#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1igc s ILE 2 N 0.00 2.52 -0.16 2.41 1.01 -1.26 -5.01 121.20 120.71 1igc s ILE 2 Ca 0.00 0.45 0.01 0.00 0.00 0.00 0.00 60.65 61.11 1igc s ILE 2 Cb 0.00 -3.26 0.03 0.00 0.01 0.00 0.00 42.46 39.24 1igc s ILE 2 CO 0.00 0.05 -0.15 -0.69 0.00 0.00 0.00 174.94 174.16 1igc s VAL 3 N -1.28 1.68 -0.32 2.92 1.01 -1.26 -4.73 120.40 118.42 1igc s VAL 3 Ca 0.60 -0.75 -0.15 0.00 0.00 0.00 0.00 61.98 61.67 1igc s VAL 3 Cb -0.38 -1.59 -0.02 0.00 0.00 0.00 0.00 36.38 34.39 1igc s VAL 3 CO 0.49 0.43 0.35 -0.04 0.00 0.00 0.00 175.10 176.32 1igc s MET 4 N 1.43 3.71 -0.31 2.72 -1.94 -1.26 -0.10 119.30 123.55 1igc s MET 4 Ca 0.04 -0.30 0.00 0.00 -1.71 0.00 0.00 55.69 53.72 1igc s MET 4 Cb -0.13 -3.76 0.07 0.00 2.01 0.00 0.00 34.83 33.02 1igc s MET 4 CO -0.11 -0.43 0.01 0.99 -0.01 0.00 0.00 175.02 175.47 1igc s THR 5 N 2.00 2.71 -0.17 2.05 2.01 -0.58 -4.12 115.64 119.55 1igc s THR 5 Ca 0.12 -1.69 -0.10 0.00 0.31 0.00 0.00 61.69 60.32 1igc s THR 5 Cb -0.16 -2.68 -0.05 0.00 0.01 0.00 0.00 72.50 69.62 1igc s THR 5 CO 0.11 -0.25 0.18 -1.10 -0.69 0.00 0.00 174.62 172.88 1igc s GLN 6 N 1.14 4.03 0.01 4.92 -0.21 -1.26 -2.12 119.66 126.17 1igc s GLN 6 Ca -0.02 -0.10 0.01 0.00 0.02 0.00 0.00 55.36 55.26 1igc s GLN 6 Cb -0.20 -3.36 -0.01 0.00 1.00 0.00 0.00 33.01 30.44 1igc s GLN 6 CO -0.04 0.41 -0.03 0.45 -2.12 0.00 0.00 175.29 173.97 1igc s SER 7 N 0.02 0.28 0.11 5.90 0.15 -0.99 -4.47 113.70 114.70 1igc s SER 7 Ca 0.12 -0.20 -0.14 0.00 0.70 0.00 0.00 55.95 56.43 1igc s SER 7 Cb -0.12 0.01 -0.05 0.00 -1.71 0.00 0.00 66.02 64.15 1igc s SER 7 CO 0.01 -0.08 1.49 1.55 1.20 0.00 0.00 173.24 177.42 1igc h PRO 8 N 5.59 0.73 0.00 5.44 0.13 -1.86 -2.24 132.00 139.79 1igc h PRO 8 Ca -0.28 -0.31 0.00 0.00 -0.87 0.00 0.00 66.00 64.54 1igc h PRO 8 Cb 1.21 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1igc h PRO 8 CO 0.47 0.92 0.00 1.17 -0.23 0.00 0.00 178.00 180.33 1igc n LYS 9 N -4.33 0.00 -3.52 0.86 0.00 -1.26 -5.04 118.16 104.87 1igc n LYS 9 Ca -0.02 0.00 -0.16 0.00 0.00 0.00 0.00 58.31 58.13 1igc n LYS 9 Cb 0.39 0.00 -0.05 0.00 0.00 0.00 0.00 35.03 35.37 1igc n LYS 9 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 1igc s SER 10 N -0.50 -0.58 -0.29 3.14 0.01 -1.26 -2.99 113.70 111.22 1igc s SER 10 Ca 0.00 0.56 -0.25 0.00 1.31 0.00 0.00 55.95 57.58 1igc s SER 10 Cb 0.00 0.49 0.16 0.00 0.21 0.00 0.00 66.02 66.89 1igc s SER 10 CO 0.00 -0.59 1.27 0.00 0.41 0.00 0.00 173.24 174.33 1igc s MET 11 N -1.48 0.24 -0.11 12.44 0.23 -1.07 -4.93 119.30 124.61 1igc s MET 11 Ca -0.07 0.29 0.03 0.00 -1.03 0.00 0.00 55.69 54.90 1igc s MET 11 Cb -0.00 0.11 -0.00 0.00 -1.53 0.00 0.00 34.83 33.41 1igc s MET 11 CO 0.06 -0.03 -0.22 -1.12 -2.03 0.00 0.00 175.02 171.68 1igc s SER 12 N 0.16 3.24 -0.03 -1.18 0.01 -1.25 -1.33 113.70 113.32 1igc s SER 12 Ca 0.05 -0.53 0.01 0.00 1.31 0.00 0.00 55.95 56.78 1igc s SER 12 Cb -0.05 -1.45 0.02 0.00 0.21 0.00 0.00 66.02 64.75 1igc s SER 12 CO -0.12 0.14 -0.02 -0.04 0.41 0.00 0.00 173.24 173.61 1igc s MET 13 N 0.45 0.50 0.73 12.44 -1.94 -0.39 -4.78 119.30 126.32 1igc s MET 13 Ca -0.15 -0.02 -0.13 0.00 -1.71 0.00 0.00 55.69 53.68 1igc s MET 13 Cb -0.17 -0.59 0.04 0.00 2.01 0.00 0.00 34.83 36.12 1igc s MET 13 CO 0.06 -0.09 1.13 -1.54 -0.01 0.00 0.00 175.02 174.58 1igc s SER 14 N 0.83 4.49 0.32 3.03 1.04 -1.26 -1.63 113.70 120.53 1igc s SER 14 Ca -0.09 2.07 -0.29 0.00 0.48 0.00 0.00 55.95 58.11 1igc s SER 14 Cb -0.13 -2.56 -0.10 0.00 0.10 0.00 0.00 66.02 63.34 1igc s SER 14 CO -0.01 -2.05 1.26 -0.69 0.98 0.00 0.00 173.24 172.73 1igc s VAL 15 N -2.42 2.89 0.00 5.02 1.01 -1.26 -3.30 120.40 122.34 1igc s VAL 15 Ca 0.67 0.90 0.00 0.00 0.00 0.00 0.00 61.98 63.55 1igc s VAL 15 Cb -0.22 -3.57 0.00 0.00 0.00 0.00 0.00 36.38 32.59 1igc s VAL 15 CO 0.48 0.22 0.00 0.61 0.00 0.00 0.00 175.10 176.40 1igc n GLY 16 N 0.89 0.70 3.89 4.51 0.00 0.42 -4.91 105.19 110.69 1igc n GLY 16 Ca -0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.77 1igc n GLY 16 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1igc s GLU 17 N -0.61 3.20 0.36 1.61 2.56 -1.21 -4.62 118.70 119.99 1igc s GLU 17 Ca 0.00 -0.79 -0.13 0.00 0.00 0.00 0.00 54.97 54.05 1igc s GLU 17 Cb 0.00 -2.79 -0.08 0.00 2.00 0.00 0.00 34.13 33.26 1igc s GLU 17 CO 0.00 0.47 0.75 0.50 -0.56 0.00 0.00 175.26 176.42 1igc s ARG 18 N -3.47 3.89 0.02 4.30 3.52 -1.23 -0.79 118.95 125.19 1igc s ARG 18 Ca 0.33 0.57 -0.01 0.00 -0.13 0.00 0.00 55.73 56.49 1igc s ARG 18 Cb -0.10 -2.41 -0.02 0.00 -1.56 0.00 0.00 34.95 30.86 1igc s ARG 18 CO 0.27 0.07 -0.01 0.08 -0.81 0.00 0.00 175.30 174.89 1igc s VAL 19 N -2.17 0.11 -0.04 7.11 1.01 -0.01 -4.97 120.40 121.45 1igc s VAL 19 Ca 0.53 -0.95 0.03 0.00 0.00 0.00 0.00 61.98 61.59 1igc s VAL 19 Cb -0.10 -0.36 0.00 0.00 0.00 0.00 0.00 36.38 35.92 1igc s VAL 19 CO 0.24 -0.52 -0.14 -0.89 0.00 0.00 0.00 175.10 173.79 1igc s THR 20 N -1.62 1.16 -0.02 3.92 2.01 -1.26 -1.55 115.64 118.27 1igc s THR 20 Ca -0.14 -0.56 0.07 0.00 0.31 0.00 0.00 61.69 61.36 1igc s THR 20 Cb -0.09 -1.01 -0.02 0.00 0.01 0.00 0.00 72.50 71.40 1igc s THR 20 CO -0.01 0.34 -0.23 -0.76 -0.69 0.00 0.00 174.62 173.27 1igc s LEU 21 N 0.15 2.04 -0.10 4.42 1.43 0.18 -4.78 118.68 122.02 1igc s LEU 21 Ca -0.04 -0.42 -0.01 0.00 -1.03 0.00 0.00 54.13 52.63 1igc s LEU 21 Cb -0.11 -1.19 -0.03 0.00 0.03 0.00 0.00 46.19 44.90 1igc s LEU 21 CO 0.02 0.27 -0.07 -0.89 0.23 0.00 0.00 176.35 175.91 1igc s THR 22 N -0.47 3.64 -0.06 5.49 2.01 -0.84 -0.70 115.64 124.72 1igc s THR 22 Ca 0.07 -0.48 0.02 0.00 0.31 0.00 0.00 61.69 61.61 1igc s THR 22 Cb -0.09 -2.52 0.01 0.00 0.01 0.00 0.00 72.50 69.91 1igc s THR 22 CO -0.00 0.56 -0.11 0.00 -0.69 0.00 0.00 174.62 174.38 1igc s LYS 24 N 0.64 1.37 0.39 0.00 3.01 -0.90 0.84 119.74 125.08 1igc s LYS 24 Ca -0.13 -0.30 -0.10 0.00 -1.01 0.00 0.00 55.97 54.43 1igc s LYS 24 Cb -0.15 -1.66 -0.07 0.00 -1.01 0.00 0.00 37.83 34.94 1igc s LYS 24 CO 0.03 -0.33 0.75 0.00 0.51 0.00 0.00 175.35 176.30 1igc s ALA 25 N 1.72 3.37 0.13 5.17 0.00 0.73 -1.52 121.76 131.35 1igc s ALA 25 Ca 0.04 -0.21 0.15 0.00 0.00 0.00 0.00 51.96 51.94 1igc s ALA 25 Cb -0.13 -2.68 0.38 0.00 0.00 0.00 0.00 23.12 20.69 1igc s ALA 25 CO -0.08 0.05 1.60 0.66 0.00 0.00 0.00 175.76 177.98 1igc h SER 26 N 1.40 0.00 -5.04 0.00 4.64 -0.82 -3.47 113.55 110.25 1igc h SER 26 Ca -0.47 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 60.85 1igc h SER 26 Cb 1.19 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 63.19 1igc h SER 26 CO 0.64 0.53 0.13 -1.83 -0.87 0.00 0.00 176.83 175.44 1igc s GLU 27 N -3.38 1.49 0.05 4.77 -1.05 -1.26 -4.94 118.70 114.38 1igc s GLU 27 Ca 0.01 -0.82 -0.38 0.00 -0.15 0.00 0.00 54.97 53.63 1igc s GLU 27 Cb 0.11 0.56 -0.18 0.00 -0.44 0.00 0.00 34.13 34.18 1igc s GLU 27 CO 0.73 -0.65 1.16 -1.71 0.95 0.00 0.00 175.26 175.73 1igc n ASN 28 N -0.39 0.63 -0.10 0.83 2.85 -1.26 -4.79 115.26 113.04 1igc n ASN 28 Ca -0.10 1.14 0.02 0.00 -0.11 0.00 0.00 54.58 55.53 1igc n ASN 28 Cb 0.62 -1.04 0.02 0.00 1.24 0.00 0.00 39.78 40.62 1igc n ASN 