#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 -0.03 2.12 0.00 -1.26 -4.18 120.64 117.29 1a6x n GLU 71 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 57.16 57.10 1a6x n GLU 71 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 31.44 31.39 1a6x n GLU 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1a6x h ALA 72 N -0.20 -0.05 -2.37 -1.84 0.00 -2.07 -3.45 119.26 109.29 1a6x h ALA 72 Ca 0.00 -0.19 -0.55 0.00 0.00 0.00 0.00 54.91 54.18 1a6x h ALA 72 Cb 0.00 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1a6x h ALA 72 CO 0.00 -0.06 0.66 -1.25 0.00 0.00 0.00 179.25 178.60 1a6x s PRO 73 N -2.06 4.38 0.10 0.00 0.04 -1.26 -4.57 135.00 131.63 1a6x s PRO 73 Ca -0.08 1.71 0.00 0.00 0.04 0.00 0.00 61.00 62.67 1a6x s PRO 73 Cb -0.01 -3.50 0.00 0.00 0.04 0.00 0.00 34.50 31.03 1a6x s PRO 73 CO 0.28 -0.39 0.00 0.00 0.04 0.00 0.00 177.00 176.93 1a6x n ALA 74 N 4.82 -2.20 -2.49 8.56 0.00 -1.26 -4.77 120.51 123.17 1a6x n ALA 74 Ca 0.10 0.40 -0.27 0.00 0.00 0.00 0.00 53.44 53.67 1a6x n ALA 74 Cb 0.46 -1.25 -0.04 0.00 0.00 0.00 0.00 19.45 18.62 1a6x n ALA 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1a6x s ALA 75 N -0.46 4.12 -0.29 0.00 0.00 -1.26 -2.94 121.76 120.93 1a6x s ALA 75 Ca 0.00 -1.29 -0.16 0.00 0.00 0.00 0.00 51.96 50.52 1a6x s ALA 75 Cb 0.00 -0.46 0.16 0.00 0.00 0.00 0.00 23.12 22.82 1a6x s ALA 75 CO 0.00 -0.26 1.03 0.00 0.00 0.00 0.00 175.76 176.52 1a6x s ALA 76 N -2.74 -2.52 -0.30 0.00 0.00 -1.26 -4.46 121.76 110.47 1a6x s ALA 76 Ca 0.29 2.11 -0.10 0.00 0.00 0.00 0.00 51.96 54.26 1a6x s ALA 76 Cb 0.00 -1.89 0.18 0.00 0.00 0.00 0.00 23.12 21.42 1a6x s ALA 76 CO 0.17 -0.58 1.00 -2.00 0.00 0.00 0.00 175.76 174.35 1a6x s GLU 77 N 1.72 0.20 0.30 0.00 2.12 -1.26 -4.39 118.70 117.39 1a6x s GLU 77 Ca -0.06 0.25 0.00 0.00 0.36 0.00 0.00 54.97 55.52 1a6x s GLU 77 Cb -0.04 0.13 0.00 0.00 0.26 0.00 0.00 34.13 34.48 1a6x s GLU 77 CO -0.15 -0.31 0.00 1.51 -0.54 0.00 0.00 175.26 175.77 1a6x n ILE 78 N 5.27 0.00 -1.35 -3.70 0.13 -1.26 -5.05 119.36 113.41 1a6x n ILE 78 Ca 0.03 0.00 -0.47 0.00 -1.10 0.00 0.00 62.75 61.20 1a6x n ILE 78 Cb 0.56 -0.45 -0.13 0.00 -0.84 0.00 0.00 39.64 38.78 1a6x n ILE 78 CO 0.00 0.00 0.00 -1.20 2.80 0.00 0.00 176.55 178.15 1a6x n SER 79 N -3.45 0.47 0.00 9.51 7.64 -1.26 -4.00 113.62 122.52 1a6x n SER 79 Ca 0.00 0.38 0.00 0.00 1.01 0.00 0.00 58.87 60.26 1a6x n SER 79 Cb 0.00 -0.88 0.00 0.00 -1.01 0.00 0.00 64.21 62.32 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 6.70 1.07 3.22 0.23 0.00 -1.18 -4.99 105.19 110.24 1a6x n GLY 80 Ca 0.59 -0.55 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 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 3.44 -0.33 1.61 0.09 0.14 -4.90 115.29 115.34 1a6x s HIS 81 Ca 0.00 -1.91 -0.24 0.00 -0.00 0.00 0.00 55.06 52.91 1a6x s HIS 81 Cb 0.00 -3.53 0.01 0.00 -0.00 0.00 0.00 32.58 29.06 1a6x s HIS 81 CO 0.00 -0.98 0.83 0.42 -0.00 0.00 0.00 174.74 175.01 1a6x s ILE 82 N 1.14 4.72 -0.20 0.60 1.09 -1.26 -1.35 121.20 125.95 1a6x s ILE 82 Ca 0.08 1.16 -0.22 0.00 -1.10 0.00 0.00 60.65 60.57 1a6x s ILE 82 Cb -0.25 -4.21 -0.02 0.00 -1.06 0.00 0.00 42.46 36.92 1a6x s ILE 82 CO -0.01 -0.35 0.69 -0.69 -0.10 0.00 0.00 174.94 174.47 1a6x s VAL 83 N 3.12 4.97 -0.16 2.92 1.01 -0.98 -4.95 120.40 126.33 1a6x s VAL 83 Ca 0.34 1.31 -0.11 0.00 0.00 0.00 0.00 61.98 63.52 1a6x s VAL 83 Cb -0.13 -4.00 -0.05 0.00 0.00 0.00 0.00 36.38 32.20 1a6x s VAL 83 CO 0.15 0.07 0.20 -0.13 0.00 0.00 0.00 175.10 175.38 1a6x s ARG 84 N 2.09 4.07 -0.77 2.72 0.52 -1.26 0.11 118.95 126.44 1a6x s ARG 84 Ca 0.31 -0.07 -0.33 0.00 -0.52 0.00 0.00 55.73 55.12 1a6x s ARG 84 Cb -0.16 -3.37 -0.19 0.00 0.52 0.00 0.00 34.95 31.74 1a6x s ARG 84 CO 0.10 0.38 2.32 -1.13 0.02 0.00 0.00 175.30 176.99 1a6x n SER 85 N 3.20 0.41 0.00 0.23 3.41 -0.24 -4.69 113.62 115.94 1a6x n SER 85 Ca -0.15 0.32 0.12 0.00 -0.26 0.00 0.00 58.87 58.89 1a6x n SER 85 Cb 0.52 -0.84 0.69 0.00 -0.26 0.00 0.00 64.21 64.32 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 7.54 0.75 -3.65 4.33 -0.04 -1.26 -3.85 135.00 138.82 1a6x n PRO 86 Ca 0.58 0.00 -0.08 0.00 -0.04 0.00 0.00 63.50 63.95 1a6x n PRO 86 Cb 0.01 -1.49 -0.07 0.00 -0.04 0.00 0.00 33.50 31.91 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 0.69 0.29 0.54 1.75 -1.26 -5.00 119.30 114.30 1a6x s MET 87 Ca 0.35 1.15 -0.29 0.00 -1.25 0.00 0.00 55.69 55.65 1a6x s MET 87 Cb 0.16 0.15 -0.10 0.00 2.84 0.00 0.00 34.83 37.89 1a6x s MET 87 CO 0.27 -0.14 1.20 0.08 -0.65 0.00 0.00 175.02 175.77 1a6x s VAL 88 N 1.46 3.19 0.00 10.11 1.01 -1.26 -4.65 120.40 130.26 1a6x s VAL 88 Ca -0.09 1.17 0.00 0.00 0.00 0.00 0.00 61.98 63.06 1a6x s VAL 88 Cb -0.05 -3.74 0.00 0.00 0.00 0.00 0.00 36.38 32.58 1a6x s VAL 88 CO -0.17 0.27 0.00 0.61 0.00 0.00 0.00 175.10 175.81 1a6x n GLY 89 N 1.18 -0.15 3.40 4.51 0.00 -0.53 -4.69 105.19 108.91 1a6x n GLY 89 Ca 0.00 -0.09 -0.20 0.00 0.00 0.00 0.00 46.02 45.73 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 1.16 -0.01 2.61 2.01 -0.29 -0.01 115.64 121.11 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 -2.59 0.00 0.00 0.01 0.00 0.00 72.50 69.92 1a6x s THR 90 CO 0.00 -0.15 -0.03 0.12 -0.69 0.00 0.00 174.62 173.88 1a6x s PHE 91 N -3.33 0.30 0.13 4.92 2.19 -0.04 -0.24 117.98 121.91 1a6x s PHE 91 Ca 0.33 -0.05 0.06 0.00 0.33 0.00 0.00 56.93 57.60 1a6x s PHE 91 Cb 0.07 -0.23 -0.04 0.00 -1.31 0.00 0.00 43.02 41.51 1a6x s PHE 91 CO 0.13 -0.03 -0.13 0.71 1.83 0.00 0.00 175.22 177.72 1a6x s TYR 92 N 0.14 1.41 -0.55 10.12 2.02 0.23 0.97 117.35 131.70 1a6x s TYR 92 Ca -0.01 -0.59 0.18 0.00 -0.37 0.00 0.00 57.07 56.28 1a6x s TYR 92 Cb -0.04 -0.72 -0.23 0.00 -0.40 0.00 0.00 41.96 40.57 1a6x s TYR 92 CO -0.00 0.16 0.63 0.54 -1.57 0.00 0.00 175.55 175.30 1a6x n ARG 93 N 0.34 0.93 -4.30 -0.62 5.12 -1.26 -1.28 116.66 115.58 1a6x n ARG 93 Ca -0.14 -0.06 -0.20 0.00 -1.93 0.00 0.00 57.85 55.52 1a6x n ARG 93 Cb 0.58 -1.37 -0.11 0.00 -1.16 0.00 0.00 32.46 30.40 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 -2.89 1.63 0.18 0.55 -4.23 -1.26 -1.30 115.64 108.32 1a6x s THR 94 Ca 0.02 -1.88 0.02 0.00 -1.18 0.00 0.00 61.69 58.67 1a6x s THR 94 Cb 0.13 -1.76 -0.13 0.00 1.34 0.00 0.00 72.50 72.09 1a6x s THR 94 CO 0.74 -0.39 1.41 1.55 -0.54 0.00 0.00 174.62 177.40 1a6x h PRO 95 N 3.27 0.24 -5.02 3.99 0.13 -1.88 -3.45 132.00 129.27 1a6x h PRO 95 Ca -0.41 -0.23 -0.44 0.00 -0.87 0.00 0.00 66.00 64.05 1a6x h PRO 95 Cb 1.20 0.06 -0.14 0.00 0.13 0.00 0.00 31.00 32.25 1a6x h PRO 95 CO 0.52 0.93 -0.58 -1.12 -0.23 0.00 0.00 178.00 177.52 1a6x s SER 96 N -6.94 1.92 0.42 1.44 0.01 -1.26 -5.04 113.70 104.26 1a6x s SER 96 Ca -0.04 -1.47 0.23 0.00 1.31 0.00 0.00 55.95 55.99 1a6x s SER 96 Cb 0.10 0.19 0.68 0.00 0.21 0.00 0.00 66.02 67.20 1a6x s SER 96 CO 0.83 -0.76 1.72 1.55 0.41 0.00 0.00 173.24 176.99 1a6x h PRO 97 N 2.15 0.00 -2.23 12.44 0.13 -2.00 -3.30 132.00 139.19 1a6x h PRO 97 Ca -0.38 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.17 1a6x h PRO 97 Cb 1.25 0.00 -0.42 0.00 0.13 0.00 0.00 31.00 31.96 1a6x h PRO 97 CO 0.61 0.20 -0.67 -0.40 -0.23 0.00 0.00 178.00 177.52 1a6x n ASP 98 N -3.25 3.95 -3.69 1.44 5.68 -1.26 -5.02 116.55 114.40 1a6x n ASP 98 Ca 0.01 -3.55 -0.14 0.00 -0.50 0.00 0.00 54.79 50.61 1a6x n ASP 98 Cb 0.50 -0.60 -0.08 0.00 -1.14 0.00 0.00 41.12 39.80 1a6x n ASP 98 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1a6x s ALA 99 N -3.04 -1.13 1.11 2.12 0.00 -1.24 -5.13 121.76 114.44 1a6x s ALA 99 Ca 0.45 0.87 -0.12 0.00 0.00 0.00 0.00 51.96 53.16 1a6x s ALA 99 Cb 0.24 -0.20 0.26 0.00 0.00 0.00 0.00 23.12 23.41 1a6x s ALA 99 CO -0.09 -0.27 1.05 0.15 0.00 0.00 0.00 175.76 176.59 1a6x s LYS 100 N -0.82 -0.52 0.16 0.00 1.02 -1.26 -4.82 119.74 113.50 1a6x s LYS 100 Ca -0.09 0.91 -0.31 0.00 0.02 0.00 0.00 55.97 56.51 1a6x s LYS 100 Cb -0.03 -1.59 -0.08 0.00 -0.52 0.00 0.00 37.83 35.60 1a6x s LYS 100 CO 0.05 -3.48 1.33 0.00 -0.92 0.00 0.00 175.35 172.33 1a6x s ALA 101 N -2.54 3.54 0.32 5.17 0.00 -1.26 -4.60 121.76 122.39 1a6x s ALA 101 Ca 0.68 1.09 0.05 0.00 0.00 0.00 0.00 51.96 53.78 1a6x s ALA 101 Cb -0.24 -3.50 0.85 0.00 0.00 0.00 0.00 23.12 20.23 1a6x s ALA 101 CO 0.63 -0.56 1.57 0.74 0.00 0.00 0.00 175.76 178.15 1a6x h PHE 102 N 6.02 0.10 -3.21 0.00 0.04 -1.53 -3.40 116.94 114.95 1a6x h PHE 102 Ca -0.43 0.07 -0.39 0.00 2.80 0.00 0.00 57.97 60.01 