#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 4.01 0.50 0.38 -2.45 0.12 -4.93 119.30 116.92 1n13 s MET 55 Ca 0.00 0.39 -0.22 0.00 -1.25 0.00 0.00 55.69 54.61 1n13 s MET 55 Cb 0.00 -3.68 -0.08 0.00 1.25 0.00 0.00 34.83 32.32 1n13 s MET 55 CO 0.00 -0.47 1.04 -2.30 1.05 0.00 0.00 175.02 174.34 1n13 n PRO 56 N 5.74 1.28 -1.65 4.11 -0.02 -1.26 -0.79 135.00 142.41 1n13 n PRO 56 Ca -0.02 0.47 -0.41 0.00 -2.02 0.00 0.00 63.50 61.52 1n13 n PRO 56 Cb 0.49 -2.16 0.01 0.00 -0.02 0.00 0.00 33.50 31.82 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 -0.35 1.56 -0.53 0.52 -0.02 -1.26 -1.55 135.00 133.37 1n13 n PRO 57 Ca 0.11 0.56 0.00 0.00 -2.02 0.00 0.00 63.50 62.14 1n13 n PRO 57 Cb 0.43 -2.19 0.00 0.00 -0.02 0.00 0.00 33.50 31.72 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 0.03 0.00 -1.54 -0.52 -0.58 -1.23 -4.99 120.64 111.81 1n13 n GLU 58 Ca 0.09 0.00 -0.32 0.00 -0.42 0.00 0.00 57.16 56.50 1n13 n GLU 58 Cb 0.40 -2.92 0.07 0.00 -0.57 0.00 0.00 31.44 28.41 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 -2.69 2.39 0.05 0.62 0.00 -0.59 -5.05 121.76 116.48 1n13 s ALA 59 Ca 0.00 0.41 0.08 0.00 0.00 0.00 0.00 51.96 52.45 1n13 s ALA 59 Cb 0.00 -3.29 -0.03 0.00 0.00 0.00 0.00 23.12 19.80 1n13 s ALA 59 CO 0.00 -1.48 -0.22 -1.21 0.00 0.00 0.00 175.76 172.85 1n13 s GLU 60 N -4.48 1.46 -0.17 0.00 0.41 -1.26 -5.01 118.70 109.66 1n13 s GLU 60 Ca 0.64 -1.00 -0.28 0.00 -0.41 0.00 0.00 54.97 53.93 1n13 s GLU 60 Cb -0.19 -1.60 -0.01 0.00 -1.78 0.00 0.00 34.13 30.55 1n13 s GLU 60 CO 0.48 0.41 0.94 0.42 -0.49 0.00 0.00 175.26 177.02 1n13 s ILE 61 N -0.83 4.80 0.11 -1.63 1.01 -1.26 -5.02 121.20 118.38 1n13 s ILE 61 Ca 0.08 1.86 0.02 0.00 0.00 0.00 0.00 60.65 62.61 1n13 s ILE 61 Cb -0.09 -4.24 -0.04 0.00 0.01 0.00 0.00 42.46 38.10 1n13 s ILE 61 CO 0.02 -0.04 -0.05 0.68 0.00 0.00 0.00 174.94 175.55 1n13 s VAL 62 N 2.39 0.68 0.71 2.92 -7.23 -1.26 -5.14 120.40 113.48 1n13 s VAL 62 Ca 0.43 -1.94 -0.15 0.00 -1.81 0.00 0.00 61.98 58.50 1n13 s VAL 62 Cb -0.17 -1.77 0.03 0.00 0.56 0.00 0.00 36.38 35.03 1n13 s VAL 62 CO 0.12 -0.79 1.18 -2.84 -0.31 0.00 0.00 175.10 172.46 1n13 s PRO 63 N -3.85 2.33 -0.06 4.82 0.02 -1.26 -4.84 135.00 132.16 1n13 s PRO 63 Ca 0.14 1.65 -0.35 0.00 0.02 0.00 0.00 61.00 62.47 1n13 s PRO 63 Cb 0.05 -1.87 -0.13 0.00 0.02 0.00 0.00 34.50 32.58 1n13 s PRO 63 CO -0.03 -1.67 1.77 -0.11 -0.33 0.00 0.00 177.00 176.63 1n13 n LEU 64 N -2.62 3.11 -4.82 -5.54 7.94 -1.26 -4.95 117.00 108.86 1n13 n LEU 64 Ca 0.13 1.02 -0.29 0.00 -1.11 0.00 0.00 56.01 55.75 1n13 n LEU 64 Cb 0.51 -1.34 0.15 0.00 0.53 0.00 0.00 43.42 43.27 1n13 n LEU 64 CO 0.47 -0.21 0.76 -2.16 -1.11 0.00 0.00 177.39 175.14 1n13 s PRO 65 N 3.16 0.96 -0.59 1.96 0.04 -1.26 -4.94 135.00 134.32 1n13 s PRO 65 Ca 0.90 0.05 -0.28 0.00 0.04 0.00 0.00 61.00 61.72 1n13 s PRO 65 Cb -0.76 -1.84 0.01 0.00 0.04 0.00 0.00 34.50 31.95 1n13 s PRO 65 CO 0.51 -2.28 1.47 0.21 0.04 0.00 0.00 177.00 176.95 1n13 s LYS 66 N -5.50 3.19 0.06 4.56 2.20 -1.26 -4.98 119.74 118.01 1n13 s LYS 66 Ca 0.66 0.41 -0.23 0.00 -0.36 0.00 0.00 55.97 56.46 1n13 s LYS 66 Cb -0.11 -4.17 -0.06 0.00 -1.51 0.00 0.00 37.83 31.98 1n13 s LYS 66 CO 0.53 -2.07 0.69 -0.51 -0.36 0.00 0.00 175.35 173.62 1n13 s LEU 67 N 6.45 4.48 0.16 5.43 1.43 -1.26 -5.03 118.68 130.34 1n13 s LEU 67 Ca 0.53 1.37 -0.31 0.00 -1.03 0.00 0.00 54.13 54.70 1n13 s LEU 67 Cb -0.11 -3.10 -0.08 0.00 0.03 0.00 0.00 46.19 42.93 1n13 s LEU 67 CO 0.23 0.12 1.38 -2.84 0.23 0.00 0.00 176.35 175.47 1n13 s PRO 68 N -0.49 4.33 0.26 1.29 0.02 -1.26 -4.92 135.00 134.23 1n13 s PRO 68 Ca 0.34 