28 CO 0.00 0.00 0.00 1.33 -2.11 0.00 0.00 177.26 176.48 1igc n VAL 29 N 1.83 0.60 0.00 3.44 0.24 -0.16 -5.00 118.33 119.27 1igc n VAL 29 Ca 0.19 -0.65 0.00 0.00 -2.04 0.00 0.00 64.34 61.84 1igc n VAL 29 Cb 0.14 0.57 0.00 0.00 -1.47 0.00 0.00 33.84 33.07 1igc n VAL 29 CO 0.00 0.00 0.00 1.33 -2.14 0.00 0.00 176.83 176.02 1igc n VAL 30 N -0.37 0.00 -1.18 3.34 0.24 -1.24 -0.24 118.33 118.88 1igc n VAL 30 Ca 0.02 0.00 0.02 0.00 -2.04 0.00 0.00 64.34 62.35 1igc n VAL 30 Cb 0.48 0.00 0.23 0.00 -1.47 0.00 0.00 33.84 33.08 1igc n VAL 30 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1igc n THR 31 N 0.00 2.43 -1.47 3.34 -2.24 -1.17 -3.34 114.28 111.83 1igc n THR 31 Ca 0.00 -2.22 -0.27 0.00 -2.27 0.00 0.00 64.05 59.29 1igc n THR 31 Cb 0.00 -0.29 -0.07 0.00 -2.10 0.00 0.00 70.33 67.87 1igc n THR 31 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1igc n TYR 32 N -0.79 1.51 -4.99 4.78 4.01 0.67 -2.73 117.16 119.62 1igc n TYR 32 Ca 0.28 -2.13 -0.32 0.00 -0.16 0.00 0.00 57.90 55.56 1igc n TYR 32 Cb 0.98 -1.63 -0.16 0.00 -0.31 0.00 0.00 39.34 38.21 1igc n TYR 32 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 1igc s VAL 33 N -0.85 2.21 0.27 -0.72 1.01 -1.22 -1.26 120.40 119.84 1igc s VAL 33 Ca 0.61 -0.95 0.12 0.00 0.00 0.00 0.00 61.98 61.75 1igc s VAL 33 Cb 0.31 -1.87 -0.05 0.00 0.00 0.00 0.00 36.38 34.77 1igc s VAL 33 CO -0.13 0.55 -0.20 -0.44 0.00 0.00 0.00 175.10 174.88 1igc s SER 34 N 0.49 3.55 -0.02 3.32 0.01 0.70 -3.82 113.70 117.93 1igc s SER 34 Ca -0.14 -1.02 0.08 0.00 1.31 0.00 0.00 55.95 56.18 1igc s SER 34 Cb -0.17 -0.29 -0.02 0.00 0.21 0.00 0.00 66.02 65.75 1igc s SER 34 CO 0.05 0.04 -0.25 0.26 0.41 0.00 0.00 173.24 173.75 1igc s TRP 35 N -2.46 2.35 0.19 2.43 0.52 -0.39 -1.15 118.94 120.43 1igc s TRP 35 Ca 0.29 -0.42 0.11 0.00 0.02 0.00 0.00 56.10 56.11 1igc s TRP 35 Cb -0.05 -1.50 -0.04 0.00 -1.15 0.00 0.00 33.47 30.73 1igc s TRP 35 CO 0.14 -0.01 -0.24 0.71 0.02 0.00 0.00 176.95 177.57 1igc s TYR 36 N -0.64 2.30 -0.10 -1.98 1.51 0.54 -0.24 117.35 118.74 1igc s TYR 36 Ca 0.10 -0.36 0.04 0.00 -1.01 0.00 0.00 57.07 55.84 1igc s TYR 36 Cb -0.10 -1.15 0.00 0.00 -0.11 0.00 0.00 41.96 40.60 1igc s TYR 36 CO -0.01 0.48 -0.23 -1.14 -1.11 0.00 0.00 175.55 173.55 1igc s GLN 37 N -2.61 2.91 -0.47 -0.62 0.74 -0.41 -2.25 119.66 116.95 1igc s GLN 37 Ca 0.20 -0.83 0.03 0.00 0.05 0.00 0.00 55.36 54.81 1igc s GLN 37 Cb -0.08 -2.21 0.13 0.00 1.10 0.00 0.00 33.01 31.95 1igc s GLN 37 CO 0.09 0.16 0.23 -1.14 -0.55 0.00 0.00 175.29 174.08 1igc s GLN 38 N 0.39 1.68 0.62 1.67 0.74 -0.66 0.62 119.66 124.72 1igc s GLN 38 Ca -0.18 -2.33 -0.17 0.00 0.05 0.00 0.00 55.36 52.73 1igc s GLN 38 Cb -0.18 -2.96 -0.02 0.00 1.10 0.00 0.00 33.01 30.96 1igc s GLN 38 CO 0.08 -1.11 1.17 0.15 -0.55 0.00 0.00 175.29 175.03 1igc s LYS 39 N 0.06 2.85 -0.46 1.67 1.02 -1.26 -2.68 119.74 120.94 1igc s LYS 39 Ca 0.17 1.66 -0.41 0.00 0.02 0.00 0.00 55.97 57.40 1igc s LYS 39 Cb -0.25 -1.93 -0.18 0.00 -0.52 0.00 0.00 37.83 34.95 1igc s LYS 39 CO -0.01 -1.26 1.88 -2.30 -0.92 0.00 0.00 175.35 172.74 1igc n PRO 40 N -1.95 0.00 -0.54 -1.68 -0.02 -1.26 -2.10 135.00 127.45 1igc n PRO 40 Ca 0.12 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.60 1igc n PRO 40 Cb 0.51 -1.38 0.00 0.00 -0.02 0.00 0.00 33.50 32.60 1igc n PRO 40 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1igc n GLU 41 N 6.33 -0.01 -3.84 -0.52 4.71 -1.26 -5.03 120.64 121.02 1igc n GLU 41 Ca 0.47 0.03 -0.10 0.00 -0.01 0.00 0.00 57.16 57.55 1igc n GLU 41 Cb -0.04 -0.03 -0.08 0.00 -1.01 0.00 0.00 31.44 30.28 1igc n GLU 41 CO 0.00 0.00 0.00 -0.65 0.09 0.00 0.00 177.13 176.57 1igc s GLN 42 N -0.03 0.76 0.78 3.49 -0.21 -0.89 -5.17 119.66 118.39 1igc s GLN 42 Ca 0.00 -0.76 -0.10 0.00 0.02 0.00 0.00 55.36 54.52 1igc s GLN 42 Cb 0.00 0.31 0.08 0.00 1.00 0.00 0.00 33.01 34.40 1igc s GLN 42 CO 0.00 -0.23 1.13 -1.54 -2.12 0.00 0.00 175.29 172.53 1igc s SER 43 N -2.40 4.52 0.43 5.90 1.04 -1.26 -4.64 113.70 117.30 1igc s SER 43 Ca -0.01 0.61 -0.25 0.00 0.48 0.00 0.00 55.95 56.79 1igc s SER 43 Cb 0.01 -1.13 -0.08 0.00 0.10 0.00 0.00 66.02 64.92 1igc s SER 43 CO -0.07 -1.85 1.26 -2.84 0.98 0.00 0.00 173.24 170.73 1igc s PRO 44 N -5.47 3.83 0.09 4.02 0.02 -1.26 -4.65 135.00 131.57 1igc s PRO 44 Ca 0.62 2.04 0.05 0.00 0.02 0.00 0.00 61.00 63.73 1igc s PRO 44 Cb -0.10 -2.61 -0.04 0.00 0.02 0.00 0.00 34.50 31.77 1igc s PRO 44 CO 0.48 -0.57 -0.00 0.15 -0.33 0.00 0.00 177.00 176.72 1igc s LYS 45 N -2.43 2.55 0.42 5.54 3.01 0.20 -4.89 119.74 124.15 1igc s LYS 45 Ca 0.60 -0.83 -0.24 0.00 -1.01 0.00 0.00 55.97 54.49 1igc s LYS 45 Cb -0.35 -2.54 -0.08 0.00 -1.01 0.00 0.00 37.83 33.85 1igc s LYS 45 CO 0.44 0.54 1.17 -1.17 0.51 0.00 0.00 175.35 176.84 1igc s LEU 46 N -2.27 4.12 0.01 3.17 2.96 -1.26 -1.29 118.68 124.13 1igc s LEU 46 Ca 0.25 2.32 0.00 0.00 -0.22 0.00 0.00 54.13 56.49 1igc s LEU 46 Cb -0.12 -4.11 0.00 0.00 0.50 0.00 0.00 46.19 42.47 1igc s LEU 46 CO 0.18 -0.76 0.00 -0.11 -1.32 0.00 0.00 176.35 174.34 1igc n LEU 47 N -0.14 0.08 -3.98 -0.68 7.94 0.66 -4.76 117.00 116.11 1igc n LEU 47 Ca 0.05 0.02 -0.22 0.00 -1.11 0.00 0.00 56.01 54.75 1igc n LEU 47 Cb 0.47 -0.02 -0.16 0.00 0.53 0.00 0.00 43.42 44.24 1igc n LEU 47 CO 0.49 -0.12 -0.44 -0.63 -1.11 0.00 0.00 177.39 175.58 1igc s ILE 48 N -2.00 0.87 0.29 1.96 -1.09 -0.98 -1.83 121.20 118.43 1igc s ILE 48 Ca 0.00 -0.35 0.05 0.00 -2.23 0.00 0.00 60.65 58.12 1igc s ILE 48 Cb 0.00 -0.81 -0.06 0.00 -1.58 0.00 0.00 42.46 40.01 1igc s ILE 48 CO 0.00 0.29 0.00 -0.72 -1.23 0.00 0.00 174.94 173.28 1igc s TYR 49 N 0.60 1.88 0.00 3.97 -0.85 -0.53 -1.26 117.35 121.16 1igc s TYR 49 Ca -0.11 -0.86 0.00 0.00 -0.52 0.00 0.00 57.07 55.59 1igc s TYR 49 Cb -0.14 -1.15 0.00 0.00 0.38 0.00 0.00 41.96 41.05 1igc s TYR 49 CO 0.02 0.10 0.00 0.41 -1.52 0.00 0.00 175.55 174.56 1igc n GLY 50 N -0.60 0.82 0.00 5.49 0.00 -1.25 -1.79 105.19 107.86 1igc n GLY 50 Ca -0.04 -0.74 0.03 0.00 0.00 0.00 0.00 46.02 45.27 1igc n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1igc n ALA 51 N 5.69 2.69 -0.98 4.61 0.00 -1.11 -3.44 120.51 127.98 1igc n ALA 51 Ca 0.00 -0.17 0.04 0.00 0.00 0.00 0.00 53.44 53.32 1igc n ALA 51 Cb 0.00 -0.22 0.06 0.00 0.00 0.00 0.00 19.45 19.29 1igc n ALA 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1igc n SER 52 N -1.25 1.49 -4.82 0.00 3.41 -1.24 -3.16 113.62 108.06 1igc n SER 52 Ca 0.01 -2.32 -0.33 0.00 -0.26 0.00 0.00 58.87 55.96 1igc n SER 52 Cb 0.11 -0.22 -0.06 0.00 -0.26 0.00 0.00 64.21 63.77 1igc n SER 52 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1igc s ASN 53 N -1.65 5.90 0.13 4.04 0.01 -0.74 -4.61 114.94 118.02 1igc s ASN 53 Ca 0.13 0.23 -0.13 0.00 -0.71 0.00 0.00 52.86 52.38 1igc s ASN 53 Cb 0.12 -1.76 -0.07 0.00 0.41 0.00 0.00 41.25 39.95 1igc s ASN 53 CO 0.01 0.28 0.51 -0.13 -1.51 0.00 0.00 177.10 176.27 1igc s ARG 54 N -1.70 3.91 0.33 -0.60 0.52 -1.26 -1.46 118.95 118.68 1igc s ARG 54 Ca 0.23 0.39 0.01 0.00 -0.52 0.00 0.00 55.73 55.84 1igc s ARG 54 Cb -0.12 -2.93 0.06 0.00 0.52 0.00 0.00 34.95 32.48 1igc s ARG 54 CO 0.14 