#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n13 s MET 55 N 0.00 3.83 0.56 0.38 -2.45 -0.26 -4.94 119.30 116.42 1n13 s MET 55 Ca 0.00 0.14 -0.20 0.00 -1.25 0.00 0.00 55.69 54.38 1n13 s MET 55 Cb 0.00 -3.74 -0.06 0.00 1.25 0.00 0.00 34.83 32.28 1n13 s MET 55 CO 0.00 -0.57 1.03 -2.30 1.05 0.00 0.00 175.02 174.23 1n13 n PRO 56 N 5.79 1.09 -1.69 4.11 -0.02 -1.26 -0.51 135.00 142.51 1n13 n PRO 56 Ca -0.03 0.41 -0.39 0.00 -2.02 0.00 0.00 63.50 61.47 1n13 n PRO 56 Cb 0.49 -2.20 0.04 0.00 -0.02 0.00 0.00 33.50 31.81 1n13 n PRO 56 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1n13 n PRO 57 N -0.81 1.45 -0.20 0.52 -0.02 -1.26 -1.90 135.00 132.78 1n13 n PRO 57 Ca 0.12 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 62.14 1n13 n PRO 57 Cb 0.46 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.55 1n13 n PRO 57 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1n13 n GLU 58 N -0.80 0.00 -1.63 -0.52 -0.58 -1.19 -4.99 120.64 110.93 1n13 n GLU 58 Ca 0.11 0.00 -0.32 0.00 -0.42 0.00 0.00 57.16 56.53 1n13 n GLU 58 Cb 0.44 -2.65 0.06 0.00 -0.57 0.00 0.00 31.44 28.72 1n13 n GLU 58 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1n13 s ALA 59 N -2.40 2.45 0.05 0.62 0.00 -0.80 -5.05 121.76 116.63 1n13 s ALA 59 Ca 0.00 0.42 0.08 0.00 0.00 0.00 0.00 51.96 52.46 1n13 s ALA 59 Cb 0.00 -3.29 -0.03 0.00 0.00 0.00 0.00 23.12 19.81 1n13 s ALA 59 CO 0.00 -1.37 -0.22 -1.21 0.00 0.00 0.00 175.76 172.97 1n13 s GLU 60 N -4.39 1.41 -0.14 0.00 2.02 -1.26 -5.00 118.70 111.34 1n13 s GLU 60 Ca 0.64 -1.00 -0.28 0.00 0.02 0.00 0.00 54.97 54.35 1n13 s GLU 60 Cb -0.19 -1.56 -0.01 0.00 0.10 0.00 0.00 34.13 32.47 1n13 s GLU 60 CO 0.46 0.39 0.96 0.42 0.02 0.00 0.00 175.26 177.52 1n13 s ILE 61 N -0.85 4.79 0.10 -1.63 1.01 -1.26 -5.02 121.20 118.34 1n13 s ILE 61 Ca 0.08 1.93 0.01 0.00 0.00 0.00 0.00 60.65 62.67 1n13 s ILE 61 Cb -0.09 -4.26 -0.04 0.00 0.01 0.00 0.00 42.46 38.07 1n13 s ILE 61 CO 0.02 -0.02 -0.04 0.68 0.00 0.00 0.00 174.94 175.59 1n13 s VAL 62 N 2.23 0.51 0.70 2.92 -7.23 -1.26 -5.14 120.40 113.13 1n13 s VAL 62 Ca 0.45 -1.91 -0.16 0.00 -1.81 0.00 0.00 61.98 58.55 1n13 s VAL 62 Cb -0.17 -1.73 0.02 0.00 0.56 0.00 0.00 36.38 35.06 1n13 s VAL 62 CO 0.15 -0.82 1.21 -2.84 -0.31 0.00 0.00 175.10 172.49 1n13 s PRO 63 N -3.89 2.34 -0.01 4.82 0.02 -1.26 -4.84 135.00 132.18 1n13 s PRO 63 Ca 0.13 1.77 -0.34 0.00 0.02 0.00 0.00 61.00 62.58 1n13 s PRO 63 Cb 0.06 -1.86 -0.13 0.00 0.02 0.00 0.00 34.50 32.60 1n13 s PRO 63 CO -0.04 -1.69 1.75 -0.11 -0.33 0.00 0.00 177.00 176.58 1n13 n LEU 64 N -2.46 3.21 -4.87 -5.54 7.94 -1.26 -4.95 117.00 109.07 1n13 n LEU 64 Ca 0.13 1.02 -0.29 0.00 -1.11 0.00 0.00 56.01 55.76 1n13 n LEU 64 Cb 0.50 -1.37 0.13 0.00 0.53 0.00 0.00 43.42 43.21 1n13 n LEU 64 CO 0.47 -0.19 0.79 -2.16 -1.11 0.00 0.00 177.39 175.19 1n13 s PRO 65 N 2.86 1.33 -0.62 1.96 0.04 -1.26 -4.96 135.00 134.35 1n13 s PRO 65 Ca 0.88 0.02 -0.28 0.00 0.04 0.00 0.00 61.00 61.66 1n13 s PRO 65 Cb -0.72 -1.89 0.03 0.00 0.04 0.00 0.00 34.50 31.96 1n13 s PRO 65 CO 0.48 -2.02 1.27 0.21 0.04 0.00 0.00 177.00 176.98 1n13 s LYS 66 N -5.58 3.38 0.02 4.56 2.20 -1.26 -4.99 119.74 118.07 1n13 s LYS 66 Ca 0.66 0.17 -0.19 0.00 -0.36 0.00 0.00 55.97 56.24 1n13 s LYS 66 Cb -0.10 -4.08 -0.06 0.00 -1.51 0.00 0.00 37.83 32.08 1n13 s LYS 66 CO 0.51 -1.86 0.55 -0.51 -0.36 0.00 0.00 175.35 173.68 1n13 s LEU 67 N 5.42 4.46 0.29 5.43 1.43 -1.26 -5.05 118.68 129.41 1n13 s LEU 67 Ca 0.43 1.15 -0.29 0.00 -1.03 0.00 0.00 54.13 54.39 1n13 s LEU 67 Cb -0.08 -2.85 -0.10 0.00 0.03 0.00 0.00 46.19 43.19 1n13 s LEU 67 CO 0.23 0.20 1.34 -2.84 0.23 0.00 0.00 176.35 175.51 1n13 s PRO 68 