2.10 -0.31 0.00 0.02 0.00 0.00 61.00 63.15 1n13 s PRO 68 Cb -0.20 -3.21 -0.12 0.00 0.02 0.00 0.00 34.50 30.99 1n13 s PRO 68 CO 0.21 -0.38 1.62 -1.33 -0.33 0.00 0.00 177.00 176.80 1n13 n MET 69 N 3.36 2.67 -0.44 5.54 2.81 -1.26 -1.83 117.12 127.97 1n13 n MET 69 Ca 0.09 0.95 0.00 0.00 -1.81 0.00 0.00 57.70 56.94 1n13 n MET 69 Cb 0.42 -2.75 0.00 0.00 -0.71 0.00 0.00 33.22 30.18 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 2.76 0.79 3.73 3.03 0.00 -1.26 -5.04 105.19 109.20 1n13 n GLY 70 Ca 0.11 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.62 1.47 -3.00 4.61 0.00 -0.76 -4.91 120.51 117.30 1n13 n ALA 71 Ca 0.00 0.15 -0.44 0.00 0.00 0.00 0.00 53.44 53.15 1n13 n ALA 71 Cb 0.00 -2.33 -0.02 0.00 0.00 0.00 0.00 19.45 17.10 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 -2.97 5.34 -0.32 0.00 1.43 -1.26 -5.01 118.68 115.89 1n13 s LEU 72 Ca 0.69 -2.30 -0.19 0.00 -1.03 0.00 0.00 54.13 51.31 1n13 s LEU 72 Cb -0.43 -2.37 -0.01 0.00 0.03 0.00 0.00 46.19 43.41 1n13 s LEU 72 CO 0.51 -0.93 0.55 -0.69 0.23 0.00 0.00 176.35 176.02 1n13 s VAL 73 N 2.07 5.00 -0.04 -1.59 1.01 -1.26 -5.02 120.40 120.57 1n13 s VAL 73 Ca 0.32 0.61 -0.30 0.00 0.00 0.00 0.00 61.98 62.61 1n13 s VAL 73 Cb -0.05 -3.95 -0.06 0.00 0.00 0.00 0.00 36.38 32.31 1n13 s VAL 73 CO -0.08 -0.14 1.68 -2.84 0.00 0.00 0.00 175.10 173.72 1n13 s PRO 74 N 2.46 4.18 -0.02 2.72 0.02 -1.26 -4.90 135.00 138.21 1n13 s PRO 74 Ca 0.21 2.23 0.01 0.00 0.02 0.00 0.00 61.00 63.47 1n13 s PRO 74 Cb -0.15 -3.97 0.02 0.00 0.02 0.00 0.00 34.50 30.42 1n13 s PRO 74 CO 0.12 -0.84 -0.01 0.99 -0.33 0.00 0.00 177.00 176.93 1n13 s THR 75 N 3.95 0.17 -0.20 0.99 2.01 -1.26 -0.96 115.64 120.33 1n13 s THR 75 Ca 0.75 0.02 -0.10 0.00 0.31 0.00 0.00 61.69 62.67 1n13 s THR 75 Cb -0.35 -0.22 -0.05 0.00 0.01 0.00 0.00 72.50 71.90 1n13 s THR 75 CO 0.31 0.11 0.12 0.00 -0.69 0.00 0.00 174.62 174.46 1n13 s ALA 76 N 0.60 3.62 0.11 7.40 0.00 -0.58 -4.95 121.76 127.96 1n13 s ALA 76 Ca -0.06 -0.74 -0.11 0.00 0.00 0.00 0.00 51.96 51.05 1n13 s ALA 76 Cb -0.09 -2.15 0.01 0.00 0.00 0.00 0.00 23.12 20.90 1n13 s ALA 76 CO -0.01 0.10 0.26 1.52 0.00 0.00 0.00 175.76 177.63 1n13 s TYR 77 N 0.49 0.07 0.02 0.00 -0.85 -1.26 -0.53 117.35 115.29 1n13 s TYR 77 Ca 0.07 -0.46 0.04 0.00 -0.52 0.00 0.00 57.07 56.20 1n13 s TYR 77 Cb -0.12 0.04 -0.02 0.00 0.38 0.00 0.00 41.96 42.24 1n13 s TYR 77 CO -0.00 -0.61 -0.13 0.20 -1.52 0.00 0.00 175.55 173.48 1n13 s GLY 78 N -2.85 0.73 0.12 5.49 0.00 -0.20 -4.94 107.32 105.66 1n13 s GLY 78 Ca 0.06 -0.74 -0.17 0.00 0.00 0.00 0.00 44.72 43.87 1n13 s GLY 78 CO -0.10 -0.70 0.42 -2.52 0.00 0.00 0.00 173.10 170.20 1n13 s TYR 79 N -0.69 -0.24 -0.12 1.90 -0.85 -1.26 -1.75 117.35 114.34 1n13 s TYR 79 Ca 0.02 -0.03 -0.09 0.00 -0.52 0.00 0.00 57.07 56.45 1n13 s TYR 79 Cb -0.07 0.27 0.04 0.00 0.38 0.00 0.00 41.96 42.58 1n13 s TYR 79 CO 0.01 -0.69 0.31 -1.50 -1.52 0.00 0.00 175.55 172.16 1n13 s ILE 80 N -3.61 -0.01 -0.02 -3.49 2.07 -0.64 -4.87 121.20 110.63 1n13 s ILE 80 Ca 0.02 0.04 0.07 0.00 -1.41 0.00 0.00 60.65 59.37 1n13 s ILE 80 Cb 0.01 -0.45 -0.02 0.00 0.13 0.00 0.00 42.46 42.13 1n13 s ILE 80 CO -0.11 0.02 -0.23 -0.63 -1.91 0.00 0.00 174.94 172.08 1n13 s ILE 81 N 0.58 1.82 -0.06 2.00 1.01 -1.26 -1.32 121.20 123.96 1n13 s ILE 81 Ca -0.03 -0.98 -0.06 0.00 0.00 0.00 0.00 60.65 59.57 1n13 s ILE 81 Cb -0.05 -1.51 0.01 0.00 0.01 0.00 0.00 42.46 40.93 1n13 s ILE 81 CO -0.03 0.51 0.17 -0.55 0.00 0.00 0.00 174.94 175.04 1n13 s SER 82 N -0.53 -0.15 -0.20 3.58 0.15 -0.22 -5.00 113.70 111.33 1n13 s SER 82 Ca 0.09 0.28 0.15 0.00 0.70 0.00 0.00 55.95 