#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a6x n GLU 71 N 0.00 -3.79 -1.46 0.03 2.13 -1.26 -4.77 120.64 111.52 1a6x n GLU 71 Ca 0.00 2.83 0.18 0.00 0.66 0.00 0.00 57.16 60.83 1a6x n GLU 71 Cb 0.00 -2.90 -0.07 0.00 0.27 0.00 0.00 31.44 28.74 1a6x n GLU 71 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1a6x n ALA 72 N 1.15 -3.83 -0.89 4.31 0.00 -1.26 -3.86 120.51 116.15 1a6x n ALA 72 Ca 0.00 0.74 -0.21 0.00 0.00 0.00 0.00 53.44 53.97 1a6x n ALA 72 Cb 0.00 -1.48 -0.07 0.00 0.00 0.00 0.00 19.45 17.90 1a6x n ALA 72 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1a6x n PRO 73 N -4.32 2.25 0.26 0.00 -0.04 -1.26 -4.59 135.00 127.29 1a6x n PRO 73 Ca -0.05 -1.35 -0.16 0.00 -0.04 0.00 0.00 63.50 61.90 1a6x n PRO 73 Cb 0.69 -2.30 -0.09 0.00 -0.04 0.00 0.00 33.50 31.76 1a6x n PRO 73 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1a6x h ALA 74 N 4.92 -1.11 0.72 0.55 0.00 -1.86 -3.21 119.26 119.27 1a6x h ALA 74 Ca 0.44 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 55.15 1a6x h ALA 74 Cb 0.60 0.70 0.01 0.00 0.00 0.00 0.00 17.79 19.09 1a6x h ALA 74 CO 1.05 -1.14 -0.35 0.00 0.00 0.00 0.00 179.25 178.81 1a6x h ALA 75 N -0.97 -1.06 -5.29 0.00 0.00 -1.91 -3.49 119.26 106.54 1a6x h ALA 75 Ca -0.06 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1a6x h ALA 75 Cb 0.79 0.37 -0.02 0.00 0.00 0.00 0.00 17.79 18.93 1a6x h ALA 75 CO -0.07 -0.98 -1.07 0.00 0.00 0.00 0.00 179.25 177.13 1a6x n ALA 76 N -2.62 -3.30 -2.85 0.00 0.00 -1.21 -5.01 120.51 105.51 1a6x n ALA 76 Ca -0.12 0.73 -0.11 0.00 0.00 0.00 0.00 53.44 53.94 1a6x n ALA 76 Cb 0.38 -1.51 0.06 0.00 0.00 0.00 0.00 19.45 18.38 1a6x n ALA 76 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1a6x n GLU 77 N 0.98 1.01 -3.47 0.00 0.28 -1.26 -5.12 120.64 113.06 1a6x n GLU 77 Ca -0.07 -2.31 -0.11 0.00 -0.16 0.00 0.00 57.16 54.51 1a6x n GLU 77 Cb 0.16 -1.19 -0.02 0.00 1.43 0.00 0.00 31.44 31.82 1a6x n GLU 77 CO 0.00 0.00 0.00 -1.50 -0.16 0.00 0.00 177.13 175.47 1a6x s ILE 78 N -0.45 0.00 -0.76 3.84 1.10 -1.26 -5.02 121.20 118.65 1a6x s ILE 78 Ca 0.27 0.00 -0.02 0.00 -0.51 0.00 0.00 60.65 60.39 1a6x s ILE 78 Cb 0.31 -1.00 0.00 0.00 0.15 0.00 0.00 42.46 41.92 1a6x s ILE 78 CO -0.06 0.00 0.65 -1.54 -2.11 0.00 0.00 174.94 171.88 1a6x n SER 79 N -0.17 -6.37 0.00 4.50 3.41 -1.26 -4.96 113.62 108.76 1a6x n SER 79 Ca -0.14 -0.47 0.00 0.00 -0.26 0.00 0.00 58.87 58.00 1a6x n SER 79 Cb 0.63 -3.53 0.00 0.00 -0.26 0.00 0.00 64.21 61.05 1a6x n SER 79 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1a6x n GLY 80 N -1.62 -0.87 3.57 5.00 0.00 -1.19 -4.72 105.19 105.35 1a6x n GLY 80 Ca -0.15 0.73 -0.26 0.00 0.00 0.00 0.00 46.02 46.34 1a6x n GLY 80 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1a6x s HIS 81 N 0.00 2.18 -0.17 1.61 0.09 0.14 -4.93 115.29 114.21 1a6x s HIS 81 Ca 0.00 -0.86 -0.05 0.00 -0.00 0.00 0.00 