N -0.64 4.34 0.27 1.29 0.02 -1.26 -4.92 135.00 134.10 1n13 s PRO 68 Ca 0.29 2.22 -0.31 0.00 0.02 0.00 0.00 61.00 63.22 1n13 s PRO 68 Cb -0.18 -3.10 -0.12 0.00 0.02 0.00 0.00 34.50 31.12 1n13 s PRO 68 CO 0.17 -0.26 1.63 -1.33 -0.33 0.00 0.00 177.00 176.88 1n13 n MET 69 N 1.48 2.73 -0.63 5.54 2.81 -1.26 -2.08 117.12 125.72 1n13 n MET 69 Ca 0.03 0.97 0.00 0.00 -1.81 0.00 0.00 57.70 56.89 1n13 n MET 69 Cb 0.41 -2.77 0.00 0.00 -0.71 0.00 0.00 33.22 30.15 1n13 n MET 69 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1n13 n GLY 70 N 2.59 0.80 3.71 3.03 0.00 -1.26 -5.04 105.19 109.03 1n13 n GLY 70 Ca 0.10 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 1n13 n GLY 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n13 n ALA 71 N -0.12 1.34 -2.99 4.61 0.00 -0.88 -4.91 120.51 117.55 1n13 n ALA 71 Ca 0.00 0.17 -0.44 0.00 0.00 0.00 0.00 53.44 53.16 1n13 n ALA 71 Cb 0.00 -2.30 -0.03 0.00 0.00 0.00 0.00 19.45 17.12 1n13 n ALA 71 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1n13 s LEU 72 N -2.63 5.24 -0.33 0.00 1.43 -1.26 -5.01 118.68 116.12 1n13 s LEU 72 Ca 0.68 -1.92 -0.15 0.00 -1.03 0.00 0.00 54.13 51.71 1n13 s LEU 72 Cb -0.45 -2.36 -0.02 0.00 0.03 0.00 0.00 46.19 43.39 1n13 s LEU 72 CO 0.52 -1.05 0.35 -0.69 0.23 0.00 0.00 176.35 175.71 1n13 s VAL 73 N 2.53 5.18 -0.01 -1.59 1.01 -1.26 -5.04 120.40 121.22 1n13 s VAL 73 Ca 0.27 0.10 -0.30 0.00 0.00 0.00 0.00 61.98 62.05 1n13 s VAL 73 Cb -0.09 -3.79 -0.07 0.00 0.00 0.00 0.00 36.38 32.43 1n13 s VAL 73 CO -0.05 -0.04 1.71 -2.84 0.00 0.00 0.00 175.10 173.88 1n13 s PRO 74 N 2.00 4.18 -0.02 2.72 0.02 -1.26 -4.89 135.00 137.75 1n13 s PRO 74 Ca 0.12 2.29 0.00 0.00 0.02 0.00 0.00 61.00 63.43 1n13 s PRO 74 Cb -0.16 -3.93 0.02 0.00 0.02 0.00 0.00 34.50 30.44 1n13 s PRO 74 CO 0.11 -0.84 0.02 0.99 -0.33 0.00 0.00 177.00 176.95 1n13 s THR 75 N 3.80 -0.01 -0.18 0.99 2.01 -1.26 -0.96 115.64 120.02 1n13 s THR 75 Ca 0.76 0.13 -0.13 0.00 0.31 0.00 0.00 61.69 62.77 1n13 s THR 75 Cb -0.36 -0.09 -0.05 0.00 0.01 0.00 0.00 72.50 72.01 1n13 s THR 75 CO 0.32 0.07 0.24 0.00 -0.69 0.00 0.00 174.62 174.57 1n13 s ALA 76 N 0.75 3.62 0.07 7.40 0.00 -0.67 -4.95 121.76 127.97 1n13 s ALA 76 Ca -0.06 -0.55 -0.16 0.00 0.00 0.00 0.00 51.96 51.19 1n13 s ALA 76 Cb -0.09 -2.34 0.03 0.00 0.00 0.00 0.00 23.12 20.72 1n13 s ALA 76 CO -0.02 0.07 0.37 1.52 0.00 0.00 0.00 175.76 177.70 1n13 s TYR 77 N 0.53 -0.18 0.02 0.00 -0.85 -1.26 -0.48 117.35 115.12 1n13 s TYR 77 Ca 0.14 0.02 0.06 0.00 -0.52 0.00 0.00 57.07 56.76 1n13 s TYR 77 Cb -0.13 0.18 -0.02 0.00 0.38 0.00 0.00 41.96 42.38 1n13 s TYR 77 CO 0.02 -0.59 -0.17 0.20 -1.52 0.00 0.00 175.55 173.49 1n13 s GLY 78 N -2.31 0.91 0.09 5.49 0.00 -0.18 -4.95 107.32 106.37 1n13 s GLY 78 Ca -0.02 -0.85 -0.17 0.00 0.00 0.00 0.00 44.72 43.68 1n13 s GLY 78 CO -0.06 -0.76 0.41 -2.52 0.00 0.00 0.00 173.10 170.17 1n13 s TYR 79 N -0.62 -0.24 -0.10 1.90 -0.85 -1.26 -1.63 117.35 114.55 1n13 s TYR 79 Ca 0.06 0.06 -0.08 0.00 -0.52 0.00 0.00 57.07 56.58 1n13 s TYR 79 Cb -0.07 0.25 0.03 0.00 0.38 0.00 0.00 41.96 42.54 1n13 s TYR 79 CO 0.00 -0.64 0.25 -1.50 -1.52 0.00 0.00 175.55 172.14 1n13 s ILE 80 N -3.18 -0.00 -0.04 -3.49 2.07 -0.63 -4.88 121.20 111.04 1n13 s ILE 80 Ca -0.01 0.01 0.05 0.00 -1.41 0.00 0.00 60.65 59.29 1n13 s ILE 80 Cb 0.01 -0.36 -0.01 0.00 0.13 0.00 0.00 42.46 42.23 1n13 s ILE 80 CO -0.07 0.00 -0.19 -0.63 -1.91 0.00 0.00 174.94 172.14 1n13 s ILE 81 N 0.22 1.59 0.00 2.00 1.01 -1.26 -1.40 121.20 123.36 1n13 s ILE 81 Ca -0.01 -0.82 -0.00 0.00 0.00 0.00 0.00 60.65 59.82 1n13 s ILE 81 Cb -0.02 -1.36 -0.00 0.00 0.01 0.00 0.00 42.46 41.09 1n13 s ILE 81 CO -0.00 0.45 0.00 -0.55 0.00 0.00 0.00 174.94 174.84 1n13 s SER 82 N -0.09 0.02 -0.11 3.58 0.15 -0.44 -5.00 113.70 111.80 1n13 s SER 82 Ca -0.02 -0.04 0.14 0.00 0.70 0.00 0.00 55.95 56.73 1n13 s SER 82 Cb -0.11 0.02 0.40 0.00 -1.71 0.00 0.00 66.02 64.62 1n13 s SER 82 CO 0.02 -0.03 1.31 -0.90 1.20 0.00 0.00 173.24 174.84 1n13 n ASP 83 N 2.92 3.29 -4.53 5.45 5.75 -1.26 -0.99 116.55 127.18 1n13 n ASP 83 Ca -0.13 -2.69 -0.42 0.00 -0.01 0.00 0.00 54.79 51.53 1n13 n ASP 83 Cb 0.59 -0.41 -0.07 0.00 -1.03 0.00 0.00 41.12 40.20 1n13 n ASP 83 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1n13 s VAL 84 N -2.23 4.95 0.25 2.12 1.01 -1.26 -4.75 120.40 120.49 1n13 s VAL 84 Ca 0.33 0.11 -0.31 0.00 0.00 0.00 0.00 61.98 62.10 1n13 s VAL 84 Cb 0.25 -4.09 -0.12 0.00 0.00 0.00 0.00 36.38 32.42 1n13 s VAL 84 CO 0.09 -0.43 1.55 -2.65 0.00 0.00 0.00 175.10 173.67 1n13 n PRO 85 N 5.95 2.46 0.00 2.72 -0.02 -1.26 -2.13 135.00 142.72 1n13 n PRO 85 Ca -0.04 0.88 0.00 0.00 -2.02 0.00 0.00 63.50 62.32 1n13 n PRO 85 Cb 0.48 -2.63 0.00 0.00 -0.02 0.00 0.00 33.50 31.33 1n13 n PRO 85 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1n13 n GLY 86 N 2.50 2.29 3.73 -1.23 0.00 0.12 -4.99 105.19 107.61 1n13 n GLY 86 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 1n13 n GLY 86 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1n13 s GLU 87 N -0.25 4.59 -0.23 1.61 2.12 -0.90 -4.71 118.70 120.93 1n13 s GLU 87 Ca 0.00 1.62 -0.13 0.00 0.36 0.00 0.00 54.97 56.82 1n13 s GLU 87 Cb 0.00 -3.33 -0.04 0.00 0.26 0.00 0.00 34.13 31.01 1n13 s GLU 87 CO 0.00 0.05 0.30 0.99 -0.54 0.00 0.00 175.26 176.06 1n13 s THR 88 N 0.14 5.26 0.10 -1.70 2.01 -1.26 -0.86 115.64 119.33 1n13 s THR 88 Ca 0.50 0.46 0.10 0.00 0.31 0.00 0.00 61.69 63.07 1n13 s THR 88 Cb -0.27 -3.63 -0.04 0.00 0.01 0.00 0.00 72.50 68.58 1n13 s THR 88 CO 0.32 0.26 -0.27 0.27 -0.69 0.00 0.00 174.62 174.52 1n13 s ILE 89 N 1.41 2.20 0.06 1.82 -4.36 0.20 -3.08 121.20 119.46 1n13 s ILE 89 Ca 0.13 -1.61 -0.00 0.00 -0.26 0.00 0.00 60.65 58.91 1n13 s ILE 89 Cb -0.15 -1.93 -0.04 0.00 1.25 0.00 0.00 42.46 41.60 1n13 s ILE 89 CO 0.07 0.19 -0.04 -0.44 0.24 0.00 0.00 174.94 174.97 1n13 s SER 90 N -1.74 0.62 -0.03 4.36 0.01 -0.09 -0.13 113.70 116.70 1n13 s SER 90 Ca 0.13 -0.98 -0.06 0.00 1.31 0.00 0.00 55.95 56.35 1n13 s SER 90 Cb -0.10 0.17 0.01 0.00 0.21 0.00 0.00 66.02 66.31 1n13 s SER 90 CO 0.04 -0.56 0.14 0.00 0.41 0.00 0.00 173.24 173.27 1n13 s ALA 91 N -3.76 -0.33 0.05 1.44 0.00 -0.70 -1.32 121.76 117.14 1n13 s ALA 91 Ca 0.07 0.13 -0.10 0.00 0.00 0.00 0.00 51.96 52.07 1n13 s ALA 91 Cb 0.07 -0.07 0.00 0.00 0.00 0.00 0.00 23.12 23.12 1n13 s ALA 91 CO -0.09 -0.13 0.20 0.00 0.00 0.00 0.00 175.76 175.74 1n13 s ALA 92 N -0.63 -0.35 0.02 0.00 0.00 0.66 -1.47 121.76 119.99 1n13 s ALA 92 Ca -0.07 -0.34 0.02 0.00 0.00 0.00 0.00 51.96 51.56 1n13 s ALA 92 Cb -0.04 0.33 -0.01 0.00 0.00 0.00 0.00 23.12 23.40 1n13 s ALA 92 CO 0.01 -0.40 -0.05 -1.50 0.00 0.00 0.00 175.76 173.81 1n13 s ILE 93 N -2.88 0.39 0.04 0.00 1.10 -0.33 -1.06 121.20 118.45 1n13 s ILE 93 Ca -0.03 -0.59 -0.03 0.00 -0.51 0.00 0.00 60.65 59.49 1n13 s ILE 93 Cb 0.00 -0.40 -0.02 0.00 0.15 0.00 0.00 42.46 42.19 1n13 s ILE 93 CO -0.06 -0.15 0.03 -0.94 -2.11 0.00 0.00 174.94 171.72 1n13 s SER 94 N -0.79 0.28 -0.08 4.50 1.04 -0.30 -1.45 113.70 116.89 1n13 s SER 94 Ca -0.05 -0.65 -0.02 0.00 0.48 0.00 0.00 55.95 55.72 1n13 s SER 94 Cb -0.06 0.19 0.03 0.00 0.10 0.00 0.00 66.02 66.28 1n13 s SER 94 CO -0.00 -0.48 0.01 -0.69 0.98 0.00 0.00 173.24 173.06 1n13 s VAL 95 N -2.67 0.33 -0.26 5.02 1.01 0.46 -1.07 120.40 123.21 1n13 s VAL 95 Ca -0.05 0.08 -0.22 0.00 0.00 0.00 0.00 61.98 61.79 