0.49 0.45 0.98 0.02 0.00 0.00 175.30 177.38 1igc n TYR 55 N 0.76 -3.04 -1.67 -0.53 9.36 -0.76 -4.87 117.16 116.40 1igc n TYR 55 Ca -0.06 -0.87 -0.44 0.00 3.32 0.00 0.00 57.90 59.85 1igc n TYR 55 Cb 0.52 -0.32 -0.03 0.00 -0.63 0.00 0.00 39.34 38.87 1igc n TYR 55 CO 0.00 0.00 0.00 0.25 0.22 0.00 0.00 176.86 177.33 1igc n THR 56 N -1.96 0.61 -1.02 2.97 -2.24 -1.26 -2.74 114.28 108.64 1igc n THR 56 Ca 0.08 -0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 1igc n THR 56 Cb 0.28 -2.16 0.00 0.00 -2.10 0.00 0.00 70.33 66.35 1igc n THR 56 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1igc n GLY 57 N 4.41 0.43 3.50 3.38 0.00 -1.26 -5.06 105.19 110.59 1igc n GLY 57 Ca 0.20 -1.00 -0.35 0.00 0.00 0.00 0.00 46.02 44.87 1igc n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1igc s VAL 58 N -2.00 4.27 0.38 1.61 1.01 -1.11 -5.09 120.40 119.47 1igc s VAL 58 Ca 0.00 -0.20 -0.21 0.00 0.00 0.00 0.00 61.98 61.57 1igc s VAL 58 Cb 0.00 -2.94 -0.10 0.00 0.00 0.00 0.00 36.38 33.33 1igc s VAL 58 CO 0.00 0.42 0.89 -2.16 0.00 0.00 0.00 175.10 174.25 1igc s PRO 59 N 0.96 4.25 0.00 2.72 0.04 -1.26 -4.86 135.00 136.85 1igc s PRO 59 Ca 0.03 1.05 0.00 0.00 0.04 0.00 0.00 61.00 62.12 1igc s PRO 59 Cb -0.14 -2.38 0.00 0.00 0.04 0.00 0.00 34.50 32.02 1igc s PRO 59 CO 0.02 0.09 0.04 -0.40 0.04 0.00 0.00 177.00 176.79 1igc n ASP 60 N -0.29 0.00 0.08 6.66 5.75 -1.26 -0.76 116.55 126.73 1igc n ASP 60 Ca 0.05 0.00 -0.09 0.00 -0.01 0.00 0.00 54.79 54.73 1igc n ASP 60 Cb 0.53 0.00 -0.04 0.00 -1.03 0.00 0.00 41.12 40.58 1igc n ASP 60 CO 0.00 0.00 0.00 0.03 -0.11 0.00 0.00 177.20 177.12 1igc h ARG 61 N 0.00 0.18 -6.76 0.11 3.08 -1.93 -3.42 114.38 105.64 1igc h ARG 61 Ca 0.00 -0.22 -0.49 0.00 0.07 0.00 0.00 59.98 59.34 1igc h ARG 61 Cb 0.00 0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.10 1igc h ARG 61 CO 0.00 1.00 0.24 -0.06 -1.07 0.00 0.00 179.97 180.08 1igc s PHE 62 N -3.06 3.65 -0.20 3.04 0.40 0.06 -1.63 117.98 120.25 1igc s PHE 62 Ca -0.03 1.60 -0.06 0.00 -0.60 0.00 0.00 56.93 57.84 1igc s PHE 62 Cb 0.10 -2.79 0.09 0.00 0.51 0.00 0.00 43.02 40.94 1igc s PHE 62 CO 0.83 0.25 0.40 0.99 0.70 0.00 0.00 175.22 178.40 1igc s THR 63 N -1.60 -0.63 0.02 0.64 2.01 -1.14 -4.92 115.64 110.02 1igc s THR 63 Ca 0.48 0.15 0.03 0.00 0.31 0.00 0.00 61.69 62.65 1igc s THR 63 Cb -0.17 -0.67 -0.04 0.00 0.01 0.00 0.00 72.50 71.63 1igc s THR 63 CO 0.22 0.05 -0.02 -0.83 -0.69 0.00 0.00 174.62 173.35 1igc s GLY 64 N 2.59 1.86 0.13 4.40 0.00 -1.26 -0.43 107.32 114.61 1igc s GLY 64 Ca 0.01 -1.01 -0.13 0.00 0.00 0.00 0.00 44.72 43.58 1igc s GLY 64 CO -0.13 -0.91 0.35 -1.35 0.00 0.00 0.00 173.10 171.06 1igc s SER 65 N -1.73 -0.11 0.00 1.64 1.04 -0.16 -4.07 113.70 110.31 1igc s SER 65 Ca 0.21 -0.50 0.00 0.00 0.48 0.00 0.00 55.95 56.14 1igc s SER 65 Cb -0.11 0.45 0.00 0.00 0.10 0.00 0.00 66.02 66.45 1igc s SER 65 CO 0.12 -0.85 0.00 0.61 0.98 0.00 0.00 173.24 174.09 1igc n GLY 66 N -0.20 3.08 1.71 7.32 0.00 -1.26 -0.51 105.19 115.33 1igc n GLY 66 Ca -0.14 -1.38 0.00 0.00 0.00 0.00 0.00 46.02 44.50 1igc n GLY 66 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1igc n SER 67 N 0.00 0.01 0.00 1.61 2.88 -1.18 -4.86 113.62 112.08 1igc n SER 67 Ca 0.00 0.03 0.00 0.00 -1.33 0.00 0.00 58.87 57.57 1igc n SER 67 Cb 0.00 0.02 0.00 0.00 -0.75 0.00 0.00 64.21 63.48 1igc n SER 67 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1igc n ALA 68 N -2.58 1.94 0.00 -1.46 0.00 -1.21 -3.05 120.51 114.15 1igc n ALA 68 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1igc n ALA 68 Cb 0.00 0.32 0.00 0.00 0.00 0.00 0.00 19.45 19.77 1igc n ALA 68 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1igc n THR 69 N -2.08 0.00 -4.06 0.00 5.66 -1.26 -0.99 114.28 111.54 1igc n THR 69 Ca 0.00 0.00 -0.33 0.00 -3.05 0.00 0.00 64.05 60.67 1igc n THR 69 Cb 0.35 -0.58 -0.15 0.00 -1.55 0.00 0.00 70.33 68.39 1igc n THR 69 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 1igc s ASP 70 N -2.45 3.49 0.25 1.09 1.01 -1.26 -0.19 116.67 118.61 1igc s ASP 70 Ca 0.00 -0.63 0.11 0.00 0.71 0.00 0.00 52.55 52.74 1igc s ASP 70 Cb 0.00 -1.55 -0.05 0.00 1.01 0.00 0.00 42.92 42.33 1igc s ASP 70 CO 0.00 -0.02 -0.18 -0.36 0.21 0.00 0.00 175.17 174.82 1igc s PHE 71 N 1.33 2.36 -0.02 4.23 0.40 0.25 -3.11 117.98 123.41 1igc s PHE 71 Ca 0.04 -0.32 -0.13 0.00 -0.60 0.00 0.00 56.93 55.92 1igc s PHE 71 Cb -0.14 -1.07 0.02 0.00 0.51 0.00 0.00 43.02 42.34 1igc s PHE 71 CO -0.10 0.63 0.29 0.95 0.70 0.00 0.00 175.22 177.69 1igc s THR 72 N -2.20 0.05 -0.12 0.64 -4.23 0.33 -0.92 115.64 109.19 1igc s THR 72 Ca 0.27 -0.45 0.02 0.00 -1.18 0.00 0.00 61.69 60.35 1igc s THR 72 Cb -0.06 -0.57 0.01 0.00 1.34 0.00 0.00 72.50 73.22 1igc s THR 72 CO 0.14 -0.25 -0.20 -0.22 -0.54 0.00 0.00 174.62 173.56 1igc s LEU 73 N -1.17 1.96 -0.32 4.79 2.96 0.13 -0.99 118.68 126.04 1igc s LEU 73 Ca -0.12 -0.53 -0.00 0.00 -0.22 0.00 0.00 54.13 53.26 1igc s LEU 73 Cb -0.05 -1.30 0.07 0.00 0.50 0.00 0.00 46.19 45.41 1igc s LEU 73 CO 0.03 0.07 0.02 -0.89 -1.32 0.00 0.00 176.35 174.26 1igc s THR 74 N 0.80 2.76 -0.41 3.68 2.01 0.42 0.50 115.64 125.40 1igc s THR 74 Ca -0.09 -1.69 -0.26 0.00 0.31 0.00 0.00 61.69 59.96 1igc s THR 74 Cb -0.16 -2.71 0.02 0.00 0.01 0.00 0.00 72.50 69.66 1igc s THR 74 CO -0.00 -0.26 0.95 -0.63 -0.69 0.00 0.00 174.62 173.99 1igc s ILE 75 N 1.15 4.50 -0.14 1.82 1.01 -0.60 -2.91 121.20 126.04 1igc s ILE 75 Ca -0.01 1.07 0.19 0.00 0.00 0.00 0.00 60.65 61.90 1igc s ILE 75 Cb -0.20 -4.40 0.17 0.00 0.01 0.00 0.00 42.46 38.03 1igc s ILE 75 CO -0.03 -0.68 1.58 0.77 0.00 0.00 0.00 174.94 176.57 1igc h SER 76 N 8.74 0.00 -2.72 3.58 4.64 -1.57 0.01 113.55 126.23 1igc h SER 76 Ca -0.23 0.00 -0.48 0.00 -0.47 0.00 0.00 61.79 60.61 1igc h SER 76 Cb 1.07 0.00 -0.39 0.00 -0.31 0.00 0.00 62.40 62.78 1igc h SER 76 CO 1.01 0.33 -0.75 -0.44 -0.87 0.00 0.00 176.83 176.11 1igc s SER 77 N -6.33 3.01 0.64 4.97 0.01 -1.25 -3.53 113.70 111.21 1igc s SER 77 Ca 0.04 -1.07 -0.17 0.00 1.31 0.00 0.00 55.95 56.06 1igc s SER 77 Cb 0.08 -0.18 -0.01 0.00 0.21 0.00 0.00 66.02 66.12 1igc s SER 77 CO 0.70 -0.42 1.18 -0.69 0.41 0.00 0.00 173.24 174.42 1igc s VAL 78 N 2.15 2.72 0.23 3.43 1.01 0.03 -4.74 120.40 125.23 1igc s VAL 78 Ca 0.08 0.40 -0.06 0.00 0.00 0.00 0.00 61.98 62.39 1igc s VAL 78 Cb -0.16 -3.03 -0.02 0.00 0.00 0.00 0.00 36.38 33.17 1igc s VAL 78 CO -0.31 -0.15 0.31 -1.58 0.00 0.00 0.00 175.10 173.36 1igc s GLN 79 N -3.66 1.39 0.18 2.72 0.74 -1.26 -0.44 119.66 119.34 1igc s GLN 79 Ca 0.74 -1.46 -0.08 0.00 0.05 0.00 0.00 55.36 54.60 1igc s GLN 79 Cb -0.27 0.37 0.07 0.00 1.10 0.00 0.00 33.01 34.28 1igc s GLN 79 CO 0.38 -0.52 1.59 0.00 -0.55 0.00 0.00 175.29 176.18 1igc h ALA 80 N 2.43 0.77 -0.09 1.58 0.00 -1.89 -3.06 119.26 119.00 1igc h ALA 80 Ca -0.31 -0.37 0.01 0.00 0.00 0.00 0.00 54.91 54.24 1igc h ALA 80 Cb 1.25 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 1igc h ALA 80 CO 0.44 0.66 -0.10 1.49 0.00 0.00 0.00 179.25 181.74 1igc h GLU 81 N 0.83 -0.06 0.00 0.00 4.22 -1.91 -2.66 114.58 114.99 1igc h GLU 81 Ca 0.12 