#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qqc s MET 55 N 0.00 3.78 0.58 0.38 -2.45 0.44 -4.93 119.30 117.11 2qqc s MET 55 Ca 0.00 0.21 -0.18 0.00 -1.25 0.00 0.00 55.69 54.47 2qqc s MET 55 Cb 0.00 -3.78 -0.07 0.00 1.25 0.00 0.00 34.83 32.23 2qqc s MET 55 CO 0.00 -0.69 0.70 -2.30 1.05 0.00 0.00 175.02 173.78 2qqc n PRO 56 N 6.06 0.66 -1.73 4.11 -0.02 -1.26 -0.62 135.00 142.20 2qqc n PRO 56 Ca -0.00 0.26 -0.42 0.00 -2.02 0.00 0.00 63.50 61.32 2qqc n PRO 56 Cb 0.49 -1.88 -0.01 0.00 -0.02 0.00 0.00 33.50 32.07 2qqc n PRO 56 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2qqc n PRO 57 N -0.44 2.42 0.00 0.52 -0.02 -1.26 -1.92 135.00 134.31 2qqc n PRO 57 Ca 0.12 0.85 0.00 0.00 -2.02 0.00 0.00 63.50 62.46 2qqc n PRO 57 Cb 0.47 -2.54 0.00 0.00 -0.02 0.00 0.00 33.50 31.42 2qqc n PRO 57 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2qqc n GLU 58 N 1.04 0.00 -1.28 -0.52 1.02 -1.25 -5.00 120.64 114.66 2qqc n GLU 58 Ca 0.05 0.00 -0.36 0.00 -0.02 0.00 0.00 57.16 56.83 2qqc n GLU 58 Cb 0.37 -1.40 0.08 0.00 -0.02 0.00 0.00 31.44 30.46 2qqc n GLU 58 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2qqc n ALA 59 N 0.08 -0.90 -2.41 0.62 0.00 -0.81 -4.99 120.51 112.11 2qqc n ALA 59 Ca 0.00 -0.23 -0.31 0.00 0.00 0.00 0.00 53.44 52.90 2qqc n ALA 59 Cb 0.00 -1.99 -0.14 0.00 0.00 0.00 0.00 19.45 17.33 2qqc n ALA 59 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2qqc s GLU 60 N -3.10 2.00 -0.23 0.00 2.12 -1.26 -5.01 118.70 113.22 2qqc s GLU 60 Ca 0.69 -1.01 -0.24 0.00 0.36 0.00 0.00 54.97 54.77 2qqc s GLU 60 Cb -0.34 -2.12 -0.01 0.00 0.26 0.00 0.00 34.13 31.92 2qqc s GLU 60 CO 0.54 0.54 0.80 0.42 -0.54 0.00 0.00 175.26 177.03 2qqc s ILE 61 N -0.85 4.86 0.06 -3.70 1.01 -1.26 -5.03 121.20 116.29 2qqc s ILE 61 Ca 0.13 1.53 0.00 0.00 0.00 0.00 0.00 60.65 62.31 2qqc s ILE 61 Cb -0.10 -4.10 -0.04 0.00 0.01 0.00 0.00 42.46 38.23 2qqc s ILE 61 CO 0.03 -0.04 -0.04 0.68 0.00 0.00 0.00 174.94 175.57 2qqc s VAL 62 N 2.64 0.36 0.58 2.92 -7.23 -1.26 -5.13 120.40 113.28 2qqc s VAL 62 Ca 0.35 -1.65 -0.20 0.00 -1.81 0.00 0.00 61.98 58.67 2qqc s VAL 62 Cb -0.16 -1.30 -0.04 0.00 0.56 0.00 0.00 36.38 35.45 2qqc s VAL 62 CO 0.08 -0.84 1.32 -2.65 -0.31 0.00 0.00 175.10 172.70 2qqc n PRO 63 N 0.41 1.45 -1.68 4.82 -0.02 -1.26 -4.80 135.00 133.93 2qqc n PRO 63 Ca -0.16 0.54 -0.57 0.00 -2.02 0.00 0.00 63.50 61.30 2qqc n PRO 63 Cb 0.59 -2.54 -0.07 0.00 -0.02 0.00 0.00 33.50 31.47 2qqc n PRO 63 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 2qqc n LEU 64 N -1.29 2.03 -4.71 2.45 7.94 -1.26 -4.94 117.00 117.22 2qqc n LEU 64 Ca 0.13 1.10 -0.29 0.00 -1.11 0.00 0.00 56.01 55.83 2qqc n LEU 64 Cb 0.46 -1.13 0.19 0.00 0.53 0.00 0.00 43.42 43.47 2qqc n LEU 64 CO 0.51 -0.67 0.69 -2.84 -1.11 0.00 0.00 177.39 173.97 2qqc s PRO 65 N 2.58 0.03 -0.50 1.96 0.02 -1.26 -4.95 135.00 132.88 2qqc s PRO 65 Ca 0.95 0.11 -0.23 0.00 0.02 0.00 0.00 61.00 61.84 2qqc s PRO 65 Cb -1.07 -1.73 0.04 0.00 0.02 0.00 0.00 34.50 31.75 2qqc s PRO 65 CO 0.61 -2.91 0.85 0.21 -0.33 0.00 0.00 177.00 175.43 2qqc s LYS 66 N -5.34 3.36 0.03 5.54 2.20 -1.26 -5.02 119.74 119.25 2qqc s LYS 66 Ca 0.68 -0.22 -0.17 0.00 -0.36 0.00 0.00 55.97 55.90 2qqc s LYS 66 Cb -0.12 -4.00 -0.06 0.00 -1.51 0.00 0.00 37.83 32.14 2qqc s LYS 66 CO 0.55 -1.29 0.50 -0.51 -0.36 0.00 0.00 175.35 174.23 2qqc s LEU 67 N 3.56 4.49 0.27 5.43 1.43 -1.26 -5.06 118.68 127.54 2qqc s LEU 67 Ca 0.29 1.10 -0.29 0.00 -1.03 0.00 0.00 54.13 54.21 2qqc s LEU 67 Cb -0.13 -2.75 -0.09 0.00 0.03 0.00 0.00 46.19 43.25 2qqc s LEU 67 CO 0.21 0.27 1.22 -2.16 0.23 0.00 0.00 176.35 176.12 2qqc s PRO 68 N -0.96 4.48 0.32 1.29 0.04 -1.26 -4.94 135.00 133.96 2qqc s PRO 68 Ca 0.27 2.00 -0.29 0.00 0.04 0.00 0.00 61.00 63.01 2qqc s PRO 68 Cb -0.18 -3.16 -0.12 0.00 0.04 0.00 0.00 34.50 31.08 2qqc s PRO 68 CO 0.16 -0.05 1.46 -1.33 0.04 0.00 0.00 177.00 177.28 2qqc n MET 69 N 1.49 2.43 -0.51 4.56 2.81 -1.26 -1.88 117.12 124.76 2qqc n MET 69 Ca 0.01 0.86 0.00 0.00 -1.81 0.00 0.00 57.70 56.76 2qqc n MET 69 Cb 0.43 -2.55 0.00 0.00 -0.71 0.00 0.00 33.22 30.39 2qqc n MET 69 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2qqc n GLY 70 N 1.41 1.26 3.74 3.03 0.00 -1.26 -5.01 105.19 108.35 2qqc n GLY 70 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 2qqc n GLY 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qqc n ALA 71 N -0.04 1.82 -2.85 4.61 0.00 -0.79 -4.92 120.51 118.33 2qqc n ALA 71 Ca 0.00 0.34 -0.43 0.00 0.00 0.00 0.00 53.44 53.35 2qqc n ALA 71 Cb 0.00 -2.34 -0.04 0.00 0.00 0.00 0.00 19.45 17.07 2qqc n ALA 71 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2qqc s LEU 72 N -1.62 4.51 -0.30 0.00 1.43 -1.26 -5.01 118.68 116.43 2qqc s LEU 72 Ca 0.55 -0.95 -0.08 0.00 -1.03 0.00 0.00 54.13 52.62 2qqc s LEU 72 Cb -0.52 -2.46 -0.00 0.00 0.03 0.00 0.00 46.19 43.24 2qqc s LEU 72 CO 0.62 -1.34 0.11 -0.69 0.23 0.00 0.00 176.35 175.29 2qqc s VAL 73 N 3.79 4.30 0.01 -1.59 1.01 -1.26 -5.05 120.40 121.60 2qqc s VAL 73 Ca 0.21 -0.50 -0.30 0.00 0.00 0.00 0.00 61.98 61.40 2qqc s VAL 73 Cb -0.17 -3.18 -0.08 0.00 0.00 0.00 0.00 36.38 32.95 2qqc s VAL 73 CO 0.11 0.11 1.84 -2.84 0.00 0.00 0.00 175.10 174.32 2qqc s PRO 74 N 1.57 4.16 -0.02 2.72 0.02 -1.26 -4.88 135.00 137.30 2qqc s PRO 74 Ca 0.04 2.46 0.01 0.00 0.02 0.00 0.00 61.00 63.52 2qqc s PRO 74 Cb -0.17 -4.04 0.02 0.00 0.02 0.00 0.00 34.50 30.33 2qqc s PRO 74 CO 0.04 -0.90 -0.01 0.99 -0.33 0.00 0.00 177.00 176.80 2qqc s THR 75 N 4.12 0.18 -0.21 0.99 2.01 -1.26 -1.05 115.64 120.43 2qqc s THR 75 Ca 0.82 0.04 -0.11 0.00 0.31 0.00 0.00 61.69 62.75 2qqc s THR 75 Cb -0.40 -0.25 -0.05 0.00 0.01 0.00 0.00 72.50 71.82 2qqc s THR 75 CO 0.37 0.12 0.18 0.00 -0.69 0.00 0.00 174.62 174.60 2qqc s ALA 76 N 0.75 3.64 0.14 7.40 0.00 -0.79 -4.96 121.76 127.94 2qqc s ALA 76 Ca -0.07 -0.71 -0.14 0.00 0.00 0.00 0.00 51.96 51.04 2qqc s ALA 76 Cb -0.11 -2.29 0.02 0.00 0.00 0.00 0.00 23.12 20.74 2qqc s ALA 76 CO -0.01 -0.00 0.37 1.52 0.00 0.00 0.00 175.76 177.64 2qqc s TYR 77 N 0.69 -0.01 -0.00 0.00 -0.85 -1.26 -0.51 117.35 115.40 2qqc s TYR 77 Ca 0.10 -0.34 0.02 0.00 -0.52 0.00 0.00 57.07 56.33 2qqc s TYR 77 Cb -0.12 0.18 -0.01 0.00 0.38 0.00 0.00 41.96 42.39 2qqc s TYR 77 CO 0.02 -0.73 -0.07 0.20 -1.52 0.00 0.00 175.55 173.45 2qqc s GLY 78 N -2.86 0.34 0.15 5.49 0.00 -0.13 -4.95 107.32 105.35 2qqc s GLY 78 Ca 0.08 -0.30 -0.11 0.00 0.00 0.00 0.00 44.72 44.38 2qqc s GLY 78 CO -0.07 -0.26 0.31 -2.52 0.00 0.00 0.00 173.10 170.56 2qqc s TYR 79 N -0.19 0.21 -0.15 1.90 -0.85 -1.26 -1.31 117.35 115.70 2qqc s TYR 79 Ca 0.02 -0.58 -0.12 0.00 -0.52 0.00 0.00 57.07 55.87 2qqc s TYR 79 Cb -0.03 0.04 0.04 0.00 0.38 0.00 0.00 41.96 42.39 2qqc s TYR 79 CO -0.00 -0.71 0.38 -1.50 -1.52 0.00 0.00 175.55 172.20 2qqc s ILE 80 N -3.91 -0.01 -0.05 -3.49 2.07 -0.65 -4.89 121.20 110.27 2qqc s ILE 80 Ca 0.12 0.03 0.06 0.00 -1.41 0.00 0.00 60.65 59.46 2qqc s ILE 80 Cb 0.03 -0.54 -0.01 0.00 0.13 0.00 0.00 42.46 42.06 2qqc s ILE 80 CO -0.04 0.01 -0.25 -0.63 -1.91 0.00 0.00 174.94 172.13 2qqc s ILE 81 N 0.58 2.00 0.00 2.00 1.01 -1.26 -1.58 121.20 123.95 2qqc s ILE 81 Ca -0.03 -1.04 0.00 0.00 0.00 0.00 0.00 60.65 59.58 2qqc s ILE 81 Cb -0.05 -1.68 -0.00 0.00 0.01 0.00 0.00 42.46 40.74 2qqc s ILE 81 CO -0.04 0.56 -0.01 -0.55 0.00 0.00 0.00 174.94 174.90 2qqc s SER 82 