#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 0.00 0.00 0.03 0.00 -1.23 -4.58 120.64 114.87 1a6x n GLU 71 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 1a6x n GLU 71 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.44 1a6x n GLU 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1a6x n ALA 72 N 0.00 0.00 0.08 4.31 0.00 -1.26 -5.01 120.51 118.63 1a6x n ALA 72 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.40 1a6x n ALA 72 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 1a6x n ALA 72 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1a6x h PRO 73 N 0.00 -0.26 -0.21 0.00 0.13 -2.08 -3.47 132.00 126.12 1a6x h PRO 73 Ca 0.00 0.02 0.05 0.00 -0.87 0.00 0.00 66.00 65.20 1a6x h PRO 73 Cb 0.00 0.06 -0.16 0.00 0.13 0.00 0.00 31.00 31.03 1a6x h PRO 73 CO 0.00 -0.17 -0.12 0.00 -0.23 0.00 0.00 178.00 177.47 1a6x s ALA 74 N -3.33 -4.46 -0.30 -0.56 0.00 -1.26 -5.11 121.76 106.75 1a6x s ALA 74 Ca -0.04 0.82 -0.11 0.00 0.00 0.00 0.00 51.96 52.63 1a6x s ALA 74 Cb 0.00 -2.99 0.18 0.00 0.00 0.00 0.00 23.12 20.31 1a6x s ALA 74 CO 0.12 -2.52 1.04 0.00 0.00 0.00 0.00 175.76 174.41 1a6x s ALA 75 N 1.32 -3.91 0.04 0.00 0.00 -1.26 -4.74 121.76 113.20 1a6x s ALA 75 Ca 0.20 1.36 -0.04 0.00 0.00 0.00 0.00 51.96 53.49 1a6x s ALA 75 Cb 0.09 -2.77 -0.01 0.00 0.00 0.00 0.00 23.12 20.43 1a6x s ALA 75 CO -0.12 -1.97 -0.08 0.00 0.00 0.00 0.00 175.76 173.60 1a6x n ALA 76 N 5.19 2.54 -2.82 0.00 0.00 -1.26 -3.52 120.51 120.64 1a6x n ALA 76 Ca 0.06 -0.18 -0.35 0.00 0.00 0.00 0.00 53.44 52.98 1a6x n ALA 76 Cb 0.57 0.20 -0.07 0.00 0.00 0.00 0.00 19.45 20.15 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 -2.19 3.24 0.54 0.00 2.12 -1.26 -5.00 118.70 116.15 1a6x s GLU 77 Ca -0.06 -0.34 0.00 0.00 0.36 0.00 0.00 54.97 54.93 1a6x s GLU 77 Cb 0.01 -2.99 0.00 0.00 0.26 0.00 0.00 34.13 31.41 1a6x s GLU 77 CO 0.09 0.70 0.00 0.44 -0.54 0.00 0.00 175.26 175.95 1a6x n ILE 78 N 1.52 0.00 -3.65 -3.70 -5.35 -1.26 -4.94 119.36 101.98 1a6x n ILE 78 Ca -0.15 0.00 0.03 0.00 -0.27 0.00 0.00 62.75 62.35 1a6x n ILE 78 Cb 0.53 0.00 -0.06 0.00 -1.74 0.00 0.00 39.64 38.37 1a6x n ILE 78 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1a6x s SER 79 N -4.00 -0.02 0.00 7.28 1.04 -1.26 -5.00 113.70 111.74 1a6x s SER 79 Ca 0.00 0.03 0.00 0.00 0.48 0.00 0.00 55.95 56.46 1a6x s SER 79 Cb 0.00 0.96 0.00 0.00 0.10 0.00 0.00 66.02 67.08 1a6x s SER 79 CO 0.00 -0.01 0.00 0.61 0.98 0.00 0.00 173.24 174.82 1a6x n GLY 80 N 2.96 -2.84 2.86 7.32 0.00 -1.26 -5.02 105.19 109.20 1a6x n GLY 80 Ca -0.17 -0.93 -0.14 0.00 0.00 0.00 0.00 46.02 44.78 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 -0.47 -0.05 -0.28 1.61 5.04 0.60 -4.95 115.29 116.80 1a6x s HIS 81 Ca 0.00 0.21 -0.11 0.00 -1.54 0.00 0.00 55.06 53.63 1a6x s HIS 81 Cb 0.00 -0.11 -0.05 