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.56 1igc h GLU 81 Cb 0.74 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.00 1igc h GLU 81 CO 0.06 -0.04 0.00 -0.25 -2.18 0.00 0.00 179.01 176.60 1igc n ASP 82 N -3.22 0.00 -4.60 1.04 8.00 -1.15 -4.71 116.55 111.90 1igc n ASP 82 Ca -0.01 0.00 -0.43 0.00 0.71 0.00 0.00 54.79 55.06 1igc n ASP 82 Cb 0.06 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.14 1igc n ASP 82 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1igc s LEU 83 N -0.30 3.58 0.00 0.64 2.96 -1.01 -4.87 118.68 119.68 1igc s LEU 83 Ca 0.00 1.04 0.00 0.00 -0.22 0.00 0.00 54.13 54.95 1igc s LEU 83 Cb 0.00 -3.53 0.00 0.00 0.50 0.00 0.00 46.19 43.16 1igc s LEU 83 CO 0.00 -1.51 0.00 0.00 -1.32 0.00 0.00 176.35 173.52 1igc n ALA 84 N 9.26 0.00 -2.73 5.97 0.00 -1.24 -4.24 120.51 127.54 1igc n ALA 84 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.29 1igc n ALA 84 Cb 0.47 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.84 1igc n ALA 84 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1igc s ASP 85 N -2.48 5.41 -0.22 0.00 1.11 -1.09 -1.05 116.67 118.35 1igc s ASP 85 Ca 0.00 0.10 0.01 0.00 0.18 0.00 0.00 52.55 52.84 1igc s ASP 85 Cb 0.00 -1.51 0.05 0.00 1.07 0.00 0.00 42.92 42.54 1igc s ASP 85 CO 0.00 0.31 -0.07 -0.31 1.18 0.00 0.00 175.17 176.28 1igc s TYR 86 N -1.08 2.37 0.06 4.23 1.51 -0.08 -1.65 117.35 122.71 1igc s TYR 86 Ca 0.19 -1.68 0.01 0.00 -1.01 0.00 0.00 57.07 54.59 1igc s TYR 86 Cb -0.12 -1.58 -0.04 0.00 -0.11 0.00 0.00 41.96 40.11 1igc s TYR 86 CO 0.09 -0.76 0.16 -1.01 -1.11 0.00 0.00 175.55 172.93 1igc s HIS 87 N 1.41 3.40 -0.03 2.71 3.76 -0.95 -2.01 115.29 123.57 1igc s HIS 87 Ca -0.04 0.19 0.04 0.00 -0.15 0.00 0.00 55.06 55.10 1igc s HIS 87 Cb -0.18 -1.71 -0.00 0.00 1.11 0.00 0.00 32.58 31.79 1igc s HIS 87 CO -0.07 0.57 -0.14 0.00 -0.85 0.00 0.00 174.74 174.24 1igc s GLY 89 N -0.04 0.90 -0.11 0.00 0.00 -0.30 0.63 107.32 108.40 1igc s GLY 89 Ca -0.01 -1.27 0.03 0.00 0.00 0.00 0.00 44.72 43.48 1igc s GLY 89 CO 0.01 -1.34 -0.21 -0.86 0.00 0.00 0.00 173.10 170.70 1igc s GLN 90 N -3.03 2.75 -0.28 2.90 1.03 -1.10 -0.21 119.66 121.72 1igc s GLN 90 Ca 0.08 -0.77 0.08 0.00 0.04 0.00 0.00 55.36 54.80 1igc s GLN 90 Cb -0.02 -2.17 0.46 0.00 0.03 0.00 0.00 33.01 31.32 1igc s GLN 90 CO 0.00 0.07 1.19 0.41 -2.54 0.00 0.00 175.29 174.42 1igc n GLY 91 N 3.83 6.05 0.07 2.60 0.00 -0.39 -3.52 105.19 113.83 1igc n GLY 91 Ca -0.20 -2.46 -0.09 0.00 0.00 0.00 0.00 46.02 43.28 1igc n GLY 91 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1igc h ASN 92 N 2.08 0.00 -4.53 1.61 -1.24 -1.87 -3.48 115.58 108.15 1igc h ASN 92 Ca 0.31 -0.52 -0.13 0.00 0.71 0.00 0.00 56.30 56.67 1igc h ASN 92 Cb 1.48 0.00 -0.22 0.00 0.73 0.00 0.00 38.32 40.31 1igc h ASN 92 CO 0.66 0.86 -0.29 -0.55 -1.29 0.00 0.00 177.43 176.82 1igc s SER 93 N -6.01 -0.26 0.24 1.15 0.15 -1.26 -5.14 113.70 102.55 1igc s SER 93 Ca -0.13 0.34 -0.30 0.00 0.70 0.00 0.00 55.95 56.56 1igc s SER 93 Cb -0.01 0.48 -0.09 0.00 -1.71 0.00 0.00 66.02 64.69 1igc s SER 93 CO 0.40 -0.31 1.00 -0.31 1.20 0.00 0.00 173.24 175.22 1igc s TYR 94 N -0.71 3.83 0.26 3.44 1.51 -1.26 -3.73 117.35 120.69 1igc s TYR 94 Ca -0.08 1.83 -0.30 0.00 -1.01 0.00 0.00 57.07 57.51 1igc s TYR 94 Cb -0.04 -3.09 -0.10 0.00 -0.11 0.00 0.00 41.96 38.61 1igc s TYR 94 CO 0.03 0.07 1.47 -2.14 -1.11 0.00 0.00 175.55 173.87 1igc s PRO 95 N -1.12 4.24 0.04 -1.71 0.02 -1.26 -4.95 135.00 130.26 1igc s PRO 95 Ca 0.43 2.36 -0.30 0.00 0.02 0.00 0.00 61.00 63.50 1igc s PRO 95 Cb -0.28 -3.09 -0.07 0.00 0.02 0.00 0.00 34.50 31.08 1igc s PRO 95 CO 0.35 -0.46 1.47 0.71 -0.33 0.00 0.00 177.00 178.74 1igc s TYR 96 N -0.04 2.79 0.15 6.54 1.51 -1.24 -4.56 117.35 122.50 1igc s TYR 96 Ca 0.60 0.70 0.09 0.00 -1.01 0.00 0.00 57.07 57.44 1igc s TYR 96 Cb -0.43 -3.75 -0.04 0.00 -0.11 0.00 0.00 41.96 37.63 1igc s TYR 96 CO 0.45 -2.83 -0.19 0.95 -1.11 0.00 0.00 175.55 172.81 1igc s THR 97 N 2.26 1.83 0.34 -0.71 -4.23 -1.23 -5.03 115.64 108.88 1igc s THR 97 Ca 0.67 -1.84 0.09 0.00 -1.18 0.00 0.00 61.69 59.42 1igc s THR 97 Cb -0.35 -1.80 -0.05 0.00 1.34 0.00 0.00 72.50 71.65 1igc s THR 97 CO 0.29 -0.24 0.07 -0.36 -0.54 0.00 0.00 174.62 173.84 1igc s PHE 98 N -1.82 2.63 0.14 3.99 0.40 -1.26 -2.71 117.98 119.35 1igc s PHE 98 Ca 0.14 -0.40 -0.01 0.00 -0.60 0.00 0.00 56.93 56.06 1igc s PHE 98 Cb -0.07 -1.54 0.03 0.00 0.51 0.00 0.00 43.02 41.95 1igc s PHE 98 CO 0.06 0.42 0.18 0.41 0.70 0.00 0.00 175.22 177.00 1igc n GLY 99 N -1.04 -0.11 0.14 4.36 0.00 0.21 -4.54 105.19 104.20 1igc n GLY 99 Ca -0.04 -1.84 0.12 0.00 0.00 0.00 0.00 46.02 44.26 1igc n GLY 99 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1igc h GLY 100 N -0.18 0.00 0.00 -0.02 0.00 -1.89 -3.44 103.07 97.55 1igc h GLY 100 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.27 1igc h GLY 100 CO 0.05 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.20 1igc n GLY 101 N 1.21 2.30 2.91 4.60 0.00 -1.26 -5.03 105.19 109.92 1igc n GLY 101 Ca 0.03 -1.82 -0.22 0.00 0.00 0.00 0.00 46.02 44.01 1igc n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1igc s THR 102 N -2.49 0.67 -0.05 2.61 2.01 -0.85 -4.62 115.64 112.92 1igc s THR 102 Ca 0.00 -0.19 -0.13 0.00 0.31 0.00 0.00 61.69 61.69 1igc s THR 102 Cb 0.00 -0.69 -0.05 0.00 0.01 0.00 0.00 72.50 71.77 1igc s THR 102 CO 0.00 0.26 0.32 -0.75 -0.69 0.00 0.00 174.62 173.77 1igc s LYS 103 N 0.99 3.83 -0.21 4.92 2.36 -1.16 -0.90 119.74 129.56 1igc s LYS 103 Ca -0.10 0.23 0.01 0.00 -2.55 0.00 0.00 55.97 53.57 1igc s LYS 103 Cb -0.14 -3.24 0.04 0.00 -1.05 0.00 0.00 37.83 33.44 1igc s LYS 103 CO -0.00 0.66 -0.13 -1.17 1.55 0.00 0.00 175.35 176.26 1igc s LEU 104 N -0.87 2.58 -0.12 5.43 0.20 -0.21 -2.61 118.68 123.07 1igc s LEU 104 Ca 0.21 -0.98 -0.10 0.00 0.69 0.00 0.00 54.13 53.95 1igc s LEU 104 Cb -0.15 -1.38 -0.05 0.00 -0.43 0.00 0.00 46.19 44.19 1igc s LEU 104 CO 0.10 -0.13 0.21 -1.61 -0.29 0.00 0.00 176.35 174.63 1igc s GLU 105 N 1.29 3.77 -0.21 1.98 2.02 -0.44 -3.63 118.70 123.48 1igc s GLU 105 Ca -0.02 -0.02 -0.22 0.00 0.02 0.00 0.00 54.97 54.73 1igc s GLU 105 Cb -0.17 -3.27 -0.02 0.00 0.10 0.00 0.00 34.13 30.77 1igc s GLU 105 CO -0.08 0.60 0.68 0.42 0.02 0.00 0.00 175.26 176.90 1igc s ILE 106 N -0.57 4.97 0.30 -1.63 -1.09 -1.26 -1.26 121.20 120.66 1igc s ILE 106 Ca 0.15 1.28 -0.13 0.00 -2.23 0.00 0.00 60.65 59.73 1igc s ILE 106 Cb -0.13 -3.99 -0.08 0.00 -1.58 0.00 0.00 42.46 36.68 1igc s ILE 106 CO 0.04 0.06 0.68 -0.75 -1.23 0.00 0.00 174.94 173.74 1igc s LYS 107 N 2.21 3.92 0.16 2.79 2.20 -0.64 -4.81 119.74 125.57 1igc s LYS 107 Ca 0.30 0.52 -0.23 0.00 -0.36 0.00 0.00 55.97 56.21 1igc s LYS 107 Cb -0.16 -2.50 0.08 0.00 -1.51 0.00 0.00 37.83 33.74 1igc s LYS 107 CO 0.10 0.20 1.07 0.50 -0.36 0.00 0.00 175.35 176.86 1igc s ARG 108 N -2.98 1.21 0.40 4.03 3.00 -1.26 -4.13 118.95 119.21 1igc s ARG 108 Ca 0.52 -0.79 -0.27 0.00 -1.00 0.00 0.00 55.73 54.19 1igc s ARG 108 Cb -0.10 0.33 -0.10 0.00 0.00 0.00 0.00 34.95 35.08 1igc s ARG 108 CO 0.19 -0.57 1.41 0.00 0.00 0.00 0.00 175.30 176.33 1igc s ALA 