57.16 1n13 s SER 82 Cb -0.09 0.33 0.47 0.00 -1.71 0.00 0.00 66.02 65.02 1n13 s SER 82 CO -0.01 -0.10 1.37 -0.90 1.20 0.00 0.00 173.24 174.81 1n13 n ASP 83 N 2.80 3.16 -4.44 5.45 5.75 -1.26 -1.18 116.55 126.84 1n13 n ASP 83 Ca -0.14 -3.25 -0.43 0.00 -0.01 0.00 0.00 54.79 50.96 1n13 n ASP 83 Cb 0.58 -0.55 -0.10 0.00 -1.03 0.00 0.00 41.12 40.03 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 -2.96 5.16 0.22 2.12 1.01 -1.26 -4.81 120.40 119.87 1n13 s VAL 84 Ca 0.41 -0.76 -0.32 0.00 0.00 0.00 0.00 61.98 61.30 1n13 s VAL 84 Cb 0.35 -3.92 -0.13 0.00 0.00 0.00 0.00 36.38 32.68 1n13 s VAL 84 CO 0.05 -0.35 1.51 -2.65 0.00 0.00 0.00 175.10 173.65 1n13 n PRO 85 N 5.14 2.20 -0.47 2.72 -0.02 -1.26 -1.89 135.00 141.43 1n13 n PRO 85 Ca -0.11 0.79 0.00 0.00 -2.02 0.00 0.00 63.50 62.16 1n13 n PRO 85 Cb 0.46 -2.51 0.00 0.00 -0.02 0.00 0.00 33.50 31.43 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 2.67 1.43 3.74 -1.23 0.00 0.72 -4.99 105.19 107.52 1n13 n GLY 86 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.24 4.66 -0.27 1.61 2.12 -0.79 -4.77 118.70 121.02 1n13 s GLU 87 Ca 0.00 1.34 -0.12 0.00 0.36 0.00 0.00 54.97 56.55 1n13 s GLU 87 Cb 0.00 -3.36 -0.05 0.00 0.26 0.00 0.00 34.13 30.99 1n13 s GLU 87 CO 0.00 0.29 0.24 0.99 -0.54 0.00 0.00 175.26 176.23 1n13 s THR 88 N -0.22 5.28 0.07 -1.70 2.01 -1.26 -0.76 115.64 119.06 1n13 s THR 88 Ca 0.43 0.28 0.09 0.00 0.31 0.00 0.00 61.69 62.81 1n13 s THR 88 Cb -0.23 -3.57 -0.03 0.00 0.01 0.00 0.00 72.50 68.68 1n13 s THR 88 CO 0.28 0.24 -0.24 0.27 -0.69 0.00 0.00 174.62 174.48 1n13 s ILE 89 N 1.73 2.37 0.04 1.82 -4.36 0.14 -3.00 121.20 119.95 1n13 s ILE 89 Ca 0.09 -1.44 -0.01 0.00 -0.26 0.00 0.00 60.65 59.04 1n13 s ILE 89 Cb -0.16 -1.98 -0.04 0.00 1.25 0.00 0.00 42.46 41.54 1n13 s ILE 89 CO 0.10 0.28 -0.03 -0.94 0.24 0.00 0.00 174.94 174.58 1n13 s SER 90 N -1.54 0.45 0.00 4.36 1.04 -0.20 0.16 113.70 117.97 1n13 s SER 90 Ca 0.13 -0.88 -0.01 0.00 0.48 0.00 0.00 55.95 55.67 1n13 s SER 90 Cb -0.10 0.17 -0.01 0.00 0.10 0.00 0.00 66.02 66.19 1n13 s SER 90 CO 0.04 -0.52 0.02 0.00 0.98 0.00 0.00 173.24 173.76 1n13 s ALA 91 N -3.31 -0.04 0.06 5.32 0.00 -0.67 -1.40 121.76 121.73 1n13 s ALA 91 Ca 0.02 -0.18 -0.07 0.00 0.00 0.00 0.00 51.96 51.73 1n13 s ALA 91 Cb 0.04 0.04 -0.01 0.00 0.00 0.00 0.00 23.12 23.18 1n13 s ALA 91 CO -0.08 -0.09 0.13 0.00 0.00 0.00 0.00 175.76 175.72 1n13 s ALA 92 N -0.67 -0.07 -0.00 0.00 0.00 0.77 -1.36 121.76 120.42 1n13 s ALA 92 Ca -0.07 -0.65 -0.01 0.00 0.00 0.00 0.00 51.96 51.22 1n13 s ALA 92 Cb -0.05 0.35 -0.00 0.00 0.00 0.00 0.00 23.12 23.43 1n13 s ALA 92 CO -0.00 -0.41 0.02 -1.50 0.00 0.00 0.00 175.76 173.86 1n13 s ILE 93 N -3.34 0.03 0.05 0.00 1.10 -0.35 -1.15 121.20 117.53 1n13 s ILE 93 Ca 0.01 -0.21 -0.03 0.00 -0.51 0.00 0.00 60.65 59.91 1n13 s ILE 93 Cb 0.03 -0.10 -0.03 0.00 0.15 0.00 0.00 42.46 42.51 1n13 s ILE 93 CO -0.08 -0.12 0.02 -0.94 -2.11 0.00 0.00 174.94 171.72 1n13 s SER 94 N -0.34 0.36 -0.06 4.50 1.04 -0.17 -1.77 113.70 117.26 1n13 s SER 94 Ca -0.04 -0.83 -0.02 0.00 0.48 0.00 0.00 55.95 55.54 1n13 s SER 94 Cb -0.02 0.22 0.03 0.00 0.10 0.00 0.00 66.02 66.35 1n13 s SER 94 CO -0.00 -0.58 0.06 -0.69 0.98 0.00 0.00 173.24 173.01 1n13 s VAL 95 N -3.51 -0.07 -0.20 5.02 1.01 0.11 -0.85 120.40 121.91 1n13 s VAL 95 Ca 0.03 0.33 -0.20 0.00 0.00 0.00 0.00 61.98 62.14 1n13 s VAL 95 Cb 0.05 -0.23 -0.03 0.00 0.00 0.00 0.00 36.38 36.16 1n13 s VAL 95 CO -0.09 0.13 0.59 0.00 0.00 0.00 0.00 175.10 175.73 1n13 s ALA 96 N 2.15 3.55 -0.19 5.51 0.00 0.42 -1.54 121.76 131.65 1n13 s ALA 96 Ca 0.05 -0.32 -0.08 0.00 