0.00 0.04 0.00 0.00 32.58 32.46 1a6x s HIS 81 CO 0.00 -0.09 0.18 0.42 -2.34 0.00 0.00 174.74 172.91 1a6x s ILE 82 N 0.73 5.22 0.10 0.89 1.09 -1.26 -1.23 121.20 126.73 1a6x s ILE 82 Ca -0.06 0.14 -0.31 0.00 -1.10 0.00 0.00 60.65 59.32 1a6x s ILE 82 Cb -0.08 -3.48 -0.08 0.00 -1.06 0.00 0.00 42.46 37.76 1a6x s ILE 82 CO -0.03 0.26 1.41 -0.69 -0.10 0.00 0.00 174.94 175.80 1a6x s VAL 83 N 1.72 3.33 -0.23 2.92 1.01 0.26 -4.93 120.40 124.48 1a6x s VAL 83 Ca 0.07 0.92 -0.01 0.00 0.00 0.00 0.00 61.98 62.96 1a6x s VAL 83 Cb -0.16 -3.59 0.02 0.00 0.00 0.00 0.00 36.38 32.65 1a6x s VAL 83 CO 0.10 0.06 -0.08 -0.13 0.00 0.00 0.00 175.10 175.05 1a6x s ARG 84 N 1.38 2.93 -0.84 2.72 0.52 -1.26 -0.03 118.95 124.37 1a6x s ARG 84 Ca 0.65 -0.91 -0.33 0.00 -0.52 0.00 0.00 55.73 54.63 1a6x s ARG 84 Cb -0.36 -2.92 -0.19 0.00 0.52 0.00 0.00 34.95 31.99 1a6x s ARG 84 CO 0.30 -0.34 2.56 -1.13 0.02 0.00 0.00 175.30 176.71 1a6x n SER 85 N 4.68 0.67 0.00 0.23 3.41 0.14 -4.70 113.62 118.04 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 0.48 -1.00 0.68 0.00 -0.26 0.00 0.00 64.21 64.10 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 8.38 0.75 -3.64 4.33 -0.04 -1.26 -2.76 135.00 140.76 1a6x n PRO 86 Ca 0.60 0.00 -0.05 0.00 -0.04 0.00 0.00 63.50 64.01 1a6x n PRO 86 Cb 0.08 -1.48 -0.07 0.00 -0.04 0.00 0.00 33.50 32.00 1a6x n PRO 86 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 1a6x s MET 87 N -2.00 0.47 0.46 0.54 -1.94 -1.26 -4.98 119.30 110.59 1a6x s MET 87 Ca 0.34 0.73 -0.24 0.00 -1.71 0.00 0.00 55.69 54.81 1a6x s MET 87 Cb 0.16 0.14 -0.08 0.00 2.01 0.00 0.00 34.83 37.06 1a6x s MET 87 CO 0.26 -0.09 1.35 0.08 -0.01 0.00 0.00 175.02 176.61 1a6x s VAL 88 N 1.08 2.35 0.00 -6.03 1.01 -1.26 -4.72 120.40 112.82 1a6x s VAL 88 Ca -0.06 0.29 0.00 0.00 0.00 0.00 0.00 61.98 62.22 1a6x s VAL 88 Cb -0.04 -3.17 0.00 0.00 0.00 0.00 0.00 36.38 33.17 1a6x s VAL 88 CO -0.13 0.03 0.00 0.61 0.00 0.00 0.00 175.10 175.61 1a6x n GLY 89 N 0.63 -0.59 3.03 4.51 0.00 -0.35 -4.68 105.19 107.75 1a6x n GLY 89 Ca 0.06 -0.30 -0.30 0.00 0.00 0.00 0.00 46.02 45.49 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 -3.43 1.55 -0.01 2.61 2.01 0.31 -0.59 115.64 118.08 1a6x s THR 90 Ca 0.00 -0.64 -0.22 0.00 0.31 0.00 0.00 61.69 61.15 1a6x s THR 90 Cb 0.00 -1.44 -0.05 0.00 0.01 0.00 0.00 72.50 71.02 1a6x s THR 90 CO 0.00 0.45 0.64 0.12 -0.69 0.00 0.00 174.62 175.15 1a6x s PHE 91 N 1.30 3.67 0.02 4.92 2.19 -0.29 -0.02 117.98 129.77 1a6x s PHE 91 Ca 0.01 1.25 0.04 0.00 0.33 0.00 0.00 56.93 58.56 1a6x s PHE 91 Cb -0.14 -2.68 -0.01 0.00 -1.31 0.00 0.00 43.02 38.88 1a6x s PHE 91 CO -0.07 0.29 -0.12 0.71 1.83 0.00 0.00 175.22 177.86 1a6x s TYR 92 N 0.02 1.04 -0.09 10.12 2.02 0.15 0.48 117.35 131.09 1a6x s TYR 92 Ca 0.33 -0.28 0.22 0.00 -0.37 0.00 0.00 57.07 56.98 1a6x