.64 102.19 1ict s THR 40 Ca 0.00 -1.04 -0.08 0.00 -1.18 0.00 0.00 61.69 59.38 1ict s THR 40 Cb 0.00 -3.05 -0.04 0.00 1.34 0.00 0.00 72.50 70.75 1ict s THR 40 CO 0.00 -0.02 0.09 0.26 -0.54 0.00 0.00 174.62 174.40 1ict s TRP 41 N -2.34 3.29 -0.22 3.99 0.52 -1.26 -1.54 118.94 121.37 1ict s TRP 41 Ca 0.53 0.13 -0.11 0.00 0.02 0.00 0.00 56.10 56.67 1ict s TRP 41 Cb -0.09 -2.12 -0.05 0.00 -1.15 0.00 0.00 33.47 30.06 1ict s TRP 41 CO 0.32 0.17 0.18 -1.21 0.02 0.00 0.00 176.95 176.43 1ict s GLU 42 N 0.45 4.13 -0.58 4.98 0.41 0.72 -4.91 118.70 123.90 1ict s GLU 42 Ca 0.05 -0.19 -0.27 0.00 -0.41 0.00 0.00 54.97 54.15 1ict s GLU 42 Cb -0.12 -3.50 -0.03 0.00 -1.78 0.00 0.00 34.13 28.70 1ict s GLU 42 CO 0.00 0.13 1.95 -2.14 -0.49 0.00 0.00 175.26 174.71 1ict s PRO 43 N 0.84 2.57 -0.06 0.39 0.02 -1.26 0.06 135.00 137.55 1ict s PRO 43 Ca 0.09 0.78 -0.24 0.00 0.02 0.00 0.00 61.00 61.65 1ict s PRO 43 Cb -0.13 -4.41 -0.19 0.00 0.02 0.00 0.00 34.50 29.79 1ict s PRO 43 CO 0.03 -2.78 0.96 0.35 -0.33 0.00 0.00 177.00 175.22 1ict h PHE 44 N 15.62 -0.09 -3.58 6.54 3.57 -0.88 -3.48 116.94 134.63 1ict h PHE 44 Ca -0.26 -0.00 -0.12 0.00 3.53 0.00 0.00 57.97 61.12 1ict h PHE 44 Cb 1.18 0.03 -0.06 0.00 2.79 0.00 0.00 35.95 39.89 1ict h PHE 44 CO 1.03 0.47 -0.00 0.00 -2.23 0.00 0.00 178.31 177.57 1ict s ALA 45 N -3.55 -0.09 -0.06 2.41 0.00 0.50 -5.00 121.76 115.98 1ict s ALA 45 Ca -0.15 -1.03 -0.31 0.00 0.00 0.00 0.00 51.96 50.47 1ict s ALA 45 Cb 0.00 0.97 0.08 0.00 0.00 0.00 0.00 23.12 24.17 1ict s ALA 45 CO 0.57 -0.89 0.73 -1.12 0.00 0.00 0.00 175.76 175.05 1ict s SER 46 N -3.11 -0.61 0.00 0.00 0.01 -1.26 -0.86 113.70 107.86 1ict s SER 46 Ca 0.22 0.66 0.00 0.00 1.31 0.00 0.00 55.95 58.14 1ict s SER 46 Cb -0.02 0.51 0.00 0.00 0.21 0.00 0.00 66.02 66.71 1ict s SER 46 CO 0.14 -0.58 0.00 0.61 0.41 0.00 0.00 173.24 173.82 1ict n GLY 47 N 0.85 -0.24 3.26 3.44 0.00 -0.78 -5.01 105.19 106.70 1ict n GLY 47 Ca -0.18 -0.96 -0.24 0.00 0.00 0.00 0.00 46.02 44.65 1ict n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ict s LYS 48 N -2.00 1.15 0.14 1.61 -2.85 -1.26 -0.39 119.74 116.14 1ict s LYS 48 Ca 0.00 -1.06 -0.30 0.00 -1.00 0.00 0.00 55.97 53.61 1ict s LYS 48 Cb 0.00 -1.34 -0.07 0.00 -2.06 0.00 0.00 37.83 34.36 1ict s LYS 48 CO 0.00 0.32 1.23 0.95 0.10 0.00 0.00 175.35 177.95 1ict s THR 49 N -1.05 3.65 1.30 3.79 -4.23 -1.08 -4.81 115.64 113.21 1ict s THR 49 Ca 0.06 1.30 -0.22 0.00 -1.18 0.00 0.00 61.69 61.65 1ict s THR 49 Cb -0.10 -3.83 0.33 0.00 1.34 0.00 0.00 72.50 70.24 1ict s THR 49 CO 0.03 0.16 1.06 -0.94 -0.54 0.00 0.00 174.62 174.40 1ict s SER 50 N 0.53 0.03 0.24 3.99 1.04 -1.21 -0.34 113.70 117.97 1ict s SER 50 Ca 0.56 0.57 0.19 0.00 0.48 0.00 0.00 55.95 57.75 1ict s SER 50 Cb -0.32 -0.75 0.92 0.00 0.10 0.00 0.00 66.02 65.96 1ict s SER 50 CO 0.34 -4.67 1.57 1.21 0.98 0.00 0.00 173.24 172.67 1ict n GLU 51 N -5.12 0.13 0.01 4.02 2.13 -1.26 0.03 120.64 120.57 1ict n GLU 51 Ca 0.15 0.54 0.12 0.00 0.66 0.00 0.00 57.16 58.62 1ict n GLU 51 Cb 0.60 -1.84 0.16 0.00 0.27 0.00 0.00 31.44 30.63 1ict n GLU 51 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 1ict n SER 52 N -2.10 0.60 0.00 4.31 3.41 -1.26 -4.82 113.62 113.76 1ict n SER 52 Ca -0.00 -0.31 0.00 0.00 -0.26 0.00 0.00 58.87 58.30 1ict n SER 52 Cb 0.09 0.41 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 1ict n SER 52 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ict n GLY 53 N 1.47 0.64 3.21 5.00 0.00 0.10 -4.72 105.19 110.90 1ict n GLY 53 Ca 0.05 -0.12 -0.26 0.00 0.00 0.00 0.00 46.02 45.69 1ict n GLY 53 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1ict s GLU 54 N -0.49 1.50 -0.77 1.61 -1.05 -1.26 -0.29 118.70 117.96 1ict s GLU 54 Ca 0.00 -0.78 0.03 0.00 -0.15 0.00 0.00 54.97 54.07 1ict s GLU 54 Cb 0.00 -1.50 0.26 0.00 -0.44 0.00 0.00 34.13 32.44 1ict s GLU 54 CO 0.00 0.40 0.90 -0.11 0.95 0.00 0.00 175.26 177.40 1ict n LEU 55 N 2.33 4.36 -4.89 1.83 7.94 0.19 -3.32 117.00 125.44 1ict n LEU 55 Ca -0.16 -5.35 -0.29 0.00 -1.11 0.00 0.00 56.01 49.09 1ict n LEU 55 Cb 0.53 -0.85 0.06 0.00 0.53 0.00 0.00 43.42 43.70 1ict n LEU 55 CO 0.23 1.91 0.75 -1.38 -1.11 0.00 0.00 177.39 177.80 1ict s HIS 56 N -2.39 3.17 -0.64 1.96 -3.43 -1.26 -3.90 115.29 108.79 1ict s HIS 56 Ca 0.36 0.90 -0.01 0.00 -0.80 0.00 0.00 55.06 55.50 1ict s HIS 56 Cb 0.09 -3.21 0.00 0.00 -1.43 0.00 0.00 32.58 28.04 1ict s HIS 56 CO -0.01 -1.38 0.54 0.41 -2.00 0.00 0.00 174.74 172.31 1ict n GLY 57 N -3.09 0.07 0.08 -1.38 0.00 -1.26 -4.96 105.19 94.65 1ict n GLY 57 Ca 0.07 -0.18 -0.04 0.00 0.00 0.00 0.00 46.02 45.87 1ict n GLY 57 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1ict n LEU 58 N -2.68 0.42 -4.00 0.99 7.94 -1.26 -5.01 117.00 113.40 1ict n LEU 58 Ca -0.11 0.19 -0.12 0.00 -1.11 0.00 0.00 56.01 54.86 1ict n LEU 58 Cb 0.57 0.24 -0.02 0.00 0.53 0.00 0.00 43.42 44.74 1ict n LEU 58 CO 0.32 0.29 0.25 0.28 -1.11 0.00 0.00 177.39 177.43 1ict s THR 59 N -2.80 0.00 0.14 1.96 -1.32 -1.26 -4.79 115.64 107.58 1ict s THR 59 Ca -0.07 -1.41 0.08 0.00 -1.21 0.00 0.00 61.69 59.08 1ict s THR 59 Cb 0.08 -2.66 -0.04 0.00 -1.51 0.00 0.00 72.50 68.37 1ict s THR 59 CO 0.83 0.00 -0.18 0.42 -2.21 0.00 0.00 174.62 173.48 1ict s THR 60 N -2.94 1.72 0.26 5.08 -4.23 -1.26 -4.68 115.64 109.58 1ict s THR 60 Ca 0.25 -1.79 -0.09 0.00 -1.18 0.00 0.00 61.69 58.88 1ict s THR 60 Cb -0.02 -1.72 0.37 0.00 1.34 0.00 0.00 72.50 72.47 1ict s THR 60 CO 0.17 -0.27 1.59 -0.33 -0.54 0.00 0.00 174.62 175.24 1ict h GLU 61 N 3.50 0.01 -0.80 3.99 4.39 -1.99 -0.37 114.58 123.31 1ict h GLU 61 Ca -0.43 -0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.23 1ict h GLU 61 Cb 1.20 -0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.81 1ict h GLU 61 CO 0.48 0.00 0.34 0.93 -1.16 0.00 0.00 