#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a6x s GLU 71 N 0.00 4.45 0.00 3.17 2.12 -1.26 -4.44 118.70 122.74 1a6x s GLU 71 Ca 0.00 1.89 0.00 0.00 0.36 0.00 0.00 54.97 57.22 1a6x s GLU 71 Cb 0.00 -3.26 0.00 0.00 0.26 0.00 0.00 34.13 31.13 1a6x s GLU 71 CO 0.00 -0.18 0.00 0.00 -0.54 0.00 0.00 175.26 174.54 1a6x n ALA 72 N 2.99 0.00 -0.89 6.30 0.00 -1.26 -5.00 120.51 122.65 1a6x n ALA 72 Ca 0.06 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.29 1a6x n ALA 72 Cb 0.45 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.83 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 0.00 2.28 -3.06 0.00 -0.04 -1.26 -4.68 135.00 128.24 1a6x n PRO 73 Ca 0.00 -1.38 -0.00 0.00 -0.04 0.00 0.00 63.50 62.08 1a6x n PRO 73 Cb 0.00 -2.32 -0.00 0.00 -0.04 0.00 0.00 33.50 31.14 1a6x n PRO 73 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1a6x n ALA 74 N 3.44 -2.30 0.06 0.55 0.00 -1.26 -4.98 120.51 116.02 1a6x n ALA 74 Ca 0.49 0.19 0.00 0.00 0.00 0.00 0.00 53.44 54.12 1a6x n ALA 74 Cb 0.37 -0.75 0.00 0.00 0.00 0.00 0.00 19.45 19.07 1a6x n ALA 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1a6x n ALA 75 N 1.29 3.00 -1.34 0.00 0.00 -1.26 -5.00 120.51 117.19 1a6x n ALA 75 Ca -0.01 0.00 -0.53 0.00 0.00 0.00 0.00 53.44 52.89 1a6x n ALA 75 Cb 0.35 0.18 -0.12 0.00 0.00 0.00 0.00 19.45 19.85 1a6x n ALA 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1a6x n ALA 76 N -3.39 0.30 -3.15 0.00 0.00 -1.26 -4.78 120.51 108.23 1a6x n ALA 76 Ca 0.00 0.02 0.06 0.00 0.00 0.00 0.00 53.44 53.51 1a6x n ALA 76 Cb 0.00 -2.18 -0.00 0.00 0.00 0.00 0.00 19.45 17.27 1a6x n ALA 76 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1a6x s GLU 77 N 6.95 0.05 -0.23 0.00 2.12 -1.26 -5.15 118.70 121.18 1a6x s GLU 77 Ca 1.24 0.05 -0.06 0.00 0.36 0.00 0.00 54.97 56.56 1a6x s GLU 77 Cb -1.37 0.02 0.12 0.00 0.26 0.00 0.00 34.13 33.16 1a6x s GLU 77 CO 0.59 -0.09 0.46 -1.50 -0.54 0.00 0.00 175.26 174.18 1a6x s ILE 78 N 2.99 -0.72 0.00 -3.70 -1.16 -1.26 -5.01 121.20 112.33 1a6x s ILE 78 Ca 0.32 0.07 0.00 0.00 -0.51 0.00 0.00 60.65 60.53 1a6x s ILE 78 Cb 0.00 -0.78 0.00 0.00 0.61 0.00 0.00 42.46 42.29 1a6x s ILE 78 CO -0.22 0.01 0.00 -1.20 -2.81 0.00 0.00 174.94 170.71 1a6x n SER 79 N 5.40 0.00 -2.84 4.50 7.64 -1.26 -4.75 113.62 122.31 1a6x n SER 79 Ca -0.07 0.00 -0.03 0.00 1.01 0.00 0.00 58.87 59.78 1a6x n SER 79 Cb 0.50 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.67 1a6x n SER 79 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1a6x n GLY 80 N 0.00 -2.48 3.41 0.23 0.00 -1.26 -4.99 105.19 100.10 1a6x n GLY 80 Ca 0.00 0.85 -0.21 0.00 0.00 0.00 0.00 46.02 46.66 1a6x n GLY 80 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1a6x s HIS 81 N -0.31 2.01 -0.12 1.61 5.04 0.13 -4.92 115.29 118.73 1a6x s HIS 81 Ca -0.14 -0.45 -0.02 0.00 -1.54 0.00 0.00 55.06 52.92 1a6x s HIS 81 Cb 0.01 -0.90 0.04 0.00 0.04 0.00 0.00 32.58 31.77 1a6x s HIS 81 CO 0.37 0.54 0.01 0.42 -2.34 0.00 0.00 174.74 173.74 1a6x s ILE 82 N -2.72 0.45 -0.32 0.89 -1.09 -1.26 -0.28 121.20 116.87 1a6x s ILE 82 Ca 0.26 -0.17 -0.27 0.00 -2.23 0.00 0.00 60.65 58.24 1a6x s ILE 82 Cb -0.03 -0.75 0.01 0.00 -1.58 0.00 0.00 42.46 40.11 1a6x s ILE 82 CO 0.11 0.07 0.97 -0.69 -1.23 0.00 0.00 174.94 174.17 1a6x s VAL 83 N 1.92 4.61 -0.16 2.92 1.01 -0.06 -4.95 120.40 125.69 1a6x s VAL 83 Ca 0.03 1.52 -0.02 0.00 0.00 0.00 0.00 61.98 63.51 1a6x s VAL 83 Cb -0.14 -4.32 -0.02 0.00 0.00 0.00 0.00 36.38 31.90 1a6x s VAL 83 CO -0.07 -0.40 -0.09 -0.13 0.00 0.00 0.00 175.10 174.41 1a6x s ARG 84 N 3.40 3.46 -0.64 2.72 0.52 -1.26 0.17 118.95 127.32 1a6x s ARG 84 Ca 0.41 -0.63 -0.34 0.00 -0.52 0.00 0.00 55.73 54.65 1a6x s ARG 84 Cb -0.13 -2.79 -0.16 0.00 0.52 0.00 0.00 34.95 32.39 1a6x s ARG 84 CO 0.14 0.13 2.41 -1.13 0.02 0.00 0.00 175.30 176.87 1a6x n SER 85 N 3.82 1.25 0.00 0.23 3.41 0.14 -4.72 113.62 117.74 1a6x n SER 85 Ca -0.18 0.20 0.12 0.00 -0.26 0.00 0.00 58.87 58.75 1a6x n SER 85 Cb 0.52 -1.13 0.69 0.00 -0.26 0.00 0.00 64.21 64.03 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 8.33 0.75 -3.64 4.33 -0.04 -1.26 -3.01 135.00 140.46 1a6x n PRO 86 Ca 0.52 0.00 -0.05 0.00 -0.04 0.00 0.00 63.50 63.92 1a6x n PRO 86 Cb 0.17 -1.49 -0.06 0.00 -0.04 0.00 0.00 33.50 32.08 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 0.66 0.37 0.54 1.75 -1.26 -4.97 119.30 114.39 1a6x s MET 87 Ca 0.35 1.28 -0.28 0.00 -1.25 0.00 0.00 55.69 55.78 1a6x s MET 87 Cb 0.16 0.34 -0.11 0.00 2.84 0.00 0.00 34.83 38.06 1a6x s MET 87 CO 0.27 -0.16 1.52 0.08 -0.65 0.00 0.00 175.02 176.07 1a6x s VAL 88 N 1.98 2.01 0.00 10.11 1.01 -1.26 -4.69 120.40 129.56 1a6x s VAL 88 Ca -0.09 0.01 0.00 0.00 0.00 0.00 0.00 61.98 61.90 1a6x s VAL 88 Cb -0.07 -3.00 0.00 0.00 0.00 0.00 0.00 36.38 33.31 1a6x s VAL 88 CO -0.19 0.00 0.00 0.61 0.00 0.00 0.00 175.10 175.52 1a6x n GLY 89 N 0.72 -0.56 3.39 4.51 0.00 -0.52 -4.76 105.19 107.97 1a6x n GLY 89 Ca 0.02 0.09 -0.19 0.00 0.00 0.00 0.00 46.02 45.94 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 1.10 -0.01 2.61 2.01 -0.10 -0.22 115.64 121.02 1a6x s THR 90 Ca 0.00 -2.03 0.01 0.00 0.31 0.00 0.00 61.69 59.98 1a6x s THR 90 Cb 0.00 -2.57 0.01 0.00 0.01 0.00 0.00 72.50 69.95 1a6x s THR 90 CO 0.00 -0.15 -0.02 0.12 -0.69 0.00 0.00 174.62 173.88 1a6x s PHE 91 N -3.37 0.31 0.11 4.92 2.19 -0.05 -0.98 117.98 121.10 1a6x s PHE 91 Ca 0.33 -0.04 0.06 0.00 0.33 0.00 0.00 56.93 57.61 1a6x s PHE 91 Cb 0.07 -0.29 -0.03 0.00 -1.31 0.00 0.00 43.02 41.46 1a6x s PHE 91 CO 0.12 -0.06 -0.15 0.71 1.83 0.00 0.00 175.22 177.68 1a6x s TYR 92 N 0.39 1.38 -0.58 10.12 2.02 0.78 -0.43 117.35 131.03 1a6x s TYR 92 Ca -0.04 -0.52 0.20 0.00 -0.37 0.00 0.00 57.07 56.35 1a6x s TYR 92 Cb -0.07 -0.74 -0.26 0.00 -0.40 0.00 0.00 41.96 40.50 1a6x s TYR 92 CO -0.01 0.12 0.69 0.54 -1.57 0.00 0.00 175.55 175.33 1a6x n ARG 93 N 0.80 0.49 -4.23 -0.62 5.12 -1.26 -0.93 116.66 116.03 1a6x n ARG 93 Ca -0.17 -0.07 -0.17 0.00 -1.93 0.00 0.00 57.85 55.50 1a6x n ARG 93 Cb 0.56 -1.46 -0.11 0.00 -1.16 0.00 0.00 32.46 30.29 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 -3.10 1.23 0.09 0.55 -4.23 -1.26 -1.31 115.64 107.61 1a6x s THR 94 Ca 0.02 -1.75 0.16 0.00 -1.18 0.00 0.00 61.69 58.94 1a6x s THR 94 Cb 0.14 -1.54 0.07 0.00 1.34 0.00 0.00 72.50 72.51 1a6x s THR 94 CO 0.83 -0.49 1.60 1.55 -0.54 0.00 0.00 174.62 177.58 1a6x h PRO 95 N 3.42 0.00 -4.51 3.99 0.13 -1.89 -3.47 132.00 129.68 1a6x h PRO 95 Ca -0.39 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 64.42 1a6x h PRO 95 Cb 1.19 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.21 1a6x h PRO 95 CO 0.53 0.49 -0.41 -1.12 -0.23 0.00 0.00 178.00 177.25 1a6x s SER 96 N -6.50 0.93 0.12 1.44 0.01 -1.26 -5.06 113.70 103.38 1a6x s SER 96 Ca 0.01 -1.52 -0.07 0.00 1.31 0.00 0.00 55.95 55.67 1a6x s SER 96 Cb 0.10 0.54 -0.11 0.00 0.21 0.00 0.00 66.02 66.77 1a6x s SER 96 CO 0.72 -1.07 1.31 1.55 0.41 0.00 0.00 173.24 176.15 1a6x h PRO 97 N 2.27 0.55 -1.99 12.44 0.13 -1.99 -3.29 132.00 140.12 1a6x h PRO 97 Ca -0.29 -0.53 -0.71 0.00 -0.87 0.00 0.00 66.00 63.61 1a6x h PRO 97 Cb 1.24 0.14 -0.33 0.00 0.13 0.00 0.00 31.00 32.17 1a6x h PRO 97 CO 0.41 1.16 0.34 -3.47 -0.23 0.00 0.00 178.00 176.21 1a6x n ASP 98 N -3.82 6.30 -3.99 1.44 2.03 -1.26 -4.97 116.55 112.27 1a6x n ASP 98 Ca -0.07 -3.75 -0.10 0.00 0.52 0.00 0.00 54.79 51.39 1a6x n ASP 98 Cb 0.80 -0.86 -0.11 0.00 -0.72 0.00 0.00 41.12 40.23 1a6x n ASP 98 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1a6x s ALA 99 N -3.91 0.20 1.17 -1.67 0.00 -1.24 -5.15 121.76 111.16 1a6x s ALA 99 Ca 0.47 -0.60 -0.13 0.00 0.00 0.00 0.00 51.96 51.70 1a6x s ALA 99 Cb 0.34 0.13 0.29 0.00 0.00 0.00 0.00 23.12 23.88 1a6x s ALA 99 CO -0.25 -0.13 1.01 1.63 0.00 0.00 0.00 175.76 178.02 1a6x n LYS 100 N 1.62 -2.41 -2.93 0.00 4.01 -1.26 -4.81 118.16 112.37 1a6x n LYS 100 Ca -0.23 -0.67 -0.40 0.00 -0.51 0.00 0.00 58.31 56.49 1a6x n LYS 100 Cb 0.55 -2.17 -0.05 0.00 -0.51 0.00 0.00 35.03 32.85 1a6x n LYS 100 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1a6x s ALA 101 N -2.41 3.32 0.28 7.82 0.00 -1.26 -4.51 121.76 125.00 1a6x s ALA 101 Ca 0.69 0.32 0.03 0.00 0.00 0.00 0.00 51.96 52.99 1a6x s ALA 101 Cb -0.25 -3.06 0.67 0.00 0.00 0.00 0.00 23.12 20.47 1a6x s ALA 101 CO 0.65 -0.02 1.74 0.74 0.00 0.00 0.00 175.76 178.87 1a6x h PHE 102 N 6.04 0.83 -2.97 0.00 0.04 -1.55 -3.36 116.94 115.96 1a6x h PHE 102 Ca -0.43 