s TYR 92 Cb -0.18 -0.64 -0.31 0.00 -0.40 0.00 0.00 41.96 40.43 1a6x s TYR 92 CO 0.18 -0.00 0.54 0.54 -1.57 0.00 0.00 175.55 175.24 1a6x n ARG 93 N 2.33 0.63 -4.16 -0.62 1.74 -1.26 -0.48 116.66 114.83 1a6x n ARG 93 Ca -0.16 -0.17 -0.15 0.00 -0.77 0.00 0.00 57.85 56.60 1a6x n ARG 93 Cb 0.56 -1.54 -0.11 0.00 -1.02 0.00 0.00 32.46 30.34 1a6x n ARG 93 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 1a6x s THR 94 N -3.49 0.92 -0.40 0.55 -4.23 -1.26 -1.42 115.64 106.31 1a6x s THR 94 Ca -0.07 -1.49 0.27 0.00 -1.18 0.00 0.00 61.69 59.22 1a6x s THR 94 Cb 0.14 -1.19 0.31 0.00 1.34 0.00 0.00 72.50 73.10 1a6x s THR 94 CO 0.90 -0.46 1.77 1.55 -0.54 0.00 0.00 174.62 177.84 1a6x h PRO 95 N 3.85 0.00 -3.95 3.99 0.13 -1.87 -3.46 132.00 130.70 1a6x h PRO 95 Ca -0.38 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.63 1a6x h PRO 95 Cb 1.19 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 32.21 1a6x h PRO 95 CO 0.48 0.00 -0.26 -1.12 -0.23 0.00 0.00 178.00 176.87 1a6x s SER 96 N -5.12 0.05 0.21 1.44 0.01 -1.26 -5.04 113.70 103.99 1a6x s SER 96 Ca 0.06 -1.10 0.07 0.00 1.31 0.00 0.00 55.95 56.29 1a6x s SER 96 Cb 0.09 0.54 0.13 0.00 0.21 0.00 0.00 66.02 66.98 1a6x s SER 96 CO 0.55 -1.07 1.47 1.55 0.41 0.00 0.00 173.24 176.15 1a6x h PRO 97 N 2.34 0.08 -1.00 12.44 0.13 -1.98 -3.22 132.00 140.80 1a6x h PRO 97 Ca -0.29 -0.08 -0.59 0.00 -0.87 0.00 0.00 66.00 64.17 1a6x h PRO 97 Cb 1.25 0.02 -0.39 0.00 0.13 0.00 0.00 31.00 32.00 1a6x h PRO 97 CO 0.40 0.80 -0.39 -3.47 -0.23 0.00 0.00 178.00 175.12 1a6x n ASP 98 N -3.68 5.54 -4.21 1.44 -0.08 -1.26 -4.99 116.55 109.31 1a6x n ASP 98 Ca -0.02 -3.76 -0.24 0.00 -1.51 0.00 0.00 54.79 49.27 1a6x n ASP 98 Cb 0.73 -0.52 -0.14 0.00 2.34 0.00 0.00 41.12 43.54 1a6x n ASP 98 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1a6x s ALA 99 N -3.66 1.54 1.03 -1.67 0.00 -1.22 -5.13 121.76 112.66 1a6x s ALA 99 Ca 0.53 -0.96 -0.20 0.00 0.00 0.00 0.00 51.96 51.33 1a6x s ALA 99 Cb 0.43 -0.29 0.01 0.00 0.00 0.00 0.00 23.12 23.27 1a6x s ALA 99 CO -0.04 0.33 -0.47 1.63 0.00 0.00 0.00 175.76 177.22 1a6x n LYS 100 N 1.92 -1.12 -3.78 0.00 4.01 -1.26 -4.74 118.16 113.19 1a6x n LYS 100 Ca -0.17 -0.32 -0.36 0.00 -0.51 0.00 0.00 58.31 56.94 1a6x n LYS 100 Cb 0.54 -1.39 -0.07 0.00 -0.51 0.00 0.00 35.03 33.60 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 -2.12 3.78 0.27 7.82 0.00 -1.26 -4.50 121.76 125.75 1a6x s ALA 101 Ca 0.43 -0.62 -0.00 0.00 0.00 0.00 0.00 51.96 51.77 1a6x s ALA 101 Cb -0.03 -2.10 0.60 0.00 0.00 0.00 0.00 23.12 21.60 1a6x s ALA 101 CO 0.57 0.41 1.70 0.74 0.00 0.00 0.00 175.76 179.18 1a6x h PHE 102 N 5.69 0.52 -3.22 0.00 0.04 -1.59 -3.37 116.94 115.00 1a6x h PHE 102 Ca -0.49 0.04 -0.49 0.00 2.80 0.00 0.00 57.97 59.84 1a6x h PHE 102 Cb 1.20 -0.10 -0.37 0.00 2.20 0.00 0.00 35.95 38.87 