0.00 0.00 0.00 51.96 51.60 1n13 s ALA 96 Cb -0.13 -2.92 -0.04 0.00 0.00 0.00 0.00 23.12 20.03 1n13 s ALA 96 CO -0.04 -0.53 0.07 0.42 0.00 0.00 0.00 175.76 175.68 1n13 s ILE 97 N 1.85 4.83 0.47 0.00 1.01 0.06 -1.37 121.20 128.05 1n13 s ILE 97 Ca 0.27 -0.02 -0.19 0.00 0.00 0.00 0.00 60.65 60.72 1n13 s ILE 97 Cb -0.16 -3.19 -0.09 0.00 0.01 0.00 0.00 42.46 39.03 1n13 s ILE 97 CO 0.10 0.45 0.97 -2.16 0.00 0.00 0.00 174.94 174.29 1n13 s PRO 98 N 0.48 4.08 0.07 2.79 0.04 -1.26 -0.41 135.00 140.79 1n13 s PRO 98 Ca 0.04 1.02 -0.17 0.00 0.04 0.00 0.00 61.00 61.93 1n13 s PRO 98 Cb -0.12 -2.16 -0.11 0.00 0.04 0.00 0.00 34.50 32.15 1n13 s PRO 98 CO 0.01 -0.16 1.39 0.87 0.04 0.00 0.00 177.00 179.15 1n13 h LYS 99 N 1.38 0.53 -6.47 4.56 1.79 -1.67 -3.40 116.57 113.29 1n13 h LYS 99 Ca -0.48 -0.27 -0.56 0.00 -2.18 0.00 0.00 60.65 57.16 1n13 h LYS 99 Cb 1.18 0.01 -0.05 0.00 -1.58 0.00 0.00 32.23 31.79 1n13 h LYS 99 CO 0.61 0.85 1.10 0.34 -1.08 0.00 0.00 179.45 181.27 1n13 s ASP 100 N -6.32 6.22 0.00 0.86 -1.08 -1.26 -4.88 116.67 110.21 1n13 s ASP 100 Ca -0.13 0.65 0.09 0.00 -0.52 0.00 0.00 52.55 52.63 1n13 s ASP 100 Cb 0.07 -2.54 0.41 0.00 -1.46 0.00 0.00 42.92 39.40 1n13 s ASP 100 CO 0.79 -1.56 1.21 0.29 0.52 0.00 0.00 175.17 176.42 1n13 n LYS 101 N 8.32 0.07 0.10 4.34 4.76 -1.26 -1.60 118.16 132.88 1n13 n LYS 101 Ca 0.16 0.27 0.12 0.00 -2.87 0.00 0.00 58.31 55.99 1n13 n LYS 101 Cb 0.48 -1.50 0.20 0.00 -1.84 0.00 0.00 35.03 32.37 1n13 n LYS 101 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 1n13 h SER 102 N 0.00 0.00 -3.25 4.39 4.64 -1.94 -3.26 113.55 114.13 1n13 h SER 102 Ca 0.00 -0.10 -0.45 0.00 -0.47 0.00 0.00 61.79 60.77 1n13 h SER 102 Cb 0.11 0.00 0.06 0.00 -0.31 0.00 0.00 62.40 62.26 1n13 h SER 102 CO 0.00 0.05 0.11 -0.76 -0.87 0.00 0.00 176.83 175.36 1n13 s LEU 103 N -4.74 3.08 0.37 5.97 1.43 -0.63 -4.78 118.68 119.39 1n13 s LEU 103 Ca 0.06 0.32 0.04 0.00 -1.03 0.00 0.00 54.13 53.52 1n13 s LEU 103 Cb 0.11 -3.08 -0.01 0.00 0.03 0.00 0.00 46.19 43.24 1n13 s LEU 103 CO 0.70 -1.31 0.54 0.00 0.23 0.00 0.00 176.35 176.50 1n13 s GLY 105 N -4.18 2.01 -0.20 0.00 0.00 0.03 -4.45 107.32 100.53 1n13 s GLY 105 Ca 0.46 -0.56 -0.04 0.00 0.00 0.00 0.00 44.72 44.59 1n13 s GLY 105 CO 0.33 -0.46 -0.04 -2.27 0.00 0.00 0.00 173.10 170.66 1n13 s LEU 106 N -3.18 3.00 -0.18 0.66 2.96 -0.47 -0.71 118.68 120.75 1n13 s LEU 106 Ca 0.43 -0.31 -0.10 0.00 -0.22 0.00 0.00 54.13 53.93 1n13 s LEU 106 Cb -0.11 -1.75 -0.05 0.00 0.50 0.00 0.00 46.19 44.78 1n13 s LEU 106 CO 0.27 0.04 0.14 -0.63 -1.32 0.00 0.00 176.35 174.86 1n13 s ILE 107 N 1.11 5.42 0.08 6.68 1.01 -1.26 -0.44 121.20 133.80 1n13 s ILE 107 Ca 0.02 0.22 0.07 0.00 0.00 0.00 0.00 60.65 60.96 1n13 s ILE 107 Cb -0.15 -3.47 -0.03 0.00 0.01 0.00 0.00 42.46 38.82 1n13 s ILE 107 CO -0.00 0.47 -0.18 -0.04 0.00 0.00 0.00 174.94 175.19 1n13 s MET 108 N 0.11 1.04 0.10 2.79 -1.94 -0.03 -4.78 119.30 116.58 1n13 s MET 108 Ca 0.10 -1.05 0.06 0.00 -1.71 0.00 0.00 55.69 53.09 1n13 s MET 108 Cb -0.11 -1.19 -0.03 0.00 2.01 0.00 0.00 34.83 35.50 1n13 s MET 108 CO -0.00 0.28 -0.14 -1.83 -0.01 0.00 0.00 175.02 173.31 1n13 s GLU 109 N -1.73 0.95 -0.03 2.03 1.03 -1.26 -1.00 118.70 118.69 1n13 s GLU 109 Ca 0.04 -1.13 -0.14 0.00 0.03 0.00 0.00 54.97 53.76 1n13 s GLU 109 Cb -0.10 -0.90 0.02 0.00 -0.80 0.00 0.00 34.13 32.35 1n13 s GLU 109 CO 0.03 0.18 0.31 -0.47 -1.33 0.00 0.00 175.26 173.98 1n13 s TYR 110 N -1.78 -0.20 0.02 4.83 5.04 -0.30 -4.97 117.35 119.98 1n13 s TYR 110 Ca 0.05 0.35 -0.14 0.00 -2.44 0.00 0.00 57.07 54.89 1n13 s TYR 110 Cb -0.07 0.09 0.02 0.00 0.35 0.00 