#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yze n ARG 66 N 0.00 0.80 0.10 -2.67 1.85 -1.26 -4.12 116.66 111.35 1yze n ARG 66 Ca 0.00 0.29 0.13 0.00 -1.00 0.00 0.00 57.85 57.27 1yze n ARG 66 Cb 0.00 -1.63 0.42 0.00 -1.05 0.00 0.00 32.46 30.19 1yze n ARG 66 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 177.63 176.49 1yze n SER 67 N 1.14 0.78 -3.85 2.89 3.41 -1.26 -1.43 113.62 115.30 1yze n SER 67 Ca 0.11 0.58 -0.09 0.00 -0.26 0.00 0.00 58.87 59.21 1yze n SER 67 Cb 0.37 -0.79 -0.04 0.00 -0.26 0.00 0.00 64.21 63.50 1yze n SER 67 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 1yze s GLU 68 N -3.11 1.52 -0.09 4.33 -1.05 -1.26 -1.81 118.70 117.23 1yze s GLU 68 Ca 0.10 -1.02 -0.30 0.00 -0.15 0.00 0.00 54.97 53.60 1yze s GLU 68 Cb 0.12 0.52 0.12 0.00 -0.44 0.00 0.00 34.13 34.45 1yze s GLU 68 CO 0.58 -0.65 0.99 0.00 0.95 0.00 0.00 175.26 177.12 1yze s ALA 69 N -3.93 -1.91 -0.12 -0.84 0.00 -0.60 -5.01 121.76 109.35 1yze s ALA 69 Ca 0.14 1.32 0.02 0.00 0.00 0.00 0.00 51.96 53.44 1yze s ALA 69 Cb -0.02 -0.07 0.01 0.00 0.00 0.00 0.00 23.12 23.04 1yze s ALA 69 CO 0.03 -0.54 -0.20 0.99 0.00 0.00 0.00 175.76 176.04 1yze s THR 70 N -2.31 1.85 0.01 0.00 2.01 -1.26 -1.16 115.64 114.78 1yze s THR 70 Ca 0.04 -0.86 -0.03 0.00 0.31 0.00 0.00 61.69 61.15 1yze s THR 70 Cb -0.01 -1.65 -0.01 0.00 0.01 0.00 0.00 72.50 70.84 1yze s THR 70 CO -0.05 0.51 0.04 0.72 -0.69 0.00 0.00 174.62 175.16 1yze s PHE 71 N 0.83 0.17 0.08 4.92 -0.71 -0.65 -4.98 117.98 117.65 1yze s PHE 71 Ca -0.08 -0.38 0.04 0.00 -1.04 0.00 0.00 56.93 55.47 1yze s PHE 71 Cb -0.16 -0.13 -0.03 0.00 -1.21 0.00 0.00 43.02 41.49 1yze s PHE 71 CO -0.01 -0.24 -0.12 1.14 -1.34 0.00 0.00 175.22 174.65 1yze s GLN 72 N -1.53 0.82 -0.09 1.99 -2.07 -1.26 0.21 119.66 117.73 1yze s GLN 72 Ca -0.15 -1.03 -0.00 0.00 -1.82 0.00 0.00 55.36 52.36 1yze s GLN 72 Cb -0.08 -0.67 0.02 0.00 -1.09 0.00 0.00 33.01 31.19 1yze s GLN 72 CO -0.00 0.13 -0.05 0.12 -1.32 0.00 0.00 175.29 174.17 1yze s PHE 73 N -1.79 1.10 -0.18 9.60 5.36 0.95 -4.93 117.98 128.09 1yze s PHE 73 Ca 0.01 -0.45 -0.18 0.00 -0.96 0.00 0.00 56.93 55.35 1yze s PHE 73 Cb -0.07 -0.99 -0.04 0.00 -0.34 0.00 0.00 43.02 41.58 1yze s PHE 73 CO 0.01 -0.39 0.48 0.99 -1.46 0.00 0.00 175.22 174.85 1yze s THR 74 N 1.61 5.15 -0.29 0.12 2.01 -1.26 -1.69 115.64 121.29 1yze s THR 74 Ca 0.01 0.89 -0.09 0.00 0.31 0.00 0.00 61.69 62.81 1yze s THR 74 Cb -0.13 -3.81 -0.02 0.00 0.01 0.00 0.00 72.50 68.56 1yze s THR 74 CO -0.05 0.23 0.14 -0.69 -0.69 0.00 0.00 174.62 173.55 1yze s VAL 75 N 1.34 4.62 0.56 3.82 1.01 -0.17 -4.95 120.40 126.63 1yze s VAL 75 Ca 0.23 -0.28 -0.06 0.00 0.00 0.00 0.00 61.98 61.87 1yze s VAL 75 Cb -0.15 -3.29 -0.01 0.00 0.00 0.00 0.00 36.38 32.93 1yze s VAL 75 CO 0.09 0.16 0.89 -1.61 0.00 0.00 0.00 175.10 174.63 1yze s GLU 76 N 1.63 3.20 -0.99 2.72 0.41 -1.26 -2.09 118.70 122.32 1yze s GLU 76 Ca 0.05 0.17 0.00 0.00 -0.41 0.00 0.00 54.97 54.78 1yze s GLU 76 Cb -0.16 -2.27 0.00 0.00 -1.78 0.00 0.00 34.13 29.91 1yze s GLU 76 CO 0.06 -0.54 0.00 -2.13 -0.49 0.00 0.00 175.26 172.17 1yze n ARG 77 N -2.51 -2.05 -1.65 1.61 0.00 -1.26 -4.95 116.66 105.85 1yze n ARG 77 Ca 0.03 0.56 -0.45 0.00 -0.00 0.00 0.00 57.85 57.99 1yze n ARG 77 Cb 0.56 -5.05 -0.04 0.00 0.00 0.00 0.00 32.46 27.93 1yze n ARG 77 