179.01 179.61 1ict h GLU 62 N 0.01 1.18 0.00 2.33 4.39 -2.04 -3.18 114.58 117.28 1ict h GLU 62 Ca 0.42 -0.20 -0.20 0.00 0.34 0.00 0.00 59.36 59.72 1ict h GLU 62 Cb 0.67 -0.20 -0.03 0.00 -0.10 0.00 0.00 28.75 29.09 1ict h GLU 62 CO -0.87 0.94 -0.95 0.93 -1.16 0.00 0.00 179.01 177.91 1ict h GLU 63 N 1.16 0.00 -3.80 2.33 5.08 -1.55 -3.39 114.58 114.41 1ict h GLU 63 Ca 0.27 -0.00 -0.64 0.00 -1.00 0.00 0.00 59.36 57.99 1ict h GLU 63 Cb 0.18 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.44 1ict h GLU 63 CO -0.03 0.95 3.03 0.34 -1.00 0.00 0.00 179.01 182.30 1ict n PHE 64 N -3.42 2.58 -0.89 4.33 7.35 -0.38 -4.94 117.46 122.09 1ict n PHE 64 Ca -0.00 -2.58 -0.09 0.00 -0.76 0.00 0.00 57.45 54.01 1ict n PHE 64 Cb 0.89 -2.22 0.07 0.00 0.35 0.00 0.00 39.48 38.58 1ict n PHE 64 CO 0.00 0.00 0.00 1.33 -0.76 0.00 0.00 176.76 177.33 1ict n VAL 65 N 4.83 0.00 -1.52 -2.13 0.24 -1.26 -4.96 118.33 113.53 1ict n VAL 65 Ca 0.56 -0.21 -0.33 0.00 -2.04 0.00 0.00 64.34 62.33 1ict n VAL 65 Cb 0.32 -1.35 0.07 0.00 -1.47 0.00 0.00 33.84 31.42 1ict n VAL 65 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 1ict s GLU 66 N -3.82 2.44 0.00 7.34 2.12 -1.26 -4.76 118.70 120.76 1ict s GLU 66 Ca 0.23 1.42 0.00 0.00 0.36 0.00 0.00 54.97 56.98 1ict s GLU 66 Cb -0.02 -1.90 0.00 0.00 0.26 0.00 0.00 34.13 32.47 1ict s GLU 66 CO 0.17 -1.54 0.00 0.41 -0.54 0.00 0.00 175.26 173.76 1ict n GLY 67 N -0.45 1.49 3.63 -1.50 0.00 -1.03 -5.02 105.19 102.32 1ict n GLY 67 Ca 0.11 -1.80 -0.37 0.00 0.00 0.00 0.00 46.02 43.95 1ict n GLY 67 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ict s ILE 68 N -1.40 5.31 0.12 -0.61 1.01 -1.26 -0.96 121.20 123.40 1ict s ILE 68 Ca 0.00 0.28 0.08 0.00 0.00 0.00 0.00 60.65 61.01 1ict s ILE 68 Cb 0.00 -3.56 -0.04 0.00 0.01 0.00 0.00 42.46 38.87 1ict s ILE 68 CO 0.00 0.29 -0.15 -0.31 0.00 0.00 0.00 174.94 174.77 1ict s TYR 69 N 1.41 2.61 -0.18 3.97 1.51 0.10 -1.00 117.35 125.77 1ict s TYR 69 Ca 0.09 -0.22 0.01 0.00 -1.01 0.00 0.00 57.07 55.94 1ict s TYR 69 Cb -0.15 -1.37 0.02 0.00 -0.11 0.00 0.00 41.96 40.35 1ict s TYR 69 CO 0.07 0.41 -0.20 0.21 -1.11 0.00 0.00 175.55 174.94 1ict s LYS 70 N -2.23 2.99 -0.31 -0.62 2.20 -0.65 -1.55 119.74 119.58 1ict s LYS 70 Ca 0.20 -0.83 -0.07 0.00 -0.36 0.00 0.00 55.97 54.90 1ict s LYS 70 Cb -0.11 -2.56 0.01 0.00 -1.51 0.00 0.00 37.83 33.67 1ict s LYS 70 CO 0.12 -0.20 0.10 0.08 -0.36 0.00 0.00 175.35 175.09 1ict s VAL 71 N 1.28 4.05 -0.25 4.02 1.01 -0.20 -0.63 120.40 129.69 1ict s VAL 71 Ca 0.05 -0.76 -0.05 0.00 0.00 0.00 0.00 61.98 61.22 1ict s VAL 71 Cb -0.13 -3.14 -0.01 0.00 0.00 0.00 0.00 36.38 33.10 1ict s VAL 71 CO -0.13 0.00 0.01 -0.70 0.00 0.00 0.00 175.10 174.29 1ict s GLU 72 N 1.50 3.35 -0.22 2.72 2.12 0.62 -0.33 118.70 128.45 1ict s GLU 72 Ca 0.02 -0.66 -0.10 0.00 0.36 0.00 0.00 54.97 54.59 1ict s GLU 72 Cb -0.18 -3.17 -0.05 0.00 0.26 0.00 