N -0.23 0.14 -0.11 3.58 0.15 -0.54 -5.01 113.70 111.68 2qqc s SER 82 Ca -0.01 -0.04 0.14 0.00 0.70 0.00 0.00 55.95 56.74 2qqc s SER 82 Cb -0.13 -0.01 0.39 0.00 -1.71 0.00 0.00 66.02 64.57 2qqc s SER 82 CO 0.03 0.00 1.31 -0.90 1.20 0.00 0.00 173.24 174.88 2qqc n ASP 83 N 3.00 3.27 -4.50 5.45 5.68 -1.26 -0.84 116.55 127.34 2qqc n ASP 83 Ca -0.13 -2.64 -0.43 0.00 -0.50 0.00 0.00 54.79 51.09 2qqc n ASP 83 Cb 0.59 -0.39 -0.06 0.00 -1.14 0.00 0.00 41.12 40.12 2qqc n ASP 83 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 2qqc s VAL 84 N -2.14 4.81 0.41 2.12 1.01 -1.26 -4.72 120.40 120.63 2qqc s VAL 84 Ca 0.32 -0.02 -0.25 0.00 0.00 0.00 0.00 61.98 62.03 2qqc s VAL 84 Cb 0.24 -4.25 -0.10 0.00 0.00 0.00 0.00 36.38 32.27 2qqc s VAL 84 CO 0.10 -0.68 1.09 -2.65 0.00 0.00 0.00 175.10 172.95 2qqc n PRO 85 N 6.32 1.51 -0.17 2.72 -0.02 -1.26 -1.87 135.00 142.23 2qqc n PRO 85 Ca -0.03 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 62.00 2qqc n PRO 85 Cb 0.47 -2.13 0.00 0.00 -0.02 0.00 0.00 33.50 31.82 2qqc n PRO 85 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qqc n GLY 86 N 1.08 1.32 3.77 -1.23 0.00 0.92 -4.97 105.19 106.09 2qqc n GLY 86 Ca 0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.73 2qqc n GLY 86 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2qqc s GLU 87 N -0.11 4.43 -0.22 1.61 2.12 -0.78 -4.73 118.70 121.02 2qqc s GLU 87 Ca 0.00 1.52 -0.08 0.00 0.36 0.00 0.00 54.97 56.77 2qqc s GLU 87 Cb 0.00 -2.81 -0.04 0.00 0.26 0.00 0.00 34.13 31.54 2qqc s GLU 87 CO 0.00 0.10 0.09 0.99 -0.54 0.00 0.00 175.26 175.90 2qqc s THR 88 N -1.50 4.78 0.08 -1.70 2.01 -1.26 -0.79 115.64 117.26 2qqc s THR 88 Ca 0.52 -0.02 0.09 0.00 0.31 0.00 0.00 61.69 62.58 2qqc s THR 88 Cb -0.24 -3.21 -0.03 0.00 0.01 0.00 0.00 72.50 69.04 2qqc s THR 88 CO 0.30 0.38 -0.23 0.27 -0.69 0.00 0.00 174.62 174.65 2qqc s ILE 89 N 1.00 1.90 0.07 1.82 -4.36 -0.09 -3.36 121.20 118.19 2qqc s ILE 89 Ca 0.05 -1.45 0.01 0.00 -0.26 0.00 0.00 60.65 59.00 2qqc s ILE 89 Cb -0.14 -1.67 -0.04 0.00 1.25 0.00 0.00 42.46 41.86 2qqc s ILE 89 CO 0.03 0.14 -0.05 -0.44 0.24 0.00 0.00 174.94 174.86 2qqc s SER 90 N -1.57 0.80 -0.02 4.36 0.01 0.15 0.37 113.70 117.81 2qqc s SER 90 Ca 0.09 -0.88 -0.02 0.00 1.31 0.00 0.00 55.95 56.45 2qqc s SER 90 Cb -0.10 0.12 0.00 0.00 0.21 0.00 0.00 66.02 66.25 2qqc s SER 90 CO 0.03 -0.45 0.06 0.00 0.41 0.00 0.00 173.24 173.30 2qqc s ALA 91 N -3.12 -0.14 0.07 1.44 0.00 -0.33 -1.73 121.76 117.94 2qqc s ALA 91 Ca 0.04 0.04 -0.10 0.00 0.00 0.00 0.00 51.96 51.94 2qqc s ALA 91 Cb 0.02 -0.05 0.01 0.00 0.00 0.00 0.00 23.12 23.10 2qqc s ALA 91 CO -0.05 -0.07 0.23 0.00 0.00 0.00 0.00 175.76 175.87 2qqc s ALA 92 N -0.32 -0.41 0.02 0.00 0.00 0.22 -1.14 121.76 120.13 2qqc s ALA 92 Ca -0.04 -0.34 0.01 0.00 0.00 0.00 0.00 51.96 51.59 2qqc s ALA 92 Cb -0.03 0.40 -0.02 0.00 0.00 0.00 0.00 23.12 23.48 2qqc s ALA 92 CO 0.00 -0.45 -0.04 -1.50 0.00 0.00 0.00 175.76 173.77 2qqc s ILE 93 N -3.16 0.22 0.04 0.00 1.10 -0.61 -1.03 121.20 117.75 2qqc s ILE 93 Ca -0.01 -0.74 -0.02 0.00 -0.51 0.00 0.00 60.65 59.38 2qqc s ILE 93 Cb 0.02 -0.31 -0.03 0.00 0.15 0.00 0.00 42.46 42.29 2qqc s ILE 93 CO -0.07 -0.34 0.00 -0.94 -2.11 0.00 0.00 174.94 171.49 2qqc s SER 94 N -1.13 0.35 -0.10 4.50 1.04 0.01 -1.63 113.70 116.75 2qqc s SER 94 Ca -0.10 -0.76 -0.03 0.00 0.48 0.00 0.00 55.95 55.53 2qqc s SER 94 Cb -0.08 0.19 0.04 0.00 0.10 0.00 0.00 66.02 66.27 2qqc s SER 94 CO -0.00 -0.51 0.07 0.54 0.98 0.00 0.00 173.24 174.31 2qqc s VAL 95 N -3.02 -0.07 -0.16 5.02 0.11 0.45 -0.99 120.40 121.74 2qqc s VAL 95 Ca -0.01 0.17 -0.19 0.00 -2.93 0.00 0.00 61.98 59.01 2qqc s VAL 95 Cb 0.01 -0.35 -0.03 0.00 -1.53 0.00 0.00 36.38 34.48 2qqc s VAL 95 CO -0.07 -0.00 0.53 0.00 -3.33 0.00 0.00 175.10 172.23 2qqc s ALA 96 N 2.14 3.51 -0.17 1.54 0.00 0.86 -1.97 121.76 127.66 2qqc s ALA 96 Ca 0.04 -0.28 -0.06 0.00 0.00 0.00 0.00 51.96 51.65 2qqc s ALA 96 Cb -0.14 -2.78 -0.04 0.00 0.00 0.00 0.00 23.12 20.16 2qqc s ALA 96 CO -0.06 -0.28 0.04 0.42 0.00 0.00 0.00 175.76 175.89 2qqc s ILE 97 N 1.26 4.62 0.42 0.00 1.01 -0.10 -1.08 121.20 127.33 2qqc s ILE 97 Ca 0.26 -0.10 -0.18 0.00 0.00 0.00 0.00 60.65 60.63 2qqc s ILE 97 Cb -0.15 -3.06 -0.09 0.00 0.01 0.00 0.00 42.46 39.16 2qqc s ILE 97 CO 0.10 0.48 0.89 -2.16 0.00 0.00 0.00 174.94 174.26 2qqc s PRO 98 N 0.23 4.08 0.15 2.79 0.04 -1.26 0.57 135.00 141.60 2qqc s PRO 98 Ca 0.03 0.93 -0.06 0.00 0.04 0.00 0.00 61.00 61.93 2qqc s PRO 98 Cb -0.13 -2.25 -0.01 0.00 0.04 0.00 0.00 34.50 32.15 2qqc s PRO 98 CO 0.01 -0.04 1.40 -0.22 0.04 0.00 0.00 177.00 178.19 2qqc h LYS 99 N 1.73 0.60 -6.55 4.56 3.64 -1.57 -3.39 116.57 115.59 2qqc h LYS 99 Ca -0.48 -0.46 -0.55 0.00 -1.27 0.00 0.00 60.65 57.89 2qqc h LYS 99 Cb 1.18 0.09 -0.07 0.00 -0.41 0.00 0.00 32.23 33.02 2qqc h LYS 99 CO 0.62 1.08 1.02 0.34 -2.27 0.00 0.00 179.45 180.24 2qqc s ASP 100 N -7.01 6.37 0.12 4.20 -1.08 -1.26 -4.87 116.67 113.14 2qqc s ASP 100 Ca -0.08 0.33 0.16 0.00 -0.52 0.00 0.00 52.55 52.44 2qqc s ASP 100 Cb 0.10 -2.55 0.70 0.00 -1.46 0.00 0.00 42.92 39.71 2qqc s ASP 100 CO 0.87 -1.50 1.49 0.29 0.52 0.00 0.00 175.17 176.83 2qqc n LYS 101 N 8.35 0.08 0.08 4.34 4.76 -1.26 -1.52 118.16 132.98 2qqc n LYS 101 Ca 0.12 0.39 0.13 0.00 -2.87 0.00 0.00 58.31 56.08 2qqc n LYS 101 Cb 0.49 -1.67 0.46 0.00 -1.84 0.00 0.00 35.03 32.47 2qqc n LYS 101 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 2qqc n SER 102 N -1.82 0.56 -4.97 4.39 3.41 -1.26 -3.79 113.62 110.13 2qqc n SER 102 Ca 0.02 0.56 -0.22 0.00 -0.26 0.00 0.00 58.87 58.98 2qqc n SER 102 Cb 0.14 -0.71 0.04 0.00 -0.26 0.00 0.00 64.21 63.42 2qqc n SER 102 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2qqc s LEU 103 N -4.07 3.27 0.33 1.04 1.43 -0.58 -4.82 118.68 115.28 2qqc s LEU 103 Ca 0.11 0.06 0.05 0.00 -1.03 0.00 0.00 54.13 53.31 2qqc s LEU 103 Cb 0.13 -2.92 -0.01 0.00 0.03 0.00 0.00 46.19 43.42 2qqc s LEU 103 CO 0.54 -1.13 0.48 0.00 0.23 0.00 0.00 176.35 176.47 2qqc s GLY 105 N -4.13 1.56 -0.12 0.00 0.00 0.21 -4.46 107.32 100.39 2qqc s GLY 105 Ca 0.43 -0.84 -0.00 0.00 0.00 0.00 0.00 44.72 44.30 2qqc s GLY 105 CO 0.32 -0.78 -0.10 -2.27 0.00 0.00 0.00 173.10 170.27 2qqc s LEU 106 N -3.85 2.92 -0.14 0.66 2.96 -0.24 -0.42 118.68 120.57 2qqc s LEU 106 Ca 0.40 -0.21 -0.03 0.00 -0.22 0.00 0.00 54.13 54.06 2qqc s LEU 106 Cb -0.10 -1.66 -0.03 0.00 0.50 0.00 0.00 46.19 44.90 2qqc s LEU 106 CO 0.32 0.22 -0.03 -0.63 -1.32 0.00 0.00 176.35 174.91 2qqc s ILE 107 N 0.02 3.98 0.08 6.68 1.01 -1.26 -0.10 121.20 131.62 2qqc s ILE 107 Ca -0.03 -0.34 0.07 0.00 0.00 0.00 0.00 60.65 60.36 2qqc s ILE 107 Cb -0.14 -2.73 -0.03 0.00 0.01 0.00 0.00 42.46 39.57 2qqc s ILE 107 CO 0.04 0.52 -0.18 -0.04 0.00 0.00 0.00 174.94 175.27 2qqc s MET 108 N 0.08 1.02 0.12 2.79 -1.94 -0.16 -4.75 119.30 116.46 2qqc s MET 108 Ca 0.00 -1.04 0.05 0.00 -1.71 0.00 0.00 55.69 52.99 2qqc s MET 108 Cb -0.13 -1.17 -0.04 0.00 2.01 0.00 0.00 34.83 35.50 2qqc s MET 108 CO 0.03 0.27 -0.11 1.14 -0.01 0.00 0.00 175.02 176.34 2qqc s GLN 109 N -1.73 0.98 0.02 2.03 0.00 -1.26 -0.81 119.66 118.89 2qqc s GLN 109 Ca 0.03 -1.29 -0.20 0.00 -0.00 0.00 0.00 55.36 53.89 2qqc s GLN 109 Cb -0.10 -0.66 0.04 0.00 0.00 0.00 0.00 33.01 32.29 2qqc s GLN 109 CO 0.03 0.10 0.46 -0.47 0.00 0.00 0.00 175.29 175.41 2qqc s TYR 110 N -2.71 -0.34 