55.06 54.16 1a6x s HIS 81 Cb 0.00 -1.53 0.08 0.00 -0.00 0.00 0.00 32.58 31.13 1a6x s HIS 81 CO 0.00 0.21 0.30 0.42 -0.00 0.00 0.00 174.74 175.67 1a6x s ILE 82 N -2.98 -0.47 -0.24 0.60 1.09 -1.26 0.10 121.20 118.04 1a6x s ILE 82 Ca 0.31 0.16 -0.29 0.00 -1.10 0.00 0.00 60.65 59.73 1a6x s ILE 82 Cb 0.08 -0.56 -0.01 0.00 -1.06 0.00 0.00 42.46 40.91 1a6x s ILE 82 CO 0.15 0.03 1.33 -0.69 -0.10 0.00 0.00 174.94 175.66 1a6x s VAL 83 N 2.46 4.14 -0.23 2.92 1.01 0.66 -4.94 120.40 126.43 1a6x s VAL 83 Ca 0.03 1.32 -0.06 0.00 0.00 0.00 0.00 61.98 63.27 1a6x s VAL 83 Cb -0.13 -4.04 -0.02 0.00 0.00 0.00 0.00 36.38 32.19 1a6x s VAL 83 CO -0.11 -0.33 0.02 -0.13 0.00 0.00 0.00 175.10 174.55 1a6x s ARG 84 N 3.98 3.56 -0.68 2.72 0.52 -1.26 0.77 118.95 128.56 1a6x s ARG 84 Ca 0.58 -0.54 -0.33 0.00 -0.52 0.00 0.00 55.73 54.92 1a6x s ARG 84 Cb -0.20 -3.16 -0.17 0.00 0.52 0.00 0.00 34.95 31.95 1a6x s ARG 84 CO 0.21 -0.14 2.44 -1.13 0.02 0.00 0.00 175.30 176.70 1a6x n SER 85 N 4.70 1.11 0.00 0.23 3.41 0.14 -4.72 113.62 118.50 1a6x n SER 85 Ca -0.17 0.20 0.11 0.00 -0.26 0.00 0.00 58.87 58.75 1a6x n SER 85 Cb 0.51 -1.10 0.68 0.00 -0.26 0.00 0.00 64.21 64.04 1a6x n SER 85 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 1a6x n PRO 86 N 8.34 0.75 -3.64 4.33 -0.04 -1.26 -2.81 135.00 140.66 1a6x n PRO 86 Ca 0.54 0.00 -0.08 0.00 -0.04 0.00 0.00 63.50 63.92 1a6x n PRO 86 Cb 0.15 -1.48 -0.07 0.00 -0.04 0.00 0.00 33.50 32.06 1a6x n PRO 86 CO 0.00 0.00 0.00 1.41 -0.04 0.00 0.00 175.50 176.87 1a6x s MET 87 N -2.00 0.64 0.52 0.54 1.75 -1.26 -4.97 119.30 114.52 1a6x s MET 87 Ca 0.34 0.99 -0.21 0.00 -1.25 0.00 0.00 55.69 55.56 1a6x s MET 87 Cb 0.16 0.19 -0.06 0.00 2.84 0.00 0.00 34.83 37.96 1a6x s MET 87 CO 0.26 -0.11 1.23 0.08 -0.65 0.00 0.00 175.02 175.83 1a6x s VAL 88 N 1.15 2.70 0.00 10.11 1.01 -1.26 -4.60 120.40 129.51 1a6x s VAL 88 Ca -0.06 0.49 0.00 0.00 0.00 0.00 0.00 61.98 62.41 1a6x s VAL 88 Cb -0.05 -3.24 0.00 0.00 0.00 0.00 0.00 36.38 33.10 1a6x s VAL 88 CO -0.13 -0.03 0.00 0.61 0.00 0.00 0.00 175.10 175.55 1a6x n GLY 89 N 0.53 -0.32 3.27 4.51 0.00 -0.44 -4.81 105.19 107.93 1a6x n GLY 89 Ca 0.10 -0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.97 1a6x n GLY 89 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1a6x s THR 90 N 0.00 0.98 -0.02 2.61 2.01 0.14 -0.36 115.64 121.00 1a6x s THR 90 Ca 0.00 -2.03 0.02 0.00 0.31 0.00 0.00 61.69 59.99 1a6x s THR 90 Cb 0.00 -2.08 0.00 0.00 0.01 0.00 0.00 72.50 70.43 1a6x s THR 90 CO 0.00 -0.54 -0.06 0.12 -0.69 0.00 0.00 174.62 173.45 1a6x s PHE 91 N -3.46 0.65 0.11 4.92 2.19 -0.14 -0.81 117.98 121.44 1a6x s PHE 91 Ca 0.22 -0.14 0.06 0.00 0.33 0.00 0.00 56.93 57.40 1a6x s PHE 91 Cb 0.05 -0.48 -0.04 0.00 -1.31 0.00 0.00 43.02 41.24 1a6x s PHE 91 CO 0.04 -0.07 -0.14 0.71 1.83 0.00 0.00 175.22 177.59 1a6x s TYR 92 N 0.21 1.34 -0.56 10.12 2.02 0.12 