1a6x h PHE 102 CO 0.68 -0.04 -0.79 0.96 -0.60 0.00 0.00 178.31 178.53 1a6x s ILE 103 N -5.96 0.74 -0.41 -0.55 -4.36 -1.26 -4.91 121.20 104.50 1a6x s ILE 103 Ca -0.12 -0.11 -0.23 0.00 -0.26 0.00 0.00 60.65 59.93 1a6x s ILE 103 Cb 0.23 -0.82 0.02 0.00 1.25 0.00 0.00 42.46 43.14 1a6x s ILE 103 CO 0.77 0.32 0.75 -1.61 0.24 0.00 0.00 174.94 175.41 1a6x s GLU 104 N 1.79 3.55 -0.50 0.37 2.02 -1.26 -4.96 118.70 119.72 1a6x s GLU 104 Ca 0.04 0.04 -0.46 0.00 0.02 0.00 0.00 54.97 54.62 1a6x s GLU 104 Cb -0.12 -3.88 -0.19 0.00 0.10 0.00 0.00 34.13 30.03 1a6x s GLU 104 CO -0.07 -0.97 1.83 0.28 0.02 0.00 0.00 175.26 176.36 1a6x n VAL 105 N 5.92 0.00 0.00 2.63 0.31 -1.26 -1.33 118.33 124.61 1a6x n VAL 105 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.35 1a6x n VAL 105 Cb 0.48 -0.50 0.00 0.00 -0.91 0.00 0.00 33.84 32.91 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 5.51 1.80 3.60 2.92 0.00 -1.26 -5.10 105.19 112.66 1a6x n GLY 106 Ca 0.41 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 46.16 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 -0.52 1.93 -0.16 1.61 0.74 -0.44 -5.06 119.66 117.76 1a6x s GLN 107 Ca 0.00 -2.11 -0.06 0.00 0.05 0.00 0.00 55.36 53.24 1a6x s GLN 107 Cb 0.00 -1.45 -0.04 0.00 1.10 0.00 0.00 33.01 32.62 1a6x s GLN 107 CO 0.00 -0.12 0.05 0.21 -0.55 0.00 0.00 175.29 174.88 1a6x s LYS 108 N -3.76 3.73 -0.05 1.67 2.20 -1.26 -4.01 119.74 118.26 1a6x s LYS 108 Ca 0.32 -0.35 0.02 0.00 -0.36 0.00 0.00 55.97 55.60 1a6x s LYS 108 Cb 0.09 -3.11 0.01 0.00 -1.51 0.00 0.00 37.83 33.31 1a6x s LYS 108 CO 0.16 0.40 -0.10 0.14 -0.36 0.00 0.00 175.35 175.58 1a6x s VAL 109 N 0.01 0.93 0.07 4.02 -7.23 -0.36 -5.01 120.40 112.83 1a6x s VAL 109 Ca 0.05 -0.40 0.07 0.00 -1.81 0.00 0.00 61.98 59.90 1a6x s VAL 109 Cb -0.12 -0.85 -0.04 0.00 0.56 0.00 0.00 36.38 35.93 1a6x s VAL 109 CO 0.01 0.30 -0.15 0.21 -0.31 0.00 0.00 175.10 175.16 1a6x s ASN 110 N 0.48 4.03 -0.53 4.85 2.47 -1.26 -0.72 114.94 124.26 1a6x s ASN 110 Ca -0.09 -0.43 -0.43 0.00 0.42 0.00 0.00 52.86 52.33 1a6x s ASN 110 Cb -0.13 -0.68 -0.19 0.00 -1.45 0.00 0.00 41.25 38.80 1a6x s ASN 110 CO 0.02 0.22 2.18 0.55 -3.72 0.00 0.00 177.10 176.34 1a6x n VAL 111 N 1.16 0.00 0.00 -5.21 3.14 -1.26 -0.53 118.33 115.63 1a6x n VAL 111 Ca -0.15 -0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.22 1a6x n VAL 111 Cb 0.52 -0.52 0.00 0.00 -1.06 0.00 0.00 33.84 32.79 1a6x n VAL 111 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1a6x n GLY 112 N 7.42 1.65 3.74 7.55 0.00 -0.62 -4.99 105.19 119.94 1a6x n GLY 112 Ca 0.56 -0.13 -0.41 0.00 0.00 0.00 0.00 46.02 46.03 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 -0.24 7.34 0.46 1.61 1.01 0.31 -4.53 116.67 122.62 1a6x s ASP 113 Ca 0.00 2.00 -0.24 0.00 0.71 0.00 0.00 52.55 55.03 1a6x s ASP 113 Cb 0.00 -2.60 -0.09 0.00 1.01 0.00 0.00 42.92 41.24 1a6x s ASP 113 CO 0.00 -0.17 1.12 0.41 0.21 0.00 0.00 175.17 176.74 1a6x n THR 114 N 2.50 2.77 -0.03 -1.27 -1.04 -1.26 -0.04 114.28 115.90 1a6x n THR 114 Ca 0.03 -0.50 -0.04 0.00 -2.04 0.00 0.00 64.05 61.50 1a6x n THR 114 Cb 0.47 -1.34 -0.04 0.00 -1.82 0.00 0.00 70.33 67.60 1a6x n THR 114 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 1a6x n LEU 115 N 0.10 1.52 0.00 -4.42 7.94 0.15 -4.65 117.00 117.64 1a6x n LEU 115 Ca 0.09 -0.02 0.00 0.00 -1.11 0.00 0.00 56.01 54.97 1a6x n LEU 115 Cb 0.41 -0.06 0.00 0.00 0.53 0.00 0.00 43.42 44.30 1a6x n LEU 115 CO 0.56 0.39 0.00 0.00 -1.11 0.00 0.00 177.39 177.23 1a6x s ILE 117 N -2.10 0.17 -0.07 0.00 1.01 0.37 -0.34 121.20 120.25 1a6x s ILE 117 Ca 0.00 -1.44 -0.02 0.00 0.00 0.00 0.00 60.65 59.19 1a6x s ILE 117 Cb 0.00 -1.07 0.03 0.00 0.01 0.00 0.00 42.46 41.43 1a6x s ILE 117 CO 0.00 -0.79 0.02 -0.69 0.00 0.00 0.00 174.94 173.48 1a6x s VAL 118 N -3.03 0.22 -0.20 2.92 1.01 0.12 -0.67 120.40 120.77 1a6x s VAL 118 Ca -0.01 0.19 -0.15 0.00 0.00 0.00 0.00 61.98 62.02 1a6x s VAL 118 Cb 0.01 -0.43 -0.04 0.00 0.00 0.00 0.00 36.38 35.92 1a6x s VAL 118 CO -0.07 0.21 0.34 -0.70 0.00 0.00 0.00 175.10 174.88 1a6x s GLU 119 N 2.03 4.17 0.15 2.72 2.12 0.97 0.24 118.70 131.11 1a6x s GLU 119 Ca 0.05 0.09 -0.17 0.00 0.36 0.00 0.00 54.97 55.30 1a6x s GLU 119 Cb -0.12 -3.52 0.04 0.00 0.26 0.00 0.00 34.13 30.78 1a6x s GLU 119 CO -0.05 0.02 0.46 0.00 -0.54 0.00 0.00 175.26 175.16 1a6x s ALA 120 N 1.13 -1.00 -1.36 6.30 0.00 0.34 -0.53 121.76 126.63 1a6x s ALA 120 Ca 0.16 -0.05 0.00 0.00 0.00 0.00 0.00 51.96 52.08 1a6x s ALA 120 Cb -0.14 0.78 0.00 0.00 0.00 0.00 0.00 23.12 23.75 1a6x s ALA 120 CO 0.07 -0.71 0.00 -1.33 0.00 0.00 0.00 175.76 173.78 1a6x n MET 121 N -0.28 -1.37 -2.75 0.00 2.81 -1.26 0.20 117.12 114.47 1a6x n MET 121 Ca -0.14 0.79 -0.07 0.00 -1.81 0.00 0.00 57.70 56.47 1a6x n MET 121 Cb 0.63 -5.01 0.02 0.00 -0.71 0.00 0.00 33.22 28.16 1a6x n MET 121 CO 0.00 0.00 0.00 1.17 1.51 0.00 0.00 175.97 178.65 1a6x n LYS 122 N -1.70 -2.30 -3.63 0.03 3.00 -1.26 -5.04 118.16 107.25 1a6x n LYS 122 Ca -0.13 0.25 -0.12 0.00 -0.00 0.00 0.00 58.31 58.31 1a6x n LYS 122 Cb 0.45 -3.50 -0.07 0.00 0.00 0.00 0.00 35.03 31.91 1a6x n LYS 122 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1a6x s MET 123 N -5.20 0.74 0.34 1.64 0.23 0.13 -5.16 119.30 112.03 1a6x s MET 123 Ca 0.14 0.92 -0.26 0.00 -1.03 0.00 0.00 55.69 55.46 1a6x s MET 123 Cb -0.06 0.34 -0.09 0.00 -1.53 0.00 0.00 34.83 33.49 1a6x s MET 123 CO 0.22 -0.09 1.00 0.00 -2.03 0.00 0.00 175.02 174.12 1a6x s MET 124 N 0.46 4.45 -0.23 3.16 0.23 -1.26 -0.50 119.30 125.61 1a6x s MET 124 Ca -0.00 1.46 -0.04 0.00 -1.03 0.00 0.00 55.69 56.08 1a6x s MET 124 Cb -0.05 -2.77 0.08 0.00 -1.53 0.00 0.00 34.83 30.56 