1n13 s VAL 95 Cb -0.01 -0.55 -0.01 0.00 0.00 0.00 0.00 36.38 35.81 1n13 s VAL 95 CO -0.05 0.19 0.70 0.00 0.00 0.00 0.00 175.10 175.94 1n13 s ALA 96 N 1.99 3.61 -0.20 5.51 0.00 0.90 -1.72 121.76 131.84 1n13 s ALA 96 Ca 0.04 -0.36 -0.09 0.00 0.00 0.00 0.00 51.96 51.55 1n13 s ALA 96 Cb -0.13 -3.14 -0.05 0.00 0.00 0.00 0.00 23.12 19.81 1n13 s ALA 96 CO -0.05 -0.90 0.11 0.42 0.00 0.00 0.00 175.76 175.33 1n13 s ILE 97 N 2.65 5.17 0.42 0.00 1.01 0.19 -1.33 121.20 129.32 1n13 s ILE 97 Ca 0.29 0.10 -0.18 0.00 0.00 0.00 0.00 60.65 60.87 1n13 s ILE 97 Cb -0.15 -3.35 -0.09 0.00 0.01 0.00 0.00 42.46 38.87 1n13 s ILE 97 CO 0.09 0.44 0.89 -2.16 0.00 0.00 0.00 174.94 174.20 1n13 s PRO 98 N 0.40 4.07 0.10 2.79 0.04 -1.26 -0.28 135.00 140.86 1n13 s PRO 98 Ca 0.06 0.92 -0.16 0.00 0.04 0.00 0.00 61.00 61.86 1n13 s PRO 98 Cb -0.12 -2.25 -0.06 0.00 0.04 0.00 0.00 34.50 32.12 1n13 s PRO 98 CO -0.01 -0.04 1.51 -0.22 0.04 0.00 0.00 177.00 178.28 1n13 h LYS 99 N 1.71 0.61 -6.61 4.56 3.64 -1.74 -3.40 116.57 115.34 1n13 h LYS 99 Ca -0.48 -0.23 -0.56 0.00 -1.27 0.00 0.00 60.65 58.11 1n13 h LYS 99 Cb 1.18 -0.04 -0.06 0.00 -0.41 0.00 0.00 32.23 32.90 1n13 h LYS 99 CO 0.62 0.78 0.96 0.34 -2.27 0.00 0.00 179.45 179.89 1n13 s ASP 100 N -6.20 6.58 0.00 4.20 2.15 -1.26 -4.90 116.67 117.24 1n13 s ASP 100 Ca -0.13 0.65 0.09 0.00 0.43 0.00 0.00 52.55 53.59 1n13 s ASP 100 Cb 0.09 -2.55 0.39 0.00 -0.30 0.00 0.00 42.92 40.55 1n13 s ASP 100 CO 0.79 -1.27 1.28 0.29 -0.17 0.00 0.00 175.17 176.09 1n13 n LYS 101 N 7.81 0.02 0.08 4.34 4.76 -1.26 -1.67 118.16 132.23 1n13 n LYS 101 Ca 0.13 0.33 0.13 0.00 -2.87 0.00 0.00 58.31 56.03 1n13 n LYS 101 Cb 0.48 -1.50 0.38 0.00 -1.84 0.00 0.00 35.03 32.56 1n13 n LYS 101 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 1n13 n SER 102 N -1.48 0.71 -4.94 4.39 3.41 -1.26 -3.20 113.62 111.26 1n13 n SER 102 Ca 0.02 0.47 -0.24 0.00 -0.26 0.00 0.00 58.87 58.86 1n13 n SER 102 Cb 0.10 -0.58 0.02 0.00 -0.26 0.00 0.00 64.21 63.49 1n13 n SER 102 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1n13 s LEU 103 N -4.29 3.52 0.45 1.04 1.43 -0.67 -4.79 118.68 115.36 1n13 s LEU 103 Ca 0.10 0.47 0.01 0.00 -1.03 0.00 0.00 54.13 53.68 1n13 s LEU 103 Cb 0.13 -3.34 -0.00 0.00 0.03 0.00 0.00 46.19 43.01 1n13 s LEU 103 CO 0.61 -0.80 0.67 0.00 0.23 0.00 0.00 176.35 177.06 1n13 s GLY 105 N -4.24 1.57 -0.16 0.00 0.00 0.33 -4.47 107.32 100.36 1n13 s GLY 105 Ca 0.49 -0.83 -0.01 0.00 0.00 0.00 0.00 44.72 44.38 1n13 s GLY 105 CO 0.37 -0.76 -0.12 -2.27 0.00 0.00 0.00 173.10 170.32 1n13 s LEU 106 N -3.86 2.65 -0.17 0.66 2.96 -0.44 -1.11 118.68 119.38 1n13 s LEU 106 Ca 0.40 -0.40 -0.07 0.00 -0.22 0.00 0.00 54.13 53.84 1n13 s LEU 106 Cb -0.10 -1.61 -0.04 0.00 0.50 0.00 0.00 46.19 44.93 1n13 s LEU 106 CO 0.32 0.10 0.08 -0.63 -1.32 0.00 0.00 176.35 174.90 1n13 s ILE 107 N 0.74 4.95 0.07 6.68 1.01 -1.26 -0.07 121.20 133.32 1n13 s ILE 107 Ca -0.05 0.02 0.07 0.00 0.00 0.00 0.00 60.65 60.68 1n13 s ILE 107 Cb -0.15 -3.21 -0.03 0.00 0.01 0.00 0.00 42.46 39.08 1n13 s ILE 107 CO 0.01 0.49 -0.18 -0.04 0.00 0.00 0.00 174.94 175.22 1n13 s MET 108 N 0.05 1.09 0.09 2.79 -1.94 -0.24 -4.76 119.30 116.38 1n13 s MET 108 Ca 0.06 -1.01 0.05 0.00 -1.71 0.00 0.00 55.69 53.08 1n13 s MET 108 Cb -0.12 -1.23 -0.03 0.00 2.01 0.00 0.00 34.83 35.45 1n13 s MET 108 CO 0.00 0.29 -0.13 -1.83 -0.01 0.00 0.00 175.02 173.35 1n13 s GLU 109 N -1.61 0.89 -0.02 2.03 1.03 -1.26 -1.15 118.70 118.62 1n13 s GLU 109 Ca 0.04 -1.09 -0.18 0.00 0.03 0.00 0.00 54.97 53.77 1n13 s GLU 109 Cb -0.09 -0.79 0.03 0.00 -0.80 0.00 0.00 34.13 32.48 1n13 s GLU 109 CO 0.03 0.16 0.39 -0.47 -1.33 0.00 0.00 175.26 174.04 