1a6x h PHE 102 Cb 1.21 0.12 -0.14 0.00 2.20 0.00 0.00 35.95 39.34 1a6x h PHE 102 CO 0.64 -0.44 -0.68 0.42 -0.60 0.00 0.00 178.31 177.65 1a6x s ILE 103 N -5.93 1.19 -0.20 -0.55 1.09 -1.26 -4.98 121.20 110.56 1a6x s ILE 103 Ca -0.12 -2.06 0.01 0.00 -1.10 0.00 0.00 60.65 57.37 1a6x s ILE 103 Cb 0.30 -2.23 0.04 0.00 -1.06 0.00 0.00 42.46 39.51 1a6x s ILE 103 CO 0.78 -0.43 -0.11 -1.83 -0.10 0.00 0.00 174.94 173.25 1a6x s GLU 104 N -3.80 2.12 -0.49 2.79 -1.05 -1.26 -5.06 118.70 111.94 1a6x s GLU 104 Ca 0.26 -0.84 -0.46 0.00 -0.15 0.00 0.00 54.97 53.78 1a6x s GLU 104 Cb 0.04 -2.42 -0.19 0.00 -0.44 0.00 0.00 34.13 31.12 1a6x s GLU 104 CO 0.07 -0.40 1.83 0.28 0.95 0.00 0.00 175.26 177.98 1a6x n VAL 105 N 4.68 0.01 0.00 1.83 0.31 -1.26 -1.68 118.33 122.21 1a6x n VAL 105 Ca -0.15 -0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.17 1a6x n VAL 105 Cb 0.47 -0.52 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 5.43 1.77 3.59 2.92 0.00 -1.26 -5.10 105.19 112.54 1a6x n GLY 106 Ca 0.41 0.00 -0.25 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 -0.29 1.97 -0.34 1.61 0.74 -0.68 -5.06 119.66 117.61 1a6x s GLN 107 Ca 0.00 -1.79 -0.12 0.00 0.05 0.00 0.00 55.36 53.50 1a6x s GLN 107 Cb 0.00 -1.86 -0.01 0.00 1.10 0.00 0.00 33.01 32.25 1a6x s GLN 107 CO 0.00 0.17 0.21 0.15 -0.55 0.00 0.00 175.29 175.28 1a6x s LYS 108 N -3.66 3.37 -0.11 1.67 3.01 -1.26 -4.04 119.74 118.72 1a6x s LYS 108 Ca 0.33 -0.72 -0.02 0.00 -1.01 0.00 0.00 55.97 54.55 1a6x s LYS 108 Cb -0.00 -3.73 -0.03 0.00 -1.01 0.00 0.00 37.83 33.05 1a6x s LYS 108 CO 0.18 -0.47 -0.01 0.14 0.51 0.00 0.00 175.35 175.70 1a6x s VAL 109 N 1.67 4.16 0.10 3.17 -7.23 -0.48 -4.99 120.40 116.80 1a6x s VAL 109 Ca 0.05 -0.29 0.06 0.00 -1.81 0.00 0.00 61.98 59.99 1a6x s VAL 109 Cb -0.17 -2.77 -0.03 0.00 0.56 0.00 0.00 36.38 33.96 1a6x s VAL 109 CO 0.09 0.57 -0.15 0.21 -0.31 0.00 0.00 175.10 175.51 1a6x s ASN 110 N -0.49 1.90 -0.50 4.85 2.47 -1.26 -0.86 114.94 121.05 1a6x s ASN 110 Ca 0.08 -0.72 -0.44 0.00 0.42 0.00 0.00 52.86 52.20 1a6x s ASN 110 Cb -0.12 -0.06 -0.19 0.00 -1.45 0.00 0.00 41.25 39.43 1a6x s ASN 110 CO 0.02 -0.10 2.14 0.52 -3.72 0.00 0.00 177.10 175.96 1a6x n VAL 111 N 0.87 0.01 0.00 -5.21 0.31 -1.26 -0.46 118.33 112.59 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 0.56 -0.54 0.00 0.00 -0.91 0.00 0.00 33.84 32.95 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 7.47 1.32 3.78 2.92 0.00 -1.26 -5.06 105.19 114.36 1a6x n GLY 112 Ca 0.55 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 46.18 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 -0.64 7.02 1.31 1.61 1.11 0.39 -4.87 116.67 122.60 1a6x s ASP 113 Ca 0.00 1.21 -0.18 0.00 0.18 0.00 0.00 52.55 53.76 1a6x s ASP 113 Cb 0.00 -2.37 0.33 0.00 1.07 0.00 0.00 42.92 