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 1yze n PHE 78 N -2.91 2.29 0.00 -0.14 7.35 -1.25 -5.03 117.46 117.77 1yze n PHE 78 Ca -0.12 -0.14 0.00 0.00 -0.76 0.00 0.00 57.45 56.42 1yze n PHE 78 Cb 0.54 -2.72 0.00 0.00 0.35 0.00 0.00 39.48 37.65 1yze n PHE 78 CO 0.00 0.00 0.00 1.33 -0.76 0.00 0.00 176.76 177.33 1yze n VAL 85 N 5.85 0.00 -4.47 -2.13 0.24 -1.26 -5.08 118.33 111.49 1yze n VAL 85 Ca 0.24 -0.26 -0.22 0.00 -2.04 0.00 0.00 64.34 62.06 1yze n VAL 85 Cb 0.35 0.78 -0.11 0.00 -1.47 0.00 0.00 33.84 33.40 1yze n VAL 85 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1yze s LEU 86 N -1.96 2.35 0.42 1.34 1.43 -1.26 -0.86 118.68 120.15 1yze s LEU 86 Ca 0.00 -1.33 0.07 0.00 -1.03 0.00 0.00 54.13 51.84 1yze s LEU 86 Cb 0.00 -0.51 -0.07 0.00 0.03 0.00 0.00 46.19 45.64 1yze s LEU 86 CO 0.00 -0.52 0.05 -0.94 0.23 0.00 0.00 176.35 175.16 1yze s SER 87 N -3.50 4.01 0.91 2.29 1.04 -0.93 -4.97 113.70 112.54 1yze s SER 87 Ca 0.34 -1.34 -0.11 0.00 0.48 0.00 0.00 55.95 55.33 1yze s SER 87 Cb 0.08 -0.32 0.14 0.00 0.10 0.00 0.00 66.02 66.01 1yze s SER 87 CO 0.15 -0.51 1.10 -2.84 0.98 0.00 0.00 173.24 172.12 1yze s PRO 88 N -3.77 1.13 0.47 4.02 0.02 -1.26 -4.65 135.00 130.97 1yze s PRO 88 Ca 0.34 1.21 -0.21 0.00 0.02 0.00 0.00 61.00 62.35 1yze s PRO 88 Cb 0.08 -1.77 -0.08 0.00 0.02 0.00 0.00 34.50 32.76 1yze s PRO 88 CO 0.18 -2.44 1.08 -1.25 -0.33 0.00 0.00 177.00 174.24 1yze s PRO 89 N -4.75 3.79 -0.25 5.54 0.04 -1.26 -4.72 135.00 133.39 1yze s PRO 89 Ca 0.65 1.53 0.00 0.00 0.04 0.00 0.00 61.00 63.21 1yze s PRO 89 Cb -0.21 -2.24 0.07 0.00 0.04 0.00 0.00 34.50 32.17 1yze s PRO 89 CO 0.58 -0.47 -0.00 0.00 0.04 0.00 0.00 177.00 177.15 1yze s PHE 91 N 1.48 3.77 -0.10 0.00 0.40 -1.25 -1.05 117.98 121.23 1yze s PHE 91 Ca -0.01 1.74 -0.05 0.00 -0.60 0.00 0.00 56.93 58.02 1yze s PHE 91 Cb -0.18 -3.05 0.05 0.00 0.51 0.00 0.00 43.02 40.35 1yze s PHE 91 CO -0.10 0.16 0.23 0.08 0.70 0.00 0.00 175.22 176.30 1yze s VAL 92 N 0.23 -0.05 -1.51 -0.44 1.01 -0.48 -4.74 120.40 114.41 1yze s VAL 92 Ca 0.47 0.16 0.00 0.00 0.00 0.00 0.00 61.98 62.61 1yze s VAL 92 Cb -0.22 -0.37 0.00 0.00 0.00 0.00 0.00 36.38 35.79 1yze s VAL 92 CO 0.29 0.06 0.00 0.54 0.00 0.00 0.00 175.10 175.99 1yze n ARG 93 N 4.27 -1.14 -0.90 2.72 5.12 -0.51 -2.10 116.66 124.10 1yze n ARG 93 Ca -0.25 0.92 0.00 0.00 -1.93 0.00 0.00 57.85 56.59 1yze n ARG 93 Cb 0.53 -5.16 0.00 0.00 -1.16 0.00 0.00 32.46 26.66 1yze n ARG 93 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 1yze n ASN 94 N -0.69 -0.76 -4.86 0.55 4.13 -1.26 -4.82 115.26 107.55 1yze n ASN 94 Ca -0.17 0.00 -0.30 0.00 1.68 0.00 0.00 54.58 55.79 1yze n ASN 94 Cb 0.56 -0.73 -0.05 0.00 -1.54 0.00 0.00 39.78 38.02 1yze n ASN 94 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1yze s LEU 95 N 0.00 4.10 -0.29 3.41 1.43 -0.89 -5.00 118.68 121.43 1yze s LEU 95 Ca 0.00 0.13 -0.24 0.00 -1.03 0.00 0.00 54.13 52.98 1yze s LEU 95 Cb 0.00 -2.73 0.00 0.00 0.03 0.00 0.00 46.19 43.49 1yze s LEU 95 CO 0.00 0.16 0.84 -2.16 0.23 0.00 0.00 176.35 175.41 1yze s PRO 96 N -2.54 4.02 -0.01 1.29 0.04 -1.26 -1.39 135.00 135.15 1yze s PRO 96 Ca 0.32 0.73 -0.00 0.00 0.04 0.00 0.00 61.00 62.09 1yze s PRO 96 Cb -0.12 -3.71 -0.04 0.00 0.04 0.00 0.00 34.50 30.67 1yze s PRO 96 CO 0.25 -0.68 0.05 -1.58 0.04 