0.70 117.35 131.30 1a6x s TYR 92 Ca -0.02 -0.56 0.17 0.00 -0.37 0.00 0.00 57.07 56.29 1a6x s TYR 92 Cb -0.07 -0.71 -0.22 0.00 -0.40 0.00 0.00 41.96 40.57 1a6x s TYR 92 CO -0.00 0.12 0.62 0.54 -1.57 0.00 0.00 175.55 175.26 1a6x n ARG 93 N 0.63 1.03 -4.12 -0.62 5.12 -1.26 -1.41 116.66 116.04 1a6x n ARG 93 Ca -0.16 -0.05 -0.11 0.00 -1.93 0.00 0.00 57.85 55.59 1a6x n ARG 93 Cb 0.57 -1.35 -0.11 0.00 -1.16 0.00 0.00 32.46 30.41 1a6x n ARG 93 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 1a6x s THR 94 N -2.83 0.59 -0.99 0.55 -4.23 -1.26 -1.40 115.64 106.07 1a6x s THR 94 Ca 0.02 -1.56 0.22 0.00 -1.18 0.00 0.00 61.69 59.19 1a6x s THR 94 Cb 0.13 -1.21 0.18 0.00 1.34 0.00 0.00 72.50 72.94 1a6x s THR 94 CO 0.72 -0.67 1.70 -0.81 -0.54 0.00 0.00 174.62 175.01 1a6x n PRO 95 N 0.61 0.01 -3.85 3.99 -0.04 -1.26 -4.86 135.00 129.59 1a6x n PRO 95 Ca -0.17 0.13 -0.09 0.00 -0.04 0.00 0.00 63.50 63.33 1a6x n PRO 95 Cb 0.58 -1.51 0.01 0.00 -0.04 0.00 0.00 33.50 32.54 1a6x n PRO 95 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1a6x s SER 96 N -3.03 0.07 0.07 3.54 0.15 -1.26 -4.98 113.70 108.25 1a6x s SER 96 Ca 0.10 -1.11 -0.15 0.00 0.70 0.00 0.00 55.95 55.50 1a6x s SER 96 Cb 0.14 0.81 -0.21 0.00 -1.71 0.00 0.00 66.02 65.05 1a6x s SER 96 CO 0.40 -1.58 1.21 1.55 1.20 0.00 0.00 173.24 176.01 1a6x h PRO 97 N 2.02 0.66 -0.33 5.44 0.13 -1.97 -3.24 132.00 134.71 1a6x h PRO 97 Ca -0.30 -0.64 0.00 0.00 -0.87 0.00 0.00 66.00 64.19 1a6x h PRO 97 Cb 1.25 0.17 0.00 0.00 0.13 0.00 0.00 31.00 32.54 1a6x h PRO 97 CO 0.38 1.24 0.00 -0.25 -0.23 0.00 0.00 178.00 179.14 1a6x n ASP 98 N -3.98 4.33 -4.93 1.44 9.92 -1.26 -4.98 116.55 117.09 1a6x n ASP 98 Ca -0.10 -3.00 -0.26 0.00 -0.53 0.00 0.00 54.79 50.90 1a6x n ASP 98 Cb 0.78 -0.58 -0.02 0.00 -0.64 0.00 0.00 41.12 40.66 1a6x n ASP 98 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1a6x s ALA 99 N -2.82 3.70 1.17 2.24 0.00 -1.22 -5.07 121.76 119.75 1a6x s ALA 99 Ca 0.45 -0.77 -0.14 0.00 0.00 0.00 0.00 51.96 51.50 1a6x s ALA 99 Cb 0.36 -2.15 0.25 0.00 0.00 0.00 0.00 23.12 21.58 1a6x s ALA 99 CO 0.11 0.17 0.80 1.63 0.00 0.00 0.00 175.76 178.47 1a6x n LYS 100 N -1.24 -2.32 -3.58 0.00 5.02 -1.26 -4.72 118.16 110.06 1a6x n LYS 100 Ca -0.04 -0.65 -0.37 0.00 -2.02 0.00 0.00 58.31 55.23 1a6x n LYS 100 Cb 0.55 -2.07 -0.07 0.00 -0.02 0.00 0.00 35.03 33.42 1a6x n LYS 100 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1a6x s ALA 101 N -2.37 3.67 0.31 7.82 0.00 -1.26 -4.11 121.76 125.82 1a6x s ALA 101 Ca 0.66 -0.41 0.00 0.00 0.00 0.00 0.00 51.96 52.21 1a6x s ALA 101 Cb -0.23 -2.33 0.52 0.00 0.00 0.00 0.00 23.12 21.09 1a6x s ALA 101 CO 0.66 0.29 1.93 0.74 0.00 0.00 0.00 175.76 179.38 1a6x h PHE 102 N 5.83 1.02 -2.27 0.00 0.04 -1.58 -3.38 116.94 116.60 1a6x h PHE 102 Ca -0.46 0.03 -0.30 0.00 2.80 0.00 0.00 57.97 60.03 1a6x h PHE 102 Cb 1.19 -0.34 -0.34 0.00 