1n13 s TYR 110 N -1.80 -0.28 0.02 4.83 5.04 -0.23 -4.97 117.35 119.96 1n13 s TYR 110 Ca 0.03 0.43 -0.18 0.00 -2.44 0.00 0.00 57.07 54.91 1n13 s TYR 110 Cb -0.07 0.17 0.03 0.00 0.35 0.00 0.00 41.96 42.44 1n13 s TYR 110 CO 0.02 -0.45 0.40 -1.83 -1.34 0.00 0.00 175.55 172.35 1n13 s GLU 111 N -1.42 0.85 0.00 4.97 1.03 -1.26 -0.24 118.70 122.63 1n13 s GLU 111 Ca -0.12 -0.28 0.00 0.00 0.03 0.00 0.00 54.97 54.60 1n13 s GLU 111 Cb -0.04 0.38 0.00 0.00 -0.80 0.00 0.00 34.13 33.67 1n13 s GLU 111 CO 0.05 -0.27 0.00 0.41 -1.33 0.00 0.00 175.26 174.11 1n13 n GLY 112 N 0.76 0.42 3.22 -3.83 0.00 -0.44 -4.99 105.19 100.33 1n13 n GLY 112 Ca -0.19 -0.95 -0.43 0.00 0.00 0.00 0.00 46.02 44.44 1n13 n GLY 112 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1n13 n LYS 113 N -0.30 3.35 -3.97 1.61 5.02 -1.26 -0.91 118.16 121.69 1n13 n LYS 113 Ca 0.00 -3.50 -0.13 0.00 -2.02 0.00 0.00 58.31 52.66 1n13 n LYS 113 Cb 0.00 -3.12 -0.01 0.00 -0.02 0.00 0.00 35.03 31.88 1n13 n LYS 113 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1n13 s SER 115 N -3.18 5.17 0.21 0.00 1.04 -1.26 -3.53 113.70 112.15 1n13 s SER 115 Ca 0.24 1.18 -0.10 0.00 0.48 0.00 0.00 55.95 57.75 1n13 s SER 115 Cb -0.02 -1.95 0.15 0.00 0.10 0.00 0.00 66.02 64.30 1n13 s SER 115 CO 0.17 -1.52 1.86 0.50 0.98 0.00 0.00 173.24 175.23 1n13 h LYS 116 N -0.78 1.02 -0.55 4.02 3.64 -1.91 -1.75 116.57 120.27 1n13 h LYS 116 Ca -0.45 -0.09 -0.03 0.00 -1.27 0.00 0.00 60.65 58.81 1n13 h LYS 116 Cb 1.26 -0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 32.84 1n13 h LYS 116 CO 0.63 0.71 0.23 0.87 -2.27 0.00 0.00 179.45 179.62 1n13 h LYS 117 N 1.04 0.82 -0.37 1.90 1.57 -1.96 -1.37 116.57 118.20 1n13 h LYS 117 Ca 0.27 -0.14 -0.12 0.00 -1.87 0.00 0.00 60.65 58.79 1n13 h LYS 117 Cb -0.06 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.11 1n13 h LYS 117 CO -0.05 0.70 -0.25 0.93 -0.57 0.00 0.00 179.45 180.21 1n13 h GLU 118 N 0.75 0.74 -0.42 3.15 4.39 -1.89 -0.73 114.58 120.57 1n13 h GLU 118 Ca 0.18 -0.31 -0.03 0.00 0.34 0.00 0.00 59.36 59.54 1n13 h GLU 118 Cb 0.18 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.79 1n13 h GLU 118 CO -0.02 0.92 0.13 0.00 -1.16 0.00 0.00 179.01 178.88 1n13 h ALA 119 N 1.08 0.55 -0.54 3.43 0.00 -1.13 -0.57 119.26 122.08 1n13 h ALA 119 Ca 0.09 -0.17 -0.11 0.00 0.00 0.00 0.00 54.91 54.71 1n13 h ALA 119 Cb 0.75 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1n13 h ALA 119 CO 0.06 0.20 -0.09 1.49 0.00 0.00 0.00 179.25 180.91 1n13 h GLU 120 N 0.53 1.00 -0.51 0.00 4.81 -1.12 -0.80 114.58 118.49 1n13 h GLU 120 Ca 0.13 -0.35 -0.02 0.00 -0.13 0.00 0.00 59.36 59.00 1n13 h GLU 120 Cb 0.27 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.55 1n13 h GLU 120 CO -0.00 1.03 0.26 -0.22 -0.73 0.00 0.00 179.01 179.35 1n13 h LYS 121 N 0.89 0.73 -0.21 1.92 3.64 -0.90 -1.49 116.57 121.15 1n13 h LYS 121 Ca 0.14 -0.10 -0.03 0.00 -1.27 0.00 0.00 60.65 59.40 1n13 h LYS 121 Cb 0.64 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.32 1n13 h LYS 121 CO 0.04 0.59 0.02 1.15 -2.27 0.00 0.00 179.45 178.99 1n13 h THR 122 N 0.68 1.24 0.00 1.00 2.02 -0.91 -2.25 112.91 114.69 1n13 h THR 122 Ca 0.18 -0.79 -0.08 0.00 0.77 0.00 0.00 66.41 66.49 1n13 h THR 122 Cb 0.09 1.35 -0.01 0.00 -1.74 0.00 0.00 68.15 67.85 1n13 h THR 122 CO -0.02 0.24 -0.37 1.62 0.37 0.00 0.00 175.52 177.35 1n13 h VAL 123 N 0.14 1.24 -0.31 3.16 3.04 -1.05 -1.52 116.25 120.95 1n13 h VAL 123 Ca 0.06 -1.30 -0.17 0.00 -1.01 0.00 0.00 66.70 64.29 1n13 h VAL 123 Cb 0.34 1.70 -0.00 0.00 -2.01 0.00 0.00 31.29 31.32 1n13 h VAL 123 CO 0.01 0.37 -0.48 0.03 -1.01 0.00 0.00 177.57 176.48 1n13 h ARG 124 N 0.00 0.84 -0.65 4.17 