109 N -2.05 3.40 0.75 6.12 0.00 -1.26 -4.95 121.76 123.76 1igc s ALA 109 Ca 0.24 1.43 -0.12 0.00 0.00 0.00 0.00 51.96 53.51 1igc s ALA 109 Cb -0.03 -3.56 0.05 0.00 0.00 0.00 0.00 23.12 19.58 1igc s ALA 109 CO 0.05 -1.00 1.11 -0.51 0.00 0.00 0.00 175.76 175.42 1igc s ASP 110 N -0.42 4.50 -0.24 0.00 1.11 -1.26 -4.86 116.67 115.50 1igc s ASP 110 Ca 0.55 1.97 -0.11 0.00 0.18 0.00 0.00 52.55 55.14 1igc s ASP 110 Cb -0.43 -2.54 0.09 0.00 1.07 0.00 0.00 42.92 41.11 1igc s ASP 110 CO 0.57 -2.04 0.56 0.00 1.18 0.00 0.00 175.17 175.44 1igc s ALA 111 N -2.61 -1.59 0.53 5.23 0.00 -0.19 -4.98 121.76 118.14 1igc s ALA 111 Ca 0.65 2.01 -0.17 0.00 0.00 0.00 0.00 51.96 54.45 1igc s ALA 111 Cb -0.20 -1.41 -0.07 0.00 0.00 0.00 0.00 23.12 21.45 1igc s ALA 111 CO 0.51 -0.60 1.02 0.00 0.00 0.00 0.00 175.76 176.68 1igc s ALA 112 N 2.17 2.91 0.64 0.00 0.00 -1.26 -2.29 121.76 123.93 1igc s ALA 112 Ca -0.07 0.34 -0.08 0.00 0.00 0.00 0.00 51.96 52.15 1igc s ALA 112 Cb -0.09 -3.18 0.01 0.00 0.00 0.00 0.00 23.12 19.85 1igc s ALA 112 CO -0.17 -0.44 0.98 -1.25 0.00 0.00 0.00 175.76 174.89 1igc s PRO 113 N -3.89 2.92 -0.37 0.00 0.04 -1.26 -4.58 135.00 127.86 1igc s PRO 113 Ca 0.62 0.21 -0.03 0.00 0.04 0.00 0.00 61.00 61.85 1igc s PRO 113 Cb -0.13 -2.16 0.09 0.00 0.04 0.00 0.00 34.50 32.33 1igc s PRO 113 CO 0.30 -0.83 0.14 0.99 0.04 0.00 0.00 177.00 177.64 1igc s THR 114 N -3.15 3.20 -0.21 1.26 2.01 0.85 -4.81 115.64 114.79 1igc s THR 114 Ca 0.56 -1.83 -0.14 0.00 0.31 0.00 0.00 61.69 60.58 1igc s THR 114 Cb -0.11 -3.08 -0.04 0.00 0.01 0.00 0.00 72.50 69.28 1igc s THR 114 CO 0.48 -0.50 0.34 -0.69 -0.69 0.00 0.00 174.62 173.56 1igc s VAL 115 N 1.18 5.24 -0.02 3.82 1.01 -1.24 -0.77 120.40 129.61 1igc s VAL 115 Ca 0.04 0.57 0.05 0.00 0.00 0.00 0.00 61.98 62.65 1igc s VAL 115 Cb -0.22 -3.67 -0.01 0.00 0.00 0.00 0.00 36.38 32.48 1igc s VAL 115 CO -0.03 0.27 -0.18 -0.44 0.00 0.00 0.00 175.10 174.72 1igc s SER 116 N 1.07 2.09 0.18 3.32 0.01 -0.88 -4.90 113.70 114.59 1igc s SER 116 Ca 0.16 -0.32 0.11 0.00 1.31 0.00 0.00 55.95 57.21 1igc s SER 116 Cb -0.14 -0.27 -0.04 0.00 0.21 0.00 0.00 66.02 65.77 1igc s SER 116 CO 0.07 0.21 -0.24 -0.51 0.41 0.00 0.00 173.24 173.18 1igc s ILE 117 N -0.37 2.36 -0.02 1.44 2.07 -1.26 -0.19 121.20 125.23 1igc s ILE 117 Ca 0.06 -1.96 0.00 0.00 -1.41 0.00 0.00 60.65 57.34 1igc s ILE 117 Cb -0.07 -2.11 0.02 0.00 0.13 0.00 0.00 42.46 40.43 1igc s ILE 117 CO -0.00 -0.07 0.01 -0.36 -1.91 0.00 0.00 174.94 172.60 1igc s PHE 118 N -1.54 0.20 0.49 3.50 0.08 0.11 -4.97 117.98 115.86 1igc s PHE 118 Ca 0.19 0.04 -0.18 0.00 0.12 0.00 0.00 56.93 57.10 1igc s PHE 118 Cb -0.08 -0.31 -0.09 0.00 -0.57 0.00 0.00 43.02 41.97 1igc s PHE 118 CO 0.09 -0.10 0.98 -2.14 -0.10 0.00 0.00 175.22 173.96 1igc s PRO 119 N 0.89 3.98 0.51 0.24 0.02 -1.26 -2.67 135.00 136.71 1igc s PRO 119 Ca -0.08 1.04 -0.21 0.00 0.02 0.00 0.00 61.00 61.77 1igc s PRO 119 Cb -0.12 -2.14 -0.08 0.00 0.02 0.00 0.00 34.50 32.18 1igc s PRO 119 CO -0.02 -0.25 0.92 -2.30 -0.33 0.00 0.00 177.00 175.03 1igc n PRO 120 N -1.30 1.05 -2.47 5.54 -0.02 -1.25 -4.97 135.00 131.58 1igc n PRO 120 Ca 0.07 0.39 -0.34 0.00 -2.02 0.00 0.00 63.50 61.60 1igc n PRO 120 Cb 0.54 -2.04 -0.03 0.00 -0.02 0.00 0.00 33.50 31.95 1igc n PRO 120 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 1igc s SER 121 N -1.00 6.20 0.21 2.55 0.01 -1.26 -4.97 113.70 115.44 1igc s SER 121 Ca 0.69 1.99 -0.09 0.00 1.31 0.00 0.00 55.95 59.85 1igc s SER 121 Cb -0.48 -2.57 0.24 0.00 0.21 0.00 0.00 66.02 63.42 1igc s SER 121 CO 0.53 -0.88 1.80 0.28 0.41 0.00 0.00 173.24 175.37 1igc h SER 122 N 1.49 0.49 -0.88 2.44 0.02 -1.99 -2.08 113.55 113.05 1igc h SER 122 Ca -0.50 0.04 0.03 0.00 -0.84 0.00 0.00 61.79 60.53 1igc h SER 122 Cb 1.23 -0.05 -0.05 0.00 0.14 0.00 0.00 62.40 63.67 1igc h SER 122 CO 0.59 0.31 0.57 -0.33 -1.14 0.00 0.00 176.83 176.82 1igc h GLU 123 N 0.62 1.06 0.11 3.45 3.07 -1.98 0.37 114.58 121.30 1igc h GLU 123 Ca 0.30 -0.06 0.01 0.00 -0.50 0.00 0.00 59.36 59.10 1igc h GLU 123 Cb 0.22 -0.24 -0.02 0.00 -0.84 0.00 0.00 28.75 27.87 1igc h GLU 123 CO -0.20 0.70 -0.16 0.37 -1.40 0.00 0.00 179.01 178.32 1igc h GLN 124 N 1.10 -0.31 -0.27 2.33 4.15 -1.67 -2.95 115.11 117.49 1igc h GLN 124 Ca 0.35 0.02 -0.00 0.00 0.77 0.00 0.00 58.65 59.79 1igc h GLN 124 Cb 0.01 0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.76 1igc h GLN 124 CO -0.12 -0.21 0.16 -0.07 -1.93 0.00 0.00 178.83 176.66 1igc h LEU 125 N -0.32 0.33 -0.97 -2.39 3.38 -1.00 -2.71 115.31 111.63 1igc h LEU 125 Ca 0.02 -0.07 0.36 0.00 0.09 0.00 0.00 57.88 58.28 1igc h LEU 125 Cb 0.33 -0.08 -0.18 0.00 0.09 0.00 0.00 40.66 40.82 1igc h LEU 125 CO -0.07 0.30 0.34 0.41 0.09 0.00 0.00 178.44 179.51 1igc n THR 126 N -4.86 -0.41 1.42 0.22 -1.04 0.09 0.22 114.28 109.94 1igc n THR 126 Ca -0.02 2.02 0.14 0.00 -2.04 0.00 0.00 64.05 64.15 1igc n THR 126 Cb 0.06 -3.16 0.55 0.00 -1.82 0.00 0.00 70.33 65.97 1igc n THR 126 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1igc n SER 127 N -5.28 0.78 0.00 8.00 3.41 -1.04 -4.96 113.62 114.54 1igc n SER 127 Ca 0.32 -0.86 0.00 0.00 -0.26 0.00 0.00 58.87 58.06 1igc n SER 127 Cb 1.07 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 65.02 1igc n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1igc n GLY 128 N 1.26 0.66 3.39 5.00 0.00 0.61 -5.06 105.19 111.05 1igc n GLY 128 Ca 0.15 -0.47 -0.27 0.00 0.00 0.00 0.00 46.02 45.44 1igc n GLY 128 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1igc s GLY 129 N -2.42 1.61 -0.15 -0.02 0.00 -1.12 -1.27 107.32 103.94 1igc s GLY 129 Ca 0.00 -1.54 -0.03 0.00 0.00 0.00 0.00 44.72 43.15 1igc s GLY 129 CO 0.00 -1.55 0.04 0.00 0.00 0.00 0.00 173.10 171.58 1igc s ALA 130 N -1.45 0.80 -0.32 3.20 0.00 -0.87 -2.21 121.76 120.91 1igc s ALA 130 Ca 0.17 -0.45 -0.03 0.00 0.00 0.00 0.00 51.96 51.65 1igc s ALA 130 Cb -0.09 -1.02 0.06 0.00 0.00 0.00 0.00 23.12 22.07 1igc s ALA 130 CO 0.08 -0.96 0.05 -1.12 0.00 0.00 0.00 175.76 173.81 1igc s SER 131 N 1.94 5.03 0.00 0.00 0.01 -1.26 -1.22 113.70 118.21 1igc s SER 131 Ca 0.01 -1.36 -0.18 0.00 1.31 0.00 0.00 55.95 55.73 1igc s SER 131 Cb -0.15 -1.76 -0.06 0.00 0.21 0.00 0.00 66.02 64.26 1igc s SER 131 CO -0.07 -0.32 0.50 -0.69 0.41 0.00 0.00 173.24 173.07 1igc s VAL 132 N 1.26 4.94 -0.00 3.43 1.01 1.12 -3.91 120.40 128.25 1igc s VAL 132 Ca -0.02 1.05 0.04 0.00 0.00 0.00 0.00 61.98 63.05 1igc s VAL 132 Cb -0.20 -3.83 -0.01 0.00 0.00 0.00 0.00 36.38 32.34 1igc s VAL 132 CO -0.01 0.50 -0.14 -0.69 0.00 0.00 0.00 175.10 174.76 1igc s VAL 133 N -0.66 1.11 -0.03 2.92 1.01 -1.09 0.12 120.40 123.78 1igc s VAL 133 Ca 0.27 -0.66 0.01 0.00 0.00 0.00 0.00 61.98 61.60 1igc s VAL 133 Cb -0.18 -0.94 0.02 0.00 0.00 0.00 0.00 36.38 35.28 1igc s VAL 133 CO 0.15 0.27 -0.03 0.00 0.00 0.00 0.00 175.10 175.49 1igc s PHE 135 N 0.78 3.18 -0.40 0.00 0.08 0.73 -1.56 117.98 120.79 1igc s PHE 135 Ca -0.09 -1.10 -0.15 0.00 0.12 0.00 0.00 56.93 55.71 1igc s PHE 135 Cb -0.13 -2.26 0.02 0.00 -0.57 0.00 0.00 43.02 40.08 1igc s PHE 135 CO -0.00 -0.62 0.29 -0.51 -0.10 0.00 