41.95 1a6x s ASP 113 CO 0.00 0.17 0.88 0.41 1.18 0.00 0.00 175.17 177.81 1a6x n THR 114 N 2.32 0.00 0.00 -1.27 -1.04 -1.26 -0.25 114.28 112.78 1a6x n THR 114 Ca -0.08 -0.28 0.00 0.00 -2.04 0.00 0.00 64.05 61.65 1a6x n THR 114 Cb 0.51 -0.96 0.00 0.00 -1.82 0.00 0.00 70.33 68.06 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 -5.08 0.18 0.00 -4.42 7.94 1.00 -4.31 117.00 112.31 1a6x n LEU 115 Ca 0.07 0.00 0.01 0.00 -1.11 0.00 0.00 56.01 54.98 1a6x n LEU 115 Cb 0.56 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.52 1a6x n LEU 115 CO 0.49 -0.25 0.38 0.00 -1.11 0.00 0.00 177.39 176.91 1a6x s ILE 117 N -2.05 1.79 -0.09 0.00 1.01 -0.41 -0.15 121.20 121.31 1a6x s ILE 117 Ca 0.11 -2.21 -0.04 0.00 0.00 0.00 0.00 60.65 58.51 1a6x s ILE 117 Cb -0.00 -2.21 0.05 0.00 0.01 0.00 0.00 42.46 40.31 1a6x s ILE 117 CO -0.01 -0.48 0.18 -0.69 0.00 0.00 0.00 174.94 173.95 1a6x s VAL 118 N -2.93 -0.19 -0.09 2.92 1.01 0.14 -0.60 120.40 120.66 1a6x s VAL 118 Ca 0.26 0.26 -0.28 0.00 0.00 0.00 0.00 61.98 62.22 1a6x s VAL 118 Cb 0.00 -0.31 -0.02 0.00 0.00 0.00 0.00 36.38 36.05 1a6x s VAL 118 CO 0.09 0.11 0.91 -0.70 0.00 0.00 0.00 175.10 175.51 1a6x s GLU 119 N 1.81 4.43 0.03 2.72 2.12 0.67 -1.19 118.70 129.29 1a6x s GLU 119 Ca -0.03 1.23 -0.29 0.00 0.36 0.00 0.00 54.97 56.25 1a6x s GLU 119 Cb -0.12 -3.51 0.10 0.00 0.26 0.00 0.00 34.13 30.86 1a6x s GLU 119 CO -0.07 -0.19 1.20 0.00 -0.54 0.00 0.00 175.26 175.66 1a6x s ALA 120 N 1.60 -2.08 -1.63 6.30 0.00 -0.54 -1.14 121.76 124.27 1a6x s ALA 120 Ca 0.45 0.48 -0.09 0.00 0.00 0.00 0.00 51.96 52.80 1a6x s ALA 120 Cb -0.18 0.47 0.08 0.00 0.00 0.00 0.00 23.12 23.49 1a6x s ALA 120 CO 0.19 -1.06 0.33 0.00 0.00 0.00 0.00 175.76 175.23 1a6x n MET 121 N -0.52 -1.63 -4.24 0.00 0.00 -1.26 0.24 117.12 109.72 1a6x n MET 121 Ca -0.07 0.20 -0.33 0.00 0.00 0.00 0.00 57.70 57.50 1a6x n MET 121 Cb 0.62 -4.25 -0.07 0.00 0.00 0.00 0.00 33.22 29.52 1a6x n MET 121 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 175.97 176.33 1a6x n LYS 122 N -4.40 -1.02 -3.60 3.17 2.85 -1.26 -4.87 118.16 109.03 1a6x n LYS 122 Ca -0.16 0.12 -0.03 0.00 -1.05 0.00 0.00 58.31 57.18 1a6x n LYS 122 Cb 0.61 -3.48 -0.02 0.00 -0.65 0.00 0.00 35.03 31.49 1a6x n LYS 122 CO 0.00 0.00 0.00 -1.64 -0.05 0.00 0.00 177.40 175.71 1a6x s MET 123 N -7.32 0.26 -0.13 -1.58 -1.94 0.14 -5.14 119.30 103.58 1a6x s MET 123 Ca 0.09 -0.10 -0.20 0.00 -1.71 0.00 0.00 55.69 53.76 1a6x s MET 123 Cb -0.05 0.12 -0.04 0.00 2.01 0.00 0.00 34.83 36.87 1a6x s MET 123 CO 0.99 -0.12 0.57 -1.64 -0.01 0.00 0.00 175.02 174.81 1a6x s MET 124 N -2.35 4.32 -0.16 2.03 -1.94 -1.26 -1.47 119.30 118.46 1a6x s MET 124 Ca 0.10 0.58 -0.00 0.00 -1.71 0.00 0.00 55.69 54.66 1a6x s MET 124 Cb -0.00 -3.49 -0.00 0.00 2.01 0.00 0.00 34.83 