2.20 0.00 0.00 35.95 38.66 1a6x h PHE 102 CO 0.66 0.57 -0.61 0.96 -0.60 0.00 0.00 178.31 179.29 1a6x s ILE 103 N -5.89 -0.40 -0.17 -0.55 -4.36 -1.26 -4.85 121.20 103.72 1a6x s ILE 103 Ca -0.11 -0.28 -0.25 0.00 -0.26 0.00 0.00 60.65 59.75 1a6x s ILE 103 Cb 0.19 -0.83 -0.01 0.00 1.25 0.00 0.00 42.46 43.05 1a6x s ILE 103 CO 0.80 -0.31 0.82 -1.83 0.24 0.00 0.00 174.94 174.66 1a6x s GLU 104 N 2.37 4.29 -0.49 0.37 -1.05 -1.26 -4.94 118.70 117.99 1a6x s GLU 104 Ca 0.09 1.00 -0.46 0.00 -0.15 0.00 0.00 54.97 55.45 1a6x s GLU 104 Cb -0.15 -3.58 -0.19 0.00 -0.44 0.00 0.00 34.13 29.77 1a6x s GLU 104 CO -0.22 -0.33 1.81 0.28 0.95 0.00 0.00 175.26 177.74 1a6x n VAL 105 N 4.76 0.01 0.00 1.83 0.31 -1.26 -0.64 118.33 123.35 1a6x n VAL 105 Ca 0.04 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.37 1a6x n VAL 105 Cb 0.49 -0.54 0.00 0.00 -0.91 0.00 0.00 33.84 32.88 1a6x n VAL 105 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1a6x n GLY 106 N 5.30 1.30 3.61 2.92 0.00 -1.26 -5.11 105.19 111.95 1a6x n GLY 106 Ca 0.40 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.18 1a6x n GLY 106 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1a6x s GLN 107 N -0.39 2.17 0.34 1.61 0.74 0.19 -5.00 119.66 119.31 1a6x s GLN 107 Ca 0.00 -1.47 0.07 0.00 0.05 0.00 0.00 55.36 54.01 1a6x s GLN 107 Cb 0.00 -2.09 -0.03 0.00 1.10 0.00 0.00 33.01 31.99 1a6x s GLN 107 CO 0.00 0.36 0.30 -1.59 -0.55 0.00 0.00 175.29 173.81 1a6x s LYS 108 N -3.60 2.73 -0.04 1.67 -2.85 -1.26 -2.93 119.74 113.46 1a6x s LYS 108 Ca 0.31 -1.29 -0.04 0.00 -1.00 0.00 0.00 55.97 53.95 1a6x s LYS 108 Cb -0.06 -2.48 0.01 0.00 -2.06 0.00 0.00 37.83 33.24 1a6x s LYS 108 CO 0.19 0.10 0.12 0.14 0.10 0.00 0.00 175.35 175.99 1a6x s VAL 109 N -2.30 -0.00 0.07 1.79 -7.23 -0.06 -5.00 120.40 107.65 1a6x s VAL 109 Ca 0.41 0.02 0.07 0.00 -1.81 0.00 0.00 61.98 60.67 1a6x s VAL 109 Cb -0.06 -0.17 -0.04 0.00 0.56 0.00 0.00 36.38 36.67 1a6x s VAL 109 CO 0.27 0.01 -0.15 0.54 -0.31 0.00 0.00 175.10 175.45 1a6x s ASN 110 N 0.16 4.02 -0.52 4.85 4.22 -1.26 -0.88 114.94 125.53 1a6x s ASN 110 Ca -0.01 -0.42 -0.43 0.00 -2.14 0.00 0.00 52.86 49.86 1a6x s ASN 110 Cb -0.02 -0.69 -0.19 0.00 1.28 0.00 0.00 41.25 41.64 1a6x s ASN 110 CO -0.00 0.23 2.17 0.52 -2.04 0.00 0.00 177.10 177.97 1a6x n VAL 111 N 1.21 0.00 0.00 3.54 0.31 -1.26 -1.18 118.33 120.95 1a6x n VAL 111 Ca -0.15 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.17 1a6x n VAL 111 Cb 0.52 -0.53 0.00 0.00 -0.91 0.00 0.00 33.84 32.92 1a6x n VAL 111 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1a6x n GLY 112 N 7.43 1.83 3.13 2.92 0.00 -1.25 -5.02 105.19 114.24 1a6x n GLY 112 Ca 0.55 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 46.30 1a6x n GLY 112 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1a6x s ASP 113 N -2.00 2.32 0.44 1.61 1.11 -0.33 -4.95 116.67 114.87 1a6x