0.00 0.00 177.00 175.09 1yze s TRP 97 N 3.03 3.22 0.02 0.56 0.52 -0.21 -1.21 118.94 124.87 1yze s TRP 97 Ca 0.35 0.18 -0.02 0.00 0.02 0.00 0.00 56.10 56.62 1yze s TRP 97 Cb -0.14 -1.73 -0.02 0.00 -1.15 0.00 0.00 33.47 30.43 1yze s TRP 97 CO 0.12 0.52 0.01 0.15 0.02 0.00 0.00 176.95 177.78 1yze s LYS 98 N -1.59 0.41 -0.11 4.98 1.02 0.59 -0.16 119.74 124.89 1yze s LYS 98 Ca 0.21 -0.67 -0.12 0.00 0.02 0.00 0.00 55.97 55.40 1yze s LYS 98 Cb -0.12 0.15 -0.05 0.00 -0.52 0.00 0.00 37.83 37.30 1yze s LYS 98 CO 0.11 -0.08 0.28 0.42 -0.92 0.00 0.00 175.35 175.17 1yze s ILE 99 N -1.91 5.28 -0.14 2.17 1.01 -1.26 0.42 121.20 126.78 1yze s ILE 99 Ca -0.11 0.54 0.01 0.00 0.00 0.00 0.00 60.65 61.09 1yze s ILE 99 Cb -0.06 -3.60 0.02 0.00 0.01 0.00 0.00 42.46 38.83 1yze s ILE 99 CO -0.02 0.50 -0.17 -0.04 0.00 0.00 0.00 174.94 175.20 1yze s MET 100 N -0.30 2.57 -0.05 2.79 -1.94 0.57 -2.20 119.30 120.74 1yze s MET 100 Ca 0.18 -0.68 0.04 0.00 -1.71 0.00 0.00 55.69 53.52 1yze s MET 100 Cb -0.14 -2.20 -0.00 0.00 2.01 0.00 0.00 34.83 34.50 1yze s MET 100 CO 0.06 -0.12 -0.17 0.14 -0.01 0.00 0.00 175.02 174.92 1yze s VAL 101 N 1.13 1.45 -0.08 -6.03 -7.23 -0.04 -0.69 120.40 108.91 1yze s VAL 101 Ca -0.02 -0.72 -0.30 0.00 -1.81 0.00 0.00 61.98 59.14 1yze s VAL 101 Cb -0.14 -1.25 0.11 0.00 0.56 0.00 0.00 36.38 35.65 1yze s VAL 101 CO -0.06 0.42 0.88 0.00 -0.31 0.00 0.00 175.10 176.02 1yze s MET 102 N 0.08 0.79 -0.03 4.82 0.23 -0.47 -4.58 119.30 120.14 1yze s MET 102 Ca -0.05 0.05 -0.30 0.00 -1.03 0.00 0.00 55.69 54.36 1yze s MET 102 Cb -0.12 0.37 -0.05 0.00 -1.53 0.00 0.00 34.83 33.50 1yze s MET 102 CO 0.03 -0.28 1.45 -1.25 -2.03 0.00 0.00 175.02 172.93 1yze s PRO 103 N -1.69 4.25 -0.20 3.16 0.04 -1.26 0.17 135.00 139.47 1yze s PRO 103 Ca -0.02 1.99 -0.01 0.00 0.04 0.00 0.00 61.00 63.00 1yze s PRO 103 Cb -0.00 -3.68 -0.01 0.00 0.04 0.00 0.00 34.50 30.84 1yze s PRO 103 CO 0.01 -0.66 0.17 0.54 0.04 0.00 0.00 177.00 177.10 1yze n ARG 104 N 5.90 -0.70 -2.35 4.56 1.74 -1.26 -4.80 116.66 119.75 1yze n ARG 104 Ca 0.14 0.15 -0.39 0.00 -0.77 0.00 0.00 57.85 56.99 1yze n ARG 104 Cb 0.43 -2.59 -0.03 0.00 -1.02 0.00 0.00 32.46 29.25 1yze n ARG 104 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1yze s VAL 115 N -3.07 3.24 0.07 1.55 0.11 0.57 -4.59 120.40 118.28 1yze s VAL 115 Ca 0.05 1.12 -0.20 0.00 -2.93 0.00 0.00 61.98 60.03 1yze s VAL 115 Cb -0.01 -3.67 -0.07 0.00 -1.53 0.00 0.00 36.38 31.11 1yze s VAL 115 CO 0.13 0.17 0.58 -0.83 -3.33 0.00 0.00 175.10 171.82 1yze s GLY 116 N -1.01 2.67 -0.29 6.54 0.00 0.44 -1.46 107.32 114.21 1yze s GLY 116 Ca 0.52 0.05 -0.03 0.00 0.00 0.00 0.00 44.72 45.26 1yze s GLY 116 CO 0.40 0.52 0.19 -0.12 0.00 0.00 0.00 173.10 174.08 1yze s PHE 117 N -0.98 0.06 0.23 1.90 5.36 0.11 -1.36 117.98 123.29 1yze s PHE 117 Ca 0.29 -0.65 0.11 0.00 -0.96 0.00 0.00 56.93 55.72 1yze s PHE 117 Cb -0.19 -0.75 -0.05 0.00 -0.34 0.00 0.00 43.02 41.69 1yze s PHE 117 CO 0.19 -0.86 -0.18 -0.06 -1.46 0.00 0.00 175.22 172.85 1yze s PHE 118 N 2.17 2.39 -0.18 10.12 0.40 0.13 -2.64 117.98 130.37 1yze s PHE 118 Ca 0.09 -0.31 -0.07 0.00 -0.60 0.00 0.00 56.93 56.04 1yze s PHE 118 Cb -0.15 -1.12 -0.04 0.00 0.51 0.00 0.00 43.02 42.21 1yze s PHE 118 CO -0.35 0.59 0.06 -1.17 0.70 0.00 0.00 175.22 175.05 1yze s LEU 119 N -3.07 3.83 -0.00 -0.37 2.96 0.72 -0.32 118.68 122.44 1yze s LEU 119 Ca 0.25 0.09 0.04 0.00 -0.22 0.00 0.00 54.13 54.30 1yze s LEU 119 Cb -0.07 -1.97 -0.03 0.00 0.50 0.00 0.00 46.19 44.62 1yze s LEU 119 CO 0.13 0.18 -0.12 -1.58 -1.32 0.00 0.00 176.35 173.64 1yze s GLN 120 N 0.31 2.40 -0.04 1.98 0.74 0.17 -1.17 119.66 124.05 1yze s GLN 120 Ca 0.04 -0.78 0.00 0.00 0.05 0.00 0.00 55.36 54.67 1yze s GLN 120 Cb -0.12 -2.38 0.02 0.00 1.10 0.00 0.00 33.01 31.64 1yze s GLN 120 CO 0.00 0.59 -0.02 0.00 -0.55 0.00 0.00 175.29 175.31 1yze n ASN 122 N 4.25 -2.85 0.22 0.00 4.05 -0.35 -4.78 115.26 115.81 1yze n ASN 122 Ca -0.22 -0.97 0.10 0.00 0.45 0.00 0.00 54.58 53.94 1yze n ASN 122 Cb 0.51 -3.02 0.47 0.00 1.23 0.00 0.00 39.78 38.96 1yze n ASN 122 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1yze h ALA 123 N 0.91 1.02 -0.12 5.20 0.00 -1.90 -3.25 119.26 121.11 1yze h ALA 123 Ca -0.60 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.10 1yze h ALA 123 Cb 1.38 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.13 1yze h ALA 123 CO 0.73 0.26 -0.01 0.93 0.00 0.00 0.00 179.25 181.16 1yze h GLU 124 N 0.00 0.22 -6.30 0.00 4.39 -1.94 -3.46 114.58 107.49 1yze h GLU 124 Ca -0.00 -0.08 -0.57 0.00 0.34 0.00 0.00 59.36 59.05 1yze h GLU 124 Cb 0.74 -0.02 0.19 0.00 -0.10 0.00 0.00 28.75 29.56 1yze h GLU 124 CO 0.03 0.48 -0.93 0.45 -1.16 0.00 0.00 179.01 177.88 1yze n SER 125 N -4.77 -2.94 -0.54 1.42 2.88 -1.23 -4.88 113.62 103.56 1yze n SER 125 Ca -0.06 0.54 0.05 0.00 -1.33 0.00 0.00 58.87 58.08 1yze n SER 125 Cb 0.22 -1.00 0.11 0.00 -0.75 0.00 0.00 64.21 62.79 1yze n SER 125 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1yze n ASP 126 N 1.40 2.58 -4.81 -3.46 5.68 -1.26 -4.98 116.55 111.70 1yze n ASP 126 Ca 0.07 -1.84 -0.34 0.00 -0.50 0.00 0.00 54.79 52.18 1yze n ASP 126 Cb 0.50 -0.16 -0.07 0.00 -1.14 0.00 0.00 41.12 40.26 1yze n ASP 126 CO 0.00 0.00 0.00 -0.55 -1.33 0.00 0.00 177.20 175.32 1yze s SER 127 N -0.96 7.03 0.00 -1.12 0.15 -1.26 -5.00 113.70 112.53 1yze s SER 127 Ca 0.19 1.66 0.00 0.00 0.70 0.00 0.00 55.95 58.50 1yze s SER 127 Cb 0.10 -2.52 0.00 0.00 -1.71 0.00 0.00 66.02 61.89 1yze s SER 127 CO 0.14 -0.24 0.26 1.07 1.20 0.00 0.00 173.24 175.67 1yze n THR 128 N -0.22 0.00 0.76 6.45 5.66 -1.26 -4.77 114.28 120.91 1yze n THR 128 Ca 0.05 -0.49 0.09 0.00 -3.05 0.00 0.00 64.05 60.64 1yze n THR 128 Cb 0.53 1.01 0.03 0.00 -1.55 0.00 0.00 70.33 70.35 1yze n THR 128 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 1yze n SER 129 N -0.46 2.05 -4.79 1.09 3.41 -1.26 -4.54 113.62 109.11 1yze n SER 129 Ca 0.00 -1.52 -0.36 0.00 -0.26 0.00 0.00 58.87 56.73 1yze n SER 129 Cb 0.00 0.27 -0.05 0.00 -0.26 0.00 0.00 64.21 64.18 1yze n SER 129 CO 0.00 0.00 0.00 -1.66 -0.16 0.00 0.00 175.04 173.22 1yze s TRP 130 N -1.80 3.34 -0.17 7.33 1.48 -1.25 -4.35 118.94 123.52 1yze s TRP 130 Ca 0.17 1.66 -0.13 0.00 -1.06 0.00 0.00 56.10 56.74 1yze s TRP 130 Cb 0.14 -3.03 0.05 0.00 -1.16 0.00 0.00 33.47 29.47 1yze s TRP 130 CO 0.35 -0.38 0.43 -1.54 -4.06 0.00 0.00 176.95 171.74 1yze s SER 131 N -1.71 -0.48 -0.15 -2.66 1.04 -1.26 -4.05 113.70 104.43 1yze s SER 131 Ca 0.58 0.88 -0.04 0.00 0.48 0.00 0.00 55.95 57.85 1yze s SER 131 Cb -0.19 0.85 0.05 0.00 0.10 0.00 0.00 66.02 66.84 1yze s SER 131 CO 0.24 -0.16 0.07 0.00 0.98 0.00 