#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 -4.00 0.11 3.17 4.71 -1.26 -4.72 120.64 118.65 1a6x n GLU 71 Ca 0.00 3.13 -0.12 0.00 -0.01 0.00 0.00 57.16 60.16 1a6x n GLU 71 Cb 0.00 -4.02 -0.08 0.00 -1.01 0.00 0.00 31.44 26.33 1a6x n GLU 71 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1a6x h ALA 72 N -0.13 -0.33 -1.54 0.62 0.00 -2.10 -3.40 119.26 112.38 1a6x h ALA 72 Ca -0.04 -0.20 -0.54 0.00 0.00 0.00 0.00 54.91 54.14 1a6x h ALA 72 Cb 1.05 0.13 -0.06 0.00 0.00 0.00 0.00 17.79 18.91 1a6x h ALA 72 CO 0.01 -0.45 1.16 -1.25 0.00 0.00 0.00 179.25 178.73 1a6x s PRO 73 N -4.10 3.12 -0.84 0.00 0.04 -1.26 -4.93 135.00 127.03 1a6x s PRO 73 Ca -0.13 0.41 -0.25 0.00 0.04 0.00 0.00 61.00 61.07 1a6x s PRO 73 Cb 0.01 -4.20 -0.02 0.00 0.04 0.00 0.00 34.50 30.33 1a6x s PRO 73 CO 0.51 -2.16 1.80 0.00 0.04 0.00 0.00 177.00 177.19 1a6x s ALA 74 N 6.77 2.02 -0.65 8.56 0.00 -1.26 -3.99 121.76 133.21 1a6x s ALA 74 Ca 0.54 -1.43 -0.13 0.00 0.00 0.00 0.00 51.96 50.95 1a6x s ALA 74 Cb -0.11 -4.47 0.02 0.00 0.00 0.00 0.00 23.12 18.55 1a6x s ALA 74 CO 0.23 -4.31 0.64 0.00 0.00 0.00 0.00 175.76 172.32 1a6x n ALA 75 N 12.56 -2.65 0.38 0.00 0.00 -1.26 -4.91 120.51 124.63 1a6x n ALA 75 Ca 0.32 0.19 -0.15 0.00 0.00 0.00 0.00 53.44 53.80 1a6x n ALA 75 Cb 0.49 -1.80 -0.07 0.00 0.00 0.00 0.00 19.45 18.07 1a6x n ALA 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1a6x h ALA 76 N 1.41 -1.08 -3.25 0.00 0.00 -1.99 -3.49 119.26 110.87 1a6x h ALA 76 Ca -0.36 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.33 1a6x h ALA 76 Cb 1.24 0.38 0.00 0.00 0.00 0.00 0.00 17.79 19.41 1a6x h ALA 76 CO 0.29 -1.00 -0.79 0.39 0.00 0.00 0.00 179.25 178.14 1a6x n GLU 77 N -5.10 -4.03 -3.92 0.00 4.71 -1.26 -5.03 120.64 106.01 1a6x n GLU 77 Ca -0.12 2.99 -0.23 0.00 -0.01 0.00 0.00 57.16 59.78 1a6x n GLU 77 Cb 0.39 -3.35 -0.05 0.00 -1.01 0.00 0.00 31.44 27.42 1a6x n GLU 77 CO 0.00 0.00 0.00 0.96 0.09 0.00 0.00 177.13 178.18 1a6x s ILE 78 N -2.96 2.37 0.05 -3.67 -5.25 -1.26 -5.04 121.20 105.43 1a6x s ILE 78 Ca 0.00 -1.56 0.00 0.00 -0.99 0.00 0.00 60.65 58.10 1a6x s ILE 78 Cb 0.00 -2.93 0.00 0.00 2.95 0.00 0.00 42.46 42.48 1a6x s ILE 78 CO 0.00 0.00 0.00 -1.20 -1.79 0.00 0.00 174.94 171.95 1a6x n SER 79 N -1.39 -2.64 -0.57 4.36 7.64 -1.26 -5.01 113.62 114.76 1a6x n SER 79 Ca 0.00 0.24 0.00 0.00 1.01 0.00 0.00 58.87 60.12 1a6x n SER 79 Cb 0.64 -0.79 0.00 0.00 -1.01 0.00 0.00 64.21 63.05 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 -0.77 -1.12 2.93 0.23 0.00 -1.25 -5.00 105.19 100.21 1a6x n GLY 80 Ca 0.00 -0.59 -0.30 0.00 0.00 0.00 0.00 46.02 45.13 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 0.00 2.22 -0.22 1.61 5.04 0.13 -4.91 115.29 119.16 1a6x s HIS 81 Ca 0.00 -1.58 -0.17 