1a6x s MET 124 CO -0.03 0.12 0.10 -0.80 -2.03 0.00 0.00 175.02 172.39 1a6x s ASN 125 N -1.49 2.95 0.54 -1.18 0.01 0.14 -4.93 114.94 110.98 1a6x s ASN 125 Ca 0.52 -0.95 -0.21 0.00 -0.71 0.00 0.00 52.86 51.51 1a6x s ASN 125 Cb -0.22 -0.34 -0.05 0.00 0.41 0.00 0.00 41.25 41.05 1a6x s ASN 125 CO 0.28 -0.39 1.25 -1.10 -1.51 0.00 0.00 177.10 175.63 1a6x s GLN 126 N 2.07 3.23 -0.24 -0.60 -0.21 -1.26 0.15 119.66 122.80 1a6x s GLN 126 Ca 0.05 1.96 -0.02 0.00 0.02 0.00 0.00 55.36 57.37 1a6x s GLN 126 Cb -0.16 -2.17 0.02 0.00 1.00 0.00 0.00 33.01 31.70 1a6x s GLN 126 CO -0.21 -1.04 -0.07 0.42 -2.12 0.00 0.00 175.29 172.28 1a6x s ILE 127 N -1.47 2.91 0.00 1.08 1.01 0.54 -4.84 121.20 120.42 1a6x s ILE 127 Ca 0.72 -0.93 -0.25 0.00 0.00 0.00 0.00 60.65 60.20 1a6x s ILE 127 Cb -0.34 -2.43 -0.05 0.00 0.01 0.00 0.00 42.46 39.65 1a6x s ILE 127 CO 0.39 0.26 0.75 -0.70 0.00 0.00 0.00 174.94 175.64 1a6x s GLU 128 N 1.35 4.47 0.18 2.79 2.56 -1.26 -0.67 118.70 128.12 1a6x s GLU 128 Ca 0.02 1.01 -0.33 0.00 0.00 0.00 0.00 54.97 55.67 1a6x s GLU 128 Cb -0.16 -3.40 -0.15 0.00 2.00 0.00 0.00 34.13 32.43 1a6x s GLU 128 CO -0.05 0.19 1.36 0.00 -0.56 0.00 0.00 175.26 176.20 1a6x n ALA 129 N 3.22 0.34 -1.49 6.30 0.00 0.94 -4.81 120.51 125.00 1a6x n ALA 129 Ca -0.02 0.45 0.07 0.00 0.00 0.00 0.00 53.44 53.94 1a6x n ALA 129 Cb 0.51 -2.19 0.12 0.00 0.00 0.00 0.00 19.45 17.89 1a6x n ALA 129 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1a6x n ASP 130 N 2.42 1.67 -2.75 0.00 10.43 -1.26 -1.59 116.55 125.47 1a6x n ASP 130 Ca 0.15 -3.02 -0.03 0.00 2.57 0.00 0.00 54.79 54.46 1a6x n ASP 130 Cb 0.27 -0.41 0.02 0.00 1.84 0.00 0.00 41.12 42.85 1a6x n ASP 130 CO 0.00 0.00 0.00 -0.54 -1.07 0.00 0.00 177.20 175.59 1a6x s LYS 131 N -2.23 0.54 0.39 -1.24 1.02 -1.26 -4.98 119.74 111.98 1a6x s LYS 131 Ca 0.28 -0.49 -0.20 0.00 0.02 0.00 0.00 55.97 55.59 1a6x s LYS 131 Cb 0.27 -0.01 -0.15 0.00 -0.52 0.00 0.00 37.83 37.41 1a6x s LYS 131 CO -0.02 -0.68 0.07 -1.13 -0.92 0.00 0.00 175.35 172.67 1a6x n SER 132 N 2.93 -2.82 -1.68 2.83 3.41 -1.26 -4.79 113.62 112.25 1a6x n SER 132 Ca 0.13 0.77 0.01 0.00 -0.26 0.00 0.00 58.87 59.52 1a6x n SER 132 Cb 0.61 -0.84 0.00 0.00 -0.26 0.00 0.00 64.21 63.72 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 2.26 0.42 2.63 5.00 0.00 0.10 -4.76 105.19 110.83 1a6x n GLY 133 Ca 0.11 -0.86 -0.23 0.00 0.00 0.00 0.00 46.02 45.03 1a6x n GLY 133 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1a6x n THR 134 N -0.22 1.74 -0.99 2.61 -2.24 -1.24 -1.22 114.28 112.72 1a6x n THR 134 Ca 0.01 -5.17 0.07 0.00 -2.27 0.00 0.00 64.05 56.69 1a6x n THR 134 Cb 0.13 -0.96 -0.02 0.00 -2.10 0.00 0.00 70.33 67.39 1a6x n THR 134 CO 0.00 0.00 0.00 0.55 -0.57 0.00 0.00 175.07 175.05 1a6x n VAL 135 N -0.01 0.00 0.00 2.28 3.14 -1.26 -4.19 118.33 118.30 