0.00 173.24 174.37 1yze s HIS 133 N 2.09 3.04 0.16 0.00 2.46 -1.26 -1.70 115.29 120.08 1yze s HIS 133 Ca 0.02 0.74 0.02 0.00 0.47 0.00 0.00 55.06 56.31 1yze s HIS 133 Cb -0.15 -3.75 -0.05 0.00 -0.13 0.00 0.00 32.58 28.50 1yze s HIS 133 CO -0.08 -0.89 -0.01 0.00 -2.47 0.00 0.00 174.74 171.29 1yze s ALA 134 N 3.59 1.27 -0.04 1.58 0.00 -0.54 -2.56 121.76 125.05 1yze s ALA 134 Ca 0.39 -1.54 0.01 0.00 0.00 0.00 0.00 51.96 50.82 1yze s ALA 134 Cb -0.11 0.48 0.02 0.00 0.00 0.00 0.00 23.12 23.50 1yze s ALA 134 CO 0.20 -0.30 -0.04 1.14 0.00 0.00 0.00 175.76 176.75 1yze s GLN 135 N -3.90 0.76 0.07 0.00 -2.07 -0.71 -0.38 119.66 113.43 1yze s GLN 135 Ca 0.22 -0.11 0.02 0.00 -1.82 0.00 0.00 55.36 53.66 1yze s GLN 135 Cb 0.06 -0.77 -0.04 0.00 -1.09 0.00 0.00 33.01 31.17 1yze s GLN 135 CO 0.02 -0.06 -0.07 0.00 -1.32 0.00 0.00 175.29 173.87 1yze s ALA 136 N 0.78 0.79 -0.35 2.60 0.00 -0.71 -1.74 121.76 123.13 1yze s ALA 136 Ca -0.10 -1.13 -0.01 0.00 0.00 0.00 0.00 51.96 50.71 1yze s ALA 136 Cb -0.13 0.13 0.08 0.00 0.00 0.00 0.00 23.12 23.20 1yze s ALA 136 CO 0.00 -0.18 0.09 0.08 0.00 0.00 0.00 175.76 175.76 1yze s VAL 137 N -2.89 3.02 -0.07 0.00 1.01 -0.47 -0.70 120.40 120.31 1yze s VAL 137 Ca 0.04 -1.79 -0.25 0.00 0.00 0.00 0.00 61.98 59.97 1yze s VAL 137 Cb 0.00 -2.94 -0.03 0.00 0.00 0.00 0.00 36.38 33.41 1yze s VAL 137 CO -0.04 -0.42 0.80 -0.76 0.00 0.00 0.00 175.10 174.69 1yze s LEU 138 N 1.16 4.31 0.04 3.92 1.43 0.21 -1.96 118.68 127.78 1yze s LEU 138 Ca 0.02 1.31 0.02 0.00 -1.03 0.00 0.00 54.13 54.46 1yze s LEU 138 Cb -0.21 -3.24 -0.02 0.00 0.03 0.00 0.00 46.19 42.75 1yze s LEU 138 CO -0.03 -0.20 -0.07 -0.75 0.23 0.00 0.00 176.35 175.52 1yze s LYS 139 N 1.09 0.51 -0.11 1.70 2.20 0.26 0.92 119.74 126.32 1yze s LYS 139 Ca 0.41 -0.69 0.01 0.00 -0.36 0.00 0.00 55.97 55.34 1yze s LYS 139 Cb -0.18 -0.29 -0.02 0.00 -1.51 0.00 0.00 37.83 35.83 1yze s LYS 139 CO 0.20 0.05 -0.12 0.42 -0.36 0.00 0.00 175.35 175.54 1yze s ILE 140 N -1.24 3.20 -0.50 5.43 1.01 -1.26 0.25 121.20 128.09 1yze s ILE 140 Ca -0.09 -0.63 0.04 0.00 0.00 0.00 0.00 60.65 59.97 1yze s ILE 140 Cb -0.09 -2.32 0.17 0.00 0.01 0.00 0.00 42.46 40.22 1yze s ILE 140 CO 0.00 0.54 0.37 -0.51 0.00 0.00 0.00 174.94 175.35 1yze s ILE 141 N -0.03 1.17 -0.02 2.92 1.10 0.66 -4.85 121.20 122.14 1yze s ILE 141 Ca -0.02 -3.10 -0.00 0.00 -0.51 0.00 0.00 60.65 57.01 1yze s ILE 141 Cb -0.14 -1.79 -0.01 0.00 0.15 0.00 0.00 42.46 40.67 1yze s ILE 141 CO 0.04 -1.14 -0.02 2.22 -2.11 0.00 0.00 174.94 173.93 1yze n PHE 150 N 2.67 0.00 -4.21 3.50 -1.74 -1.26 -4.32 117.46 112.11 1yze n PHE 150 Ca 0.25 0.00 -0.12 0.00 -0.56 0.00 0.00 57.45 57.02 1yze n PHE 150 Cb 0.43 -0.06 -0.10 0.00 1.52 0.00 0.00 39.48 41.26 1yze n PHE 150 CO 0.00 0.00 0.00 -1.54 -0.56 0.00 0.00 176.76 174.66 1yze s SER 151 N -4.77 0.76 -0.03 5.98 1.04 -1.26 -4.48 113.70 110.93 1yze s SER 151 Ca -0.02 -1.22 -0.01 0.00 0.48 0.00 0.00 55.95 55.17 1yze s SER 151 Cb 0.01 0.21 0.03 0.00 0.10 0.00 0.00 66.02 66.37 1yze s SER 151 CO 0.03 -0.67 0.07 -0.13 0.98 0.00 0.00 173.24 173.53 1yze s ARG 152 N -4.00 0.03 0.16 4.02 0.52 0.26 -4.95 118.95 115.00 1yze s ARG 152 Ca 0.26 0.22 -0.02 0.00 -0.52 0.00 0.00 55.73 55.67 1yze s ARG 152 Cb 0.07 -0.15 -0.05 0.00 0.52 0.00 0.00 34.95 35.35 1yze s ARG 152 CO 0.04 -0.12 