3.08 -1.18 -2.71 114.38 117.92 1n13 h ARG 124 Ca -0.00 -0.49 -0.06 0.00 0.07 0.00 0.00 59.98 59.50 1n13 h ARG 124 Cb 0.67 0.04 -0.03 0.00 0.08 0.00 0.00 29.97 30.74 1n13 h ARG 124 CO 0.05 1.12 0.16 1.49 -1.07 0.00 0.00 179.97 181.73 1n13 h GLU 125 N 0.66 1.02 -0.74 0.04 4.57 -0.93 -1.87 114.58 117.32 1n13 h GLU 125 Ca 0.03 -0.23 -0.03 0.00 -1.18 0.00 0.00 59.36 57.96 1n13 h GLU 125 Cb 1.07 -0.14 -0.03 0.00 -0.16 0.00 0.00 28.75 29.48 1n13 h GLU 125 CO 0.11 0.90 0.36 0.52 -1.18 0.00 0.00 179.01 179.72 1n13 h MET 126 N 0.98 1.06 -0.34 1.92 2.86 -1.15 0.34 114.93 120.60 1n13 h MET 126 Ca 0.21 -0.15 -0.11 0.00 -2.06 0.00 0.00 59.70 57.59 1n13 h MET 126 Cb 0.34 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 31.79 1n13 h MET 126 CO -0.00 0.82 -0.21 0.00 1.06 0.00 0.00 176.91 178.58 1n13 h ALA 127 N 1.33 0.48 -0.47 6.32 0.00 -1.15 -1.76 119.26 124.01 1n13 h ALA 127 Ca 0.26 -0.37 0.02 0.00 0.00 0.00 0.00 54.91 54.82 1n13 h ALA 127 Cb 0.11 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 1n13 h ALA 127 CO -0.03 0.44 0.29 -0.22 0.00 0.00 0.00 179.25 179.73 1n13 h LYS 128 N 0.52 0.56 -0.96 0.00 3.64 -0.86 -1.93 116.57 117.53 1n13 h LYS 128 Ca 0.07 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 1n13 h LYS 128 Cb 0.77 -0.13 -0.05 0.00 -0.41 0.00 0.00 32.23 32.41 1n13 h LYS 128 CO 0.06 0.37 0.60 0.82 -2.27 0.00 0.00 179.45 179.03 1n13 h ILE 129 N 0.57 1.26 -0.90 2.00 2.04 -0.83 -1.16 117.51 120.49 1n13 h ILE 129 Ca 0.19 -0.52 0.00 0.00 1.00 0.00 0.00 64.86 65.53 1n13 h ILE 129 Cb 0.01 -0.13 -0.04 0.00 -0.74 0.00 0.00 36.82 35.92 1n13 h ILE 129 CO -0.08 0.26 0.58 1.23 0.00 0.00 0.00 178.15 180.14 1n13 h GLY 130 N 1.32 1.27 1.83 5.37 0.00 -0.58 0.56 103.07 112.84 1n13 h GLY 130 Ca 0.35 -0.49 -0.15 0.00 0.00 0.00 0.00 47.33 47.03 1n13 h GLY 130 CO -0.07 0.48 -0.66 0.74 0.00 0.00 0.00 176.54 177.03 1n13 h PHE 131 N 1.22 0.22 -0.47 5.60 -1.00 -0.93 -2.78 116.94 118.81 1n13 h PHE 131 Ca 0.33 -0.09 -0.10 0.00 2.81 0.00 0.00 57.97 60.92 1n13 h PHE 131 Cb -0.11 -0.04 -0.02 0.00 3.61 0.00 0.00 35.95 39.39 1n13 h PHE 131 CO -0.01 0.78 -0.09 0.93 -1.61 0.00 0.00 178.31 178.31 1n13 h GLU 132 N 0.12 0.84 -0.30 1.51 5.08 -0.46 0.28 114.58 121.65 1n13 h GLU 132 Ca -0.01 -0.28 -0.08 0.00 -1.00 0.00 0.00 59.36 57.99 1n13 h GLU 132 Cb 1.18 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 30.34 1n13 h GLU 132 CO 0.10 0.90 -0.16 0.52 -1.00 0.00 0.00 179.01 179.37 1n13 h MET 133 N 0.76 0.53 0.00 2.33 2.86 -0.80 -2.76 114.93 117.85 1n13 h MET 133 Ca 0.13 -0.17 -0.08 0.00 -2.06 0.00 0.00 59.70 57.52 1n13 h MET 133 Cb 0.59 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.19 1n13 h MET 133 CO 0.04 0.67 -0.71 0.00 1.06 0.00 0.00 176.91 177.97 1n13 h ARG 134 N 0.48 0.00 -0.60 1.72 3.08 -1.20 -3.48 114.38 114.39 1n13 h ARG 134 Ca 0.08 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.06 1n13 h ARG 134 Cb 0.56 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.60 1n13 h ARG 134 CO 0.04 0.26 -0.10 0.41 -1.07 0.00 0.00 179.97 179.51 1n13 n GLY 135 N 1.23 0.25 3.92 0.04 0.00 0.92 -5.04 105.19 106.50 1n13 n GLY 135 Ca -0.01 -0.72 -0.30 0.00 0.00 0.00 0.00 46.02 44.98 1n13 n GLY 135 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1n13 s TRP 136 N -2.23 3.50 -0.09 1.61 0.51 -0.77 -5.03 118.94 116.44 1n13 s TRP 136 Ca 0.01 0.34 -0.30 0.00 -2.12 0.00 0.00 56.10 54.02 1n13 s TRP 136 Cb -0.00 -1.83 -0.02 0.00 -0.81 0.00 0.00 33.47 30.81 1n13 s TRP 136 CO 0.01 0.52 1.04 -2.00 -0.51 0.00 0.00 176.95 176.01 1n13 s GLU 137 N -2.67 4.42 -0.13 4.98 2.12 -1.26 -4.68 118.70 121.47 1n13 s GLU 137 Ca 0.37 1.45 -0.23 0.00 0.36 0.00 0.00 54.97 