0.00 34.13 31.00 1ict s GLU 72 CO 0.03 -0.26 0.13 0.42 -0.54 0.00 0.00 175.26 175.04 1ict s ILE 73 N 1.51 5.20 -1.31 -3.70 1.01 0.62 -0.57 121.20 123.96 1ict s ILE 73 Ca 0.05 0.12 -0.16 0.00 0.00 0.00 0.00 60.65 60.66 1ict s ILE 73 Cb -0.15 -3.40 0.09 0.00 0.01 0.00 0.00 42.46 39.00 1ict s ILE 73 CO -0.00 0.38 1.77 -0.67 0.00 0.00 0.00 174.94 176.42 1ict n ASP 74 N 4.06 4.83 0.05 3.58 -0.08 -0.52 -2.24 116.55 126.24 1ict n ASP 74 Ca -0.16 -2.93 -0.10 0.00 -1.51 0.00 0.00 54.79 50.09 1ict n ASP 74 Cb 0.52 -1.68 0.02 0.00 2.34 0.00 0.00 41.12 42.32 1ict n ASP 74 CO 0.00 0.00 0.00 0.71 0.12 0.00 0.00 177.20 178.03 1ict h THR 75 N 5.02 1.38 -0.66 5.18 1.35 -1.88 -3.18 112.91 120.12 1ict h THR 75 Ca 0.44 -2.17 -0.02 0.00 -0.55 0.00 0.00 66.41 64.11 1ict h THR 75 Cb 0.82 2.14 -0.03 0.00 -1.73 0.00 0.00 68.15 69.35 1ict h THR 75 CO 1.50 0.65 0.31 0.50 -0.25 0.00 0.00 175.52 178.23 1ict h LYS 76 N 0.27 0.93 -0.24 4.72 3.64 -1.76 -2.57 116.57 121.57 1ict h LYS 76 Ca -0.04 -0.13 -0.18 0.00 -1.27 0.00 0.00 60.65 59.04 1ict h LYS 76 Cb 1.33 -0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 32.98 1ict h LYS 76 CO 0.13 0.73 -0.58 0.77 -2.27 0.00 0.00 179.45 178.23 1ict h SER 77 N 0.93 0.85 0.07 4.20 0.02 -1.86 -1.95 113.55 115.81 1ict h SER 77 Ca 0.23 -0.47 0.00 0.00 -0.84 0.00 0.00 61.79 60.71 1ict h SER 77 Cb 0.11 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.40 1ict h SER 77 CO -0.03 1.24 -0.06 0.22 -1.14 0.00 0.00 176.83 177.06 1ict h TYR 78 N 0.57 -0.16 0.09 3.45 3.20 -1.49 -2.57 116.97 120.05 1ict h TYR 78 Ca 0.00 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.87 1ict h TYR 78 Cb 1.17 0.06 0.00 0.00 1.54 0.00 0.00 36.73 39.50 1ict h TYR 78 CO 0.06 -0.10 -0.04 -1.49 -1.64 0.00 0.00 178.16 174.95 1ict h TRP 79 N -0.14 -0.11 -1.07 -3.82 -0.00 -1.48 -3.04 115.95 106.28 1ict h TRP 79 Ca 0.00 -0.00 0.30 0.00 -0.00 0.00 0.00 58.89 59.19 1ict h TRP 79 Cb 0.14 0.04 -0.11 0.00 -0.00 0.00 0.00 29.16 29.22 1ict h TRP 79 CO -0.10 0.20 0.67 0.87 -0.00 0.00 0.00 178.44 180.08 1ict h LYS 80 N -0.42 0.36 -0.84 0.49 1.57 -1.06 0.58 116.57 117.26 1ict h LYS 80 Ca -0.01 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.73 1ict h LYS 80 Cb 0.35 -0.08 -0.04 0.00 0.08 0.00 0.00 32.23 32.54 1ict h LYS 80 CO 0.02 0.24 0.46 0.00 -0.57 0.00 0.00 179.45 179.59 1ict h ALA 81 N 1.67 1.07 0.00 3.86 0.00 -1.35 -1.73 119.26 122.79 1ict h ALA 81 Ca 0.66 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.44 1ict h ALA 81 Cb 1.64 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1ict h ALA 81 CO -0.39 0.58 0.00 -0.07 0.00 0.00 0.00 179.25 179.37 1ict h LEU 82 N 1.17 0.00 0.00 0.00 3.38 0.16 -3.46 115.31 116.56 1ict h LEU 82 Ca 0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.26 1ict h LEU 82 Cb 0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.78 1ict h LEU 82 CO -0.05 