s ASP 113 Ca 0.00 -0.39 -0.25 0.00 0.18 0.00 0.00 52.55 52.08 1a6x s ASP 113 Cb 0.00 -0.83 -0.09 0.00 1.07 0.00 0.00 42.92 43.07 1a6x s ASP 113 CO 0.00 0.13 1.36 0.41 1.18 0.00 0.00 175.17 178.26 1a6x n THR 114 N 3.37 2.73 -0.04 -1.27 -1.04 -1.26 -0.31 114.28 116.45 1a6x n THR 114 Ca -0.19 -0.50 -0.04 0.00 -2.04 0.00 0.00 64.05 61.27 1a6x n THR 114 Cb 0.53 -1.73 -0.06 0.00 -1.82 0.00 0.00 70.33 67.25 1a6x n THR 114 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1a6x n LEU 115 N -0.05 0.57 0.00 -4.42 -0.00 0.13 -4.70 117.00 108.53 1a6x n LEU 115 Ca 0.06 -0.01 0.03 0.00 -0.00 0.00 0.00 56.01 56.08 1a6x n LEU 115 Cb 0.41 0.09 0.01 0.00 -0.00 0.00 0.00 43.42 43.92 1a6x n LEU 115 CO 0.59 0.28 0.72 0.00 -0.00 0.00 0.00 177.39 178.98 1a6x s ILE 117 N -2.03 1.71 -0.07 0.00 -1.09 -0.50 -1.06 121.20 118.17 1a6x s ILE 117 Ca 0.20 -1.80 0.00 0.00 -2.23 0.00 0.00 60.65 56.82 1a6x s ILE 117 Cb -0.00 -1.72 0.02 0.00 -1.58 0.00 0.00 42.46 39.18 1a6x s ILE 117 CO -0.01 -0.27 -0.05 -0.69 -1.23 0.00 0.00 174.94 172.68 1a6x s VAL 118 N -1.86 0.72 -0.13 2.92 1.01 0.51 -0.70 120.40 122.87 1a6x s VAL 118 Ca 0.12 -0.16 -0.09 0.00 0.00 0.00 0.00 61.98 61.85 1a6x s VAL 118 Cb -0.07 -0.75 -0.04 0.00 0.00 0.00 0.00 36.38 35.52 1a6x s VAL 118 CO 0.05 0.29 0.17 -0.70 0.00 0.00 0.00 175.10 174.91 1a6x s GLU 119 N 1.32 3.69 0.24 2.72 2.12 0.01 -0.13 118.70 128.68 1a6x s GLU 119 Ca -0.04 -0.09 0.03 0.00 0.36 0.00 0.00 54.97 55.23 1a6x s GLU 119 Cb -0.14 -3.26 -0.01 0.00 0.26 0.00 0.00 34.13 30.99 1a6x s GLU 119 CO -0.03 0.64 0.10 0.00 -0.54 0.00 0.00 175.26 175.43 1a6x n ALA 120 N 2.40 0.36 -1.52 6.30 0.00 0.94 0.27 120.51 129.26 1a6x n ALA 120 Ca -0.18 -1.26 -0.23 0.00 0.00 0.00 0.00 53.44 51.77 1a6x n ALA 120 Cb 0.54 0.87 -0.17 0.00 0.00 0.00 0.00 19.45 20.69 1a6x n ALA 120 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1a6x n MET 121 N -0.54 0.19 -4.10 0.00 0.00 -1.26 -1.03 117.12 110.38 1a6x n MET 121 Ca -0.03 -0.22 -0.29 0.00 0.00 0.00 0.00 57.70 57.16 1a6x n MET 121 Cb 0.37 -1.86 -0.04 0.00 0.00 0.00 0.00 33.22 31.69 1a6x n MET 121 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 175.97 177.14 1a6x n LYS 122 N 6.86 -2.77 -3.41 3.17 4.81 -1.26 -4.93 118.16 120.63 1a6x n LYS 122 Ca 0.61 0.33 -0.03 0.00 -0.87 0.00 0.00 58.31 58.36 1a6x n LYS 122 Cb 0.22 -4.48 -0.05 0.00 0.02 0.00 0.00 35.03 30.74 1a6x n LYS 122 CO 0.00 0.00 0.00 -1.64 1.17 0.00 0.00 177.40 176.93 1a6x s MET 123 N -6.81 0.47 0.13 1.64 -1.94 -0.20 -5.15 119.30 107.44 1a6x s MET 123 Ca 0.19 1.00 -0.20 0.00 -1.71 0.00 0.00 55.69 54.97 1a6x s MET 123 Cb -0.10 0.34 -0.07 0.00 2.01 0.00 0.00 34.83 37.00 1a6x s MET 123 CO 0.92 -0.46 0.64 1.41 -0.01 0.00 0.00 175.02 177.52 1a6x s MET 124 N 2.75 4.25 0.07 2.03 1.75 -1.26 -0.04 119.30 128.83 1a6x s MET 124 Ca 0.09 0.81 0.01 0.00 -1.25 0.00 0.00 55.69 55.34 1a6x s MET 124 Cb -0.14 -3.12 -0.03 0.00 2.84 0.00 0.00 34.83 34.38 1a6x s MET 124 CO -0.18 0.55 -0.06 -0.80 -0.65 0.00 0.00 175.02 173.88 1a6x s ASN 125 N -1.32 0.86 0.02 1.11 0.01 0.81 -4.97 114.94 111.47 1a6x s ASN 125 Ca 0.34 -0.81 0.08 0.00 -0.71 0.00 0.00 52.86 51.76 1a6x s ASN 125 Cb -0.19 0.09 -0.02 0.00 0.41 0.00 0.00 41.25 41.54 1a6x s ASN 125 CO 0.21 -0.39 -0.24 -1.10 -1.51 0.00 0.00 177.10 174.07 1a6x s GLN 126 N -2.90 1.76 -0.30 -0.60 1.11 -1.26 -0.36 119.66 117.11 1a6x s GLN 126 Ca 0.01 -0.96 -0.09 0.00 0.01 0.00 0.00 55.36 54.33 1a6x s GLN 126 Cb -0.01 -1.82 -0.01 0.00 -1.01 0.00 0.00 33.01 30.16 1a6x s GLN 126 CO -0.04 0.48 0.12 0.42 0.01 0.00 0.00 175.29 176.29 1a6x s ILE 127 N -0.70 4.40 -0.21 1.08 1.01 -0.22 -4.93 121.20 121.63 1a6x s ILE 127 Ca 0.10 -0.45 -0.11 0.00 0.00 0.00 0.00 60.65 60.19 1a6x s ILE 127 Cb -0.09 -3.22 -0.05 0.00 0.01 0.00 0.00 42.46 39.10 1a6x s ILE 127 CO 0.01 0.11 0.16 -0.70 0.00 0.00 0.00 174.94 174.52 1a6x s GLU 128 N 1.59 4.16 0.07 2.79 2.12 -1.26 0.19 118.70 128.34 1a6x s GLU 128 Ca 0.04 -0.20 -0.36 0.00 0.36 0.00 0.00 54.97 54.82 1a6x s GLU 128 Cb -0.17 -3.46 -0.19 0.00 0.26 0.00 0.00 34.13 30.57 1a6x s GLU 128 CO 0.05 0.20 0.91 0.00 -0.54 0.00 0.00 175.26 175.88 1a6x n ALA 129 N 3.81 -3.33 -0.56 6.30 0.00 0.57 -4.83 120.51 122.48 1a6x n ALA 129 Ca -0.15 0.55 0.07 0.00 0.00 0.00 0.00 53.44 53.91 1a6x n ALA 129 Cb 0.52 -1.72 0.22 0.00 0.00 0.00 0.00 19.45 18.46 1a6x n ALA 129 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1a6x n ASP 130 N 1.67 3.51 0.00 0.00 2.03 -1.26 -3.87 116.55 118.64 1a6x n ASP 130 Ca 0.19 -2.46 0.00 0.00 0.52 0.00 0.00 54.79 53.04 1a6x n ASP 130 Cb 0.14 -0.39 0.00 0.00 -0.72 0.00 0.00 41.12 40.14 1a6x n ASP 130 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 1a6x n LYS 131 N 0.16 0.00 -1.29 -0.67 4.81 -1.26 -5.06 118.16 114.85 1a6x n LYS 131 Ca 0.17 0.00 -0.43 0.00 -0.87 0.00 0.00 58.31 57.18 1a6x n LYS 131 Cb 0.67 0.00 -0.02 0.00 0.02 0.00 0.00 35.03 35.70 1a6x n LYS 131 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00 1a6x n SER 132 N 0.00 -1.98 0.00 3.14 7.64 -1.26 -4.88 113.62 116.27 1a6x n SER 132 Ca 0.00 0.93 0.00 0.00 1.01 0.00 0.00 58.87 60.81 1a6x n SER 132 Cb 0.00 -0.88 0.00 0.00 -1.01 0.00 0.00 64.21 62.32 1a6x n SER 132 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1a6x n GLY 133 N 2.08 -1.33 3.58 0.23 0.00 -0.06 -4.94 105.19 104.74 1a6x n GLY 133 Ca 0.14 -0.96 -0.24 0.00 0.00 0.00 0.00 46.02 44.95 1a6x n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1a6x s THR 134 N -2.55 3.12 1.00 2.61 2.01 -1.26 -0.88 115.64 119.69 1a6x s THR 134 Ca 0.00 -1.97 -0.16 0.00 0.31 0.00 0.00 61.69 59.88 1a6x s THR 134 Cb 0.00 -2.63 0.01 0.00 0.01 0.00 0.00 72.50 69.89 1a6x s THR 134 CO 0.00 -0.30 -0.00 0.55 -0.69 0.00 0.00 174.62 174.17 1a6x n VAL 135 N -0.55 0.00 0.01 3.82 3.14 -1.15 0.19 118.33 