0.00 -1.54 0.00 0.00 55.06 51.77 1a6x s HIS 81 Cb 0.00 -1.52 -0.03 0.00 0.04 0.00 0.00 32.58 31.07 1a6x s HIS 81 CO 0.00 -0.74 0.46 0.42 -2.34 0.00 0.00 174.74 172.54 1a6x s ILE 82 N 1.46 5.14 -0.32 0.89 -1.09 -1.26 0.17 121.20 126.19 1a6x s ILE 82 Ca -0.04 0.80 -0.25 0.00 -2.23 0.00 0.00 60.65 58.93 1a6x s ILE 82 Cb -0.18 -3.78 0.01 0.00 -1.58 0.00 0.00 42.46 36.93 1a6x s ILE 82 CO -0.07 0.18 0.90 -0.69 -1.23 0.00 0.00 174.94 174.03 1a6x s VAL 83 N 1.72 4.67 -0.22 2.92 1.01 0.42 -4.95 120.40 125.97 1a6x s VAL 83 Ca 0.20 1.34 -0.06 0.00 0.00 0.00 0.00 61.98 63.46 1a6x s VAL 83 Cb -0.15 -4.26 -0.03 0.00 0.00 0.00 0.00 36.38 31.94 1a6x s VAL 83 CO 0.09 -0.37 0.03 -0.13 0.00 0.00 0.00 175.10 174.71 1a6x s ARG 84 N 3.25 3.65 -0.57 2.72 0.52 -1.26 0.18 118.95 127.44 1a6x s ARG 84 Ca 0.37 -0.50 -0.34 0.00 -0.52 0.00 0.00 55.73 54.74 1a6x s ARG 84 Cb -0.13 -3.18 -0.15 0.00 0.52 0.00 0.00 34.95 32.01 1a6x s ARG 84 CO 0.14 -0.06 2.35 -1.13 0.02 0.00 0.00 175.30 176.63 1a6x n SER 85 N 4.48 1.42 0.00 0.23 3.41 0.13 -4.73 113.62 118.57 1a6x n SER 85 Ca -0.17 0.25 0.11 0.00 -0.26 0.00 0.00 58.87 58.81 1a6x n SER 85 Cb 0.52 -1.16 0.66 0.00 -0.26 0.00 0.00 64.21 63.97 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 8.28 0.75 -3.66 4.33 -0.04 -1.26 -2.85 135.00 140.54 1a6x n PRO 86 Ca 0.50 0.00 -0.05 0.00 -0.04 0.00 0.00 63.50 63.90 1a6x n PRO 86 Cb 0.18 -1.47 -0.07 0.00 -0.04 0.00 0.00 33.50 32.10 1a6x n PRO 86 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1a6x s MET 87 N -2.00 0.48 0.55 0.54 0.23 -1.26 -4.97 119.30 112.87 1a6x s MET 87 Ca 0.34 1.21 -0.21 0.00 -1.03 0.00 0.00 55.69 55.99 1a6x s MET 87 Cb 0.15 0.51 -0.05 0.00 -1.53 0.00 0.00 34.83 33.92 1a6x s MET 87 CO 0.26 -0.21 1.36 0.08 -2.03 0.00 0.00 175.02 174.48 1a6x s VAL 88 N 2.51 2.04 0.00 5.16 1.01 -1.26 -4.72 120.40 125.14 1a6x s VAL 88 Ca -0.05 0.03 0.00 0.00 0.00 0.00 0.00 61.98 61.95 1a6x s VAL 88 Cb -0.11 -3.01 0.00 0.00 0.00 0.00 0.00 36.38 33.26 1a6x s VAL 88 CO -0.16 -0.00 0.00 0.61 0.00 0.00 0.00 175.10 175.55 1a6x n GLY 89 N 0.74 -0.04 3.43 4.51 0.00 -0.51 -4.69 105.19 108.63 1a6x n GLY 89 Ca 0.11 -0.17 -0.21 0.00 0.00 0.00 0.00 46.02 45.75 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 1.22 -0.01 2.61 2.01 -0.19 -0.42 115.64 120.86 1a6x s THR 90 Ca 0.00 -2.02 -0.01 0.00 0.31 0.00 0.00 61.69 59.97 1a6x s THR 90 Cb 0.00 -2.68 -0.00 0.00 0.01 0.00 0.00 72.50 69.83 1a6x s THR 90 CO 0.00 -0.09 0.02 0.12 -0.69 0.00 0.00 174.62 173.98 1a6x s PHE 91 N -3.28 0.02 0.09 4.92 2.19 0.27 -0.28 117.98 121.89 1a6x s PHE 91 Ca 0.34 -0.03 0.02 0.00 0.33 0.00 0.00 56.93 57.60 1a6x s PHE 91 Cb 0.08 -0.02 -0.04 0.00 -1.31 0.00 0.00 43.02 41.73 1a6x s PHE 91 CO 0.14 -0.05 -0.08 0.71 1.83 0.00 0.00 