0.35 -0.98 0.02 0.00 0.00 175.30 174.62 1yze s ARG 153 N 0.81 3.53 0.21 3.54 1.70 -1.26 -0.62 118.95 126.86 1yze s ARG 153 Ca -0.06 -0.30 0.01 0.00 -0.47 0.00 0.00 55.73 54.90 1yze s ARG 153 Cb -0.09 -2.88 -0.05 0.00 -0.57 0.00 0.00 34.95 31.37 1yze s ARG 153 CO -0.03 0.46 0.06 0.96 -1.08 0.00 0.00 175.30 175.67 1yze s ILE 154 N -1.75 0.53 -0.12 4.99 -4.36 0.13 -4.98 121.20 115.63 1yze s ILE 154 Ca 0.38 -1.99 -0.05 0.00 -0.26 0.00 0.00 60.65 58.74 1yze s ILE 154 Cb -0.12 -2.39 0.06 0.00 1.25 0.00 0.00 42.46 41.26 1yze s ILE 154 CO 0.28 -0.21 0.26 -0.44 0.24 0.00 0.00 174.94 175.06 1yze s SER 155 N -3.23 0.34 -0.18 4.36 0.01 -1.26 -1.73 113.70 112.00 1yze s SER 155 Ca 0.32 0.57 -0.23 0.00 1.31 0.00 0.00 55.95 57.92 1yze s SER 155 Cb 0.07 0.65 0.06 0.00 0.21 0.00 0.00 66.02 67.02 1yze s SER 155 CO 0.09 -0.23 0.62 -2.28 0.41 0.00 0.00 173.24 171.85 1yze s HIS 156 N 2.33 -0.65 -0.64 2.43 5.04 0.49 -4.99 115.29 119.30 1yze s HIS 156 Ca 0.01 1.49 -0.19 0.00 -1.54 0.00 0.00 55.06 54.83 1yze s HIS 156 Cb -0.12 0.26 0.11 0.00 0.04 0.00 0.00 32.58 32.88 1yze s HIS 156 CO -0.08 -0.39 0.76 -1.17 -2.34 0.00 0.00 174.74 171.51 1yze s LEU 157 N -0.08 5.39 0.33 8.88 2.96 -1.26 -1.47 118.68 133.43 1yze s LEU 157 Ca -0.03 -1.54 -0.27 0.00 -0.22 0.00 0.00 54.13 52.07 1yze s LEU 157 Cb -0.04 -2.31 -0.09 0.00 0.50 0.00 0.00 46.19 44.25 1yze s LEU 157 CO 0.03 -1.10 1.04 -0.36 -1.32 0.00 0.00 176.35 174.64 1yze s PHE 158 N 2.61 3.50 0.00 5.38 0.40 -0.69 -4.86 117.98 124.32 1yze s PHE 158 Ca 0.14 1.71 0.00 0.00 -0.60 0.00 0.00 56.93 58.18 1yze s PHE 158 Cb -0.21 -3.14 0.00 0.00 0.51 0.00 0.00 43.02 40.18 1yze s PHE 158 CO 0.04 -0.39 0.00 1.97 0.70 0.00 0.00 175.22 177.54 1yze n PHE 159 N 0.58 -0.39 -0.09 0.36 -1.74 -1.21 -1.17 117.46 113.80 1yze n PHE 159 Ca 0.02 0.00 -0.03 0.00 -0.56 0.00 0.00 57.45 56.88 1yze n PHE 159 Cb 0.48 0.00 -0.02 0.00 1.52 0.00 0.00 39.48 41.45 1yze n PHE 159 CO 0.00 0.00 0.00 1.25 -0.56 0.00 0.00 176.76 177.45 1yze h HIS 160 N 0.41 -0.46 -0.01 2.97 -0.00 -1.80 -2.71 115.15 113.56 1yze h HIS 160 Ca 0.00 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.40 1yze h HIS 160 Cb 0.00 0.23 0.00 0.00 -0.00 0.00 0.00 27.41 27.64 1yze h HIS 160 CO 0.00 -0.10 -0.06 1.63 -0.00 0.00 0.00 177.93 179.40 1yze n LYS 161 N -3.53 1.00 -3.07 5.26 5.02 -1.26 -4.30 118.16 117.28 1yze n LYS 161 Ca 0.00 -0.35 -0.16 0.00 -2.02 0.00 0.00 58.31 55.78 1yze n LYS 161 Cb 0.07 -1.49 -0.01 0.00 -0.02 0.00 0.00 35.03 33.58 1yze n LYS 161 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1yze n GLU 162 N -0.69 1.00 0.00 1.97 1.02 -1.11 -4.93 120.64 117.90 1yze n GLU 162 Ca 0.18 -3.18 0.14 0.00 -0.02 0.00 0.00 57.16 54.28 1yze n GLU 162 Cb 0.25 -1.56 0.47 0.00 -0.02 0.00 0.00 31.44 30.59 1yze n GLU 162 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 1yze n ASN 163 N 0.24 1.25 -4.21 1.62 6.94 -1.04 -3.28 115.26 116.78 1yze n ASN 163 Ca 0.21 -1.20 -0.32 0.00 -0.02 0.00 0.00 54.58 53.24 1yze n ASN 163 Cb 0.68 0.05 -0.17 0.00 -2.36 0.00 0.00 39.78 37.99 1yze n ASN 163 CO 0.00 0.00 0.00 -1.81 -1.03 0.00 0.00 177.26 174.42 1yze s ASP 164 N -2.23 3.18 -0.01 0.53 1.11 -1.26 -1.16 116.67 116.83 1yze s ASP 164 Ca 0.32 -0.56 -0.01 0.00 0.18 0.00 0.00 52.55 52.48 1yze s ASP 164 Cb 0.20 -1.44 0.01 0.00 1.07 0.00 0.00 