0.00 175.22 174.28 1igc s LEU 136 N 1.47 5.05 0.07 -0.37 1.02 -0.70 -2.08 118.68 123.15 1igc s LEU 136 Ca 0.01 -0.88 0.07 0.00 0.02 0.00 0.00 54.13 53.36 1igc s LEU 136 Cb -0.18 -2.15 -0.03 0.00 0.02 0.00 0.00 46.19 43.85 1igc s LEU 136 CO 0.03 -0.43 -0.20 0.20 0.02 0.00 0.00 176.35 175.97 1igc s ASN 137 N 1.67 2.36 -0.88 2.29 0.01 0.05 0.64 114.94 121.09 1igc s ASN 137 Ca 0.05 -0.60 -0.04 0.00 -0.71 0.00 0.00 52.86 51.55 1igc s ASN 137 Cb -0.19 -0.15 -0.05 0.00 0.41 0.00 0.00 41.25 41.27 1igc s ASN 137 CO 0.10 0.08 0.78 0.59 -1.51 0.00 0.00 177.10 177.13 1igc n ASN 138 N 1.43 -6.25 0.00 -1.22 3.02 -0.94 -0.10 115.26 111.19 1igc n ASN 138 Ca -0.19 -0.53 0.00 0.00 -0.03 0.00 0.00 54.58 53.83 1igc n ASN 138 Cb 0.54 -4.67 0.00 0.00 -0.61 0.00 0.00 39.78 35.04 1igc n ASN 138 CO 0.00 0.00 0.00 2.22 -2.62 0.00 0.00 177.26 176.86 1igc n PHE 139 N -2.80 0.00 0.00 3.10 -1.74 -0.29 -4.57 117.46 111.16 1igc n PHE 139 Ca -0.05 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.84 1igc n PHE 139 Cb 0.59 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.59 1igc n PHE 139 CO 0.00 0.00 0.00 0.98 -0.56 0.00 0.00 176.76 177.18 1igc n TYR 140 N 0.00 0.00 0.00 2.97 4.19 -0.97 -4.00 117.16 119.35 1igc n TYR 140 Ca 0.00 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.21 1igc n TYR 140 Cb 0.00 0.00 0.00 0.00 0.49 0.00 0.00 39.34 39.83 1igc n TYR 140 CO 0.00 0.00 0.00 -2.30 0.91 0.00 0.00 176.86 175.47 1igc n PRO 141 N 0.00 0.00 0.00 2.98 -0.01 -1.26 -1.02 135.00 135.69 1igc n PRO 141 Ca 0.00 0.00 0.07 0.00 -0.01 0.00 0.00 63.50 63.56 1igc n PRO 141 Cb 0.00 0.00 0.37 0.00 -0.01 0.00 0.00 33.50 33.86 1igc n PRO 141 CO 0.00 0.00 0.00 1.17 -0.01 0.00 0.00 175.50 176.66 1igc n LYS 142 N -1.80 0.33 -2.89 -0.52 4.81 -1.26 -4.67 118.16 112.15 1igc n LYS 142 Ca 0.00 0.07 -0.41 0.00 -0.87 0.00 0.00 58.31 57.09 1igc n LYS 142 Cb 0.00 -1.50 -0.04 0.00 0.02 0.00 0.00 35.03 33.51 1igc n LYS 142 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1igc s ASP 143 N -2.23 6.93 -0.05 3.14 1.01 -1.26 -5.00 116.67 119.21 1igc s ASP 143 Ca 0.17 1.14 -0.30 0.00 0.71 0.00 0.00 52.55 54.28 1igc s ASP 143 Cb 0.09 -2.45 0.09 0.00 1.01 0.00 0.00 42.92 41.66 1igc s ASP 143 CO 0.17 -0.42 0.76 -0.51 0.21 0.00 0.00 175.17 175.38 1igc s ILE 144 N 2.28 0.00 -0.09 0.77 2.07 -1.26 -4.76 121.20 120.21 1igc s ILE 144 Ca 0.37 0.00 -0.00 0.00 -1.41 0.00 0.00 60.65 59.61 1igc s ILE 144 Cb -0.16 -1.00 0.02 0.00 0.13 0.00 0.00 42.46 41.45 1igc s ILE 144 CO 0.11 0.00 -0.06 0.21 -1.91 0.00 0.00 174.94 173.29 1igc s ASN 145 N -1.45 1.85 -0.12 4.50 3.04 -1.13 -5.06 114.94 116.56 1igc s ASN 145 Ca -0.06 -0.23 -0.04 0.00 0.04 0.00 0.00 52.86 52.57 1igc s ASN 145 Cb -0.00 -0.70 -0.03 0.00 -1.54 0.00 0.00 41.25 38.97 1igc s ASN 145 CO 0.04 -0.11 0.02 0.54 -3.04 0.00 0.00 177.10 174.55 1igc s VAL 146 N 1.54 4.43 -0.07 -5.21 0.11 -1.25 -2.82 120.40 117.13 1igc s VAL 146 Ca 0.01 -0.19 0.02 0.00 -2.93 0.00 0.00 61.98 58.89 1igc s VAL 146 Cb -0.13 -2.91 0.01 0.00 -1.53 0.00 0.00 36.38 31.82 1igc s VAL 146 CO -0.05 0.56 -0.13 -1.59 -3.33 0.00 0.00 175.10 170.55 1igc s LYS 147 N -0.43 1.85 -0.37 1.54 0.00 0.39 -4.93 119.74 117.79 1igc s LYS 147 Ca 0.08 -0.46 -0.09 0.00 0.00 0.00 0.00 55.97 55.50 1igc s LYS 147 Cb -0.12 -1.52 0.04 0.00 0.00 0.00 0.00 37.83 36.23 1igc s LYS 147 CO 0.02 0.03 0.18 -1.58 0.00 0.00 0.00 175.35 174.01 1igc s TRP 148 N 0.66 3.26 -0.30 1.78 0.52 -1.26 0.16 118.94 123.76 1igc s TRP 148 Ca -0.14 -1.21 -0.00 0.00 0.02 0.00 0.00 56.10 54.76 1igc s TRP 148 Cb -0.16 -2.47 0.06 0.00 -1.15 0.00 0.00 33.47 29.75 1igc s TRP 148 CO 0.04 -0.71 -0.02 -1.59 0.02 0.00 0.00 176.95 174.69 1igc s LYS 149 N 1.48 2.33 0.00 4.98 -2.85 -1.15 -1.56 119.74 122.97 1igc s LYS 149 Ca 0.01 -1.33 0.00 0.00 -1.00 0.00 0.00 55.97 53.65 1igc s LYS 149 Cb -0.20 -3.12 0.00 0.00 -2.06 0.00 0.00 37.83 32.45 1igc s LYS 149 CO 0.05 -0.63 0.49 1.51 0.10 0.00 0.00 175.35 176.86 1igc n ILE 150 N 4.56 0.00 -0.09 3.79 0.13 0.70 -1.63 119.36 126.82 1igc n ILE 150 Ca -0.12 0.99 -0.13 0.00 -1.10 0.00 0.00 62.75 62.39 1igc n ILE 150 Cb 0.43 -1.55 -0.06 0.00 -0.84 0.00 0.00 39.64 37.62 1igc n ILE 150 CO 0.00 0.00 0.00 0.47 2.80 0.00 0.00 176.55 179.82 1igc n ASP 151 N -0.91 1.84 -1.47 9.51 8.00 -1.19 -3.10 116.55 129.22 1igc n ASP 151 Ca 0.00 0.53 -0.01 0.00 0.71 0.00 0.00 54.79 56.02 1igc n ASP 151 Cb 0.00 -0.91 0.02 0.00 -0.02 0.00 0.00 41.12 40.21 1igc n ASP 151 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 1igc n SER 152 N -4.53 -0.36 -3.74 -2.24 2.88 -1.26 -4.47 113.62 99.91 1igc n SER 152 Ca -0.19 -1.10 -0.16 0.00 -1.33 0.00 0.00 58.87 56.09 1igc n SER 152 Cb 0.46 0.16 -0.16 0.00 -0.75 0.00 0.00 64.21 63.92 1igc n SER 152 CO 0.00 0.00 0.00 -0.70 -1.23 0.00 0.00 175.04 173.11 1igc s GLU 153 N 0.02 -0.01 0.45 -1.46 2.56 -1.26 -5.01 118.70 113.98 1igc s GLU 153 Ca 0.02 0.29 -0.23 0.00 0.00 0.00 0.00 54.97 55.05 1igc s GLU 153 Cb 0.09 -0.28 -0.08 0.00 2.00 0.00 0.00 34.13 35.86 1igc s GLU 153 CO -0.02 -0.21 1.17 1.03 -0.56 0.00 0.00 175.26 176.66 1igc s ARG 154 N 1.39 3.83 0.00 4.30 1.81 -1.24 0.25 118.95 129.29 1igc s ARG 154 Ca -0.06 1.79 0.00 0.00 -1.72 0.00 0.00 55.73 55.75 1igc s ARG 154 Cb -0.12 -2.47 0.00 0.00 -0.45 0.00 0.00 34.95 31.91 1igc s ARG 154 CO -0.04 -0.50 0.00 1.04 -0.68 0.00 0.00 175.30 175.12 1igc n GLN 155 N -0.36 2.47 0.00 3.54 3.00 -0.60 -4.91 117.38 120.53 1igc n GLN 155 Ca 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.06 1igc n GLN 155 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.72 1igc n GLN 155 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.06 177.33 1igc n ASN 156 N 0.00 0.00 -1.40 1.08 2.04 -1.26 -4.96 115.26 110.76 1igc n ASN 156 Ca 0.00 0.00 -0.06 0.00 -0.44 0.00 0.00 54.58 54.08 1igc n ASN 156 Cb 0.00 0.00 0.03 0.00 -2.53 0.00 0.00 39.78 37.28 1igc n ASN 156 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1igc n GLY 157 N 0.00 2.75 3.91 4.83 0.00 -1.26 -4.85 105.19 110.56 1igc n GLY 157 Ca 0.00 -0.31 -0.28 0.00 0.00 0.00 0.00 46.02 45.43 1igc n GLY 157 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1igc s VAL 158 N -0.78 3.18 -0.28 1.61 1.01 -1.26 -3.55 120.40 120.33 1igc s VAL 158 Ca 0.12 0.12 0.01 0.00 0.00 0.00 0.00 61.98 62.24 1igc s VAL 158 Cb 0.10 -3.33 0.18 0.00 0.00 0.00 0.00 36.38 33.32 1igc s VAL 158 CO 0.01 -0.39 0.52 -0.76 0.00 0.00 0.00 175.10 174.48 1igc s LEU 159 N -5.23 -1.21 0.31 3.92 1.43 -0.79 -4.94 118.68 112.17 1igc s LEU 159 Ca 0.57 0.31 0.04 0.00 -1.03 0.00 0.00 54.13 54.03 1igc s LEU 159 Cb -0.11 1.74 -0.02 0.00 0.03 0.00 0.00 46.19 47.83 1igc s LEU 159 CO 0.48 -0.30 0.46 0.20 0.23 0.00 0.00 176.35 177.42 1igc s ASN 160 N 2.73 6.14 -0.03 2.29 -0.87 -1.26 -2.05 114.94 121.90 1igc s ASN 160 Ca 0.14 0.06 -0.16 0.00 -1.57 0.00 0.00 52.86 51.33 1igc s ASN 160 Cb -0.13 -1.63 0.03 0.00 -0.02 0.00 0.00 41.25 39.50 1igc s ASN 160 CO -0.23 -0.29 0.34 -0.44 -2.57 0.00 0.00 177.10 173.91 1igc s SER 161 N -4.08 -0.25 0.06 -1.22 0.01 -0.91 -4.96 113.70 102.35 1igc s SER 161 Ca 0.40 0.21 0.05 0.00 1.31 