175.22 177.77 1a6x s TYR 92 N -0.25 0.89 -0.53 10.12 2.02 0.65 0.64 117.35 130.89 1a6x s TYR 92 Ca -0.03 -0.76 0.18 0.00 -0.37 0.00 0.00 57.07 56.09 1a6x s TYR 92 Cb -0.02 -0.51 -0.23 0.00 -0.40 0.00 0.00 41.96 40.81 1a6x s TYR 92 CO -0.00 -0.10 0.62 0.54 -1.57 0.00 0.00 175.55 175.04 1a6x n ARG 93 N 0.43 0.93 -4.20 -0.62 5.12 -1.26 -1.05 116.66 116.00 1a6x n ARG 93 Ca -0.15 -0.06 -0.15 0.00 -1.93 0.00 0.00 57.85 55.55 1a6x n ARG 93 Cb 0.59 -1.37 -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 -2.90 1.04 0.08 0.55 -4.23 -1.26 -1.34 115.64 107.59 1a6x s THR 94 Ca 0.02 -1.69 0.16 0.00 -1.18 0.00 0.00 61.69 59.00 1a6x s THR 94 Cb 0.13 -1.43 0.08 0.00 1.34 0.00 0.00 72.50 72.61 1a6x s THR 94 CO 0.74 -0.54 1.61 1.55 -0.54 0.00 0.00 174.62 177.44 1a6x h PRO 95 N 3.50 0.00 -4.10 3.99 0.13 -1.89 -3.46 132.00 130.16 1a6x h PRO 95 Ca -0.38 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.50 1a6x h PRO 95 Cb 1.19 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.24 1a6x h PRO 95 CO 0.53 0.48 -0.20 0.45 -0.23 0.00 0.00 178.00 179.03 1a6x s SER 96 N -6.49 0.81 -0.01 1.44 0.15 -1.26 -5.04 113.70 103.29 1a6x s SER 96 Ca 0.01 -1.44 -0.22 0.00 0.70 0.00 0.00 55.95 55.01 1a6x s SER 96 Cb 0.10 0.65 -0.22 0.00 -1.71 0.00 0.00 66.02 64.84 1a6x s SER 96 CO 0.72 -1.27 1.10 1.55 1.20 0.00 0.00 173.24 176.55 1a6x h PRO 97 N 2.14 0.31 -1.10 5.44 0.13 -1.98 -3.21 132.00 133.73 1a6x h PRO 97 Ca -0.28 -0.30 -0.44 0.00 -0.87 0.00 0.00 66.00 64.11 1a6x h PRO 97 Cb 1.24 0.08 -0.23 0.00 0.13 0.00 0.00 31.00 32.22 1a6x h PRO 97 CO 0.39 0.98 0.57 -0.25 -0.23 0.00 0.00 178.00 179.45 1a6x n ASP 98 N -4.38 4.99 -4.44 1.44 8.00 -1.26 -4.89 116.55 116.01 1a6x n ASP 98 Ca -0.09 -3.31 -0.28 0.00 0.71 0.00 0.00 54.79 51.81 1a6x n ASP 98 Cb 0.56 -0.86 -0.12 0.00 -0.02 0.00 0.00 41.12 40.68 1a6x n ASP 98 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1a6x s ALA 99 N -2.66 2.54 0.99 2.24 0.00 -1.21 -5.13 121.76 118.54 1a6x s ALA 99 Ca 0.46 -1.48 -0.12 0.00 0.00 0.00 0.00 51.96 50.82 1a6x s ALA 99 Cb 0.37 -0.47 0.19 0.00 0.00 0.00 0.00 23.12 23.21 1a6x s ALA 99 CO 0.05 0.52 1.08 0.15 0.00 0.00 0.00 175.76 177.56 1a6x s LYS 100 N -2.28 0.45 0.06 0.00 1.02 -1.26 -4.78 119.74 112.96 1a6x s LYS 100 Ca 0.17 0.79 -0.29 0.00 0.02 0.00 0.00 55.97 56.67 1a6x s LYS 100 Cb -0.10 -1.72 -0.05 0.00 -0.52 0.00 0.00 37.83 35.45 1a6x s LYS 100 CO 0.09 -2.78 0.91 0.00 -0.92 0.00 0.00 175.35 172.64 1a6x s ALA 101 N -2.81 3.25 0.28 5.17 0.00 -1.26 -4.43 121.76 121.97 1a6x s ALA 101 Ca 0.65 0.48 0.02 0.00 0.00 0.00 0.00 51.96 53.11 1a6x s ALA 101 Cb -0.20 -3.22 0.57 0.00 0.00 0.00 0.00 23.12 20.27 1a6x s ALA 101 CO 0.59 -0.06 1.82 0.74 0.00 0.00 0.00 175.76 178.85 1a6x h PHE 102 N 5.95 1.09 -3.52 0.00 