123.78 1a6x n VAL 135 Ca -0.07 -0.25 0.00 0.00 -2.96 0.00 0.00 64.34 61.05 1a6x n VAL 135 Cb 0.58 -0.48 0.00 0.00 -1.06 0.00 0.00 33.84 32.88 1a6x n VAL 135 CO 0.00 0.00 0.00 1.17 -6.46 0.00 0.00 176.83 171.54 1a6x n LYS 136 N -0.85 0.00 0.00 1.45 0.00 0.43 -3.85 118.16 115.34 1a6x n LYS 136 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.34 1a6x n LYS 136 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.60 1a6x n LYS 136 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1a6x n ALA 137 N -2.55 0.00 -2.77 3.14 0.00 0.06 -4.95 120.51 113.43 1a6x n ALA 137 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.08 1a6x n ALA 137 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.35 1a6x n ALA 137 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1a6x s ILE 138 N -0.30 5.01 -0.23 0.00 1.09 -1.26 0.19 121.20 125.70 1a6x s ILE 138 Ca 0.00 0.06 -0.09 0.00 -1.10 0.00 0.00 60.65 59.52 1a6x s ILE 138 Cb 0.00 -3.31 -0.18 0.00 -1.06 0.00 0.00 42.46 37.91 1a6x s ILE 138 CO 0.00 0.39 -0.07 0.18 -0.10 0.00 0.00 174.94 175.34 1a6x n LEU 139 N 4.09 2.42 -4.79 2.97 4.77 -0.25 -4.96 117.00 121.25 1a6x n LEU 139 Ca -0.16 0.17 -0.31 0.00 -0.03 0.00 0.00 56.01 55.68 1a6x n LEU 139 Cb 0.52 -0.94 0.07 0.00 -2.33 0.00 0.00 43.42 40.74 1a6x n LEU 139 CO 0.35 0.70 0.70 0.54 -1.33 0.00 0.00 177.39 178.35 1a6x s VAL 140 N -2.50 3.66 -0.02 4.08 0.11 -0.69 -5.06 120.40 119.98 1a6x s VAL 140 Ca -0.33 0.54 0.07 0.00 -2.93 0.00 0.00 61.98 59.33 1a6x s VAL 140 Cb 0.10 -3.16 -0.02 0.00 -1.53 0.00 0.00 36.38 31.77 1a6x s VAL 140 CO 0.60 -0.71 -0.23 -0.70 -3.33 0.00 0.00 175.10 170.73 1a6x s GLU 141 N -4.98 1.93 -0.72 1.54 2.12 -1.26 -5.00 118.70 112.32 1a6x s GLU 141 Ca 0.60 -0.83 -0.30 0.00 0.36 0.00 0.00 54.97 54.80 1a6x s GLU 141 Cb -0.15 -1.84 -0.15 0.00 0.26 0.00 0.00 34.13 32.25 1a6x s GLU 141 CO 0.55 0.48 2.53 -1.13 -0.54 0.00 0.00 175.26 177.15 1a6x n SER 142 N 2.57 1.28 0.00 -1.70 3.41 -1.26 0.13 113.62 118.06 1a6x n SER 142 Ca -0.16 -0.07 0.00 0.00 -0.26 0.00 0.00 58.87 58.39 1a6x n SER 142 Cb 0.52 -1.22 0.00 0.00 -0.26 0.00 0.00 64.21 63.25 1a6x n SER 142 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1a6x n GLY 143 N 6.33 1.90 3.53 5.00 0.00 0.22 -4.91 105.19 117.26 1a6x n GLY 143 Ca 0.52 -0.63 -0.37 0.00 0.00 0.00 0.00 46.02 45.53 1a6x n GLY 143 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1a6x n GLN 144 N 0.00 0.58 -1.54 1.61 3.00 0.35 -4.44 117.38 116.95 1a6x n GLN 144 Ca 0.00 0.24 -0.29 0.00 -0.01 0.00 0.00 57.00 56.94 1a6x n GLN 144 Cb 0.00 -1.95 0.13 0.00 0.00 0.00 0.00 30.24 28.42 1a6x n GLN 144 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.06 175.81 1a6x s PRO 145 N -2.62 1.32 0.07 -1.09 0.04 -1.26 -0.97 135.00 130.50 1a6x s PRO 145 Ca 0.71 0.36 0.01 0.00 0.04 0.00 0.00 61.00 62.12 1a6x s PRO 145 Cb -0.40 -1.85 -0.04 0.00 0.04 0.00 0.00 34.50 32.25 