0.04 -0.44 0.00 2.80 0.00 0.00 57.97 59.94 1a6x h PHE 102 Cb 1.21 -0.23 -0.40 0.00 2.20 0.00 0.00 35.95 38.73 1a6x h PHE 102 CO 0.65 0.12 -0.73 -1.50 -0.60 0.00 0.00 178.31 176.25 1a6x s ILE 103 N -5.90 -0.12 -0.12 -0.55 -1.16 -1.26 -4.93 121.20 107.16 1a6x s ILE 103 Ca -0.12 -0.17 -0.19 0.00 -0.51 0.00 0.00 60.65 59.66 1a6x s ILE 103 Cb 0.24 -0.59 -0.04 0.00 0.61 0.00 0.00 42.46 42.68 1a6x s ILE 103 CO 0.79 -0.28 0.53 -1.61 -2.81 0.00 0.00 174.94 171.55 1a6x s GLU 104 N 2.16 4.34 -0.49 3.50 2.02 -1.26 -4.96 118.70 124.01 1a6x s GLU 104 Ca 0.03 0.54 -0.46 0.00 0.02 0.00 0.00 54.97 55.10 1a6x s GLU 104 Cb -0.16 -3.45 -0.19 0.00 0.10 0.00 0.00 34.13 30.42 1a6x s GLU 104 CO -0.10 0.10 1.80 0.28 0.02 0.00 0.00 175.26 177.36 1a6x n VAL 105 N 3.80 0.01 0.00 2.63 0.31 -1.26 -0.71 118.33 123.11 1a6x n VAL 105 Ca -0.05 -0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.27 1a6x n VAL 105 Cb 0.51 -0.53 0.00 0.00 -0.91 0.00 0.00 33.84 32.92 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 5.29 1.19 3.68 2.92 0.00 -1.26 -5.11 105.19 111.90 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 -0.34 2.43 0.40 1.61 0.74 0.11 -5.00 119.66 119.61 1a6x s GLN 107 Ca 0.00 -1.31 0.08 0.00 0.05 0.00 0.00 55.36 54.17 1a6x s GLN 107 Cb 0.00 -2.26 -0.02 0.00 1.10 0.00 0.00 33.01 31.83 1a6x s GLN 107 CO 0.00 0.38 0.38 0.21 -0.55 0.00 0.00 175.29 175.71 1a6x s LYS 108 N -3.62 2.61 -0.07 1.67 2.20 -1.26 -2.73 119.74 118.53 1a6x s LYS 108 Ca 0.31 -1.45 -0.06 0.00 -0.36 0.00 0.00 55.97 54.41 1a6x s LYS 108 Cb -0.07 -2.44 0.02 0.00 -1.51 0.00 0.00 37.83 33.83 1a6x s LYS 108 CO 0.21 -0.14 0.19 0.14 -0.36 0.00 0.00 175.35 175.38 1a6x s VAL 109 N -2.42 -0.00 0.07 4.02 -7.23 -0.06 -4.98 120.40 109.80 1a6x s VAL 109 Ca 0.47 0.02 0.08 0.00 -1.81 0.00 0.00 61.98 60.74 1a6x s VAL 109 Cb -0.04 -0.27 -0.03 0.00 0.56 0.00 0.00 36.38 36.59 1a6x s VAL 109 CO 0.28 0.01 -0.23 0.21 -0.31 0.00 0.00 175.10 175.06 1a6x s ASN 110 N 0.20 2.75 -0.54 4.85 2.47 -1.26 -1.03 114.94 122.37 1a6x s ASN 110 Ca -0.01 -0.62 -0.42 0.00 0.42 0.00 0.00 52.86 52.23 1a6x s ASN 110 Cb -0.02 -0.20 -0.19 0.00 -1.45 0.00 0.00 41.25 39.38 1a6x s ASN 110 CO -0.00 0.15 2.20 0.52 -3.72 0.00 0.00 177.10 176.25 1a6x n VAL 111 N 1.48 0.01 0.00 -5.21 0.31 -1.26 0.10 118.33 113.75 1a6x n VAL 111 Ca -0.18 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.14 1a6x n VAL 111 Cb 0.53 -0.54 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 7.37 1.16 3.61 2.92 0.00 -1.24 -5.05 105.19 113.95 1a6x n GLY 112 Ca 0.56 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.23 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 -0.80 4.95 0.39 1.61 -0.00 0.11 -4.90 116.67 118.03 1a6x s ASP 113 Ca 0.00 0.03 -0.27 0.00 -0.00 0.00 0.00 52.55 52.31 1a6x s ASP 113 Cb 0.00 -1.45 -0.10 0.00 -0.00 0.00 0.00 42.92 41.38 1a6x s ASP 113 CO 0.00 0.32 1.39 -0.89 -0.00 0.00 0.00 175.17 175.99 1a6x s THR 114 N -0.55 2.33 -0.08 -1.27 2.01 -1.26 -0.24 115.64 116.58 1a6x s THR 114 Ca 0.09 0.32 0.05 0.00 0.31 0.00 0.00 61.69 62.45 1a6x s THR 114 Cb -0.12 -3.19 -0.08 0.00 0.01 0.00 0.00 72.50 69.11 1a6x s THR 114 CO 0.02 0.06 -0.01 0.00 -0.69 0.00 0.00 174.62 174.01 1a6x n LEU 115 N 0.28 0.85 0.00 4.42 -0.00 0.02 -4.70 117.00 117.87 1a6x n LEU 115 Ca 0.02 -0.01 0.00 0.00 -0.00 0.00 0.00 56.01 56.02 1a6x n LEU 115 Cb 0.41 0.04 0.00 0.00 -0.00 0.00 0.00 43.42 43.87 1a6x n LEU 115 CO 0.60 0.32 0.00 0.00 -0.00 0.00 0.00 177.39 178.30 1a6x s ILE 117 N -2.06 0.15 -0.04 0.00 1.01 -0.11 -0.30 121.20 119.85 1a6x s ILE 117 Ca 0.00 -0.98 0.02 0.00 0.00 0.00 0.00 60.65 59.69 1a6x s ILE 117 Cb 0.00 -0.37 0.01 0.00 0.01 0.00 0.00 42.46 42.11 1a6x s ILE 117 CO 0.00 -0.52 -0.10 -0.69 0.00 0.00 0.00 174.94 173.63 1a6x s VAL 118 N -1.61 0.92 -0.20 2.92 1.01 0.95 -0.16 120.40 124.23 1a6x s VAL 118 Ca -0.14 -0.39 -0.09 0.00 0.00 0.00 0.00 61.98 61.35 1a6x s VAL 118 Cb -0.09 -0.84 -0.05 0.00 0.00 0.00 0.00 36.38 35.41 1a6x s VAL 118 CO -0.01 0.29 0.11 -0.70 0.00 0.00 0.00 175.10 174.79 1a6x s GLU 119 N 0.46 4.13 0.10 2.72 2.12 -0.15 0.23 118.70 128.30 1a6x s GLU 119 Ca -0.09 -0.25 -0.23 0.00 0.36 0.00 0.00 54.97 54.77 1a6x s GLU 119 Cb -0.12 -3.38 0.06 0.00 0.26 0.00 0.00 34.13 30.95 1a6x s GLU 119 CO 0.02 0.28 0.55 0.00 -0.54 0.00 0.00 175.26 175.57 1a6x s ALA 120 N 0.41 -1.44 -1.30 6.30 0.00 -0.46 -0.93 121.76 124.35 1a6x s ALA 120 Ca 0.07 0.52 0.00 0.00 0.00 0.00 0.00 51.96 52.55 1a6x s ALA 120 Cb -0.11 0.63 0.00 0.00 0.00 0.00 0.00 23.12 23.63 1a6x s ALA 120 CO -0.01 -0.64 0.00 -1.33 0.00 0.00 0.00 175.76 173.78 1a6x n MET 121 N -0.01 -1.31 -2.93 0.00 2.81 -1.26 0.20 117.12 114.62 1a6x n MET 121 Ca -0.17 0.72 -0.11 0.00 -1.81 0.00 0.00 57.70 56.33 1a6x n MET 121 Cb 0.63 -4.97 0.04 0.00 -0.71 0.00 0.00 33.22 28.22 1a6x n MET 121 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1a6x n LYS 122 N -1.86 -3.89 -3.58 0.03 4.76 -1.26 -5.03 118.16 107.32 1a6x n LYS 122 Ca -0.12 0.44 -0.17 0.00 -2.87 0.00 0.00 58.31 55.59 1a6x n LYS 122 Cb 0.41 -4.29 -0.07 0.00 -1.84 0.00 0.00 35.03 29.25 1a6x n LYS 122 CO 0.00 0.00 0.00 1.41 -1.37 0.00 0.00 177.40 177.44 1a6x s MET 123 N -5.23 0.97 0.18 1.97 1.75 0.13 -5.15 119.30 113.92 1a6x s MET 123 Ca 0.16 0.13 -0.30 0.00 -1.25 0.00 0.00 55.69 54.43 1a6x s MET 123 Cb -0.07 0.45 -0.08 0.00 2.84 0.00 0.00 34.83 37.97 1a6x s MET 123 CO 0.39 -0.30 0.98 -1.64 -0.65 0.00 0.00 175.02 173.80 1a6x s MET 124 N -1.29 4.74 -0.33 4.11 -1.94 -1.26 -1.35 119.30 121.99 1a6x s MET 124 Ca -0.11 1.52 -0.02 0.00 -1.71 0.00 0.00 55.69 55.37 1a6x s MET 124 Cb -0.01 -3.31 0.12 0.00 