56.92 1n13 s GLU 137 Cb -0.12 -3.54 -0.03 0.00 0.26 0.00 0.00 34.13 30.70 1n13 s GLU 137 CO 0.27 -0.32 0.70 -1.17 -0.54 0.00 0.00 175.26 174.20 1n13 s LEU 138 N 1.96 4.23 -0.16 2.70 2.96 -1.26 -2.27 118.68 126.85 1n13 s LEU 138 Ca 0.50 1.06 -0.19 0.00 -0.22 0.00 0.00 54.13 55.28 1n13 s LEU 138 Cb -0.20 -3.04 -0.16 0.00 0.50 0.00 0.00 46.19 43.30 1n13 s LEU 138 CO 0.19 -0.22 0.30 -0.78 -1.32 0.00 0.00 176.35 174.53 1n13 h ASP 139 N 7.10 0.00 -5.17 3.68 3.58 -0.89 -3.43 116.42 121.29 1n13 h ASP 139 Ca -0.36 -0.51 0.16 0.00 0.42 0.00 0.00 57.03 56.75 1n13 h ASP 139 Cb 1.17 0.00 -0.10 0.00 1.72 0.00 0.00 39.33 42.12 1n13 h ASP 139 CO 0.78 1.06 0.49 0.00 -2.88 0.00 0.00 179.24 178.69 1n13 s ARG 140 N -2.17 1.10 -0.11 0.28 1.70 -1.12 -5.00 118.95 113.63 1n13 s ARG 140 Ca -0.19 -0.57 0.01 0.00 -0.47 0.00 0.00 55.73 54.51 1n13 s ARG 140 Cb 0.01 0.40 0.02 0.00 -0.57 0.00 0.00 34.95 34.81 1n13 s ARG 140 CO 0.47 -0.50 -0.13 0.42 -1.08 0.00 0.00 175.30 174.49 1n13 s ILE 141 N -3.24 1.33 -0.13 4.99 1.01 -1.26 -0.63 121.20 123.27 1n13 s ILE 141 Ca 0.10 -0.53 -0.04 0.00 0.00 0.00 0.00 60.65 60.19 1n13 s ILE 141 Cb -0.01 -1.25 -0.03 0.00 0.01 0.00 0.00 42.46 41.17 1n13 s ILE 141 CO -0.01 0.41 0.02 -1.61 0.00 0.00 0.00 174.94 173.75 1n13 s GLU 142 N 1.20 3.49 0.08 2.79 2.02 -0.70 -4.94 118.70 122.64 1n13 s GLU 142 Ca -0.03 -0.40 -0.08 0.00 0.02 0.00 0.00 54.97 54.48 1n13 s GLU 142 Cb -0.14 -2.97 -0.01 0.00 0.10 0.00 0.00 34.13 31.11 1n13 s GLU 142 CO -0.04 0.46 0.16 -1.54 0.02 0.00 0.00 175.26 174.33 1n13 s SER 143 N -0.20 0.15 -0.01 -0.19 1.04 -1.26 -0.40 113.70 112.82 1n13 s SER 143 Ca 0.06 -0.65 -0.05 0.00 0.48 0.00 0.00 55.95 55.78 1n13 s SER 143 Cb -0.12 0.32 0.00 0.00 0.10 0.00 0.00 66.02 66.31 1n13 s SER 143 CO 0.02 -0.69 0.12 -0.63 0.98 0.00 0.00 173.24 173.04 1n13 s ILE 144 N -3.67 0.06 0.11 -1.02 -1.09 -0.53 -5.01 121.20 110.05 1n13 s ILE 144 Ca 0.04 -0.47 -0.07 0.00 -2.23 0.00 0.00 60.65 57.91 1n13 s ILE 144 Cb 0.04 -0.33 -0.01 0.00 -1.58 0.00 0.00 42.46 40.58 1n13 s ILE 144 CO -0.10 -0.26 0.18 0.00 -1.23 0.00 0.00 174.94 173.53 1n13 s ALA 145 N -0.88 0.05 -0.07 9.38 0.00 -1.26 -1.19 121.76 127.79 1n13 s ALA 145 Ca -0.10 -0.87 -0.14 0.00 0.00 0.00 0.00 51.96 50.86 1n13 s ALA 145 Cb -0.06 0.63 0.03 0.00 0.00 0.00 0.00 23.12 23.73 1n13 s ALA 145 CO 0.01 -0.54 0.34 0.54 0.00 0.00 0.00 175.76 176.11 1n13 s VAL 146 N -3.92 0.03 0.17 0.00 0.11 -0.54 -5.01 120.40 111.24 1n13 s VAL 146 Ca 0.11 -0.25 0.08 0.00 -2.93 0.00 0.00 61.98 59.00 1n13 s VAL 146 Cb 0.05 -0.57 -0.04 0.00 -1.53 0.00 0.00 36.38 34.29 1n13 s VAL 146 CO -0.06 -0.14 -0.17 -1.83 -3.33 0.00 0.00 175.10 169.57 1n13 s GLU 147 N -0.64 1.27 -0.08 1.54 -1.05 -1.26 -1.72 118.70 116.76 1n13 s GLU 147 Ca -0.07 -1.42 -0.04 0.00 -0.15 0.00 0.00 54.97 53.29 1n13 s GLU 147 Cb -0.04 -1.28 0.04 0.00 -0.44 0.00 0.00 34.13 32.41 1n13 s GLU 147 CO 0.03 0.25 0.18 -1.58 0.95 0.00 0.00 175.26 175.09 1n13 s HIS 148 N -2.17 -0.21 -0.39 4.83 2.46 0.81 -4.98 115.29 115.64 1n13 s HIS 148 Ca 0.16 0.56 -0.14 0.00 0.47 0.00 0.00 55.06 56.11 1n13 s HIS 148 Cb -0.05 -0.02 0.01 0.00 -0.13 0.00 0.00 32.58 32.39 1n13 s HIS 148 CO 0.06 -0.17 0.28 0.99 -2.47 0.00 0.00 174.74 173.43 1n13 s THR 149 N 1.02 5.26 0.23 0.89 2.01 -1.26 -0.63 115.64 123.16 1n13 s THR 149 Ca -0.08 -0.54 -0.32 0.00 0.31 0.00 0.00 61.69 61.07 1n13 s THR 149 Cb -0.10 -3.86 -0.12 0.00 0.01 0.00 0.00 72.50 68.43 1n13 s THR 149 CO -0.06 -0.22 1.70 -0.69 -0.69 0.00 0.00 174.62 174.66 1n13 s VAL 150 N 1.69 2.02 -0.26 3.82 1.01 -0.04 -4.87 120.40 123.78 1n13 s VAL 150 Ca 0.05 0.01 -0.10 0.00 0.00 0.00 0.00 61.98 61.94 1n13 s VAL 150 Cb -0.19 -3.01 -0.15 0.00 0.00 0.00 0.00 36.38 33.04 1n13 s VAL 150 CO 0.10 0.00 -0.23 -0.62 0.00 0.00 0.00 175.10 174.35 1n13 n GLU 151 N 3.56 0.61 0.03 2.72 1.02 -1.26 0.10 120.64 127.42 1n13 n GLU 151 Ca 0.14 0.27 0.00 0.00 -0.02 0.00 0.00 57.16 57.55 1n13 n GLU 151 Cb 0.36 -1.54 0.00 0.00 -0.02 0.00 0.00 31.44 30.24 1n13 n GLU 151 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1n13 n LYS 152 N -3.98 0.00 -3.35 3.49 3.00 -1.26 -4.53 118.16 111.53 1n13 n LYS 152 Ca -0.49 0.00 -0.02 0.00 -0.00 0.00 0.00 58.31 57.80 1n13 n LYS 152 Cb 0.90 -0.05 -0.04 0.00 0.00 0.00 0.00 35.03 35.84 1n13 n LYS 152 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.40 176.23 1n13 s LEU 153 N -5.48 -1.07 0.27 3.14 0.20 -1.26 -4.29 118.68 110.19 1n13 s LEU 153 Ca 0.00 0.86 0.04 0.00 0.69 0.00 0.00 54.13 55.72 1n13 s LEU 153 Cb 0.00 1.84 -0.06 0.00 -0.43 0.00 0.00 46.19 47.54 1n13 s LEU 153 CO 0.00 -0.26 0.00 -0.83 -0.29 0.00 0.00 176.35 174.97 1n13 s GLY 154 N 2.76 1.79 -0.02 7.98 0.00 -0.16 -4.98 107.32 114.70 1n13 s GLY 154 Ca 0.11 -1.89 0.01 0.00 0.00 0.00 0.00 44.72 42.95 1n13 s GLY 154 CO -0.18 -1.76 -0.01 0.00 0.00 0.00 0.00 173.10 171.15 1n13 s ALA 156 N 0.52 2.72 -0.03 0.00 0.00 -0.50 -4.94 121.76 119.54 1n13 s ALA 156 Ca -0.05 -0.92 -0.03 0.00 0.00 0.00 0.00 51.96 50.96 1n13 s ALA 156 Cb -0.08 -1.14 0.01 0.00 0.00 0.00 0.00 23.12 21.91 1n13 s ALA 156 CO -0.01 0.43 0.09 0.12 0.00 0.00 0.00 175.76 176.39 1n13 s PHE 157 N -0.30 -0.10 -0.03 0.00 5.36 -1.26 -1.60 117.98 120.05 1n13 s PHE 157 Ca 0.03 0.24 -0.03 0.00 -0.96 0.00 0.00 56.93 56.21 1n13 s PHE 157 Cb -0.13 0.03 0.01 0.00 -0.34 0.00 0.00 43.02 42.59 1n13 s PHE 157 CO 0.03 -0.05 0.07 0.00 -1.46 0.00 0.00 175.22 173.81 1n13 s ALA 158 N 0.04 -0.18 0.12 11.12 0.00 -0.65 -4.82 121.76 127.38 1n13 s ALA 158 Ca -0.00 0.21 -0.13 0.00 0.00 0.00 0.00 51.96 52.04 1n13 s ALA 158 Cb -0.01 -0.13 0.02 0.00 0.00 0.00 0.00 23.12 23.01 1n13 s ALA 158 CO 0.00 -0.04 0.32 0.00 0.00 0.00 0.00 175.76 176.05 1n13 s ALA 159 N 0.06 -0.61 -0.27 0.00 0.00 -1.26 -1.02 121.76 118.66 1n13 s ALA 159 Ca -0.00 -0.33 0.02 0.00 0.00 0.00 0.00 51.96 51.65 1n13 s ALA 159 Cb -0.01 0.64 0.07 0.00 0.00 0.00 0.00 23.12 23.83 1n13 s ALA 159 CO -0.00 -0.61 -0.04 0.00 0.00 0.00 0.00 175.76 175.11 1n13 s ALA 160 N -3.84 2.38 -0.25 0.00 0.00 0.37 -4.96 121.76 115.45 1n13 s ALA 160 Ca 0.05 -1.81 -0.14 0.00 0.00 0.00 0.00 51.96 50.06 1n13 s ALA 160 Cb 0.03 -1.63 -0.04 0.00 0.00 0.00 0.00 23.12 21.48 1n13 s ALA 160 CO -0.10 -1.34 0.34 0.00 0.00 0.00 0.00 175.76 174.66 1n13 s ALA 161 N 1.18 3.57 -0.03 0.00 0.00 -1.26 -1.67 121.76 123.54 1n13 s ALA 161 Ca -0.02 -0.78 -0.20 0.00 0.00 0.00 0.00 51.96 50.95 1n13 s ALA 161 Cb -0.19 -2.64 -0.05 0.00 0.00 0.00 0.00 23.12 20.24 1n13 s ALA 161 CO -0.07 -0.53 0.57 -0.51 0.00 0.00 0.00 175.76 175.22 1n13 s LEU 162 N 1.79 4.38 0.00 0.00 1.02 -0.14 -5.03 118.68 120.70 1n13 s LEU 162 Ca 0.14 1.08 0.00 0.00 0.02 0.00 0.00 54.13 55.38 1n13 s LEU 162 Cb -0.15 -2.88 0.00 0.00 0.02 0.00 0.00 46.19 43.18 1n13 s LEU 162 CO 0.09 0.07 0.00 1.87 0.02 0.00 0.00 176.35 178.40 1n13 n TRP 163 N 3.00 -0.11 -4.71 0.29 -0.00 -1.26 -4.07 117.44 110.57 1n13 n TRP 163 Ca -0.07 0.00 -0.25 0.00 -0.00 0.00 0.00 57.50 57.18 1n13 n TRP 163 Cb 0.51 0.00 -0.14 0.00 -0.00 0.00 0.00 31.31 31.68 1n13 n TRP 163 CO 0.00 0.00 0.00 0.71 -0.00 0.00 0.00 177.69 178.40 1n13 s TYR 164 N -2.76 1.70 -2.00 5.87 2.02 -1.26 -5.10 117.35 115.82 1n13 s TYR 164 Ca 0.00 -0.35 0.12 0.00 -0.37 0.00 0.00 57.07 56.46 1n13 s TYR 164 Cb 0.00 -1.04 0.69 0.00 -0.40 0.00 0.00 41.96 41.21 1n13 s TYR 164 CO 0.00 0.04 1.12 1.63 -1.57 0.00 0.00 175.55 176.78