0.00 41.96 42.36 1n13 s TYR 110 CO 0.03 -0.35 0.30 -1.83 -1.34 0.00 0.00 175.55 172.36 1n13 s GLU 111 N -1.08 0.75 0.00 4.97 1.03 -1.26 -0.17 118.70 122.94 1n13 s GLU 111 Ca -0.11 -0.39 0.00 0.00 0.03 0.00 0.00 54.97 54.49 1n13 s GLU 111 Cb -0.05 0.33 0.00 0.00 -0.80 0.00 0.00 34.13 33.61 1n13 s GLU 111 CO 0.04 -0.23 0.00 0.41 -1.33 0.00 0.00 175.26 174.15 1n13 n GLY 112 N 0.84 0.63 3.49 -3.83 0.00 -0.49 -5.00 105.19 100.83 1n13 n GLY 112 Ca -0.20 -1.01 -0.44 0.00 0.00 0.00 0.00 46.02 44.37 1n13 n GLY 112 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n13 s LYS 113 N -2.00 4.05 0.26 1.61 1.02 -1.26 -1.04 119.74 122.38 1n13 s LYS 113 Ca 0.00 -2.42 -0.07 0.00 0.02 0.00 0.00 55.97 53.50 1n13 s LYS 113 Cb 0.00 -5.16 0.03 0.00 -0.52 0.00 0.00 37.83 32.18 1n13 s LYS 113 CO 0.00 -1.87 0.46 0.00 -0.92 0.00 0.00 175.35 173.02 1n13 s SER 115 N -2.41 5.23 0.20 0.00 1.04 -1.26 -3.76 113.70 112.73 1n13 s SER 115 Ca 0.14 0.91 -0.10 0.00 0.48 0.00 0.00 55.95 57.37 1n13 s SER 115 Cb -0.02 -1.67 0.14 0.00 0.10 0.00 0.00 66.02 64.57 1n13 s SER 115 CO 0.10 -1.42 1.84 0.50 0.98 0.00 0.00 173.24 175.24 1n13 h LYS 116 N -0.63 0.99 0.10 4.02 3.64 -1.92 -1.27 116.57 121.49 1n13 h LYS 116 Ca -0.45 -0.09 0.00 0.00 -1.27 0.00 0.00 60.65 58.84 1n13 h LYS 116 Cb 1.28 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 32.88 1n13 h LYS 116 CO 0.63 0.70 -0.08 -0.22 -2.27 0.00 0.00 179.45 178.22 1n13 h LYS 117 N 0.99 -0.18 -0.68 1.90 3.64 -1.96 -1.37 116.57 118.91 1n13 h LYS 117 Ca 0.26 0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.60 1n13 h LYS 117 Cb -0.03 0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 31.80 1n13 h LYS 117 CO -0.05 -0.12 0.23 1.49 -2.27 0.00 0.00 179.45 178.74 1n13 h GLU 118 N -0.18 1.03 -0.50 1.90 4.81 -1.88 -1.11 114.58 118.65 1n13 h GLU 118 Ca -0.00 -0.20 -0.03 0.00 -0.13 0.00 0.00 59.36 59.00 1n13 h GLU 118 Cb 0.17 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 1n13 h GLU 118 CO -0.01 0.87 0.18 0.00 -0.73 0.00 0.00 179.01 179.32 1n13 h ALA 119 N 1.25 0.65 -0.34 2.92 0.00 -1.00 -1.16 119.26 121.59 1n13 h ALA 119 Ca 0.22 -0.17 -0.10 0.00 0.00 0.00 0.00 54.91 54.87 1n13 h ALA 119 Cb 0.25 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1n13 h ALA 119 CO -0.01 0.28 -0.19 1.49 0.00 0.00 0.00 179.25 180.82 1n13 h GLU 120 N 0.66 0.72 -0.39 0.00 4.81 -1.05 -1.36 114.58 117.97 1n13 h GLU 120 Ca 0.16 -0.32 0.04 0.00 -0.13 0.00 0.00 59.36 59.10 1n13 h GLU 120 Cb 0.23 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.56 1n13 h GLU 120 CO -0.01 0.93 0.17 -0.22 -0.73 0.00 0.00 179.01 179.16 1n13 h LYS 121 N 0.50 0.35 -0.02 1.92 3.64 -1.11 -1.58 116.57 120.27 1n13 h LYS 121 Ca 0.07 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.43 1n13 h LYS 121 Cb 0.73 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 32.47 1n13 h LYS 121 CO 0.05 0.23 0.01 1.15 -2.27 0.00 0.00 179.45 178.62 1n13 h THR 122 N 0.36 1.12 -0.23 1.00 2.02 -1.12 -2.50 112.91 113.56 1n13 h THR 122 Ca 0.17 -0.36 -0.06 0.00 0.77 0.00 0.00 66.41 66.93 1n13 h THR 122 Cb 0.11 1.33 -0.01 0.00 -1.74 0.00 0.00 68.15 67.84 1n13 h THR 122 CO -0.14 0.09 -0.12 1.62 0.37 0.00 0.00 175.52 177.35 1n13 h VAL 123 N -0.12 1.20 -0.45 3.16 3.04 -1.11 -1.25 116.25 120.72 1n13 h VAL 123 Ca 0.01 -0.89 -0.07 0.00 -1.01 0.00 0.00 66.70 64.73 1n13 h VAL 123 Cb 0.15 1.16 -0.02 0.00 -2.01 0.00 0.00 31.29 30.57 1n13 h VAL 123 CO -0.00 0.29 -0.01 0.03 -1.01 0.00 0.00 177.57 176.87 1n13 h ARG 124 N 0.35 0.81 -0.55 4.17 3.08 -1.21 -2.30 114.38 118.73 1n13 h ARG 124 Ca 0.07 -0.26 -0.05 0.00 0.07 0.00 0.00 59.98 