0.04 -1.56 -3.40 116.94 115.54 1a6x h PHE 102 Ca -0.43 0.03 -0.43 0.00 2.80 0.00 0.00 57.97 59.95 1a6x h PHE 102 Cb 1.21 -0.34 -0.33 0.00 2.20 0.00 0.00 35.95 38.69 1a6x h PHE 102 CO 0.66 0.39 -0.78 0.42 -0.60 0.00 0.00 178.31 178.40 1a6x s ILE 103 N -5.95 0.67 -0.28 -0.55 -1.09 -1.26 -4.91 121.20 107.84 1a6x s ILE 103 Ca -0.12 -0.23 -0.07 0.00 -2.23 0.00 0.00 60.65 58.00 1a6x s ILE 103 Cb 0.23 -0.66 -0.01 0.00 -1.58 0.00 0.00 42.46 40.44 1a6x s ILE 103 CO 0.80 0.25 0.08 -0.70 -1.23 0.00 0.00 174.94 174.14 1a6x s GLU 104 N 0.71 3.31 -0.50 2.79 2.12 -1.26 -5.02 118.70 120.84 1a6x s GLU 104 Ca -0.11 -0.71 -0.46 0.00 0.36 0.00 0.00 54.97 54.06 1a6x s GLU 104 Cb -0.13 -3.35 -0.20 0.00 0.26 0.00 0.00 34.13 30.71 1a6x s GLU 104 CO 0.01 -0.35 1.81 0.28 -0.54 0.00 0.00 175.26 176.48 1a6x n VAL 105 N 4.89 0.00 0.00 3.70 0.31 -1.26 -1.78 118.33 124.19 1a6x n VAL 105 Ca -0.15 -0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.18 1a6x n VAL 105 Cb 0.49 -0.50 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 5.37 1.80 3.17 2.92 0.00 -1.26 -5.08 105.19 112.11 1a6x n GLY 106 Ca 0.40 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.30 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 -0.32 0.83 0.43 1.61 0.74 -0.73 -5.00 119.66 117.22 1a6x s GLN 107 Ca 0.00 -1.23 0.07 0.00 0.05 0.00 0.00 55.36 54.26 1a6x s GLN 107 Cb 0.00 -0.36 0.01 0.00 1.10 0.00 0.00 33.01 33.76 1a6x s GLN 107 CO 0.00 0.03 0.59 0.15 -0.55 0.00 0.00 175.29 175.52 1a6x s LYS 108 N -3.23 2.80 -0.05 1.67 1.02 -1.26 -2.53 119.74 118.15 1a6x s LYS 108 Ca 0.08 -1.17 -0.17 0.00 0.02 0.00 0.00 55.97 54.73 1a6x s LYS 108 Cb 0.01 -2.73 0.03 0.00 -0.52 0.00 0.00 37.83 34.62 1a6x s LYS 108 CO -0.02 -0.32 0.38 0.14 -0.92 0.00 0.00 175.35 174.61 1a6x s VAL 109 N -2.40 0.04 0.04 3.17 -7.23 0.70 -4.97 120.40 109.75 1a6x s VAL 109 Ca 0.55 -0.31 0.05 0.00 -1.81 0.00 0.00 61.98 60.47 1a6x s VAL 109 Cb -0.10 -0.65 -0.02 0.00 0.56 0.00 0.00 36.38 36.16 1a6x s VAL 109 CO 0.34 -0.17 -0.15 0.21 -0.31 0.00 0.00 175.10 175.01 1a6x s ASN 110 N -0.96 1.83 -0.58 4.85 2.47 -1.26 -0.73 114.94 120.56 1a6x s ASN 110 Ca -0.10 -0.49 -0.41 0.00 0.42 0.00 0.00 52.86 52.28 1a6x s ASN 110 Cb -0.04 -0.12 -0.19 0.00 -1.45 0.00 0.00 41.25 39.45 1a6x s ASN 110 CO 0.04 0.05 2.21 0.52 -3.72 0.00 0.00 177.10 176.19 1a6x n VAL 111 N 1.82 0.00 0.00 -5.21 0.31 -1.26 -0.40 118.33 113.59 1a6x n VAL 111 Ca -0.18 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.15 1a6x n VAL 111 Cb 0.54 -0.49 0.00 0.00 -0.91 0.00 0.00 33.84 32.98 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 7.20 1.22 3.76 2.92 0.00 -1.26 -5.03 105.19 114.00 1a6x n GLY 112 Ca 0.56 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 46.22 