0.05 9.60 5.04 -0.20 -4.97 117.35 123.82 2qqc s TYR 110 Ca 0.11 0.42 -0.26 0.00 -2.44 0.00 0.00 57.07 54.90 2qqc s TYR 110 Cb -0.01 0.25 0.07 0.00 0.35 0.00 0.00 41.96 42.61 2qqc s TYR 110 CO 0.01 -0.56 0.61 -1.83 -1.34 0.00 0.00 175.55 172.45 2qqc s GLU 111 N -2.05 1.13 0.00 4.97 1.03 -1.26 -0.61 118.70 121.91 2qqc s GLU 111 Ca -0.08 -0.12 0.00 0.00 0.03 0.00 0.00 54.97 54.80 2qqc s GLU 111 Cb -0.02 0.52 0.00 0.00 -0.80 0.00 0.00 34.13 33.84 2qqc s GLU 111 CO 0.01 -0.42 0.00 0.41 -1.33 0.00 0.00 175.26 173.93 2qqc n GLY 112 N 0.33 -2.01 3.01 -3.83 0.00 -0.71 -5.00 105.19 96.99 2qqc n GLY 112 Ca -0.18 -1.17 -0.43 0.00 0.00 0.00 0.00 46.02 44.24 2qqc n GLY 112 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2qqc n LYS 113 N -0.48 3.69 -2.79 1.61 5.02 -1.26 -0.67 118.16 123.27 2qqc n LYS 113 Ca 0.00 -3.76 -0.07 0.00 -2.02 0.00 0.00 58.31 52.46 2qqc n LYS 113 Cb 0.00 -2.88 -0.02 0.00 -0.02 0.00 0.00 35.03 32.11 2qqc n LYS 113 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2qqc s SER 115 N -1.99 5.38 0.21 0.00 1.04 -1.26 -3.74 113.70 113.33 2qqc s SER 115 Ca 0.15 0.76 -0.09 0.00 0.48 0.00 0.00 55.95 57.25 2qqc s SER 115 Cb 0.00 -1.63 0.15 0.00 0.10 0.00 0.00 66.02 64.65 2qqc s SER 115 CO 0.11 -1.25 1.80 0.50 0.98 0.00 0.00 173.24 175.38 2qqc h LYS 116 N -0.39 1.11 -0.42 4.02 3.64 -1.92 0.12 116.57 122.73 2qqc h LYS 116 Ca -0.45 -0.16 -0.04 0.00 -1.27 0.00 0.00 60.65 58.73 2qqc h LYS 116 Cb 1.27 -0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 32.87 2qqc h LYS 116 CO 0.61 0.86 0.12 -0.22 -2.27 0.00 0.00 179.45 178.55 2qqc h LYS 117 N 1.09 0.66 -0.42 1.90 3.64 -1.97 -0.29 116.57 121.16 2qqc h LYS 117 Ca 0.27 -0.15 -0.14 0.00 -1.27 0.00 0.00 60.65 59.36 2qqc h LYS 117 Cb 0.11 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 2qqc h LYS 117 CO -0.03 0.66 -0.26 0.93 -2.27 0.00 0.00 179.45 178.48 2qqc h GLU 118 N 0.53 0.93 0.08 1.90 4.39 -1.89 -1.68 114.58 118.85 2qqc h GLU 118 Ca 0.13 -0.43 0.00 0.00 0.34 0.00 0.00 59.36 59.41 2qqc h GLU 118 Cb 0.29 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.91 2qqc h GLU 118 CO -0.00 1.09 -0.09 0.00 -1.16 0.00 0.00 179.01 178.85 2qqc h ALA 119 N 0.82 -0.16 -0.78 3.43 0.00 -0.59 -1.28 119.26 120.71 2qqc h ALA 119 Ca 0.09 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 2qqc h ALA 119 Cb 0.84 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.73 2qqc h ALA 119 CO 0.07 -0.60 0.30 1.49 0.00 0.00 0.00 179.25 180.50 2qqc h GLU 120 N -0.19 1.17 -0.63 0.00 4.81 -1.02 -1.90 114.58 116.81 2qqc h GLU 120 Ca 0.01 -0.22 0.01 0.00 -0.13 0.00 0.00 59.36 59.03 2qqc h GLU 120 Cb 0.19 -0.19 -0.03 0.00 0.63 0.00 0.00 28.75 29.35 2qqc h GLU 120 CO -0.03 0.96 0.42 -0.22 -0.73 0.00 0.00 179.01 179.40 2qqc h LYS 121 N 1.13 0.82 -0.26 1.92 3.64 -1.07 -2.00 116.57 120.76 2qqc h LYS 121 Ca 0.26 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 59.55 2qqc h LYS 121 Cb 0.24 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 2qqc h LYS 121 CO -0.02 0.54 0.03 1.15 -2.27 0.00 0.00 179.45 178.89 2qqc h THR 122 N 0.84 1.24 0.00 1.00 2.02 -0.92 -2.56 112.91 114.53 2qqc h THR 122 Ca 0.24 -0.81 -0.05 0.00 0.77 0.00 0.00 66.41 66.56 2qqc h THR 122 Cb -0.08 1.27 -0.01 0.00 -1.74 0.00 0.00 68.15 67.60 2qqc h THR 122 CO -0.06 0.26 -0.26 1.62 0.37 0.00 0.00 175.52 177.45 2qqc h VAL 123 N 0.23 0.95 -0.07 3.16 3.04 -1.20 -1.42 116.25 120.95 2qqc h VAL 123 Ca 0.08 -0.96 -0.20 0.00 -1.01 0.00 0.00 66.70 64.61 2qqc h VAL 123 Cb 0.35 1.55 -0.00 0.00 -2.01 0.00 0.00 31.29 31.18 2qqc h VAL 123 CO 0.01 0.25 -0.78 0.03 -1.01 0.00 0.00 177.57 176.07 2qqc h ARG 124 N 0.00 0.43 -0.41 4.17 3.08 -1.27 -2.48 