0.00 0.00 55.95 57.92 1igc s SER 161 Cb -0.09 0.38 -0.03 0.00 0.21 0.00 0.00 66.02 66.49 1igc s SER 161 CO 0.32 -0.42 -0.14 0.26 0.41 0.00 0.00 173.24 173.66 1igc s TRP 162 N -1.14 1.21 0.73 2.43 0.52 -1.26 -1.82 118.94 119.60 1igc s TRP 162 Ca -0.12 -0.41 -0.07 0.00 0.02 0.00 0.00 56.10 55.52 1igc s TRP 162 Cb -0.05 -0.70 0.08 0.00 -1.15 0.00 0.00 33.47 31.66 1igc s TRP 162 CO 0.04 0.05 1.03 0.99 0.02 0.00 0.00 176.95 179.08 1igc s THR 163 N -1.09 2.25 0.55 2.01 2.01 -0.95 -4.99 115.64 115.42 1igc s THR 163 Ca -0.01 -0.30 0.01 0.00 0.31 0.00 0.00 61.69 61.71 1igc s THR 163 Cb -0.09 -2.95 0.03 0.00 0.01 0.00 0.00 72.50 69.50 1igc s THR 163 CO 0.02 0.00 0.77 -0.62 -0.69 0.00 0.00 174.62 174.10 1igc s ASP 164 N -4.58 5.30 0.38 3.53 -1.08 -1.26 -4.73 116.67 114.24 1igc s ASP 164 Ca 0.62 0.02 -0.27 0.00 -0.52 0.00 0.00 52.55 52.40 1igc s ASP 164 Cb -0.09 -0.92 -0.10 0.00 -1.46 0.00 0.00 42.92 40.34 1igc s ASP 164 CO 0.45 -1.12 1.41 -1.10 0.52 0.00 0.00 175.17 175.33 1igc s GLN 165 N -4.76 4.07 0.44 4.34 -0.21 -1.26 -4.65 119.66 117.63 1igc s GLN 165 Ca 0.57 2.40 -0.25 0.00 0.02 0.00 0.00 55.36 58.09 1igc s GLN 165 Cb -0.10 -2.90 -0.08 0.00 1.00 0.00 0.00 33.01 30.92 1igc s GLN 165 CO 0.39 -0.50 1.40 0.34 -2.12 0.00 0.00 175.29 174.79 1igc s ASP 166 N -0.38 5.98 0.12 5.90 -1.08 2.25 -4.82 116.67 124.63 1igc s ASP 166 Ca 0.54 2.85 -0.12 0.00 -0.52 0.00 0.00 52.55 55.30 1igc s ASP 166 Cb -0.43 -2.65 -0.12 0.00 -1.46 0.00 0.00 42.92 38.26 1igc s ASP 166 CO 0.57 -1.10 1.36 0.28 0.52 0.00 0.00 175.17 176.81 1igc h SER 167 N 2.40 0.98 0.17 -0.34 0.02 -1.89 -2.96 113.55 111.93 1igc h SER 167 Ca -0.51 -0.57 -0.01 0.00 -0.84 0.00 0.00 61.79 59.87 1igc h SER 167 Cb 1.26 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 63.52 1igc h SER 167 CO 0.61 1.37 -0.08 0.11 -1.14 0.00 0.00 176.83 177.71 1igc h LYS 168 N 0.63 -0.22 -2.70 3.45 1.57 -1.89 -3.38 116.57 114.03 1igc h LYS 168 Ca -0.01 0.02 -0.66 0.00 -1.87 0.00 0.00 60.65 58.12 1igc h LYS 168 Cb 1.26 0.05 -0.38 0.00 0.08 0.00 0.00 32.23 33.24 1igc h LYS 168 CO 0.14 0.15 -0.27 -0.40 -0.57 0.00 0.00 179.45 178.51 1igc n ASP 169 N -4.92 4.15 -0.05 0.86 5.75 -1.26 -4.86 116.55 116.23 1igc n ASP 169 Ca -0.07 -3.34 0.00 0.00 -0.01 0.00 0.00 54.79 51.38 1igc n ASP 169 Cb 0.24 -0.86 0.00 0.00 -1.03 0.00 0.00 41.12 39.47 1igc n ASP 169 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 1igc n SER 170 N 1.41 0.00 -4.90 -1.12 7.64 -1.12 -4.40 113.62 111.14 1igc n SER 170 Ca 0.26 0.00 -0.20 0.00 1.01 0.00 0.00 58.87 59.94 1igc n SER 170 Cb 0.38 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.55 1igc n SER 170 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1igc s THR 171 N 0.00 2.86 0.32 0.44 -4.23 -1.24 -4.66 115.64 109.12 1igc s THR 171 Ca 0.00 -1.28 0.09 0.00 -1.18 0.00 0.00 61.69 59.32 1igc s THR 171 Cb 0.00 -3.03 -0.05 0.00 1.34 0.00 0.00 72.50 70.76 1igc s THR 171 CO 0.00 -0.03 0.05 -0.31 -0.54 0.00 0.00 174.62 173.79 1igc s TYR 172 N -2.42 2.64 0.13 3.99 2.02 -1.26 0.56 117.35 123.01 1igc s TYR 172 Ca 0.48 -0.35 -0.07 0.00 -0.37 0.00 0.00 57.07 56.76 1igc s TYR 172 Cb -0.05 -1.44 -0.01 0.00 -0.40 0.00 0.00 41.96 40.05 1igc s TYR 172 CO 0.29 0.48 0.20 -1.12 -1.57 0.00 0.00 175.55 173.82 1igc s SER 173 N -3.74 0.14 0.11 2.29 0.01 -1.26 -1.14 113.70 110.10 1igc s SER 173 Ca 0.35 -0.89 -0.03 0.00 1.31 0.00 0.00 55.95 56.69 1igc s SER 173 Cb -0.03 0.37 -0.03 0.00 0.21 0.00 0.00 66.02 66.54 1igc s SER 173 CO 0.21 -0.80 0.07 -0.32 0.41 0.00 0.00 173.24 172.80 1igc s MET 174 N -3.95 0.85 -0.23 12.44 1.75 0.21 -2.23 119.30 128.14 1igc s MET 174 Ca 0.15 -1.30 -0.03 0.00 -1.25 0.00 0.00 55.69 53.26 1igc s MET 174 Cb 0.05 0.26 0.11 0.00 2.84 0.00 0.00 34.83 38.08 1igc s MET 174 CO -0.03 -0.23 0.26 -1.54 -0.65 0.00 0.00 175.02 172.83 1igc s SER 175 N -2.98 1.27 -0.01 1.11 1.04 -0.76 -1.72 113.70 111.64 1igc s SER 175 Ca 0.16 -0.25 -0.02 0.00 0.48 0.00 0.00 55.95 56.33 1igc s SER 175 Cb 0.07 0.51 -0.04 0.00 0.10 0.00 0.00 66.02 66.66 1igc s SER 175 CO -0.03 -0.33 0.13 -0.94 0.98 0.00 0.00 173.24 173.04 1igc s SER 176 N 2.36 6.02 -0.11 7.02 1.04 -0.60 -2.15 113.70 127.29 1igc s SER 176 Ca 0.08 0.25 -0.00 0.00 0.48 0.00 0.00 55.95 56.76 1igc s SER 176 Cb -0.15 -1.82 0.02 0.00 0.10 0.00 0.00 66.02 64.17 1igc s SER 176 CO -0.16 0.28 -0.08 -0.89 0.98 0.00 0.00 173.24 173.36 1igc s THR 177 N -1.24 1.06 -0.18 2.02 2.01 -0.87 -1.53 115.64 116.91 1igc s THR 177 Ca 0.24 -0.32 -0.05 0.00 0.31 0.00 0.00 61.69 61.88 1igc s THR 177 Cb -0.12 -1.07 -0.03 0.00 0.01 0.00 0.00 72.50 71.29 1igc s THR 177 CO 0.15 0.37 -0.00 -0.22 -0.69 0.00 0.00 174.62 174.23 1igc s LEU 178 N 1.63 3.35 -0.22 4.42 2.96 0.32 -1.89 118.68 129.26 1igc s LEU 178 Ca 0.04 -0.12 -0.01 0.00 -0.22 0.00 0.00 54.13 53.82 1igc s LEU 178 Cb -0.13 -1.83 0.06 0.00 0.50 0.00 0.00 46.19 44.79 1igc s LEU 178 CO -0.08 0.13 -0.01 -0.89 -1.32 0.00 0.00 176.35 174.18 1igc s THR 179 N 0.63 1.04 0.51 3.68 2.01 -1.23 0.36 115.64 122.64 1igc s THR 179 Ca -0.01 -0.91 0.03 0.00 0.31 0.00 0.00 61.69 61.11 1igc s THR 179 Cb -0.14 -1.43 0.00 0.00 0.01 0.00 0.00 72.50 70.94 1igc s THR 179 CO 0.02 -0.17 0.16 -1.48 -0.69 0.00 0.00 174.62 172.46 1igc s LEU 180 N 1.62 2.50 0.00 4.42 2.34 -0.35 -4.91 118.68 124.30 1igc s LEU 180 Ca -0.03 -1.47 -0.06 0.00 0.06 0.00 0.00 54.13 52.63 1igc s LEU 180 Cb -0.18 -0.94 0.17 0.00 -0.56 0.00 0.00 46.19 44.68 1igc s LEU 180 CO -0.07 -0.91 1.09 0.35 -1.06 0.00 0.00 176.35 175.74 1igc n THR 181 N -1.43 0.00 0.27 5.48 -2.24 -1.26 -2.05 114.28 113.04 1igc n THR 181 Ca -0.12 -1.30 -0.10 0.00 -2.27 0.00 0.00 64.05 60.26 1igc n THR 181 Cb 0.66 -1.14 -0.05 0.00 -2.10 0.00 0.00 70.33 67.69 1igc n THR 181 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 1igc h LYS 182 N 0.00 -0.65 -4.43 -0.78 3.64 -1.46 -1.09 116.57 111.80 1igc h LYS 182 Ca -0.36 0.04 -0.69 0.00 -1.27 0.00 0.00 60.65 58.38 1igc h LYS 182 Cb 1.17 0.15 -0.04 0.00 -0.41 0.00 0.00 32.23 33.10 1igc h LYS 182 CO 0.32 -0.44 2.84 -0.25 -2.27 0.00 0.00 179.45 179.66 1igc n ASP 183 N -3.93 3.94 0.04 4.20 8.00 -1.26 -0.94 116.55 126.60 1igc n ASP 183 Ca -0.08 -2.84 0.00 0.00 0.71 0.00 0.00 54.79 52.58 1igc n ASP 183 Cb 0.27 -1.63 0.00 0.00 -0.02 0.00 0.00 41.12 39.74 1igc n ASP 183 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 1igc n GLU 184 N 6.67 0.00 -0.19 -1.24 0.00 -1.21 -4.81 120.64 119.86 1igc n GLU 184 Ca 0.51 0.00 0.09 0.00 0.00 0.00 0.00 57.16 57.76 1igc n GLU 184 Cb 0.41 0.00 0.39 0.00 0.00 0.00 0.00 31.44 32.23 1igc n GLU 184 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.13 176.21 1igc h TYR 185 N 0.00 0.72 0.00 4.31 3.20 -0.83 -2.94 116.97 121.42 1igc h TYR 185 Ca 0.00 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.89 1igc h TYR 185 Cb 0.00 -0.23 0.00 0.00 1.54 0.00 0.00 36.73 38.04 1igc h TYR 185 CO 0.00 0.34 0.00 0.39 -1.64 0.00 0.00 178.16 177.25 1igc n GLU 186 N -4.50 0.00 -0.07 1.82 -0.58 -0.12 -2.65 120.64 114.55 1igc n GLU 186 Ca 0.12 0.43 0.00 0.00 -0.42 0.00 0.00 57.16 57.30 1igc n GLU 186 Cb 0.33 -1.39 0.00 