59.81 1n13 h ARG 124 Cb 0.42 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.38 1n13 h ARG 124 CO 0.02 0.87 0.12 1.49 -1.07 0.00 0.00 179.97 181.40 1n13 h GLU 125 N 0.65 0.85 -0.75 0.04 4.81 -0.99 -1.80 114.58 117.39 1n13 h GLU 125 Ca 0.13 -0.18 -0.05 0.00 -0.13 0.00 0.00 59.36 59.13 1n13 h GLU 125 Cb 0.51 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.73 1n13 h GLU 125 CO 0.02 0.77 0.26 0.52 -0.73 0.00 0.00 179.01 179.86 1n13 h MET 126 N 0.81 1.14 -0.41 1.92 2.86 -0.99 -0.47 114.93 119.79 1n13 h MET 126 Ca 0.18 -0.22 -0.11 0.00 -2.06 0.00 0.00 59.70 57.48 1n13 h MET 126 Cb 0.32 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.79 1n13 h MET 126 CO 0.00 0.94 -0.18 0.00 1.06 0.00 0.00 176.91 178.74 1n13 h ALA 127 N 1.18 0.58 -0.75 6.32 0.00 -1.04 -2.22 119.26 123.33 1n13 h ALA 127 Ca 0.25 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1n13 h ALA 127 Cb 0.26 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 1n13 h ALA 127 CO -0.01 0.52 0.45 -0.22 0.00 0.00 0.00 179.25 179.99 1n13 h LYS 128 N 0.66 1.02 -0.62 0.00 3.64 -0.99 -1.99 116.57 118.28 1n13 h LYS 128 Ca 0.09 -0.09 -0.03 0.00 -1.27 0.00 0.00 60.65 59.36 1n13 h LYS 128 Cb 0.73 -0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 32.31 1n13 h LYS 128 CO 0.06 0.72 0.28 0.82 -2.27 0.00 0.00 179.45 179.06 1n13 h ILE 129 N 1.02 1.21 -0.74 2.00 2.04 -0.94 -0.43 117.51 121.67 1n13 h ILE 129 Ca 0.27 -0.60 -0.05 0.00 1.00 0.00 0.00 64.86 65.48 1n13 h ILE 129 Cb -0.04 0.43 -0.03 0.00 -0.74 0.00 0.00 36.82 36.44 1n13 h ILE 129 CO -0.05 0.25 0.28 1.23 0.00 0.00 0.00 178.15 179.86 1n13 h GLY 130 N 0.97 1.20 1.81 5.37 0.00 -0.74 -0.35 103.07 111.33 1n13 h GLY 130 Ca 0.22 -0.66 -0.14 0.00 0.00 0.00 0.00 47.33 46.75 1n13 h GLY 130 CO -0.03 0.62 -0.57 0.74 0.00 0.00 0.00 176.54 177.31 1n13 h PHE 131 N 1.09 0.26 -0.51 5.60 -1.00 -0.85 -2.72 116.94 118.80 1n13 h PHE 131 Ca 0.25 -0.09 -0.05 0.00 2.81 0.00 0.00 57.97 60.88 1n13 h PHE 131 Cb 0.23 -0.05 -0.02 0.00 3.61 0.00 0.00 35.95 39.72 1n13 h PHE 131 CO 0.02 0.72 0.12 1.49 -1.61 0.00 0.00 178.31 179.05 1n13 h GLU 132 N 0.16 0.82 0.00 1.51 4.81 -0.43 0.26 114.58 121.71 1n13 h GLU 132 Ca -0.00 -0.20 -0.04 0.00 -0.13 0.00 0.00 59.36 58.98 1n13 h GLU 132 Cb 1.05 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.32 1n13 h GLU 132 CO 0.09 0.80 -0.20 0.52 -0.73 0.00 0.00 179.01 179.48 1n13 h MET 133 N 0.71 0.00 0.00 1.92 2.86 -0.95 -2.43 114.93 117.03 1n13 h MET 133 Ca 0.16 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.76 1n13 h MET 133 Cb 0.35 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.00 1n13 h MET 133 CO 0.00 0.20 -1.12 0.54 1.06 0.00 0.00 176.91 177.59 1n13 n ARG 134 N -4.25 0.61 -2.16 1.72 1.74 -0.99 -4.97 116.66 108.36 1n13 n ARG 134 Ca -0.02 0.15 -0.03 0.00 -0.77 0.00 0.00 57.85 57.18 1n13 n ARG 134 Cb 0.26 -1.82 0.00 0.00 -1.02 0.00 0.00 32.46 29.88 1n13 n ARG 134 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1n13 n GLY 135 N 1.24 0.37 3.84 -0.13 0.00 0.79 -5.04 105.19 106.25 1n13 n GLY 135 Ca -0.03 -0.74 -0.37 0.00 0.00 0.00 0.00 46.02 44.89 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 -2.30 3.56 0.23 1.61 0.51 -0.40 -5.03 118.94 117.13 1n13 s TRP 136 Ca 0.01 0.53 -0.30 0.00 -2.12 0.00 0.00 56.10 54.22 1n13 s TRP 136 Cb -0.01 -2.03 -0.09 0.00 -0.81 0.00 0.00 33.47 30.53 1n13 s TRP 136 CO 0.02 0.61 1.23 -2.00 -0.51 0.00 0.00 176.95 176.29 1n13 s GLU 137 N -0.66 4.47 -0.12 4.98 2.12 -1.26 -4.68 118.70 123.55 1n13 s GLU 137 Ca 0.14 1.97 -0.14 0.00 0.36 0.00 0.00 54.97 57.30 1n13 s GLU 137 Cb -0.12 -3.19 -0.05 0.00 