2.01 0.00 0.00 34.83 33.63 1a6x s MET 124 CO 0.08 0.31 0.17 -0.80 -0.01 0.00 0.00 175.02 174.77 1a6x s ASN 125 N -0.53 3.39 0.68 3.03 0.01 0.13 -4.96 114.94 116.69 1a6x s ASN 125 Ca 0.45 -1.78 -0.17 0.00 -0.71 0.00 0.00 52.86 50.65 1a6x s ASN 125 Cb -0.26 -0.48 0.01 0.00 0.41 0.00 0.00 41.25 40.93 1a6x s ASN 125 CO 0.32 -0.37 1.24 -1.10 -1.51 0.00 0.00 177.10 175.68 1a6x s GLN 126 N 1.51 2.42 -0.25 -0.60 -0.21 -1.26 -0.04 119.66 121.24 1a6x s GLN 126 Ca 0.13 1.89 -0.02 0.00 0.02 0.00 0.00 55.36 57.37 1a6x s GLN 126 Cb -0.20 -1.85 0.02 0.00 1.00 0.00 0.00 33.01 31.98 1a6x s GLN 126 CO -0.18 -1.65 -0.05 0.42 -2.12 0.00 0.00 175.29 171.71 1a6x s ILE 127 N -1.70 3.03 -0.18 1.08 -1.09 0.59 -4.80 121.20 118.14 1a6x s ILE 127 Ca 0.78 -0.93 -0.19 0.00 -2.23 0.00 0.00 60.65 58.08 1a6x s ILE 127 Cb -0.32 -2.52 -0.03 0.00 -1.58 0.00 0.00 42.46 38.00 1a6x s ILE 127 CO 0.41 0.22 0.55 -0.70 -1.23 0.00 0.00 174.94 174.19 1a6x s GLU 128 N 1.36 4.23 0.08 2.79 2.12 -1.26 -0.80 118.70 127.22 1a6x s GLU 128 Ca 0.01 0.50 -0.36 0.00 0.36 0.00 0.00 54.97 55.48 1a6x s GLU 128 Cb -0.16 -3.54 -0.18 0.00 0.26 0.00 0.00 34.13 30.50 1a6x s GLU 128 CO -0.04 -0.11 0.97 0.00 -0.54 0.00 0.00 175.26 175.54 1a6x n ALA 129 N 4.63 -2.83 -0.48 6.30 0.00 0.67 -4.84 120.51 123.95 1a6x n ALA 129 Ca -0.04 0.53 0.05 0.00 0.00 0.00 0.00 53.44 53.98 1a6x n ALA 129 Cb 0.50 -1.79 0.07 0.00 0.00 0.00 0.00 19.45 18.24 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 1.77 2.26 -2.87 0.00 -0.08 -1.26 -3.69 116.55 112.69 1a6x n ASP 130 Ca 0.19 -2.48 -0.01 0.00 -1.51 0.00 0.00 54.79 50.97 1a6x n ASP 130 Cb 0.15 -0.21 0.01 0.00 2.34 0.00 0.00 41.12 43.42 1a6x n ASP 130 CO 0.00 0.00 0.00 -0.75 0.12 0.00 0.00 177.20 176.57 1a6x s LYS 131 N -1.83 0.64 0.28 -0.67 2.20 -1.26 -5.05 119.74 114.04 1a6x s LYS 131 Ca 0.16 -0.46 -0.24 0.00 -0.36 0.00 0.00 55.97 55.07 1a6x s LYS 131 Cb 0.13 0.01 -0.16 0.00 -1.51 0.00 0.00 37.83 36.31 1a6x s LYS 131 CO 0.02 -0.85 0.32 -1.13 -0.36 0.00 0.00 175.35 173.35 1a6x n SER 132 N 3.42 -1.89 0.00 1.43 3.41 -1.26 -4.91 113.62 113.82 1a6x n SER 132 Ca 0.12 0.95 0.00 0.00 -0.26 0.00 0.00 58.87 59.68 1a6x n SER 132 Cb 0.60 -0.88 0.00 0.00 -0.26 0.00 0.00 64.21 63.66 1a6x n SER 132 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1a6x n GLY 133 N 2.06 -1.36 3.48 5.00 0.00 -0.20 -4.98 105.19 109.20 1a6x n GLY 133 Ca 0.14 -0.96 -0.28 0.00 0.00 0.00 0.00 46.02 44.92 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 -2.67 2.76 1.00 2.61 2.01 0.49 -0.88 115.64 120.96 1a6x s THR 134 Ca 0.00 -1.67 -0.18 0.00 0.31 0.00 0.00 61.69 60.15 1a6x s THR 134 Cb 0.00 -2.29 -0.13 0.00 0.01 0.00 0.00 72.50 70.09 1a6x s THR 134 CO 0.00 0.01 -0.76 0.55 -0.69 0.00 0.00 174.62 173.73 1a6x n VAL 135 N 0.55 0.00 0.00 3.82 3.14 -1.11 0.19 