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 -0.88 6.45 0.40 1.61 1.11 0.46 -4.81 116.67 121.01 1a6x s ASP 113 Ca 0.00 0.53 -0.26 0.00 0.18 0.00 0.00 52.55 53.00 1a6x s ASP 113 Cb 0.00 -2.16 -0.11 0.00 1.07 0.00 0.00 42.92 41.72 1a6x s ASP 113 CO 0.00 0.18 1.26 0.41 1.18 0.00 0.00 175.17 178.20 1a6x n THR 114 N 3.13 2.38 -0.05 -1.27 -1.04 -1.26 0.54 114.28 116.70 1a6x n THR 114 Ca -0.14 -0.50 -0.06 0.00 -2.04 0.00 0.00 64.05 61.31 1a6x n THR 114 Cb 0.52 -1.54 -0.07 0.00 -1.82 0.00 0.00 70.33 67.43 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 0.40 1.13 0.00 -4.42 7.94 0.96 -4.63 117.00 118.39 1a6x n LEU 115 Ca 0.06 -0.03 0.00 0.00 -1.11 0.00 0.00 56.01 54.94 1a6x n LEU 115 Cb 0.38 -0.02 0.00 0.00 0.53 0.00 0.00 43.42 44.32 1a6x n LEU 115 CO 0.60 0.42 0.00 0.00 -1.11 0.00 0.00 177.39 177.30 1a6x s ILE 117 N -2.69 1.82 -0.07 0.00 1.01 -0.22 0.04 121.20 121.08 1a6x s ILE 117 Ca 0.00 -2.11 -0.03 0.00 0.00 0.00 0.00 60.65 58.52 1a6x s ILE 117 Cb 0.00 -1.97 0.04 0.00 0.01 0.00 0.00 42.46 40.54 1a6x s ILE 117 CO 0.00 -0.47 0.14 -0.69 0.00 0.00 0.00 174.94 173.92 1a6x s VAL 118 N -2.57 -0.15 -0.12 2.92 1.01 0.12 -0.25 120.40 121.36 1a6x s VAL 118 Ca 0.20 0.27 -0.26 0.00 0.00 0.00 0.00 61.98 62.19 1a6x s VAL 118 Cb -0.03 -0.25 -0.02 0.00 0.00 0.00 0.00 36.38 36.08 1a6x s VAL 118 CO 0.07 0.11 0.86 -0.70 0.00 0.00 0.00 175.10 175.44 1a6x s GLU 119 N 1.71 4.37 0.08 2.72 2.12 0.61 0.23 118.70 130.53 1a6x s GLU 119 Ca -0.03 1.10 -0.26 0.00 0.36 0.00 0.00 54.97 56.14 1a6x s GLU 119 Cb -0.12 -3.54 0.09 0.00 0.26 0.00 0.00 34.13 30.82 1a6x s GLU 119 CO -0.06 -0.23 1.16 0.00 -0.54 0.00 0.00 175.26 175.58 1a6x s ALA 120 N 1.79 -2.00 -1.61 6.30 0.00 -0.38 -1.02 121.76 124.84 1a6x s ALA 120 Ca 0.41 0.06 -0.07 0.00 0.00 0.00 0.00 51.96 52.36 1a6x s ALA 120 Cb -0.17 0.69 0.07 0.00 0.00 0.00 0.00 23.12 23.71 1a6x s ALA 120 CO 0.16 -1.08 0.30 0.00 0.00 0.00 0.00 175.76 175.13 1a6x n MET 121 N -0.68 -1.58 -4.26 0.00 0.00 -1.26 0.25 117.12 109.58 1a6x n MET 121 Ca -0.03 0.19 -0.34 0.00 0.00 0.00 0.00 57.70 57.53 1a6x n MET 121 Cb 0.60 -4.18 -0.07 0.00 0.00 0.00 0.00 33.22 29.57 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 -4.42 -0.91 0.00 3.17 3.00 -1.26 -4.85 118.16 112.89 1a6x n LYS 122 Ca -0.18 0.10 0.00 0.00 -0.00 0.00 0.00 58.31 58.23 1a6x n LYS 122 Cb 0.62 -3.43 0.00 0.00 0.00 0.00 0.00 35.03 32.22 1a6x n LYS 122 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.40 176.07 1a6x n MET 123 N -4.67 -0.26 -2.94 1.64 2.81 0.14 -5.14 117.12 108.69 1a6x n MET 123 Ca -0.29 0.00 -0.40 0.00 -1.81 0.00 0.00 57.70 55.20 1a6x n MET 123 Cb 0.67 0.00 -0.05 0.00 -0.71 0.00 0.00 33.22 33.14 1a6x n MET 123 CO 0.00 0.00 0.00 1.41 1.51 0.00 0.00 175.97 178.89 1a6x s MET 124 N -2.00 