1a6x s PRO 145 CO 0.52 -2.09 -0.06 0.14 0.04 0.00 0.00 177.00 175.55 1a6x s VAL 146 N -3.26 0.55 0.09 -0.36 -7.23 0.52 -4.65 120.40 106.07 1a6x s VAL 146 Ca 0.63 -1.65 0.01 0.00 -1.81 0.00 0.00 61.98 59.16 1a6x s VAL 146 Cb -0.15 -1.32 -0.04 0.00 0.56 0.00 0.00 36.38 35.43 1a6x s VAL 146 CO 0.53 -0.75 -0.06 -0.70 -0.31 0.00 0.00 175.10 173.81 1a6x s GLU 147 N -3.17 0.80 0.09 4.82 2.12 -1.26 -1.32 118.70 120.78 1a6x s GLU 147 Ca 0.04 -1.31 -0.31 0.00 0.36 0.00 0.00 54.97 53.76 1a6x s GLU 147 Cb 0.01 -0.17 -0.08 0.00 0.26 0.00 0.00 34.13 34.15 1a6x s GLU 147 CO -0.04 -0.02 1.55 0.12 -0.54 0.00 0.00 175.26 176.33 1a6x s PHE 148 N -3.58 2.78 0.00 5.30 2.19 -1.26 -1.10 117.98 122.30 1a6x s PHE 148 Ca 0.11 0.57 0.00 0.00 0.33 0.00 0.00 56.93 57.94 1a6x s PHE 148 Cb 0.05 -3.87 0.00 0.00 -1.31 0.00 0.00 43.02 37.89 1a6x s PHE 148 CO -0.05 -3.32 0.00 -3.47 1.83 0.00 0.00 175.22 170.21 1a6x n ASP 149 N 4.87 -0.38 -4.81 6.13 -0.08 -1.13 -5.01 116.55 116.14 1a6x n ASP 149 Ca 0.14 0.00 -0.36 0.00 -1.51 0.00 0.00 54.79 53.06 1a6x n ASP 149 Cb 0.41 -0.06 -0.06 0.00 2.34 0.00 0.00 41.12 43.74 1a6x n ASP 149 CO 0.00 0.00 0.00 -0.70 0.12 0.00 0.00 177.20 176.62 1a6x s GLU 150 N -0.09 4.33 0.60 -0.67 2.12 -0.26 -4.87 118.70 119.86 1a6x s GLU 150 Ca 0.00 1.01 -0.15 0.00 0.36 0.00 0.00 54.97 56.19 1a6x s GLU 150 Cb 0.00 -2.76 -0.03 0.00 0.26 0.00 0.00 34.13 31.60 1a6x s GLU 150 CO 0.00 0.30 1.05 -1.25 -0.54 0.00 0.00 175.26 174.82 1a6x s PRO 151 N -2.18 3.32 0.00 4.30 0.04 -1.26 0.24 135.00 139.45 1a6x s PRO 151 Ca 0.48 1.14 0.00 0.00 0.04 0.00 0.00 61.00 62.65 1a6x s PRO 151 Cb -0.16 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.34 1a6x s PRO 151 CO 0.21 -0.80 0.00 1.28 0.04 0.00 0.00 177.00 177.73 1a6x n LEU 152 N -2.17 0.00 -4.10 -3.56 4.77 0.23 -4.65 117.00 107.53 1a6x n LEU 152 Ca 0.08 0.00 -0.22 0.00 -0.03 0.00 0.00 56.01 55.84 1a6x n LEU 152 Cb 0.53 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 41.47 1a6x n LEU 152 CO 0.49 0.00 -0.47 -0.69 -1.33 0.00 0.00 177.39 175.39 1a6x s VAL 153 N 0.00 1.07 -0.18 4.08 1.01 -1.21 -1.09 120.40 124.08 1a6x s VAL 153 Ca 0.00 -0.57 -0.14 0.00 0.00 0.00 0.00 61.98 61.27 1a6x s VAL 153 Cb 0.00 -0.90 -0.04 0.00 0.00 0.00 0.00 36.38 35.44 1a6x s VAL 153 CO 0.00 0.31 0.31 -0.69 0.00 0.00 0.00 175.10 175.03 1a6x s VAL 154 N -0.27 5.28 0.32 2.92 1.01 0.50 -0.24 120.40 129.92 1a6x s VAL 154 Ca 0.04 0.55 0.09 0.00 0.00 0.00 0.00 61.98 62.66 1a6x s VAL 154 Cb -0.06 -3.65 -0.05 0.00 0.00 0.00 0.00 36.38 32.63 1a6x s VAL 154 CO -0.00 0.34 0.07 -0.63 0.00 0.00 0.00 175.10 174.88 1a6x s ILE 155 N 0.82 3.02 0.00 2.22 1.09 0.12 -0.43 121.20 128.04 1a6x s ILE 155 Ca 0.16 -1.82 0.00 0.00 -1.10 0.00 0.00 60.65 57.89 1a6x s ILE 155 Cb -0.14 -2.90 0.00 0.00 -1.06 0.00 0.00 42.46 38.37 1a6x s ILE 155 CO 0.05 -0.23 0.00 1.21 -0.10 0.00 0.00 174.94 175.87