0.26 0.00 0.00 34.13 31.03 1n13 s GLU 137 CO 0.03 -0.09 0.33 -1.17 -0.54 0.00 0.00 175.26 173.82 1n13 s LEU 138 N -0.70 4.30 -0.16 2.70 2.96 -1.26 -2.03 118.68 124.49 1n13 s LEU 138 Ca 0.52 0.63 -0.13 0.00 -0.22 0.00 0.00 54.13 54.92 1n13 s LEU 138 Cb -0.35 -2.43 -0.09 0.00 0.50 0.00 0.00 46.19 43.83 1n13 s LEU 138 CO 0.41 0.15 -0.04 -0.78 -1.32 0.00 0.00 176.35 174.77 1n13 h ASP 139 N 6.17 0.00 -5.26 3.68 -0.00 -0.96 -3.42 116.42 116.63 1n13 h ASP 139 Ca -0.44 -0.18 0.22 0.00 -0.00 0.00 0.00 57.03 56.63 1n13 h ASP 139 Cb 1.18 0.00 -0.11 0.00 -0.00 0.00 0.00 39.33 40.40 1n13 h ASP 139 CO 0.71 1.01 0.63 0.00 -0.00 0.00 0.00 179.24 181.59 1n13 s ARG 140 N -2.27 0.80 -0.11 0.28 1.70 -1.15 -5.01 118.95 113.19 1n13 s ARG 140 Ca -0.19 -0.42 0.02 0.00 -0.47 0.00 0.00 55.73 54.67 1n13 s ARG 140 Cb 0.03 0.29 0.01 0.00 -0.57 0.00 0.00 34.95 34.72 1n13 s ARG 140 CO 0.35 -0.37 -0.16 0.42 -1.08 0.00 0.00 175.30 174.46 1n13 s ILE 141 N -2.91 1.56 -0.09 4.99 1.01 -1.26 -0.77 121.20 123.74 1n13 s ILE 141 Ca 0.11 -0.68 -0.02 0.00 0.00 0.00 0.00 60.65 60.06 1n13 s ILE 141 Cb 0.01 -1.42 -0.03 0.00 0.01 0.00 0.00 42.46 41.02 1n13 s ILE 141 CO -0.02 0.45 0.00 -1.61 0.00 0.00 0.00 174.94 173.77 1n13 s GLU 142 N 0.97 3.02 0.14 2.79 2.02 -0.59 -4.94 118.70 122.09 1n13 s GLU 142 Ca -0.07 -0.40 -0.16 0.00 0.02 0.00 0.00 54.97 54.36 1n13 s GLU 142 Cb -0.15 -2.81 0.03 0.00 0.10 0.00 0.00 34.13 31.30 1n13 s GLU 142 CO -0.02 0.69 0.41 -1.54 0.02 0.00 0.00 175.26 174.83 1n13 s SER 143 N -0.85 -0.22 0.00 -0.19 1.04 -1.26 -0.71 113.70 111.51 1n13 s SER 143 Ca 0.13 -0.38 -0.14 0.00 0.48 0.00 0.00 55.95 56.04 1n13 s SER 143 Cb -0.11 0.49 0.02 0.00 0.10 0.00 0.00 66.02 66.51 1n13 s SER 143 CO 0.02 -0.89 0.30 0.27 0.98 0.00 0.00 173.24 173.92 1n13 s ILE 144 N -3.83 0.07 0.14 -1.02 -4.36 -0.73 -5.02 121.20 106.46 1n13 s ILE 144 Ca 0.05 -0.55 -0.05 0.00 -0.26 0.00 0.00 60.65 59.83 1n13 s ILE 144 Cb 0.02 -0.71 -0.02 0.00 1.25 0.00 0.00 42.46 43.00 1n13 s ILE 144 CO -0.10 -0.30 0.16 0.00 0.24 0.00 0.00 174.94 174.94 1n13 s ALA 145 N -1.70 0.38 -0.06 2.27 0.00 -1.26 -1.21 121.76 120.17 1n13 s ALA 145 Ca -0.11 -1.13 -0.13 0.00 0.00 0.00 0.00 51.96 50.59 1n13 s ALA 145 Cb -0.04 0.80 0.03 0.00 0.00 0.00 0.00 23.12 23.90 1n13 s ALA 145 CO 0.02 -0.55 0.30 0.54 0.00 0.00 0.00 175.76 176.07 1n13 s VAL 146 N -3.99 0.03 0.16 0.00 0.11 -0.47 -5.00 120.40 111.25 1n13 s VAL 146 Ca 0.18 -0.28 0.08 0.00 -2.93 0.00 0.00 61.98 59.04 1n13 s VAL 146 Cb 0.05 -0.53 -0.04 0.00 -1.53 0.00 0.00 36.38 34.33 1n13 s VAL 146 CO -0.01 -0.15 -0.17 -1.83 -3.33 0.00 0.00 175.10 169.61 1n13 s GLU 147 N -0.66 1.24 -0.07 1.54 -1.05 -1.26 -1.67 118.70 116.76 1n13 s GLU 147 Ca -0.08 -1.40 -0.04 0.00 -0.15 0.00 0.00 54.97 53.31 1n13 s GLU 147 Cb -0.04 -1.24 0.03 0.00 -0.44 0.00 0.00 34.13 32.45 1n13 s GLU 147 CO 0.02 0.24 0.17 -1.58 0.95 0.00 0.00 175.26 175.07 1n13 s HIS 148 N -2.15 -0.20 -0.36 4.83 2.46 0.12 -4.98 115.29 115.01 1n13 s HIS 148 Ca 0.15 0.54 -0.14 0.00 0.47 0.00 0.00 55.06 56.08 1n13 s HIS 148 Cb -0.05 -0.02 -0.00 0.00 -0.13 0.00 0.00 32.58 32.37 1n13 s HIS 148 CO 0.06 -0.16 0.31 0.99 -2.47 0.00 0.00 174.74 173.47 1n13 s THR 149 N 0.93 5.22 0.19 0.89 2.01 -1.26 -0.68 115.64 122.94 1n13 s THR 149 Ca -0.07 -0.23 -0.32 0.00 0.31 0.00 0.00 61.69 61.38 1n13 s THR 149 Cb -0.09 -3.82 -0.11 0.00 0.01 0.00 0.00 72.50 68.49 1n13 s THR 149 CO -0.05 -0.14 1.62 -0.69 -0.69 0.00 0.00 174.62 174.67 1n13 s VAL 150 N 1.85 2.38 -0.25 3.82 1.01 0.06 -4.88 120.40 124.39 1n13 s VAL 150 Ca 0.08 0.28 -0.16 0.00 0.00 0.00 0.00 61.98 62.18 1n13 s VAL 150 