114.38 117.90 2qqc h ARG 124 Ca -0.00 -0.38 -0.10 0.00 0.07 0.00 0.00 59.98 59.58 2qqc h ARG 124 Cb 0.53 0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.65 2qqc h ARG 124 CO 0.03 1.02 -0.13 1.49 -1.07 0.00 0.00 179.97 181.31 2qqc h GLU 125 N 0.28 0.74 -0.66 0.04 4.57 -1.00 -2.06 114.58 116.50 2qqc h GLU 125 Ca -0.04 -0.25 -0.08 0.00 -1.18 0.00 0.00 59.36 57.80 2qqc h GLU 125 Cb 1.37 -0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 29.88 2qqc h GLU 125 CO 0.14 0.85 0.09 0.52 -1.18 0.00 0.00 179.01 179.43 2qqc h MET 126 N 0.67 1.09 -0.56 1.92 2.86 -1.16 -1.23 114.93 118.51 2qqc h MET 126 Ca 0.11 -0.29 -0.08 0.00 -2.06 0.00 0.00 59.70 57.38 2qqc h MET 126 Cb 0.61 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 32.12 2qqc h MET 126 CO 0.04 1.00 0.05 0.00 1.06 0.00 0.00 176.91 179.06 2qqc h ALA 127 N 1.07 0.75 -0.44 6.32 0.00 -1.18 -1.91 119.26 123.88 2qqc h ALA 127 Ca 0.20 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.84 2qqc h ALA 127 Cb 0.45 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 2qqc h ALA 127 CO 0.01 0.54 0.28 -0.22 0.00 0.00 0.00 179.25 179.86 2qqc h LYS 128 N 0.85 0.55 -0.75 0.00 3.64 -1.08 -2.19 116.57 117.59 2qqc h LYS 128 Ca 0.17 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.51 2qqc h LYS 128 Cb 0.47 -0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 32.13 2qqc h LYS 128 CO 0.02 0.37 0.45 0.82 -2.27 0.00 0.00 179.45 178.83 2qqc h ILE 129 N 0.57 1.21 -0.97 2.00 2.04 -1.05 -1.91 117.51 119.41 2qqc h ILE 129 Ca 0.16 -0.47 0.00 0.00 1.00 0.00 0.00 64.86 65.56 2qqc h ILE 129 Cb -0.05 0.15 -0.05 0.00 -0.74 0.00 0.00 36.82 36.14 2qqc h ILE 129 CO -0.05 0.22 0.62 1.23 0.00 0.00 0.00 178.15 180.17 2qqc h GLY 130 N 1.06 1.38 1.93 5.37 0.00 -0.73 0.24 103.07 112.31 2qqc h GLY 130 Ca 0.27 -0.54 -0.14 0.00 0.00 0.00 0.00 47.33 46.92 2qqc h GLY 130 CO -0.05 0.53 -0.65 0.74 0.00 0.00 0.00 176.54 177.11 2qqc h PHE 131 N 1.32 0.10 -0.29 5.60 -1.00 -1.03 -2.77 116.94 118.88 2qqc h PHE 131 Ca 0.35 -0.04 -0.15 0.00 2.81 0.00 0.00 57.97 60.94 2qqc h PHE 131 Cb -0.11 -0.02 -0.01 0.00 3.61 0.00 0.00 35.95 39.43 2qqc h PHE 131 CO 0.00 0.70 -0.43 0.93 -1.61 0.00 0.00 178.31 177.90 2qqc h GLU 132 N 0.05 0.72 0.00 1.51 5.08 -0.65 0.13 114.58 121.42 2qqc h GLU 132 Ca -0.01 -0.39 0.00 0.00 -1.00 0.00 0.00 59.36 57.96 2qqc h GLU 132 Cb 1.16 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.43 2qqc h GLU 132 CO 0.09 1.01 0.00 0.52 -1.00 0.00 0.00 179.01 179.63 2qqc h MET 133 N 0.58 0.00 0.00 2.33 2.86 -0.84 -2.50 114.93 117.36 2qqc h MET 133 Ca 0.04 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.66 2qqc h MET 133 Cb 0.98 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.64 2qqc h MET 133 CO 0.09 0.00 -1.79 0.54 1.06 0.00 0.00 176.91 176.81 2qqc n ARG 134 N -3.07 0.65 -2.41 1.72 1.74 -1.02 -4.98 116.66 109.29 2qqc n ARG 134 Ca 0.00 -0.12 -0.05 0.00 -0.77 0.00 0.00 57.85 56.91 2qqc n ARG 134 Cb 0.28 -1.59 0.01 0.00 -1.02 0.00 0.00 32.46 30.14 2qqc n ARG 134 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2qqc n GLY 135 N 1.26 0.38 3.76 -0.13 0.00 0.34 -5.04 105.19 105.76 2qqc n GLY 135 Ca -0.04 -0.58 -0.33 0.00 0.00 0.00 0.00 46.02 45.06 2qqc n GLY 135 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2qqc s TRP 136 N -2.64 3.25 -0.08 1.61 0.51 -0.50 -5.04 118.94 116.06 2qqc s TRP 136 Ca 0.06 0.21 -0.30 0.00 -2.12 0.00 0.00 56.10 53.95 2qqc s TRP 136 Cb -0.03 -1.75 -0.03 0.00 -0.81 0.00 0.00 33.47 30.86 2qqc s TRP 136 CO 0.08 0.54 1.15 -2.00 -0.51 0.00 0.00 176.95 176.21 2qqc s GLU 137 N -1.52 4.36 -0.15 4.98 2.12 -1.26 -4.67 118.70 122.55 2qqc s GLU 137 Ca 0.20 1.60 -0.25 0.00 