4.50 -0.41 0.03 1.75 -1.26 -1.25 119.30 120.66 1a6x s MET 124 Ca 0.00 1.09 0.03 0.00 -1.25 0.00 0.00 55.69 55.56 1a6x s MET 124 Cb 0.00 -3.40 0.11 0.00 2.84 0.00 0.00 34.83 34.38 1a6x s MET 124 CO 0.00 0.17 0.15 -0.80 -0.65 0.00 0.00 175.02 173.89 1a6x s ASN 125 N 0.34 4.37 0.63 1.11 0.01 0.14 -4.93 114.94 116.61 1a6x s ASN 125 Ca 0.41 -2.44 -0.15 0.00 -0.71 0.00 0.00 52.86 49.96 1a6x s ASN 125 Cb -0.20 -1.46 -0.02 0.00 0.41 0.00 0.00 41.25 39.99 1a6x s ASN 125 CO 0.23 -0.32 1.08 -1.10 -1.51 0.00 0.00 177.10 175.48 1a6x s GLN 126 N 0.52 3.06 -0.23 -0.60 -0.21 -1.26 0.15 119.66 121.08 1a6x s GLN 126 Ca 0.14 1.29 -0.01 0.00 0.02 0.00 0.00 55.36 56.80 1a6x s GLN 126 Cb -0.22 -1.99 0.03 0.00 1.00 0.00 0.00 33.01 31.83 1a6x s GLN 126 CO -0.06 -1.03 -0.10 0.42 -2.12 0.00 0.00 175.29 172.39 1a6x s ILE 127 N -2.41 2.64 -0.65 1.08 -1.09 0.11 -4.85 121.20 116.02 1a6x s ILE 127 Ca 0.65 -1.03 -0.19 0.00 -2.23 0.00 0.00 60.65 57.85 1a6x s ILE 127 Cb -0.18 -2.30 0.11 0.00 -1.58 0.00 0.00 42.46 38.51 1a6x s ILE 127 CO 0.39 0.28 0.80 -0.70 -1.23 0.00 0.00 174.94 174.48 1a6x s GLU 128 N 1.30 3.15 0.00 2.79 2.12 -1.26 -0.03 118.70 126.77 1a6x s GLU 128 Ca 0.01 -1.35 0.00 0.00 0.36 0.00 0.00 54.97 53.99 1a6x s GLU 128 Cb -0.16 -4.34 0.00 0.00 0.26 0.00 0.00 34.13 29.89 1a6x s GLU 128 CO -0.06 -1.60 0.00 0.00 -0.54 0.00 0.00 175.26 173.05 1a6x n ALA 129 N 6.45 0.00 0.00 6.30 0.00 0.19 -4.51 120.51 128.94 1a6x n ALA 129 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.40 1a6x n ALA 129 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.89 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 -2.21 0.00 -3.03 0.00 2.03 -1.26 -4.83 116.55 107.24 1a6x n ASP 130 Ca 0.00 0.00 0.03 0.00 0.52 0.00 0.00 54.79 55.34 1a6x n ASP 130 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1a6x n ASP 130 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 1a6x s LYS 131 N 0.00 0.32 0.15 -0.67 2.20 -1.26 -5.01 119.74 115.46 1a6x s LYS 131 Ca 0.00 0.07 -0.27 0.00 -0.36 0.00 0.00 55.97 55.40 1a6x s LYS 131 Cb 0.00 0.08 -0.16 0.00 -1.51 0.00 0.00 37.83 36.24 1a6x s LYS 131 CO 0.00 -0.52 0.57 0.45 -0.36 0.00 0.00 175.35 175.48 1a6x n SER 132 N 4.57 -0.92 0.00 1.43 2.88 -1.26 -4.88 113.62 115.44 1a6x n SER 132 Ca 0.08 1.03 0.00 0.00 -1.33 0.00 0.00 58.87 58.65 1a6x n SER 132 Cb 0.59 -0.86 0.00 0.00 -0.75 0.00 0.00 64.21 63.19 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 1.73 -1.44 3.72 0.46 0.00 0.09 -4.98 105.19 104.78 1a6x n GLY 133 Ca 0.17 -1.01 -0.24 0.00 0.00 0.00 0.00 46.02 44.94 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 -2.73 2.81 1.05 2.61 2.01 0.30 -0.22 115.64 121.46 1a6x s THR 134 Ca 0.00 -1.73 -0.15 0.00 0.31 0.00 0.00 61.69 60.12 1a6x s THR 134 Cb 0.00 -2.95 0.11 0.00 0.01 0.00 0.00 72.50 69.67 1a6x s THR 134 CO 0.00 -0.14 0.38 0.55 -0.69 0.00 0.00 174.62 174.72 1a6x n VAL 135 N -1.15 0.00 0.00 3.82 3.14 -1.05 0.19 118.33 123.27 1a6x n VAL 135 Ca -0.03 -0.26 0.00 0.00 -2.96 0.00 0.00 64.34 61.10 1a6x n VAL 135 Cb 0.62 -0.70 0.00 0.00 -1.06 0.00 0.00 33.84 32.71 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 -2.51 0.00 0.00 1.45 0.00 0.31 -3.68 118.16 113.73 1a6x n LYS 136 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.35 1a6x n LYS 136 Cb 0.57 -0.08 0.00 0.00 0.00 0.00 0.00 35.03 35.52 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 -2.20 0.00 -2.74 3.14 0.00 0.28 -4.95 120.51 114.04 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 -0.23 5.38 -0.22 0.00 1.09 -1.26 0.20 121.20 126.15 1a6x s ILE 138 Ca 0.00 0.32 -0.04 0.00 -1.10 0.00 0.00 60.65 59.83 1a6x s ILE 138 Cb 0.00 -3.52 -0.12 0.00 -1.06 0.00 0.00 42.46 37.76 1a6x s ILE 138 CO 0.00 0.46 -0.23 0.18 -0.10 0.00 0.00 174.94 175.24 1a6x n LEU 139 N 3.22 2.44 -4.78 2.97 4.77 -0.04 -4.95 117.00 120.63 1a6x n LEU 139 Ca -0.15 0.04 -0.36 0.00 -0.03 0.00 0.00 56.01 55.51 1a6x n LEU 139 Cb 0.52 -0.73 -0.04 0.00 -2.33 0.00 0.00 43.42 40.85 1a6x n LEU 139 CO 0.37 0.71 0.74 0.54 -1.33 0.00 0.00 177.39 178.42 1a6x s VAL 140 N -2.43 3.69 0.24 4.08 0.11 -0.34 -5.05 120.40 120.71 1a6x s VAL 140 Ca -0.30 1.25 0.06 0.00 -2.93 0.00 0.00 61.98 60.05 1a6x s VAL 140 Cb 0.09 -3.62 -0.03 0.00 -1.53 0.00 0.00 36.38 31.29 1a6x s VAL 140 CO 0.46 -0.04 0.32 -0.70 -3.33 0.00 0.00 175.10 171.81 1a6x s GLU 141 N -2.64 3.30 -0.72 1.54 2.12 -1.26 -4.96 118.70 116.08 1a6x s GLU 141 Ca 0.60 -0.84 -0.26 0.00 0.36 0.00 0.00 54.97 54.83 1a6x s GLU 141 Cb -0.21 -2.80 -0.02 0.00 0.26 0.00 0.00 34.13 31.36 1a6x s GLU 141 CO 0.27 0.42 1.77 -1.54 -0.54 0.00 0.00 175.26 175.63 1a6x s SER 142 N -3.95 5.44 0.00 -1.70 1.04 -1.26 -1.44 113.70 111.84 1a6x s SER 142 Ca 0.34 -0.10 0.00 0.00 0.48 0.00 0.00 55.95 56.66 1a6x s SER 142 Cb -0.09 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.49 1a6x s SER 142 CO 0.28 -2.33 0.00 0.61 0.98 0.00 0.00 173.24 172.78 1a6x n GLY 143 N 5.97 0.99 3.82 7.32 0.00 0.21 -4.92 105.19 118.58 1a6x n GLY 143 Ca 0.23 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.27 4.02 0.65 1.61 1.11 -0.52 -4.71 119.66 121.56 1a6x s GLN 144 Ca 0.00 1.16 -0.13 0.00 0.01 0.00 0.00 55.36 56.40 1a6x s GLN 144 Cb 0.00 -2.14 -0.01 0.00 -1.01 0.00 0.00 33.01 29.85 1a6x s GLN 144 CO 0.00 -0.22 1.05 -1.25 0.01 0.00 0.00 175.29 174.89 1a6x s PRO 145 N -3.39 3.13 0.06 2.91 0.04 -1.26 -0.57 135.00 135.92 1a6x s PRO 145 Ca 0.63 1.03 -0.00 0.00 0.04 0.00 0.00 61.00 62.70 1a6x s PRO 145 Cb -0.11 -2.01 -0.04 0.00 0.04 0.00 0.00 34.50 32.38 1a6x s PRO 145 CO 0.19 -0.95 -0.04 0.14 0.04 0.00 0.00 177.00 176.38 1a6x s VAL 146 N -2.83 0.34 0.22 -0.36 -7.23 0.43 -4.78 120.40 106.19 1a6x s VAL 146 Ca 0.60 -1.69 0.08 0.00 -1.81 0.00 0.00 61.98 59.16 1a6x s VAL 146 Cb -0.14 -1.36 -0.05 0.00 0.56 0.00 0.00 36.38 35.39 1a6x s VAL 146 CO 0.48 -0.87 -0.14 -1.61 -0.31 0.00 0.00 175.10 172.64 1a6x s GLU 147 N -3.47 1.37 0.15 4.82 2.02 -1.26 -1.43 118.70 120.91 1a6x s GLU 147 Ca 0.04 -1.62 -0.31 0.00 0.02 0.00 0.00 54.97 53.10 1a6x s GLU 147 Cb 0.04 -1.17 -0.09 0.00 0.10 0.00 0.00 34.13 33.00 1a6x s GLU 147 CO -0.07 0.19 1.51 0.12 0.02 0.00 0.00 175.26 177.03 1a6x s PHE 148 N -2.94 3.11 0.00 1.61 2.19 -1.26 -1.17 117.98 119.52 1a6x s PHE 148 Ca 0.24 0.73 0.00 0.00 0.33 0.00 0.00 56.93 58.23 1a6x s PHE 148 Cb -0.01 -3.85 0.00 0.00 -1.31 0.00 0.00 43.02 37.85 1a6x s PHE 148 CO 0.08 -3.10 0.00 -3.47 1.83 0.00 0.00 175.22 170.56 1a6x n ASP 149 N 3.90 0.00 -4.79 6.13 2.03 -1.13 -5.01 116.55 117.68 1a6x n ASP 149 Ca 0.13 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 -0.06 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 -0.15 4.46 0.60 -0.67 -6.30 -0.32 -4.85 118.70 111.48 1a6x s GLU 150 Ca 0.00 1.18 -0.15 0.00 -2.50 0.00 0.00 54.97 53.50 1a6x s GLU 150 Cb 0.00 -2.77 -0.03 0.00 0.00 0.00 0.00 34.13 31.33 1a6x s GLU 150 CO 0.00 0.29 1.05 -1.25 0.02 0.00 0.00 175.26 175.37 1a6x s PRO 151 N -2.13 3.33 0.00 4.30 0.04 -1.26 0.23 135.00 139.51 1a6x s PRO 151 Ca 0.49 1.14 0.00 0.00 0.04 0.00 0.00 61.00 62.68 1a6x s PRO 151 Cb -0.17 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.33 1a6x s PRO 151 CO 0.22 -0.80 0.00 1.28 0.04 0.00 0.00 177.00 177.74 1a6x n LEU 152 N -2.14 0.00 -4.37 -3.56 4.77 0.46 -4.68 117.00 107.49 1a6x n LEU 152 Ca 0.08 0.00 -0.31 0.00 -0.03 0.00 0.00 56.01 55.76 1a6x n LEU 152 Cb 0.53 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.48 1a6x n LEU 152 CO 0.48 -0.14 -0.55 -0.69 -1.33 0.00 0.00 177.39 175.16 1a6x s VAL 153 N -0.29 2.32 -0.26 4.08 1.01 -1.21 -0.86 120.40 125.18 1a6x s VAL 153 Ca 0.00 -1.25 -0.10 0.00 0.00 0.00 0.00 61.98 60.63 1a6x s VAL 153 Cb 0.00 -1.90 -0.04 0.00 0.00 0.00 0.00 36.38 34.43 1a6x s VAL 153 CO 0.00 0.42 0.15 -0.69 0.00 0.00 0.00 175.10 174.98 1a6x s VAL 154 N -0.79 5.08 0.32 2.92 1.01 0.52 -0.44 120.40 129.02 1a6x s VAL 154 Ca 0.12 0.09 0.09 0.00 0.00 0.00 0.00 61.98 62.28 1a6x s VAL 154 Cb -0.10 -3.40 -0.04 0.00 0.00 0.00 0.00 36.38 32.84 1a6x s VAL 154 CO 0.02 0.29 0.07 -0.63 0.00 0.00 0.00 175.10 174.86 1a6x s ILE 155 N 1.56 3.10 0.00 2.22 1.01 0.13 -0.53 121.20 128.69 1a6x s ILE 155 Ca 0.07 -1.81 0.00 0.00 0.00 0.00 0.00 60.65 58.91 1a6x s ILE 155 Cb -0.15 -2.91 0.00 0.00 0.01 0.00 0.00 42.46 39.41 1a6x s ILE 155 CO 0.08 -0.25 0.41 -1.84 0.00 0.00 0.00 174.94 173.34