33.35 1a6x s MET 124 CO -0.04 0.01 -0.14 -0.80 -0.01 0.00 0.00 175.02 174.04 1a6x s ASN 125 N 0.86 3.74 0.19 3.03 0.01 -0.33 -4.98 114.94 117.46 1a6x s ASN 125 Ca 0.29 -0.46 -0.16 0.00 -0.71 0.00 0.00 52.86 51.83 1a6x s ASN 125 Cb -0.16 -1.58 -0.08 0.00 0.41 0.00 0.00 41.25 39.84 1a6x s ASN 125 CO 0.12 0.07 0.62 -1.10 -1.51 0.00 0.00 177.10 175.30 1a6x s GLN 126 N 0.88 4.05 -0.25 -0.60 -0.21 -1.26 0.24 119.66 122.52 1a6x s GLN 126 Ca -0.04 0.61 -0.02 0.00 0.02 0.00 0.00 55.36 55.93 1a6x s GLN 126 Cb -0.15 -2.85 0.02 0.00 1.00 0.00 0.00 33.01 31.03 1a6x s GLN 126 CO -0.01 0.41 -0.05 0.42 -2.12 0.00 0.00 175.29 173.94 1a6x s ILE 127 N -1.55 2.97 -0.05 1.08 1.01 0.78 -4.93 121.20 120.51 1a6x s ILE 127 Ca 0.41 -0.95 -0.13 0.00 0.00 0.00 0.00 60.65 59.99 1a6x s ILE 127 Cb -0.15 -2.49 -0.05 0.00 0.01 0.00 0.00 42.46 39.78 1a6x s ILE 127 CO 0.20 0.22 0.33 -0.70 0.00 0.00 0.00 174.94 174.99 1a6x s GLU 128 N 1.35 3.83 0.10 2.79 2.56 -1.26 -0.00 118.70 128.07 1a6x s GLU 128 Ca 0.01 0.25 -0.35 0.00 0.00 0.00 0.00 54.97 54.87 1a6x s GLU 128 Cb -0.16 -3.24 -0.18 0.00 2.00 0.00 0.00 34.13 32.55 1a6x s GLU 128 CO -0.04 0.66 1.04 0.00 -0.56 0.00 0.00 175.26 176.36 1a6x n ALA 129 N 2.06 -2.22 -0.54 6.30 0.00 0.65 -4.84 120.51 121.92 1a6x n ALA 129 Ca -0.15 0.52 0.06 0.00 0.00 0.00 0.00 53.44 53.87 1a6x n ALA 129 Cb 0.53 -1.87 0.17 0.00 0.00 0.00 0.00 19.45 18.28 1a6x n ALA 129 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1a6x n ASP 130 N 1.89 3.08 0.00 0.00 5.68 -1.26 -4.16 116.55 121.78 1a6x n ASP 130 Ca 0.18 -2.48 0.00 0.00 -0.50 0.00 0.00 54.79 51.99 1a6x n ASP 130 Cb 0.18 -0.33 0.00 0.00 -1.14 0.00 0.00 41.12 39.82 1a6x n ASP 130 CO 0.00 0.00 0.00 1.17 -1.33 0.00 0.00 177.20 177.04 1a6x n LYS 131 N -0.21 0.00 -1.09 0.11 4.81 -1.26 -5.04 118.16 115.48 1a6x n LYS 131 Ca 0.14 0.00 -0.36 0.00 -0.87 0.00 0.00 58.31 57.22 1a6x n LYS 131 Cb 0.59 0.00 0.02 0.00 0.02 0.00 0.00 35.03 35.67 1a6x n LYS 131 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1a6x n SER 132 N 0.00 -4.60 -1.74 3.14 2.88 -1.26 -4.90 113.62 107.14 1a6x n SER 132 Ca 0.00 0.42 0.01 0.00 -1.33 0.00 0.00 58.87 57.97 1a6x n SER 132 Cb 0.00 -0.78 0.00 0.00 -0.75 0.00 0.00 64.21 62.68 1a6x n SER 132 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1a6x n GLY 133 N 2.86 0.50 2.50 0.46 0.00 -0.04 -4.90 105.19 106.56 1a6x n GLY 133 Ca 0.03 -0.88 -0.18 0.00 0.00 0.00 0.00 46.02 44.99 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 -0.24 1.07 -0.79 2.61 -2.24 -1.07 -1.39 114.28 112.22 1a6x n THR 134 Ca 0.01 -4.30 0.10 0.00 -2.27 0.00 0.00 64.05 57.59 1a6x n THR 134 Cb 0.15 -0.28 -0.03 0.00 -2.10 0.00 0.00 70.33 68.07 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 -0.02 0.00 0.00 2.28 3.14 -1.26 -4.20 118.33 118.27 