1a6x n VAL 135 Ca 0.28 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.66 1a6x n VAL 135 Cb 0.50 -0.18 0.00 0.00 -1.06 0.00 0.00 33.84 33.10 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 -1.94 0.00 0.00 1.45 3.00 0.13 0.16 118.16 120.96 1a6x n LYS 136 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 1a6x n LYS 136 Cb 0.24 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.27 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 -1.15 0.00 -2.83 3.14 0.00 0.09 -4.95 120.51 114.81 1a6x n ALA 137 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.06 1a6x n ALA 137 Cb 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.33 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 -0.55 4.78 -0.15 0.00 1.09 -1.26 0.12 121.20 125.23 1a6x s ILE 138 Ca 0.00 -0.09 -0.18 0.00 -1.10 0.00 0.00 60.65 59.27 1a6x s ILE 138 Cb 0.00 -3.30 -0.24 0.00 -1.06 0.00 0.00 42.46 37.86 1a6x s ILE 138 CO 0.00 0.24 0.44 -0.07 -0.10 0.00 0.00 174.94 175.45 1a6x h LEU 139 N 8.32 0.21 -9.69 2.97 3.38 -1.84 -3.46 115.31 115.21 1a6x h LEU 139 Ca -0.36 -0.76 -0.51 0.00 0.09 0.00 0.00 57.88 56.34 1a6x h LEU 139 Cb 1.17 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.83 1a6x h LEU 139 CO 0.58 1.53 0.27 0.54 0.09 0.00 0.00 178.44 181.45 1a6x s VAL 140 N -2.42 4.32 -0.14 1.22 0.11 -0.75 -5.05 120.40 117.70 1a6x s VAL 140 Ca -0.23 1.90 -0.07 0.00 -2.93 0.00 0.00 61.98 60.64 1a6x s VAL 140 Cb 0.04 -4.24 -0.04 0.00 -1.53 0.00 0.00 36.38 30.61 1a6x s VAL 140 CO 0.70 0.46 0.13 -1.83 -3.33 0.00 0.00 175.10 171.23 1a6x s GLU 141 N -0.84 3.60 -0.91 1.54 -1.05 -1.26 -4.96 118.70 114.83 1a6x s GLU 141 Ca 0.40 -0.17 -0.31 0.00 -0.15 0.00 0.00 54.97 54.74 1a6x s GLU 141 Cb -0.24 -3.23 -0.20 0.00 -0.44 0.00 0.00 34.13 30.03 1a6x s GLU 141 CO 0.29 0.66 2.64 -1.13 0.95 0.00 0.00 175.26 178.66 1a6x n SER 142 N 2.36 0.60 0.00 0.83 3.41 -1.26 0.18 113.62 119.74 1a6x n SER 142 Ca -0.19 0.11 0.00 0.00 -0.26 0.00 0.00 58.87 58.53 1a6x n SER 142 Cb 0.54 -1.01 0.00 0.00 -0.26 0.00 0.00 64.21 63.48 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 6.47 2.52 3.72 5.00 0.00 0.18 -4.87 105.19 118.21 1a6x n GLY 143 Ca 0.61 -0.64 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 1a6x n GLY 143 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1a6x n GLN 144 N 0.00 2.20 -1.56 1.61 7.27 0.47 -4.50 117.38 122.87 1a6x n GLN 144 Ca 0.00 0.78 -0.30 0.00 0.07 0.00 0.00 57.00 57.54 1a6x n GLN 144 Cb 0.00 -2.43 0.08 0.00 2.41 0.00 0.00 30.24 30.30 1a6x n GLN 144 CO 0.00 0.00 0.00 -1.25 0.07 0.00 0.00 177.06 175.88 1a6x s PRO 145 N -2.03 2.30 0.05 3.69 0.04 -1.26 -1.14 135.00 136.65 1a6x s PRO 145 Ca 0.56 0.72 -0.03 0.00 0.04 0.00 0.00 61.00 62.29 1a6x s PRO 145 Cb -0.53 -1.94 -0.02 0.00 0.04 0.00 0.00 34.50 32.05 1a6x s PRO 145 CO 0.61 -1.49 0.04 