118.33 124.92 1a6x n VAL 135 Ca -0.14 -0.39 0.00 0.00 -2.96 0.00 0.00 64.34 60.85 1a6x n VAL 135 Cb 0.54 -0.09 0.00 0.00 -1.06 0.00 0.00 33.84 33.23 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 1.90 0.00 0.00 1.45 0.00 -0.52 -3.79 118.16 117.20 1a6x n LYS 136 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.30 1a6x n LYS 136 Cb 0.59 -0.08 0.00 0.00 0.00 0.00 0.00 35.03 35.54 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 -2.21 0.00 -2.81 3.14 0.00 -0.10 -4.96 120.51 113.58 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 -0.08 0.00 0.00 0.00 0.00 19.45 19.37 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 -0.29 5.11 -0.20 0.00 1.01 -1.26 0.19 121.20 125.76 1a6x s ILE 138 Ca 0.00 0.07 -0.08 0.00 0.00 0.00 0.00 60.65 60.64 1a6x s ILE 138 Cb 0.00 -3.24 -0.09 0.00 0.01 0.00 0.00 42.46 39.13 1a6x s ILE 138 CO 0.00 0.56 -0.24 0.18 0.00 0.00 0.00 174.94 175.44 1a6x n LEU 139 N 2.54 1.73 -4.68 2.97 4.77 -0.49 -4.94 117.00 118.90 1a6x n LEU 139 Ca -0.18 0.18 -0.29 0.00 -0.03 0.00 0.00 56.01 55.68 1a6x n LEU 139 Cb 0.54 -0.61 0.17 0.00 -2.33 0.00 0.00 43.42 41.19 1a6x n LEU 139 CO 0.32 0.50 0.64 0.54 -1.33 0.00 0.00 177.39 178.06 1a6x s VAL 140 N -2.37 2.28 0.40 4.08 0.11 -0.43 -5.06 120.40 119.40 1a6x s VAL 140 Ca -0.28 0.09 0.08 0.00 -2.93 0.00 0.00 61.98 58.94 1a6x s VAL 140 Cb 0.10 -2.54 -0.08 0.00 -1.53 0.00 0.00 36.38 32.33 1a6x s VAL 140 CO 0.37 -0.12 -0.00 -1.61 -3.33 0.00 0.00 175.10 170.41 1a6x s GLU 141 N -4.92 1.95 -1.07 1.54 8.01 -1.26 -5.00 118.70 117.95 1a6x s GLU 141 Ca 0.65 -2.06 -0.20 0.00 0.01 0.00 0.00 54.97 53.37 1a6x s GLU 141 Cb -0.19 -1.68 0.08 0.00 -4.31 0.00 0.00 34.13 28.04 1a6x s GLU 141 CO 0.58 -0.01 1.44 0.45 0.01 0.00 0.00 175.26 177.72 1a6x s SER 142 N -3.70 6.65 0.00 -0.19 0.15 -1.26 -2.80 113.70 112.54 1a6x s SER 142 Ca 0.35 -1.91 0.00 0.00 0.70 0.00 0.00 55.95 55.09 1a6x s SER 142 Cb 0.08 -2.52 0.00 0.00 -1.71 0.00 0.00 66.02 61.87 1a6x s SER 142 CO 0.18 -1.28 0.00 0.61 1.20 0.00 0.00 173.24 173.95 1a6x n GLY 143 N 6.05 0.85 3.82 9.45 0.00 0.43 -4.87 105.19 120.92 1a6x n GLY 143 Ca 0.35 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.04 1a6x n GLY 143 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1a6x s GLN 144 N 0.00 4.22 0.67 1.61 -0.21 -1.12 -4.77 119.66 120.06 1a6x s GLN 144 Ca 0.00 1.10 -0.12 0.00 0.02 0.00 0.00 55.36 56.36 1a6x s GLN 144 Cb 0.00 -2.21 -0.00 0.00 1.00 0.00 0.00 33.01 31.80 1a6x s GLN 144 CO 0.00 -0.01 1.06 -1.25 -2.12 0.00 0.00 175.29 172.96 1a6x s PRO 145 N -3.15 3.03 0.07 2.91 0.04 -1.26 -0.87 135.00 135.77 1a6x s PRO 145 Ca 0.61 0.99 -0.00 0.00 0.04 0.00 0.00 61.00 62.65 1a6x s PRO 145 Cb -0.09 -2.00 -0.04 0.00 0.04 0.00 0.00 34.50 32.41 1a6x s PRO 145 CO 0.13 -1.02 -0.04 0.14 0.04 0.00 0.00 177.00 