0.36 0.00 0.00 54.97 56.88 2qqc s GLU 137 Cb -0.12 -3.57 -0.02 0.00 0.26 0.00 0.00 34.13 30.69 2qqc s GLU 137 CO 0.11 -0.43 0.80 -1.17 -0.54 0.00 0.00 175.26 174.02 2qqc s LEU 138 N 2.26 4.20 -0.10 2.70 2.96 -1.26 -1.57 118.68 127.87 2qqc s LEU 138 Ca 0.54 1.16 -0.03 0.00 -0.22 0.00 0.00 54.13 55.58 2qqc s LEU 138 Cb -0.23 -3.19 -0.02 0.00 0.50 0.00 0.00 46.19 43.25 2qqc s LEU 138 CO 0.20 -0.34 0.08 -0.78 -1.32 0.00 0.00 176.35 174.19 2qqc h ASP 139 N 7.24 -0.01 -5.35 3.68 1.82 -0.11 -3.43 116.42 120.27 2qqc h ASP 139 Ca -0.32 -0.08 0.18 0.00 -0.39 0.00 0.00 57.03 56.43 2qqc h ASP 139 Cb 1.15 0.00 -0.08 0.00 0.68 0.00 0.00 39.33 41.08 2qqc h ASP 139 CO 0.81 0.53 0.50 0.00 -1.61 0.00 0.00 179.24 179.47 2qqc s ARG 140 N -1.65 1.19 -0.08 0.28 1.70 -1.09 -5.00 118.95 114.30 2qqc s ARG 140 Ca -0.02 -0.66 0.01 0.00 -0.47 0.00 0.00 55.73 54.59 2qqc s ARG 140 Cb -0.00 0.40 0.02 0.00 -0.57 0.00 0.00 34.95 34.79 2qqc s ARG 140 CO 0.06 -0.54 -0.10 0.42 -1.08 0.00 0.00 175.30 174.05 2qqc s ILE 141 N -3.19 1.07 0.03 4.99 1.01 -1.26 -0.92 121.20 122.93 2qqc s ILE 141 Ca 0.13 -0.39 0.04 0.00 0.00 0.00 0.00 60.65 60.43 2qqc s ILE 141 Cb -0.01 -1.02 -0.04 0.00 0.01 0.00 0.00 42.46 41.40 2qqc s ILE 141 CO 0.02 0.35 -0.07 -1.61 0.00 0.00 0.00 174.94 173.64 2qqc s GLU 142 N 1.07 2.47 0.28 2.79 2.02 -0.83 -4.95 118.70 121.55 2qqc s GLU 142 Ca -0.07 -0.79 -0.19 0.00 0.02 0.00 0.00 54.97 53.94 2qqc s GLU 142 Cb -0.14 -2.47 0.02 0.00 0.10 0.00 0.00 34.13 31.63 2qqc s GLU 142 CO -0.01 0.58 0.67 -1.54 0.02 0.00 0.00 175.26 174.98 2qqc s SER 143 N -1.63 -0.21 0.14 -0.19 1.04 -1.26 -0.41 113.70 111.18 2qqc s SER 143 Ca 0.19 -0.71 -0.16 0.00 0.48 0.00 0.00 55.95 55.75 2qqc s SER 143 Cb -0.11 0.70 0.03 0.00 0.10 0.00 0.00 66.02 66.75 2qqc s SER 143 CO 0.10 -1.32 0.42 0.27 0.98 0.00 0.00 173.24 173.69 2qqc s ILE 144 N -3.87 0.06 0.15 -1.02 -4.36 -0.64 -5.00 121.20 106.51 2qqc s ILE 144 Ca 0.14 -0.60 -0.16 0.00 -0.26 0.00 0.00 60.65 59.77 2qqc s ILE 144 Cb -0.05 -1.23 0.03 0.00 1.25 0.00 0.00 42.46 42.47 2qqc s ILE 144 CO 0.08 -0.28 0.44 0.00 0.24 0.00 0.00 174.94 175.42 2qqc s ALA 145 N -3.81 -0.91 -0.04 2.27 0.00 -1.26 -1.58 121.76 116.43 2qqc s ALA 145 Ca 0.04 -0.13 -0.12 0.00 0.00 0.00 0.00 51.96 51.76 2qqc s ALA 145 Cb 0.01 0.76 0.02 0.00 0.00 0.00 0.00 23.12 23.91 2qqc s ALA 145 CO -0.11 -0.70 0.26 0.54 0.00 0.00 0.00 175.76 175.76 2qqc s VAL 146 N -3.83 0.04 0.12 0.00 0.11 -0.29 -5.00 120.40 111.55 2qqc s VAL 146 Ca 0.05 -0.36 0.07 0.00 -2.93 0.00 0.00 61.98 58.82 2qqc s VAL 146 Cb 0.01 -0.50 -0.04 0.00 -1.53 0.00 0.00 36.38 34.32 2qqc s VAL 146 CO -0.09 -0.20 -0.17 -1.83 -3.33 0.00 0.00 175.10 169.49 2qqc s GLU 147 N -0.84 1.09 -0.02 1.54 -1.05 -1.26 -1.19 118.70 116.98 2qqc s GLU 147 Ca -0.09 -1.24 0.01 0.00 -0.15 0.00 0.00 54.97 53.50 2qqc s GLU 147 Cb -0.05 -1.12 0.01 0.00 -0.44 0.00 0.00 34.13 32.54 2qqc s GLU 147 CO 0.02 0.23 -0.02 -1.58 0.95 0.00 0.00 175.26 174.87 2qqc s HIS 148 N -1.80 0.34 -0.44 4.83 2.46 0.16 -4.97 115.29 115.86 2qqc s HIS 148 Ca 0.09 -0.04 -0.15 0.00 0.47 0.00 0.00 55.06 55.43 2qqc s HIS 148 Cb -0.07 -0.33 0.05 0.00 -0.13 0.00 0.00 32.58 32.10 2qqc s HIS 148 CO 0.04 -0.08 0.35 0.99 -2.47 0.00 0.00 174.74 173.58 2qqc s THR 149 N 0.51 5.24 0.19 0.89 2.01 -1.26 -0.91 115.64 122.31 2qqc s THR 149 Ca -0.05 -0.84 -0.32 0.00 0.31 0.00 0.00 61.69 60.79 2qqc s THR 149 Cb -0.08 -4.03 -0.12 0.00 0.01 0.00 0.00 72.50 68.28 2qqc s THR 149 CO -0.01 -0.45 1.75 0.52 -0.69 0.00 0.00 174.62 175.75 2qqc n VAL 150 N 5.20 0.09 -0.09 3.82 0.31 0.03 -4.87 118.33 122.82 2qqc n VAL 150 Ca -0.12 -0.02 -0.23 0.00 -0.01 0.00 0.00 64.34 63.97 2qqc n VAL 