42.92 42.75 1yze s ASP 164 CO 0.42 0.12 0.03 0.86 1.18 0.00 0.00 175.17 177.79 1yze s TRP 165 N 0.56 -0.03 -1.95 4.23 -0.11 -0.31 -4.95 118.94 116.38 1yze s TRP 165 Ca -0.13 0.09 0.00 0.00 1.22 0.00 0.00 56.10 57.28 1yze s TRP 165 Cb -0.17 -0.01 0.00 0.00 -1.50 0.00 0.00 33.47 31.79 1yze s TRP 165 CO 0.04 -0.02 0.00 0.41 -4.62 0.00 0.00 176.95 172.75 1yze n GLY 166 N 3.17 -0.66 3.01 5.86 0.00 -1.26 -0.20 105.19 115.11 1yze n GLY 166 Ca -0.14 -0.44 -0.31 0.00 0.00 0.00 0.00 46.02 45.13 1yze n GLY 166 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1yze s PHE 167 N -4.00 2.61 0.35 1.61 0.40 -1.08 -4.97 117.98 112.90 1yze s PHE 167 Ca 0.00 -1.76 0.15 0.00 -0.60 0.00 0.00 56.93 54.72 1yze s PHE 167 Cb 0.00 -1.71 0.79 0.00 0.51 0.00 0.00 43.02 42.61 1yze s PHE 167 CO 0.00 -0.78 1.84 1.03 0.70 0.00 0.00 175.22 178.01 1yze h SER 168 N 7.93 0.00 -2.21 1.36 0.87 -1.86 0.37 113.55 120.01 1yze h SER 168 Ca -0.26 0.00 -0.59 0.00 -1.23 0.00 0.00 61.79 59.71 1yze h SER 168 Cb 1.09 0.00 -0.42 0.00 -0.44 0.00 0.00 62.40 62.63 1yze h SER 168 CO 0.48 0.35 -0.67 -3.20 -0.53 0.00 0.00 176.83 173.26 1yze n ASN 169 N -3.97 3.70 -0.08 6.23 4.05 -1.26 -3.06 115.26 120.87 1yze n ASN 169 Ca -0.02 -3.47 -0.11 0.00 0.45 0.00 0.00 54.58 51.43 1yze n ASN 169 Cb 0.41 -0.63 -0.04 0.00 1.23 0.00 0.00 39.78 40.75 1yze n ASN 169 CO 0.00 0.00 0.00 0.15 -3.05 0.00 0.00 177.26 174.36 1yze h PHE 170 N 3.67 0.44 -3.30 1.20 3.04 -1.14 -3.46 116.94 117.38 1yze h PHE 170 Ca 0.16 -0.07 -0.04 0.00 3.98 0.00 0.00 57.97 62.00 1yze h PHE 170 Cb 0.63 -0.12 -0.12 0.00 2.56 0.00 0.00 35.95 38.90 1yze h PHE 170 CO 0.73 0.55 0.00 1.41 -2.02 0.00 0.00 178.31 178.98 1yze s MET 171 N -5.09 1.16 0.55 1.11 0.00 -1.22 -4.99 119.30 110.83 1yze s MET 171 Ca -0.14 -0.69 -0.19 0.00 0.00 0.00 0.00 55.69 54.68 1yze s MET 171 Cb 0.07 0.50 -0.06 0.00 0.00 0.00 0.00 34.83 35.35 1yze s MET 171 CO 0.74 -0.47 1.13 0.00 0.00 0.00 0.00 175.02 176.41 1yze s ALA 172 N -3.80 2.69 0.14 4.11 0.00 -1.26 0.21 121.76 123.84 1yze s ALA 172 Ca 0.04 0.80 -0.11 0.00 0.00 0.00 0.00 51.96 52.68 1yze s ALA 172 Cb 0.01 -3.35 -0.07 0.00 0.00 0.00 0.00 23.12 19.71 1yze s ALA 172 CO -0.11 -0.79 0.49 -0.46 0.00 0.00 0.00 175.76 174.90 1yze s TRP 173 N -1.82 3.56 0.00 0.00 -0.11 -1.26 -4.30 118.94 115.01 1yze s TRP 173 Ca 0.72 0.91 0.00 0.00 1.22 0.00 0.00 56.10 58.95 1yze s TRP 173 Cb -0.23 -2.26 0.00 0.00 -1.50 0.00 0.00 33.47 29.48 1yze s TRP 173 CO 0.28 0.43 0.00 0.36 -4.62 0.00 0.00 176.95 173.40 1yze n LYS 188 N 0.63 -0.70 -3.63 5.86 2.85 -1.26 -4.98 118.16 116.93 1yze n LYS 188 Ca -0.05 0.00 -0.06 0.00 -1.05 0.00 0.00 58.31 57.15 1yze n LYS 188 Cb 0.52 0.00 -0.06 0.00 -0.65 0.00 0.00 35.03 34.84 1yze n LYS 188 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1yze s VAL 189 N -0.58 0.00 -0.07 0.58 0.11 -0.89 -4.90 120.40 114.66 1yze s VAL 189 Ca 0.00 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.05 1yze s VAL 189 Cb 0.00 -1.00 -0.03 0.00 -1.53 0.00 0.00 36.38 33.82 1yze s VAL 189 CO 0.00 0.00 -0.05 -0.89 -3.33 0.00 0.00 175.10 170.83 1yze s THR 190 N -0.24 3.83 0.06 5.04 2.01 -1.26 -1.00 115.64 124.09 1yze s THR 190 Ca 0.04 -0.44 0.07 0.00 0.31 0.00 0.00 61.69 61.67 1yze s THR 190 Cb -0.04 -2.58 -0.04 0.00 0.01 0.00 0.00 72.50 69.86 1yze s THR 190 CO -0.08 