0.14 0.04 0.00 0.00 177.00 176.35 1a6x s VAL 146 N -3.13 0.18 0.32 -0.36 -7.23 0.24 -4.74 120.40 105.68 1a6x s VAL 146 Ca 0.60 -1.45 0.05 0.00 -1.81 0.00 0.00 61.98 59.37 1a6x s VAL 146 Cb -0.14 -1.23 -0.06 0.00 0.56 0.00 0.00 36.38 35.50 1a6x s VAL 146 CO 0.54 -0.80 0.03 -1.61 -0.31 0.00 0.00 175.10 172.96 1a6x s GLU 147 N -3.40 1.65 0.16 4.82 8.01 -1.26 -1.21 118.70 127.48 1a6x s GLU 147 Ca 0.02 -1.90 -0.31 0.00 0.01 0.00 0.00 54.97 52.78 1a6x s GLU 147 Cb 0.04 -0.99 -0.09 0.00 -4.31 0.00 0.00 34.13 28.77 1a6x s GLU 147 CO -0.08 -0.13 1.51 0.12 0.01 0.00 0.00 175.26 176.69 1a6x s PHE 148 N -3.19 3.11 0.00 1.61 2.19 -1.26 -1.17 117.98 119.27 1a6x s PHE 148 Ca 0.35 0.75 0.00 0.00 0.33 0.00 0.00 56.93 58.36 1a6x s PHE 148 Cb 0.08 -3.85 0.00 0.00 -1.31 0.00 0.00 43.02 37.94 1a6x s PHE 148 CO 0.15 -3.07 0.00 -3.47 1.83 0.00 0.00 175.22 170.66 1a6x n ASP 149 N 3.79 0.00 -4.80 6.13 2.03 -1.11 -5.01 116.55 117.58 1a6x n ASP 149 Ca 0.12 0.00 -0.36 0.00 0.52 0.00 0.00 54.79 55.08 1a6x n ASP 149 Cb 0.40 0.00 -0.07 0.00 -0.72 0.00 0.00 41.12 40.73 1a6x n ASP 149 CO 0.00 0.00 0.00 -0.70 -1.92 0.00 0.00 177.20 174.58 1a6x s GLU 150 N -0.11 4.45 0.52 -0.67 2.12 -0.32 -4.84 118.70 119.85 1a6x s GLU 150 Ca 0.00 1.24 -0.19 0.00 0.36 0.00 0.00 54.97 56.38 1a6x s GLU 150 Cb 0.00 -2.59 -0.07 0.00 0.26 0.00 0.00 34.13 31.73 1a6x s GLU 150 CO 0.00 0.18 1.04 -1.25 -0.54 0.00 0.00 175.26 174.69 1a6x s PRO 151 N -2.43 3.67 0.00 4.30 0.04 -1.26 0.24 135.00 139.55 1a6x s PRO 151 Ca 0.54 1.31 0.00 0.00 0.04 0.00 0.00 61.00 62.89 1a6x s PRO 151 Cb -0.15 -2.08 0.00 0.00 0.04 0.00 0.00 34.50 32.31 1a6x s PRO 151 CO 0.20 -0.53 0.00 1.28 0.04 0.00 0.00 177.00 177.99 1a6x n LEU 152 N -1.28 0.00 -4.12 -3.56 4.77 0.96 -4.70 117.00 109.07 1a6x n LEU 152 Ca 0.09 0.00 -0.16 0.00 -0.03 0.00 0.00 56.01 55.91 1a6x n LEU 152 Cb 0.53 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.50 1a6x n LEU 152 CO 0.42 0.00 -0.43 -0.69 -1.33 0.00 0.00 177.39 175.36 1a6x s VAL 153 N 0.00 0.83 -0.20 4.08 1.01 -1.24 -1.81 120.40 123.06 1a6x s VAL 153 Ca 0.00 -1.20 -0.07 0.00 0.00 0.00 0.00 61.98 60.70 1a6x s VAL 153 Cb 0.00 -0.85 -0.04 0.00 0.00 0.00 0.00 36.38 35.49 1a6x s VAL 153 CO 0.00 -0.31 0.06 -0.69 0.00 0.00 0.00 175.10 174.16 1a6x s VAL 154 N -1.35 4.66 0.12 2.92 1.01 0.32 -0.57 120.40 127.51 1a6x s VAL 154 Ca -0.06 -0.07 0.11 0.00 0.00 0.00 0.00 61.98 61.96 1a6x s VAL 154 Cb -0.10 -3.12 -0.04 0.00 0.00 0.00 0.00 36.38 33.13 1a6x s VAL 154 CO 0.01 0.43 -0.27 -0.63 0.00 0.00 0.00 175.10 174.65 1a6x s ILE 155 N 0.65 2.28 0.00 2.22 1.01 -0.37 0.18 121.20 127.18 1a6x s ILE 155 Ca 0.03 -1.71 0.00 0.00 0.00 0.00 0.00 60.65 58.97 1a6x s ILE 155 Cb -0.13 -2.00 0.00 0.00 0.01 0.00 0.00 42.46 40.34 1a6x s ILE 155 CO 0.02 0.12 0.00 1.21 0.00 0.00 0.00 174.94 176.29