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.09 1ict n GLY 83 N 0.68 1.17 3.27 0.83 0.00 -0.65 -5.10 105.19 105.38 1ict n GLY 83 Ca 0.04 -0.06 -0.29 0.00 0.00 0.00 0.00 46.02 45.70 1ict n GLY 83 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ict s ILE 84 N -2.00 1.87 -0.44 -0.61 1.01 -1.09 -5.00 121.20 114.94 1ict s ILE 84 Ca 0.00 -1.01 -0.15 0.00 0.00 0.00 0.00 60.65 59.49 1ict s ILE 84 Cb 0.00 -1.56 0.04 0.00 0.01 0.00 0.00 42.46 40.95 1ict s ILE 84 CO 0.00 0.53 0.35 -0.44 0.00 0.00 0.00 174.94 175.38 1ict s SER 85 N -0.49 6.13 0.86 3.58 0.01 -1.26 -2.54 113.70 119.99 1ict s SER 85 Ca 0.07 -1.08 -0.13 0.00 1.31 0.00 0.00 55.95 56.13 1ict s SER 85 Cb -0.10 -2.17 0.11 0.00 0.21 0.00 0.00 66.02 64.07 1ict s SER 85 CO -0.00 -0.54 1.19 -2.16 0.41 0.00 0.00 173.24 172.14 1ict s PRO 86 N 1.68 1.54 -0.03 12.44 0.04 -1.26 -5.03 135.00 144.39 1ict s PRO 86 Ca 0.05 0.06 -0.02 0.00 0.04 0.00 0.00 61.00 61.13 1ict s PRO 86 Cb -0.21 -1.91 -0.01 0.00 0.04 0.00 0.00 34.50 32.41 1ict s PRO 86 CO 0.09 -1.88 0.17 0.35 0.04 0.00 0.00 177.00 175.77 1ict h PHE 87 N -1.26 -0.06 -4.13 0.56 3.57 -1.77 -3.47 116.94 110.37 1ict h PHE 87 Ca -0.47 -0.00 -0.51 0.00 3.53 0.00 0.00 57.97 60.53 1ict h PHE 87 Cb 1.32 0.02 0.09 0.00 2.79 0.00 0.00 35.95 40.16 1ict h PHE 87 CO 0.04 -0.04 0.41 -1.01 -2.23 0.00 0.00 178.31 175.48 1ict s HIS 88 N -1.60 2.62 0.04 0.41 3.76 -1.26 -4.94 115.29 114.32 1ict s HIS 88 Ca -0.01 1.55 0.09 0.00 -0.15 0.00 0.00 55.06 56.54 1ict s HIS 88 Cb 0.00 -3.25 -0.17 0.00 1.11 0.00 0.00 32.58 30.27 1ict s HIS 88 CO 0.03 -1.67 1.19 0.93 -0.85 0.00 0.00 174.74 174.37 1ict h GLU 89 N 0.68 0.00 0.00 1.40 4.39 -1.98 -3.39 114.58 115.68 1ict h GLU 89 Ca -0.49 0.00 0.19 0.00 0.34 0.00 0.00 59.36 59.40 1ict h GLU 89 Cb 1.26 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.87 1ict h GLU 89 CO 0.55 0.82 0.63 -2.39 -1.16 0.00 0.00 179.01 177.46 1ict n HIS 90 N -3.26 -1.18 -3.67 4.33 1.44 -1.26 -3.83 115.22 107.78 1ict n HIS 90 Ca -0.03 -1.16 -0.18 0.00 -2.01 0.00 0.00 57.72 54.35 1ict n HIS 90 Cb 0.92 0.56 -0.16 0.00 0.12 0.00 0.00 29.99 31.43 1ict n HIS 90 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1ict s ALA 91 N -2.01 -0.04 0.10 1.59 0.00 -0.95 -4.93 121.76 115.52 1ict s ALA 91 Ca 0.24 0.45 0.08 0.00 0.00 0.00 0.00 51.96 52.72 1ict s ALA 91 Cb -0.02 -0.73 -0.04 0.00 0.00 0.00 0.00 23.12 22.33 1ict s ALA 91 CO 0.04 -0.52 -0.21 -1.83 0.00 0.00 0.00 175.76 173.25 1ict s GLU 92 N 2.18 1.13 -0.26 0.00 -1.05 -1.26 -0.28 118.70 119.16 1ict s GLU 92 Ca 0.03 -1.17 0.00 0.00 -0.15 0.00 0.00 54.97 53.68 1ict s GLU 92 Cb -0.12 -1.39 0.04 0.00 -0.44 0.00 0.00 34.13 32.23 1ict s GLU 92 CO -0.05 0.32 -0.07 0.08 0.95 0.00 0.00 175.26 176.49 1ict s VAL 93 N -1.18 2.60 -0.24 1.83 1.01 0.55 -4.96 120.40 120.00 1ict s VAL 93 Ca 0.07 -1.34 -0.07 0.00 0.00 0.00 0.00 61.98 60.64 1ict s VAL 93 Cb -0.10 -2.42 -0.03 0.00 0.00 0.00 0.00 36.38 33.83 1ict s VAL 93 CO 0.04 0.06 0.07 -0.69 0.00 0.00 0.00 175.10 174.58 1ict s VAL 94 N 1.22 4.39 0.19 2.92 1.01 -1.26 -1.03 120.40 127.84 1ict s VAL 94 Ca -0.04 -0.15 -0.06 0.00 0.00 0.00 0.00 61.98 61.72 1ict s VAL 94 Cb -0.18 -3.04 -0.02 0.00 0.00 0.00 0.00 36.38 33.13 1ict s VAL 94 CO -0.04 0.35 0.25 0.72 0.00 0.00 0.00 175.10 176.38 1ict s PHE 95 N 1.46 0.66 -0.37 5.22 -0.12 -0.59 -5.00 117.98 119.24 1ict s PHE 95 Ca 0.06 -0.99 -0.11 0.00 -0.05 0.00 0.00 56.93 55.84 1ict s PHE 95 Cb -0.15 -0.20 0.03 0.00 -0.63 0.00 0.00 43.02 42.07 1ict s PHE 95 CO 0.04 -0.72 0.20 0.99 -0.05 0.00 0.00 175.22 175.67 1ict s THR 96 N -4.04 4.53 0.06 -4.49 2.01 -1.26 -0.73 115.64 111.72 1ict s THR 96 Ca 0.25 -0.87 0.01 0.00 0.31 0.00 0.00 61.69 61.40 1ict s THR 96 Cb 0.04 -3.53 -0.04 0.00 0.01 0.00 0.00 72.50 68.98 1ict s THR 96 CO 0.05 -0.23 0.13 0.00 -0.69 0.00 0.00 174.62 173.88 1ict s ALA 97 N 1.55 3.73 -1.74 7.40 0.00 -0.14 -4.64 121.76 127.92 1ict s ALA 97 Ca 0.02 -0.93 0.00 0.00 0.00 0.00 0.00 51.96 51.05 1ict s ALA 97 Cb -0.19 -1.60 0.00 0.00 0.00 0.00 0.00 23.12 21.33 1ict s ALA 97 CO 0.06 0.77 0.00 0.09 0.00 0.00 0.00 175.76 176.69 1ict n ASN 98 N 0.50 -5.00 0.22 0.00 3.02 -1.26 -2.46 115.26 110.27 1ict n ASN 98 Ca -0.08 0.25 -0.15 0.00 -0.03 0.00 0.00 54.58 54.58 1ict n ASN 98 Cb 0.52 -4.33 -0.08 0.00 -0.61 0.00 0.00 39.78 35.27 1ict n ASN 98 CO 0.00 0.00 0.00 -2.24 -2.62 0.00 0.00 177.26 172.40 1ict h ASP 99 N 0.00 -0.47 0.17 6.41 3.04 -1.92 -3.32 116.42 120.33 1ict h ASP 99 Ca -0.40 -0.08 -0.01 0.00 -3.24 0.00 0.00 57.03 53.30 1ict h ASP 99 Cb 1.25 0.12 0.00 0.00 -1.04 0.00 0.00 39.33 39.66 1ict h ASP 99 CO 0.52 -0.19 -0.08 0.28 -2.04 0.00 0.00 179.24 177.74 1ict h SER 100 N -0.76 -0.19 -1.37 4.15 0.02 -1.96 -3.50 113.55 109.95 1ict h SER 100 Ca -0.06 -0.34 0.08 0.00 -0.84 0.00 0.00 61.79 60.63 1ict h SER 100 Cb 0.53 0.05 -0.01 0.00 0.14 0.00 0.00 62.40 63.10 1ict h SER 100 CO 0.09 0.33 0.27 0.61 -1.14 0.00 0.00 176.83 177.00 1ict n GLY 101 N 0.44 0.93 3.55 -3.77 0.00 -1.25 -5.11 105.19 99.99 1ict n GLY 101 Ca -0.08 -1.01 -0.36 0.00 0.00 0.00 0.00 46.02 44.57 1ict n GLY 101 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ict s PRO 102 N -2.02 2.32 -0.00 1.61 0.04 -1.26 -4.35 135.00 131.34 1ict s PRO 102 Ca 0.10 0.98 0.08 0.00 0.04 0.00 0.00 61.00 62.20 1ict s PRO 102 Cb -0.01 -4.52 -0.02 0.00 0.04 0.00 0.00 34.50 29.99 1ict s PRO 102 CO 0.02 -3.09 -0.25 1.03 0.04 0.00 0.00 177.00 174.75 1ict s ARG 103 N 7.73 2.04 -0.32 4.56 3.00 -1.26 -4.46 118.95 130.24 1ict s ARG 103 Ca 0.83 -0.97 -0.17 0.00 0.00 0.00 0.00 55.73 55.43 1ict s ARG 103 Cb -0.15 -2.05 -0.02 0.00 0.00 0.00 0.00 34.95 32.74 1ict s ARG 103 CO 0.22 0.55 0.45 1.03 0.00 0.00 0.00 175.30 177.55 1ict s ARG 104 N -0.84 3.75 -0.00 3.54 0.52 0.26 -4.85 118.95 121.33 1ict s ARG 104 Ca 0.11 -0.11 -0.07 0.00 -0.52 0.00 0.00 55.73 55.13 1ict s ARG 104 Cb -0.10 -3.75 -0.05 0.00 0.52 0.00 0.00 34.95 31.57 1ict s ARG 104 CO 0.00 -0.50 0.27 0.71 0.02 0.00 0.00 175.30 175.81 1ict s TYR 105 N 2.23 3.59 -0.16 -0.53 1.51 0.99 -0.84 117.35 124.14 1ict s TYR 105 Ca 0.17 0.61 -0.02 0.00 -1.01 0.00 0.00 57.07 56.82 1ict s TYR 105 Cb -0.16 -2.02 0.05 0.00 -0.11 0.00 0.00 41.96 39.72 1ict s TYR 105 CO 0.12 0.62 0.00 0.99 -1.11 0.00 0.00 175.55 176.17 1ict s THR 106 N -1.26 0.66 -0.26 -0.71 2.01 -1.19 -1.57 115.64 113.32 1ict s THR 106 Ca 0.26 -0.42 -0.10 0.00 0.31 0.00 0.00 61.69 61.74 1ict s THR 106 Cb -0.13 -0.99 -0.04 0.00 0.01 0.00 0.00 72.50 71.34 1ict s THR 106 CO 0.15 -0.01 0.15 -0.63 -0.69 0.00 0.00 174.62 173.59 1ict s ILE 107 N 1.82 5.04 0.05 1.82 -1.09 0.50 -1.00 121.20 128.34 1ict s ILE 107 Ca 0.01 0.07 0.07 0.00 -2.23 0.00 0.00 60.65 58.57 1ict s ILE 107 Cb -0.15 -3.37 -0.03 0.00 -1.58 0.00 0.00 42.46 37.32 1ict s ILE 107 CO -0.07 0.31 -0.16 0.00 -1.23 0.00 0.00 174.94 173.79 1ict s ALA 108 N 1.48 2.70 -0.03 9.38 0.00 -0.37 -0.03 121.76 134.88 1ict s ALA 108 Ca 0.07 -1.19 -0.01 0.00 0.00 0.00 0.00 51.96 50.82 1ict s ALA 108 Cb -0.15 -0.80 0.03 0.00 0.00 0.00 0.00 23.12 22.21 1ict s ALA 108 CO 0.07 0.59 0.06 0.00 0.00 0.00 0.00 175.76 176.48 1ict s ALA 109 N -0.99 0.03 -0.30 0.00 0.00 0.78 -2.08 121.76 119.21 1ict s ALA 109 Ca 0.16 0.36 -0.11 0.00 0.00 0.00 0.00 51.96 52.38 1ict s ALA 109 Cb -0.11 -0.35 -0.03 0.00 0.00 0.00 0.00 23.12 22.64 1ict s ALA 109 CO 0.07 -0.18 0.18 -1.17 0.00 0.00 0.00 175.76 174.66 1ict s LEU 110 N 1.27 4.09 -0.12 0.00 2.96 0.01 -1.15 118.68 125.74 1ict s LEU 110 Ca -0.07 -0.26 -0.06 0.00 -0.22 0.00 0.00 54.13 53.52 1ict s LEU 110 Cb -0.13 -2.07 -0.04 0.00 0.50 0.00 0.00 46.19 44.45 1ict s LEU 110 CO -0.04 -0.13 0.11 -0.76 -1.32 0.00 0.00 176.35 174.22 1ict s LEU 111 N 1.70 4.22 -0.01 -0.68 1.43 0.46 -1.86 118.68 123.93 1ict s LEU 111 Ca 0.06 0.39 -0.12 0.00 -1.03 0.00 0.00 54.13 53.43 1ict s LEU 111 Cb -0.16 -2.02 0.02 0.00 0.03 0.00 0.00 46.19 44.05 1ict s LEU 111 CO 0.09 0.39 0.25 -0.44 0.23 0.00 0.00 176.35 176.87 1ict s SER 112 N -0.91 -0.13 0.19 2.29 0.01 -0.42 -0.69 113.70 114.04 1ict s SER 112 Ca 0.14 0.02 -0.16 0.00 1.31 0.00 0.00 55.95 57.26 1ict s SER 112 Cb -0.12 0.29 0.17 0.00 0.21 0.00 0.00 66.02 66.58 1ict s SER 112 CO 0.03 -0.41 1.63 -0.65 0.41 0.00 0.00 173.24 174.26 1ict h PRO 113 N 4.08 -0.04 -0.43 12.44 0.11 -1.98 -2.88 132.00 143.30 1ict h PRO 113 Ca -0.30 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1ict h PRO 113 Cb 1.18 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1ict h PRO 113 CO 0.40 -0.03 0.00 0.66 -0.21 0.00 0.00 178.00 178.82 1ict n TYR 114 N -5.40 0.96 -3.62 0.65 4.02 -1.26 -2.05 117.16 110.46 1ict n TYR 114 Ca 0.05 -0.65 -0.16 0.00 -0.01 0.00 0.00 57.90 57.14 1ict n TYR 114 Cb 0.31 -0.18 -0.07 0.00 -0.02 0.00 0.00 39.34 39.37 1ict n TYR 114 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 1ict s SER 115 N -1.24 -0.54 -0.06 7.72 0.15 -1.09 -4.98 113.70 113.65 1ict s SER 115 Ca 0.39 0.70 -0.06 0.00 0.70 0.00 0.00 55.95 57.68 1ict s SER 115 Cb 0.26 0.68 0.02 0.00 -1.71 0.00 0.00 66.02 65.26 1ict s SER 115 CO 0.17 -0.46 0.17 -0.72 1.20 0.00 0.00 173.24 173.60 1ict s TYR 116 N -0.80 -0.19 -0.03 3.44 -0.85 -1.26 -1.30 117.35 116.36 1ict s TYR 116 Ca -0.09 0.46 0.05 0.00 -0.52 0.00 0.00 57.07 56.97 1ict s TYR 116 Cb -0.02 0.06 -0.01 0.00 0.38 0.00 0.00 41.96 42.37 1ict s TYR 116 CO 0.06 -0.09 -0.20 0.45 -1.52 0.00 0.00 175.55 174.25 1ict s SER 117 N 0.08 2.39 -0.03 -0.18 0.15 -0.78 -4.98 113.70 110.34 1ict s SER 117 Ca -0.00 -0.38 0.01 0.00 0.70 0.00 0.00 55.95 56.28 1ict s SER 117 Cb -0.01 -0.47 0.02 0.00 -1.71 0.00 0.00 66.02 63.85 1ict s SER 117 CO 0.00 0.21 -0.04 0.28 1.20 0.00 0.00 173.24 174.89 1ict s THR 118 N -0.24 0.46 0.11 6.45 -1.32 -1.26 -0.81 115.64 119.03 1ict s THR 118 Ca 0.02 -0.11 0.06 0.00 -1.21 0.00 0.00 61.69 60.45 1ict s THR 118 Cb -0.10 -0.48 -0.04 0.00 -1.51 0.00 0.00 72.50 70.38 1ict s THR 118 CO 0.01 0.19 -0.15 0.28 -2.21 0.00 0.00 174.62 172.74 1ict s THR 119 N 0.72 1.32 0.16 5.08 -1.32 -0.88 -5.02 115.64 115.70 1ict s THR 119 Ca -0.09 -1.62 0.11 0.00 -1.21 0.00 0.00 61.69 58.88 1ict s THR 119 Cb -0.12 -1.44 -0.04 0.00 -1.51 0.00 0.00 72.50 69.38 1ict s THR 119 CO -0.00 -0.35 -0.25 0.00 -2.21 0.00 0.00 174.62 171.82 1ict s ALA 120 N -1.88 2.37 -0.45 11.08 0.00 -1.26 -1.24 121.76 130.38 1ict s ALA 120 Ca 0.07 -1.53 0.03 0.00 0.00 0.00 0.00 51.96 50.52 1ict s ALA 120 Cb -0.06 -0.33 0.15 0.00 0.00 0.00 0.00 23.12 22.87 1ict s ALA 120 CO 0.03 0.45 0.29 0.08 0.00 0.00 0.00 175.76 176.61 1ict s VAL 121 N -1.41 1.20 -0.04 0.00 1.01 -0.17 -4.99 120.40 116.00 1ict s VAL 121 Ca 0.16 -2.67 -0.30 0.00 0.00 0.00 0.00 61.98 59.18 1ict s VAL 121 Cb -0.09 -1.83 -0.04 0.00 0.00 0.00 0.00 36.38 34.42 1ict s VAL 121 CO 0.08 -0.99 1.26 -0.69 0.00 0.00 0.00 175.10 174.76 1ict s VAL 122 N 0.17 4.10 0.02 2.92 1.01 -1.26 -3.17 120.40 124.20 1ict s VAL 122 Ca 0.22 1.44 0.01 0.00 0.00 0.00 0.00 61.98 63.64 1ict s VAL 122 Cb -0.16 -3.93 -0.02 0.00 0.00 0.00 0.00 36.38 32.27 1ict s VAL 122 CO -0.06 -0.01 -0.04 -0.89 0.00 0.00 0.00 175.10 174.11 1ict s THR 123 N 2.32 0.22 0.39 3.92 2.01 -0.02 -4.97 115.64 119.51 1ict s THR 123 Ca 0.58 -0.92 -0.23 0.00 0.31 0.00 0.00 61.69 61.43 1ict s THR 123 Cb -0.26 -0.34 -0.10 0.00 0.01 0.00 0.00 72.50 71.80 1ict s THR 123 CO 0.23 -0.45 0.97 0.20 -0.69 0.00 0.00 174.62 174.87 1ict s ASN 124 N -1.44 7.02 0.00 3.53 0.01 -1.26 0.91 114.94 123.71 1ict s ASN 124 Ca -0.14 1.80 0.19 0.00 -0.71 0.00 0.00 52.86 54.00 1ict s ASN 124 Cb -0.10 -2.56 1.15 0.00 0.41 0.00 0.00 41.25 40.16 1ict s ASN 124 CO -0.01 -0.30 1.54 -0.81 -1.51 0.00 0.00 177.10 176.02