1a6x n VAL 135 Ca 0.23 0.02 0.00 0.00 -2.96 0.00 0.00 64.34 61.63 1a6x n VAL 135 Cb 0.67 -0.29 0.00 0.00 -1.06 0.00 0.00 33.84 33.16 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 -2.56 0.00 0.00 1.45 0.00 0.24 0.87 118.16 118.16 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 0.59 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.62 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 -2.31 0.00 -2.73 3.14 0.00 -0.01 -4.95 120.51 113.65 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 -0.07 0.00 0.00 0.00 0.00 19.45 19.38 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 -0.31 5.33 -0.18 0.00 1.09 -1.26 0.24 121.20 126.11 1a6x s ILE 138 Ca 0.00 0.44 -0.03 0.00 -1.10 0.00 0.00 60.65 59.96 1a6x s ILE 138 Cb 0.00 -3.56 -0.10 0.00 -1.06 0.00 0.00 42.46 37.73 1a6x s ILE 138 CO 0.00 0.46 -0.19 0.18 -0.10 0.00 0.00 174.94 175.29 1a6x n LEU 139 N 3.08 2.34 -4.76 2.97 4.77 -0.85 -4.98 117.00 119.57 1a6x n LEU 139 Ca -0.14 0.03 -0.33 0.00 -0.03 0.00 0.00 56.01 55.54 1a6x n LEU 139 Cb 0.52 -0.60 0.06 0.00 -2.33 0.00 0.00 43.42 41.08 1a6x n LEU 139 CO 0.37 0.64 0.73 0.54 -1.33 0.00 0.00 177.39 178.35 1a6x s VAL 140 N -2.35 3.15 0.19 4.08 0.11 -0.83 -5.05 120.40 119.70 1a6x s VAL 140 Ca -0.25 0.49 0.07 0.00 -2.93 0.00 0.00 61.98 59.37 1a6x s VAL 140 Cb 0.08 -3.00 -0.04 0.00 -1.53 0.00 0.00 36.38 31.89 1a6x s VAL 140 CO 0.38 -0.37 0.02 -1.61 -3.33 0.00 0.00 175.10 170.20 1a6x s GLU 141 N -4.27 2.46 -0.80 1.54 2.02 -1.26 -5.01 118.70 113.37 1a6x s GLU 141 Ca 0.66 -1.14 -0.25 0.00 0.02 0.00 0.00 54.97 54.27 1a6x s GLU 141 Cb -0.21 -2.36 -0.03 0.00 0.10 0.00 0.00 34.13 31.63 1a6x s GLU 141 CO 0.45 0.44 1.88 -1.54 0.02 0.00 0.00 175.26 176.51 1a6x s SER 142 N -3.13 5.27 0.00 -0.19 1.04 -1.26 -1.61 113.70 113.82 1a6x s SER 142 Ca 0.29 -0.36 0.00 0.00 0.48 0.00 0.00 55.95 56.36 1a6x s SER 142 Cb -0.09 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.48 1a6x s SER 142 CO 0.19 -2.55 0.00 0.61 0.98 0.00 0.00 173.24 172.48 1a6x n GLY 143 N 6.43 1.64 3.73 7.32 0.00 0.27 -4.90 105.19 119.68 1a6x n GLY 143 Ca 0.32 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.99 1a6x n GLY 143 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1a6x s GLN 144 N 0.00 2.48 0.77 1.61 0.74 -0.63 -4.53 119.66 120.09 1a6x s GLN 144 Ca 0.00 1.89 -0.11 0.00 0.05 0.00 0.00 55.36 57.19 1a6x s GLN 144 Cb 0.00 -1.86 0.05 0.00 1.10 0.00 0.00 33.01 32.30 1a6x s GLN 144 CO 0.00 -1.60 1.09 -1.25 -0.55 0.00 0.00 175.29 172.97 1a6x s PRO 145 N -3.58 2.31 0.05 1.67 0.04 -1.26 -0.86 135.00 133.37 1a6x s PRO 145 Ca 0.78 0.72 -0.05 0.00 0.04 0.00 0.00 61.00 62.49 1a6x s PRO 145 Cb -0.33 -1.94 -0.02 0.00 0.04 0.00 0.00 34.50 32.26 1a6x s PRO 145 CO 0.40 -1.48 0.07 0.14 0.04 0.00 0.00 177.00 176.17 1a6x