0.00 -0.57 0.00 0.00 31.44 29.81 1igc n GLU 186 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1igc n ARG 187 N -1.75 0.31 -4.10 3.49 1.74 -1.11 -4.70 116.66 110.54 1igc n ARG 187 Ca 0.00 0.00 -0.13 0.00 -0.77 0.00 0.00 57.85 56.95 1igc n ARG 187 Cb 0.00 -1.35 -0.06 0.00 -1.02 0.00 0.00 32.46 30.03 1igc n ARG 187 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1igc s HIS 188 N 0.99 0.96 0.00 -1.55 3.76 -1.09 -4.97 115.29 113.39 1igc s HIS 188 Ca 0.00 -1.19 0.00 0.00 -0.15 0.00 0.00 55.06 53.72 1igc s HIS 188 Cb 0.00 -0.15 0.00 0.00 1.11 0.00 0.00 32.58 33.54 1igc s HIS 188 CO 0.00 -0.99 0.00 -1.71 -0.85 0.00 0.00 174.74 171.19 1igc n ASN 189 N -0.94 0.00 -4.87 1.40 2.85 -1.26 -4.97 115.26 107.47 1igc n ASN 189 Ca 0.01 0.00 -0.32 0.00 -0.11 0.00 0.00 54.58 54.16 1igc n ASN 189 Cb 0.63 0.14 -0.05 0.00 1.24 0.00 0.00 39.78 41.73 1igc n ASN 189 CO 0.00 0.00 0.00 -0.55 -2.11 0.00 0.00 177.26 174.60 1igc s SER 190 N -2.99 6.65 -0.16 1.20 0.15 -1.26 -2.56 113.70 114.73 1igc s SER 190 Ca 0.00 0.98 -0.03 0.00 0.70 0.00 0.00 55.95 57.60 1igc s SER 190 Cb 0.00 -2.25 0.05 0.00 -1.71 0.00 0.00 66.02 62.11 1igc s SER 190 CO 0.00 -0.10 0.04 -0.31 1.20 0.00 0.00 173.24 174.07 1igc s TYR 191 N -1.86 0.74 0.20 3.44 2.02 0.50 -3.15 117.35 119.25 1igc s TYR 191 Ca 0.49 -0.56 0.10 0.00 -0.37 0.00 0.00 57.07 56.73 1igc s TYR 191 Cb -0.11 -0.89 -0.04 0.00 -0.40 0.00 0.00 41.96 40.52 1igc s TYR 191 CO 0.21 -0.51 -0.16 0.99 -1.57 0.00 0.00 175.55 174.50 1igc s THR 192 N 1.95 2.77 -0.27 -0.71 2.01 -0.65 -3.32 115.64 117.43 1igc s THR 192 Ca 0.01 -1.92 0.02 0.00 0.31 0.00 0.00 61.69 60.11 1igc s THR 192 Cb -0.16 -2.37 0.06 0.00 0.01 0.00 0.00 72.50 70.04 1igc s THR 192 CO -0.07 -0.16 -0.09 0.00 -0.69 0.00 0.00 174.62 173.60 1igc s GLU 194 N 1.14 3.16 -0.19 0.00 2.12 0.42 0.48 118.70 125.82 1igc s GLU 194 Ca -0.08 -0.61 -0.04 0.00 0.36 0.00 0.00 54.97 54.60 1igc s GLU 194 Cb -0.20 -2.65 0.08 0.00 0.26 0.00 0.00 34.13 31.62 1igc s GLU 194 CO -0.04 0.40 0.20 0.00 -0.54 0.00 0.00 175.26 175.27 1igc s ALA 195 N -0.12 -0.15 -0.00 6.30 0.00 0.18 0.15 121.76 128.12 1igc s ALA 195 Ca 0.00 0.20 -0.03 0.00 0.00 0.00 0.00 51.96 52.13 1igc s ALA 195 Cb -0.13 -1.23 -0.04 0.00 0.00 0.00 0.00 23.12 21.72 1igc s ALA 195 CO 0.03 -1.14 0.20 0.95 0.00 0.00 0.00 175.76 175.80 1igc s THR 196 N 2.29 5.42 -0.14 0.00 -4.23 -1.13 0.11 115.64 117.97 1igc s THR 196 Ca 0.06 -0.14 -0.11 0.00 -1.18 0.00 0.00 61.69 60.32 1igc s THR 196 Cb -0.15 -3.55 0.04 0.00 1.34 0.00 0.00 72.50 70.18 1igc s THR 196 CO -0.11 0.31 0.35 -2.28 -0.54 0.00 0.00 174.62 172.36 1igc s HIS 197 N -1.34 -0.42 -0.86 3.99 5.04 -1.26 -2.85 115.29 117.59 1igc s HIS 197 Ca 0.28 1.00 0.00 0.00 -1.54 0.00 0.00 55.06 54.80 1igc s HIS 197 Cb -0.13 0.15 0.00 0.00 0.04 0.00 0.00 32.58 32.64 1igc s HIS 197 CO 0.19 -0.22 0.00 0.36 -2.34 0.00 0.00 174.74 172.73 1igc n LYS 198 N 3.28 0.00 -0.01 2.88 2.85 -1.26 0.42 118.16 126.33 1igc n LYS 198 Ca -0.16 0.00 0.08 0.00 -1.05 0.00 0.00 58.31 57.18 1igc n LYS 198 Cb 0.57 -0.88 -0.12 0.00 -0.65 0.00 0.00 35.03 33.95 1igc n LYS 198 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 1igc n THR 199 N 0.10 0.00 -3.79 0.58 -2.24 -1.26 -4.93 114.28 102.74 1igc n THR 199 Ca 0.00 -0.29 -0.17 0.00 -2.27 0.00 0.00 64.05 61.32 1igc n THR 199 Cb 0.00 0.42 -0.17 0.00 -2.10 0.00 0.00 70.33 68.48 1igc n THR 199 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1igc s SER 200 N -3.46 0.44 0.12 3.42 1.04 0.17 -5.02 113.70 110.41 1igc s SER 200 Ca -0.02 0.03 -0.12 0.00 0.48 0.00 0.00 55.95 56.31 1igc s SER 200 Cb 0.11 -0.14 -0.11 0.00 0.10 0.00 0.00 66.02 65.99 1igc s SER 200 CO 0.69 -0.15 1.38 0.74 0.98 0.00 0.00 173.24 176.88 1igc h THR 201 N 6.31 1.28 -3.62 2.02 2.02 -1.92 -3.35 112.91 115.65 1igc h THR 201 Ca -0.37 -1.77 -0.61 0.00 0.77 0.00 0.00 66.41 64.43 1igc h THR 201 Cb 1.12 1.72 -0.12 0.00 -1.74 0.00 0.00 68.15 69.14 1igc h THR 201 CO 0.40 0.57 0.44 -0.94 0.37 0.00 0.00 175.52 176.37 1igc s SER 202 N -6.95 6.47 0.48 4.18 1.04 -1.26 -5.03 113.70 112.63 1igc s SER 202 Ca -0.11 0.05 -0.20 0.00 0.48 0.00 0.00 55.95 56.18 1igc s SER 202 Cb 0.09 -2.41 -0.12 0.00 0.10 0.00 0.00 66.02 63.68 1igc s SER 202 CO 0.89 -0.94 0.32 -0.81 0.98 0.00 0.00 173.24 173.68 1igc n PRO 203 N 6.83 0.34 -3.08 4.02 -0.04 -1.26 -4.89 135.00 136.92 1igc n PRO 203 Ca 0.04 0.13 -0.30 0.00 -0.04 0.00 0.00 63.50 63.33 1igc n PRO 203 Cb 0.48 -1.38 -0.04 0.00 -0.04 0.00 0.00 33.50 32.53 1igc n PRO 203 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1igc s ILE 204 N -1.70 4.86 -0.16 0.52 1.09 0.30 -4.85 121.20 121.26 1igc s ILE 204 Ca 0.63 0.47 -0.09 0.00 -1.10 0.00 0.00 60.65 60.56 1igc s ILE 204 Cb -0.53 -3.71 0.06 0.00 -1.06 0.00 0.00 42.46 37.21 1igc s ILE 204 CO 0.59 -0.38 0.39 0.54 -0.10 0.00 0.00 174.94 175.98 1igc s VAL 205 N -2.19 -0.03 -0.21 2.92 0.11 -1.26 0.47 120.40 120.21 1igc s VAL 205 Ca 0.49 0.10 -0.05 0.00 -2.93 0.00 0.00 61.98 59.59 1igc s VAL 205 Cb -0.10 -0.58 -0.02 0.00 -1.53 0.00 0.00 36.38 34.15 1igc s VAL 205 CO 0.28 0.04 -0.01 -0.54 -3.33 0.00 0.00 175.10 171.54 1igc s LYS 206 N 1.33 3.52 0.00 1.54 3.01 0.18 -4.94 119.74 124.38 1igc s LYS 206 Ca -0.09 -0.56 0.00 0.00 -1.01 0.00 0.00 55.97 54.31 1igc s LYS 206 Cb -0.08 -3.08 0.00 0.00 -1.01 0.00 0.00 37.83 33.66 1igc s LYS 206 CO -0.12 -0.10 0.00 -1.13 0.51 0.00 0.00 175.35 174.51 1igc n SER 207 N 4.57 0.00 -2.34 2.83 3.41 -1.26 0.23 113.62 121.05 1igc n SER 207 Ca -0.17 0.00 -0.01 0.00 -0.26 0.00 0.00 58.87 58.43 1igc n SER 207 Cb 0.51 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 64.46 1igc n SER 207 CO 0.00 0.00 0.00 2.22 -0.16 0.00 0.00 175.04 177.10 1igc n PHE 208 N 0.00 -1.69 -3.51 7.33 1.16 -1.21 -2.95 117.46 116.59 1igc n PHE 208 Ca 0.00 1.00 -0.39 0.00 -1.87 0.00 0.00 57.45 56.19 1igc n PHE 208 Cb 0.00 -2.02 -0.10 0.00 -1.61 0.00 0.00 39.48 35.75 1igc n PHE 208 CO 0.00 0.00 0.00 1.21 -1.87 0.00 0.00 176.76 176.10 1igc s ASN 209 N -0.22 6.10 -0.74 5.98 3.04 -1.26 -0.37 114.94 127.47 1igc s ASN 209 Ca -0.03 -0.02 -0.34 0.00 0.04 0.00 0.00 52.86 52.51 1igc s ASN 209 Cb 0.00 -2.15 -0.18 0.00 -1.54 0.00 0.00 41.25 37.38 1igc s ASN 209 CO 0.08 -0.14 2.47 0.54 -3.04 0.00 0.00 177.10 177.00 1igc n ARG 210 N 5.17 0.25 -3.06 0.43 1.74 -1.06 -4.92 116.66 115.21 1igc n ARG 210 Ca -0.12 0.03 -0.38 0.00 -0.77 0.00 0.00 57.85 56.61 1igc n ARG 210 Cb 0.51 -1.84 -0.01 0.00 -1.02 0.00 0.00 32.46 30.10 1igc n ARG 210 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1igc n ASN 211 N 10.32 5.81 -4.55 0.55 4.13 -1.26 -5.03 115.26 125.23 1igc n ASN 211 Ca 0.57 -3.47 -0.39 0.00 1.68 0.00 0.00 54.58 52.97 1igc n ASN 211 Cb 0.10 -1.08 -0.03 0.00 -1.54 0.00 0.00 39.78 37.23 1igc n ASN 211 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 1igc s GLU 212 N -2.95 3.11 0.00 3.52 8.01 -1.26 -5.29 118.70 123.84 1igc s GLU 212 Ca 0.35 -0.33 0.15 0.00 0.01 0.00 0.00 54.97 55.15 1igc s GLU 212 Cb 0.10 -4.66 0.12 0.00 -4.31 0.00 0.00 34.13 25.38 1igc s GLU 212 CO 0.04 -2.44 0.97 0.00 0.01 0.00 0.00 175.26 173.84