0.59 -0.13 -0.36 -0.69 0.00 0.00 174.62 173.95 1yze s PHE 191 N -0.84 2.68 0.04 4.92 0.08 -0.68 0.24 117.98 124.42 1yze s PHE 191 Ca 0.13 -0.18 0.04 0.00 0.12 0.00 0.00 56.93 57.04 1yze s PHE 191 Cb -0.11 -1.47 -0.02 0.00 -0.57 0.00 0.00 43.02 40.85 1yze s PHE 191 CO 0.02 0.35 -0.12 -2.00 -0.10 0.00 0.00 175.22 173.37 1yze s GLU 192 N -1.77 0.78 -0.03 0.44 2.12 0.70 -0.03 118.70 120.90 1yze s GLU 192 Ca 0.18 -0.71 -0.01 0.00 0.36 0.00 0.00 54.97 54.79 1yze s GLU 192 Cb -0.11 -0.74 0.03 0.00 0.26 0.00 0.00 34.13 33.57 1yze s GLU 192 CO 0.09 0.18 0.02 0.08 -0.54 0.00 0.00 175.26 175.09 1yze s VAL 193 N -0.91 0.06 -0.35 3.70 1.01 0.13 0.91 120.40 124.94 1yze s VAL 193 Ca -0.01 0.22 -0.09 0.00 0.00 0.00 0.00 61.98 62.10 1yze s VAL 193 Cb -0.08 -0.21 0.03 0.00 0.00 0.00 0.00 36.38 36.12 1yze s VAL 193 CO 0.01 0.15 0.16 0.12 0.00 0.00 0.00 175.10 175.54 1yze s PHE 194 N 1.45 3.24 -0.21 5.22 5.36 -0.83 -1.63 117.98 130.58 1yze s PHE 194 Ca -0.04 -1.11 -0.05 0.00 -0.96 0.00 0.00 56.93 54.77 1yze s PHE 194 Cb -0.13 -2.36 -0.02 0.00 -0.34 0.00 0.00 43.02 40.17 1yze s PHE 194 CO -0.03 -0.66 0.01 0.54 -1.46 0.00 0.00 175.22 173.62 1yze s VAL 195 N 1.50 3.96 -0.20 3.12 0.11 -0.31 -1.37 120.40 127.21 1yze s VAL 195 Ca 0.01 -0.30 0.01 0.00 -2.93 0.00 0.00 61.98 58.77 1yze s VAL 195 Cb -0.19 -2.81 0.03 0.00 -1.53 0.00 0.00 36.38 31.89 1yze s VAL 195 CO 0.05 0.41 -0.17 -1.58 -3.33 0.00 0.00 175.10 170.48 1yze s GLN 196 N 1.19 2.70 0.42 1.54 0.74 -0.71 -1.55 119.66 123.99 1yze s GLN 196 Ca 0.03 -0.92 0.06 0.00 0.05 0.00 0.00 55.36 54.59 1yze s GLN 196 Cb -0.14 -2.59 -0.07 0.00 1.10 0.00 0.00 33.01 31.31 1yze s GLN 196 CO 0.01 -0.30 0.01 0.00 -0.55 0.00 0.00 175.29 174.46 1yze s ALA 197 N 1.28 3.29 0.46 1.58 0.00 -0.75 -1.73 121.76 125.88 1yze s ALA 197 Ca 0.02 -2.00 0.04 0.00 0.00 0.00 0.00 51.96 50.02 1yze s ALA 197 Cb -0.15 0.17 -0.04 0.00 0.00 0.00 0.00 23.12 23.10 1yze s ALA 197 CO -0.11 -0.11 0.01 0.16 0.00 0.00 0.00 175.76 175.71 1yze s ASP 198 N -3.73 3.96 0.15 0.00 3.84 -1.06 -4.78 116.67 115.05 1yze s ASP 198 Ca 0.30 -1.53 -0.34 0.00 -0.00 0.00 0.00 52.55 50.98 1yze s ASP 198 Cb 0.09 0.13 -0.15 0.00 -1.38 0.00 0.00 42.92 41.61 1yze s ASP 198 CO 0.16 -0.68 1.43 0.00 -0.00 0.00 0.00 175.17 176.07 1yze n ALA 199 N -1.12 0.34 -1.71 2.11 0.00 -1.26 -4.63 120.51 114.24 1yze n ALA 199 Ca -0.13 0.47 -0.34 0.00 0.00 0.00 0.00 53.44 53.44 1yze n ALA 199 Cb 0.67 -2.22 0.00 0.00 0.00 0.00 0.00 19.45 17.90 1yze n ALA 199 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1yze s PRO 200 N 0.43 3.39 -0.59 0.00 0.02 -1.26 -4.74 135.00 132.24 1yze s PRO 200 Ca 0.78 1.37 0.05 0.00 0.02 0.00 0.00 61.00 63.22 1yze s PRO 200 Cb -0.78 -2.03 0.17 0.00 0.02 0.00 0.00 34.50 31.88 1yze s PRO 200 CO 0.44 -0.78 0.45 -2.39 -0.33 0.00 0.00 177.00 174.39 1yze n HIS 201 N -1.61 1.68 0.00 6.54 1.44 -0.69 -4.74 115.22 117.84 1yze n HIS 201 Ca 0.10 -3.93 0.00 0.00 -2.01 0.00 0.00 57.72 51.88 1yze n HIS 201 Cb 0.52 -0.29 0.00 0.00 0.12 0.00 0.00 29.99 30.34 1yze n HIS 201 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1yze n GLY 202 N 2.23 -0.03 0.03 -1.39 0.00 -1.26 -4.38 105.19 100.38 1yze n GLY 202 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.26 1yze n GLY 202 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65