s VAL 146 N -3.13 0.16 -0.00 -0.36 -7.23 0.98 -4.74 120.40 106.08 1a6x s VAL 146 Ca 0.60 -1.33 0.00 0.00 -1.81 0.00 0.00 61.98 59.44 1a6x s VAL 146 Cb -0.14 -1.16 0.00 0.00 0.56 0.00 0.00 36.38 35.64 1a6x s VAL 146 CO 0.54 -0.73 0.00 -0.70 -0.31 0.00 0.00 175.10 173.90 1a6x s GLU 147 N -3.24 0.00 -0.85 4.82 2.12 -1.26 -1.46 118.70 118.84 1a6x s GLU 147 Ca 0.00 0.02 -0.20 0.00 0.36 0.00 0.00 54.97 55.15 1a6x s GLU 147 Cb 0.03 -0.04 -0.21 0.00 0.26 0.00 0.00 34.13 34.17 1a6x s GLU 147 CO -0.07 -0.02 2.35 0.34 -0.54 0.00 0.00 175.26 177.32 1a6x n PHE 148 N 3.21 0.71 0.00 5.30 -0.00 -1.25 -0.61 117.46 124.81 1a6x n PHE 148 Ca -0.14 0.05 0.00 0.00 -0.00 0.00 0.00 57.45 57.36 1a6x n PHE 148 Cb 0.59 -1.83 0.00 0.00 -0.00 0.00 0.00 39.48 38.24 1a6x n PHE 148 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.76 176.36 1a6x n ASP 149 N 12.72 0.00 -4.77 -2.13 5.68 -1.25 -5.02 116.55 121.77 1a6x n ASP 149 Ca 0.55 0.00 -0.40 0.00 -0.50 0.00 0.00 54.79 54.44 1a6x n ASP 149 Cb 0.30 0.00 -0.01 0.00 -1.14 0.00 0.00 41.12 40.27 1a6x n ASP 149 CO 0.00 0.00 0.00 -1.61 -1.33 0.00 0.00 177.20 174.26 1a6x s GLU 150 N 0.00 4.07 0.55 0.11 0.41 0.22 -4.73 118.70 119.33 1a6x s GLU 150 Ca 0.00 2.29 -0.17 0.00 -0.41 0.00 0.00 54.97 56.67 1a6x s GLU 150 Cb 0.00 -2.87 -0.06 0.00 -1.78 0.00 0.00 34.13 29.42 1a6x s GLU 150 CO 0.00 -0.46 1.04 -1.25 -0.49 0.00 0.00 175.26 174.11 1a6x s PRO 151 N -2.12 3.54 0.00 0.39 0.04 -1.26 -1.08 135.00 134.52 1a6x s PRO 151 Ca 0.54 1.24 0.00 0.00 0.04 0.00 0.00 61.00 62.82 1a6x s PRO 151 Cb -0.41 -2.06 0.00 0.00 0.04 0.00 0.00 34.50 32.07 1a6x s PRO 151 CO 0.54 -0.63 0.00 1.28 0.04 0.00 0.00 177.00 178.23 1a6x n LEU 152 N -1.62 0.00 -4.08 -3.56 4.77 0.31 -4.48 117.00 108.34 1a6x n LEU 152 Ca 0.09 0.00 -0.21 0.00 -0.03 0.00 0.00 56.01 55.86 1a6x n LEU 152 Cb 0.53 -0.04 -0.15 0.00 -2.33 0.00 0.00 43.42 41.43 1a6x n LEU 152 CO 0.44 -0.06 -0.46 -0.69 -1.33 0.00 0.00 177.39 175.30 1a6x s VAL 153 N -0.11 0.98 -0.20 4.08 1.01 -1.25 -1.97 120.40 122.95 1a6x s VAL 153 Ca 0.00 -0.53 -0.13 0.00 0.00 0.00 0.00 61.98 61.32 1a6x s VAL 153 Cb 0.00 -0.82 -0.05 0.00 0.00 0.00 0.00 36.38 35.52 1a6x s VAL 153 CO 0.00 0.28 0.28 -0.69 0.00 0.00 0.00 175.10 174.97 1a6x s VAL 154 N -0.27 5.29 0.31 2.92 1.01 0.14 -2.32 120.40 127.48 1a6x s VAL 154 Ca 0.04 0.47 0.08 0.00 0.00 0.00 0.00 61.98 62.58 1a6x s VAL 154 Cb -0.05 -3.61 -0.04 0.00 0.00 0.00 0.00 36.38 32.68 1a6x s VAL 154 CO -0.00 0.34 0.14 -0.63 0.00 0.00 0.00 175.10 174.95 1a6x s ILE 155 N 0.89 3.38 0.00 2.22 1.09 -0.45 0.80 121.20 129.13 1a6x s ILE 155 Ca 0.14 -1.65 0.00 0.00 -1.10 0.00 0.00 60.65 58.04 1a6x s ILE 155 Cb -0.13 -3.04 0.00 0.00 -1.06 0.00 0.00 42.46 38.23 1a6x s ILE 155 CO 0.05 -0.24 0.49 1.21 -0.10 0.00 0.00 174.94 176.35