Cb -0.17 -3.18 -0.12 0.00 0.00 0.00 0.00 36.38 32.91 1n13 s VAL 150 CO 0.11 0.02 -0.25 -0.62 0.00 0.00 0.00 175.10 174.36 1n13 n GLU 151 N 3.83 0.57 0.01 2.72 1.02 -1.26 -0.20 120.64 127.33 1n13 n GLU 151 Ca 0.14 0.32 0.00 0.00 -0.02 0.00 0.00 57.16 57.60 1n13 n GLU 151 Cb 0.37 -1.53 0.00 0.00 -0.02 0.00 0.00 31.44 30.26 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 -4.32 0.00 -3.28 3.49 4.81 -1.26 -4.48 118.16 113.12 1n13 n LYS 152 Ca -0.44 0.00 -0.01 0.00 -0.87 0.00 0.00 58.31 56.98 1n13 n LYS 152 Cb 0.79 -0.15 -0.04 0.00 0.02 0.00 0.00 35.03 35.65 1n13 n LYS 152 CO 0.00 0.00 0.00 -1.17 1.17 0.00 0.00 177.40 177.40 1n13 s LEU 153 N -5.47 -1.08 0.25 3.14 2.96 -1.26 -4.36 118.68 112.86 1n13 s LEU 153 Ca 0.00 0.71 0.05 0.00 -0.22 0.00 0.00 54.13 54.67 1n13 s LEU 153 Cb 0.00 1.78 -0.05 0.00 0.50 0.00 0.00 46.19 48.42 1n13 s LEU 153 CO 0.00 -0.27 -0.03 -0.83 -1.32 0.00 0.00 176.35 173.90 1n13 s GLY 154 N 2.74 1.68 -0.01 7.98 0.00 -0.33 -4.98 107.32 114.41 1n13 s GLY 154 Ca 0.15 -1.83 0.00 0.00 0.00 0.00 0.00 44.72 43.05 1n13 s GLY 154 CO -0.19 -1.75 -0.00 0.00 0.00 0.00 0.00 173.10 171.16 1n13 s ALA 156 N 0.51 2.88 -0.04 0.00 0.00 -0.44 -4.95 121.76 119.72 1n13 s ALA 156 Ca -0.05 -0.89 -0.04 0.00 0.00 0.00 0.00 51.96 50.99 1n13 s ALA 156 Cb -0.07 -1.26 0.01 0.00 0.00 0.00 0.00 23.12 21.80 1n13 s ALA 156 CO -0.01 0.44 0.11 0.12 0.00 0.00 0.00 175.76 176.42 1n13 s PHE 157 N -0.36 -0.12 -0.01 0.00 5.36 -1.26 -1.63 117.98 119.96 1n13 s PHE 157 Ca 0.05 0.31 -0.01 0.00 -0.96 0.00 0.00 56.93 56.31 1n13 s PHE 157 Cb -0.12 0.02 0.00 0.00 -0.34 0.00 0.00 43.02 42.58 1n13 s PHE 157 CO 0.02 -0.07 0.04 0.00 -1.46 0.00 0.00 175.22 173.75 1n13 s ALA 158 N 0.20 -0.09 0.12 11.12 0.00 -0.72 -4.83 121.76 127.56 1n13 s ALA 158 Ca -0.01 0.09 -0.14 0.00 0.00 0.00 0.00 51.96 51.90 1n13 s ALA 158 Cb -0.02 -0.06 0.02 0.00 0.00 0.00 0.00 23.12 23.07 1n13 s ALA 158 CO -0.01 -0.02 0.35 0.00 0.00 0.00 0.00 175.76 176.08 1n13 s ALA 159 N -0.02 -0.69 -0.25 0.00 0.00 -1.26 -1.03 121.76 118.51 1n13 s ALA 159 Ca -0.00 -0.26 0.02 0.00 0.00 0.00 0.00 51.96 51.71 1n13 s ALA 159 Cb -0.00 0.66 0.06 0.00 0.00 0.00 0.00 23.12 23.83 1n13 s ALA 159 CO 0.00 -0.62 -0.08 0.00 0.00 0.00 0.00 175.76 175.07 1n13 s ALA 160 N -3.83 2.22 -0.23 0.00 0.00 0.31 -4.97 121.76 115.26 1n13 s ALA 160 Ca 0.05 -1.54 -0.12 0.00 0.00 0.00 0.00 51.96 50.35 1n13 s ALA 160 Cb 0.03 -1.50 -0.05 0.00 0.00 0.00 0.00 23.12 21.60 1n13 s ALA 160 CO -0.10 -1.20 0.23 0.00 0.00 0.00 0.00 175.76 174.69 1n13 s ALA 161 N 1.27 3.60 -0.15 0.00 0.00 -1.26 -1.52 121.76 123.69 1n13 s ALA 161 Ca -0.07 -0.77 -0.17 0.00 0.00 0.00 0.00 51.96 50.95 1n13 s ALA 161 Cb -0.19 -2.42 -0.04 0.00 0.00 0.00 0.00 23.12 20.47 1n13 s ALA 161 CO -0.06 -0.22 0.44 -0.51 0.00 0.00 0.00 175.76 175.41 1n13 s LEU 162 N 1.13 4.23 0.00 0.00 1.02 -0.13 -5.03 118.68 119.90 1n13 s LEU 162 Ca 0.11 0.70 0.00 0.00 0.02 0.00 0.00 54.13 54.96 1n13 s LEU 162 Cb -0.14 -2.62 0.00 0.00 0.02 0.00 0.00 46.19 43.45 1n13 s LEU 162 CO 0.05 -0.02 0.00 1.87 0.02 0.00 0.00 176.35 178.27 1n13 n TRP 163 N 3.93 0.00 -4.32 0.29 -0.00 -1.26 -4.05 117.44 112.03 1n13 n TRP 163 Ca -0.08 0.00 -0.23 0.00 -0.00 0.00 0.00 57.50 57.19 1n13 n TRP 163 Cb 0.51 0.00 -0.13 0.00 -0.00 0.00 0.00 31.31 31.70 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 -0.83 1.66 -2.00 5.87 2.02 -1.26 -5.11 117.35 117.70 1n13 s TYR 164 Ca 0.00 -0.42 0.09 0.00 -0.37 0.00 0.00 57.07 56.37 1n13 s TYR 164 Cb 0.00 -0.93 0.53 0.00 -0.40 0.00 0.00 41.96 41.17 1n13 s TYR 164 CO 0.00 0.15 0.98 1.63 -1.57 0.00 0.00 175.55 176.75