176.25 1a6x s VAL 146 N -2.94 0.37 0.12 -0.36 -7.23 0.69 -4.77 120.40 106.28 1a6x s VAL 146 Ca 0.59 -1.85 0.04 0.00 -1.81 0.00 0.00 61.98 58.95 1a6x s VAL 146 Cb -0.14 -1.59 -0.04 0.00 0.56 0.00 0.00 36.38 35.17 1a6x s VAL 146 CO 0.51 -0.94 -0.10 -0.70 -0.31 0.00 0.00 175.10 173.56 1a6x s GLU 147 N -3.90 0.93 0.26 4.82 2.12 -1.26 -1.44 118.70 120.24 1a6x s GLU 147 Ca 0.09 -1.27 -0.30 0.00 0.36 0.00 0.00 54.97 53.85 1a6x s GLU 147 Cb 0.07 -0.57 -0.11 0.00 0.26 0.00 0.00 34.13 33.78 1a6x s GLU 147 CO -0.08 0.08 1.52 0.12 -0.54 0.00 0.00 175.26 176.36 1a6x s PHE 148 N -2.79 2.91 0.00 5.30 2.19 -1.26 -1.09 117.98 123.24 1a6x s PHE 148 Ca 0.10 0.88 0.00 0.00 0.33 0.00 0.00 56.93 58.24 1a6x s PHE 148 Cb -0.01 -3.94 0.00 0.00 -1.31 0.00 0.00 43.02 37.76 1a6x s PHE 148 CO 0.00 -3.15 0.00 -3.47 1.83 0.00 0.00 175.22 170.43 1a6x n ASP 149 N 2.44 0.00 -4.84 6.13 -0.08 -1.16 -5.01 116.55 114.02 1a6x n ASP 149 Ca 0.08 0.00 -0.33 0.00 -1.51 0.00 0.00 54.79 53.03 1a6x n ASP 149 Cb 0.39 0.00 -0.06 0.00 2.34 0.00 0.00 41.12 43.79 1a6x n ASP 149 CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 1a6x s GLU 150 N -0.19 4.06 0.87 -0.67 0.41 -0.25 -4.90 118.70 118.03 1a6x s GLU 150 Ca 0.00 0.70 -0.12 0.00 -0.41 0.00 0.00 54.97 55.14 1a6x s GLU 150 Cb 0.00 -2.56 0.11 0.00 -1.78 0.00 0.00 34.13 29.91 1a6x s GLU 150 CO 0.00 0.23 1.12 -1.25 -0.49 0.00 0.00 175.26 174.87 1a6x s PRO 151 N -2.71 1.48 0.00 0.39 0.04 -1.26 0.23 135.00 133.16 1a6x s PRO 151 Ca 0.51 0.42 0.00 0.00 0.04 0.00 0.00 61.00 61.96 1a6x s PRO 151 Cb -0.12 -1.87 0.00 0.00 0.04 0.00 0.00 34.50 32.55 1a6x s PRO 151 CO 0.18 -1.99 0.00 1.28 0.04 0.00 0.00 177.00 176.51 1a6x n LEU 152 N -3.65 0.00 -4.23 -3.56 4.77 0.45 -4.48 117.00 106.31 1a6x n LEU 152 Ca 0.07 0.00 -0.26 0.00 -0.03 0.00 0.00 56.01 55.79 1a6x n LEU 152 Cb 0.58 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 41.52 1a6x n LEU 152 CO 0.57 0.00 -0.52 -0.69 -1.33 0.00 0.00 177.39 175.42 1a6x s VAL 153 N 0.00 1.62 -0.21 4.08 1.01 -1.19 -1.32 120.40 124.39 1a6x s VAL 153 Ca 0.00 -1.01 -0.10 0.00 0.00 0.00 0.00 61.98 60.87 1a6x s VAL 153 Cb 0.00 -1.37 -0.05 0.00 0.00 0.00 0.00 36.38 34.96 1a6x s VAL 153 CO 0.00 0.34 0.13 -0.69 0.00 0.00 0.00 175.10 174.88 1a6x s VAL 154 N -0.62 5.38 0.33 2.92 1.01 0.51 -0.88 120.40 129.05 1a6x s VAL 154 Ca 0.08 0.18 0.10 0.00 0.00 0.00 0.00 61.98 62.34 1a6x s VAL 154 Cb -0.08 -3.47 -0.06 0.00 0.00 0.00 0.00 36.38 32.77 1a6x s VAL 154 CO 0.00 0.42 -0.10 -0.63 0.00 0.00 0.00 175.10 174.79 1a6x s ILE 155 N 0.51 2.36 0.00 2.22 1.09 0.62 -0.92 121.20 127.08 1a6x s ILE 155 Ca 0.08 -2.21 0.00 0.00 -1.10 0.00 0.00 60.65 57.42 1a6x s ILE 155 Cb -0.12 -2.60 0.00 0.00 -1.06 0.00 0.00 42.46 38.68 1a6x s ILE 155 CO -0.01 -0.24 0.00 -1.84 -0.10 0.00 0.00 174.94 172.75