150 Cb 0.45 -2.02 -0.12 0.00 -0.91 0.00 0.00 33.84 31.25 2qqc n VAL 150 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2qqc n GLU 151 N 4.38 0.62 0.00 5.55 1.02 -1.26 -0.05 120.64 130.89 2qqc n GLU 151 Ca 0.17 0.41 0.00 0.00 -0.02 0.00 0.00 57.16 57.71 2qqc n GLU 151 Cb 0.35 -1.67 0.00 0.00 -0.02 0.00 0.00 31.44 30.11 2qqc n GLU 151 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 2qqc n LYS 152 N -4.09 0.00 -3.15 3.49 4.81 -1.26 -4.56 118.16 113.40 2qqc n LYS 152 Ca -0.38 0.00 0.05 0.00 -0.87 0.00 0.00 58.31 57.11 2qqc n LYS 152 Cb 0.83 -0.43 -0.01 0.00 0.02 0.00 0.00 35.03 35.43 2qqc n LYS 152 CO 0.00 0.00 0.00 -1.17 1.17 0.00 0.00 177.40 177.40 2qqc s LEU 153 N -3.17 -0.95 0.38 3.14 0.20 -1.26 -4.36 118.68 112.66 2qqc s LEU 153 Ca 0.00 0.59 0.04 0.00 0.69 0.00 0.00 54.13 55.44 2qqc s LEU 153 Cb 0.00 1.79 -0.04 0.00 -0.43 0.00 0.00 46.19 47.52 2qqc s LEU 153 CO 0.00 -0.18 0.09 -0.83 -0.29 0.00 0.00 176.35 175.14 2qqc s GLY 154 N 2.90 2.42 -0.05 7.98 0.00 -0.02 -4.98 107.32 115.58 2qqc s GLY 154 Ca 0.11 -1.50 -0.05 0.00 0.00 0.00 0.00 44.72 43.28 2qqc s GLY 154 CO -0.16 -1.86 0.13 0.00 0.00 0.00 0.00 173.10 171.21 2qqc s ALA 156 N 0.11 2.62 -0.02 0.00 0.00 -0.61 -4.92 121.76 118.94 2qqc s ALA 156 Ca -0.00 -0.92 0.01 0.00 0.00 0.00 0.00 51.96 51.05 2qqc s ALA 156 Cb -0.01 -1.13 0.02 0.00 0.00 0.00 0.00 23.12 22.00 2qqc s ALA 156 CO -0.00 0.34 -0.01 0.12 0.00 0.00 0.00 175.76 176.21 2qqc s PHE 157 N 0.02 0.31 -0.01 0.00 5.36 -1.26 -1.64 117.98 120.75 2qqc s PHE 157 Ca -0.04 -0.02 0.02 0.00 -0.96 0.00 0.00 56.93 55.92 2qqc s PHE 157 Cb -0.14 -0.33 -0.00 0.00 -0.34 0.00 0.00 43.02 42.20 2qqc s PHE 157 CO 0.04 -0.09 -0.07 0.00 -1.46 0.00 0.00 175.22 173.65 2qqc s ALA 158 N 0.66 0.61 0.18 11.12 0.00 -0.43 -4.86 121.76 129.04 2qqc s ALA 158 Ca -0.07 -0.26 -0.12 0.00 0.00 0.00 0.00 51.96 51.51 2qqc s ALA 158 Cb -0.10 -0.20 0.00 0.00 0.00 0.00 0.00 23.12 22.83 2qqc s ALA 158 CO -0.01 0.12 0.38 0.00 0.00 0.00 0.00 175.76 176.25 2qqc s ALA 159 N 0.03 -0.33 -0.26 0.00 0.00 -1.26 -0.96 121.76 118.98 2qqc s ALA 159 Ca 0.00 -0.67 0.01 0.00 0.00 0.00 0.00 51.96 51.30 2qqc s ALA 159 Cb -0.05 0.87 0.07 0.00 0.00 0.00 0.00 23.12 24.02 2qqc s ALA 159 CO -0.00 -0.72 -0.00 0.00 0.00 0.00 0.00 175.76 175.04 2qqc s ALA 160 N -3.94 1.99 -0.21 0.00 0.00 0.33 -4.95 121.76 114.98 2qqc s ALA 160 Ca 0.15 -1.57 -0.17 0.00 0.00 0.00 0.00 51.96 50.37 2qqc s ALA 160 Cb 0.02 -1.54 -0.04 0.00 0.00 0.00 0.00 23.12 21.56 2qqc s ALA 160 CO -0.00 -1.36 0.45 0.00 0.00 0.00 0.00 175.76 174.85 2qqc s ALA 161 N 1.38 3.55 -0.13 0.00 0.00 -1.26 -1.88 121.76 123.42 2qqc s ALA 161 Ca -0.00 -0.50 -0.17 0.00 0.00 0.00 0.00 51.96 51.29 2qqc s ALA 161 Cb -0.18 -2.73 -0.04 0.00 0.00 0.00 0.00 23.12 20.16 2qqc s ALA 161 CO -0.10 -0.41 0.42 -0.51 0.00 0.00 0.00 175.76 175.16 2qqc s LEU 162 N 1.57 4.27 0.00 0.00 1.02 -0.21 -5.03 118.68 120.29 2qqc s LEU 162 Ca 0.21 0.73 0.00 0.00 0.02 0.00 0.00 54.13 55.09 2qqc s LEU 162 Cb -0.15 -2.60 0.00 0.00 0.02 0.00 0.00 46.19 43.45 2qqc s LEU 162 CO 0.09 0.03 0.00 1.87 0.02 0.00 0.00 176.35 178.36 2qqc n TRP 163 N 3.64 -0.05 -4.15 0.29 -0.00 -1.26 -4.01 117.44 111.90 2qqc n TRP 163 Ca -0.08 0.00 -0.17 0.00 -0.00 0.00 0.00 57.50 57.24 2qqc n TRP 163 Cb 0.52 0.00 -0.12 0.00 -0.00 0.00 0.00 31.31 31.71 2qqc n TRP 163 CO 0.00 0.00 0.00 0.71 -0.00 0.00 0.00 177.69 178.40 2qqc s TYR 164 N -1.89 1.10 -2.00 5.87 2.02 -1.26 -5.09 117.35 116.10 2qqc s TYR 164 Ca 0.00 -0.47 0.32 0.00 -0.37 0.00 0.00 57.07 56.55 2qqc s TYR 164 Cb 0.00 -0.62 1.91 0.00 -0.40 0.00 0.00 41.96 42.84 2qqc s TYR 164 CO 0.00 0.03 2.23 1.63 -1.57 0.00 0.00 175.55 177.86