#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 2.12 0.28 -1.26 -4.97 120.64 116.81 1a6x n GLU 71 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 1a6x n GLU 71 Cb 0.00 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.87 1a6x n GLU 71 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1a6x n ALA 72 N 0.00 0.00 -0.01 -1.84 0.00 -1.26 -4.98 120.51 112.42 1a6x n ALA 72 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 1a6x n ALA 72 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.36 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 -0.08 0.00 0.00 0.13 -1.95 -3.46 132.00 126.63 1a6x h PRO 73 Ca 0.00 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 1a6x h PRO 73 Cb 0.00 0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.15 1a6x h PRO 73 CO 0.00 0.52 0.00 0.00 -0.23 0.00 0.00 178.00 178.29 1a6x n ALA 74 N -2.55 0.00 -2.52 -0.56 0.00 -1.26 -4.73 120.51 108.90 1a6x n ALA 74 Ca -0.08 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 52.95 1a6x n ALA 74 Cb 0.31 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.74 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 0.00 2.92 0.59 0.00 0.00 -1.26 -4.79 121.76 119.23 1a6x s ALA 75 Ca 0.00 -2.56 0.00 0.00 0.00 0.00 0.00 51.96 49.40 1a6x s ALA 75 Cb 0.00 -4.60 0.00 0.00 0.00 0.00 0.00 23.12 18.52 1a6x s ALA 75 CO 0.00 -3.61 0.00 0.00 0.00 0.00 0.00 175.76 172.15 1a6x n ALA 76 N 9.22 -2.32 -2.52 0.00 0.00 -1.26 -4.74 120.51 118.88 1a6x n ALA 76 Ca 0.42 0.58 -0.43 0.00 0.00 0.00 0.00 53.44 54.01 1a6x n ALA 76 Cb 0.48 -1.48 -0.07 0.00 0.00 0.00 0.00 19.45 18.38 1a6x n ALA 76 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1a6x s GLU 77 N -5.17 3.34 -0.00 0.00 8.01 -1.26 -4.71 118.70 118.90 1a6x s GLU 77 Ca 0.00 -0.36 -0.01 0.00 0.01 0.00 0.00 54.97 54.61 1a6x s GLU 77 Cb 0.00 -3.92 0.00 0.00 -4.31 0.00 0.00 34.13 25.91 1a6x s GLU 77 CO 0.00 -0.91 0.02 -0.89 0.01 0.00 0.00 175.26 173.50 1a6x n ILE 78 N 5.70-10.38 -2.67 -1.63 2.08 -1.26 -5.05 119.36 106.15 1a6x n ILE 78 Ca -0.03 2.29 -0.04 0.00 0.56 0.00 0.00 62.75 65.53 1a6x n ILE 78 Cb 0.48 -5.34 0.10 0.00 -0.75 0.00 0.00 39.64 34.14 1a6x n ILE 78 CO 0.00 0.00 0.00 -1.20 0.56 0.00 0.00 176.55 175.91 1a6x n SER 79 N 1.33 -1.28 -0.34 4.38 7.64 -1.26 -5.11 113.62 118.97 1a6x n SER 79 Ca -0.04 -1.89 0.00 0.00 1.01 0.00 0.00 58.87 57.95 1a6x n SER 79 Cb 0.06 1.06 0.00 0.00 -1.01 0.00 0.00 64.21 64.33 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 0.75 -1.57 3.46 0.23 0.00 -1.26 -5.05 105.19 101.75 1a6x n GLY 80 Ca -0.04 -0.92 -0.24 0.00 0.00 0.00 0.00 46.02 44.83 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 2.23 -0.05 1.61 5.04 0.12 -4.92 115.29 119.32 1a6x s HIS 81 Ca 0.00 -0.35 -0.02 0.00 -1.54 0.00 0.00 55.06 53.15 1a6x s HIS 81 Cb 0.00 -0.98 0.03 0.00 0.04 0.00 0.00 32.58 31.67 1a6x s HIS 81 CO 0.00 0.67 0.08 0.42 -2.34 0.00 0.00 174.74 173.57 1a6x s ILE 82 N -2.50 -0.13 -0.32 0.89 -1.09 -1.26 0.06 121.20 116.84 1a6x s ILE 82 Ca 0.29 0.37 -0.23 0.00 -2.23 0.00 0.00 60.65 58.85 1a6x s ILE 82 Cb -0.05 -0.17 0.00 0.00 -1.58 0.00 0.00 42.46 40.66 1a6x s ILE 82 CO 0.14 0.16 0.75 -0.69 -1.23 0.00 0.00 174.94 174.06 1a6x s VAL 83 N 1.98 4.81 -0.18 2.92 1.01 -0.03 -4.99 120.40 125.92 1a6x s VAL 83 Ca 0.02 1.01 -0.02 0.00 0.00 0.00 0.00 61.98 62.99 1a6x s VAL 83 Cb -0.12 -4.13 -0.01 0.00 0.00 0.00 0.00 36.38 32.12 1a6x s VAL 83 CO -0.04 -0.28 -0.08 -0.13 0.00 0.00 0.00 175.10 174.57 1a6x s ARG 84 N 2.91 3.39 -0.52 2.72 0.52 -1.26 0.92 118.95 127.64 1a6x s ARG 84 Ca 0.30 -0.65 -0.33 0.00 -0.52 0.00 0.00 55.73 54.53 1a6x s ARG 84 Cb -0.14 -2.84 -0.13 0.00 0.52 0.00 0.00 34.95 32.35 1a6x s ARG 84 CO 0.14 -0.01 2.33 0.45 0.02 0.00 0.00 175.30 178.22 1a6x n SER 85 N 4.22 1.69 0.00 0.23 2.88 0.14 -4.74 113.62 118.04 1a6x n SER 85 Ca -0.18 0.21 0.11 0.00 -1.33 0.00 0.00 58.87 57.68 1a6x n SER 85 Cb 0.52 -1.23 0.67 0.00 -0.75 0.00 0.00 64.21 63.42 1a6x n SER 85 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1a6x n PRO 86 N 8.36 0.75 -3.65 -1.46 -0.04 -1.26 -2.86 135.00 134.84 1a6x n PRO 86 Ca 0.46 0.00 -0.07 0.00 -0.04 0.00 0.00 63.50 63.85 1a6x n PRO 86 Cb 0.23 -1.48 -0.07 0.00 -0.04 0.00 0.00 33.50 32.14 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 0.67 0.32 0.54 1.75 -1.26 -4.96 119.30 114.36 1a6x s MET 87 Ca 0.34 1.19 -0.29 0.00 -1.25 0.00 0.00 55.69 55.68 1a6x s MET 87 Cb 0.16 0.14 -0.11 0.00 2.84 0.00 0.00 34.83 37.86 1a6x s MET 87 CO 0.26 -0.15 1.45 0.08 -0.65 0.00 0.00 175.02 176.01 1a6x s VAL 88 N 1.64 2.35 0.00 10.11 1.01 -1.26 -4.63 120.40 129.62 1a6x s VAL 88 Ca -0.10 0.33 0.00 0.00 0.00 0.00 0.00 61.98 62.21 1a6x s VAL 88 Cb -0.06 -3.21 0.00 0.00 0.00 0.00 0.00 36.38 33.12 1a6x s VAL 88 CO -0.19 0.07 0.00 0.61 0.00 0.00 0.00 175.10 175.59 1a6x n GLY 89 N 1.19 -0.51 3.46 4.51 0.00 -0.46 -4.79 105.19 108.60 1a6x n GLY 89 Ca 0.03 0.10 -0.22 0.00 0.00 0.00 0.00 46.02 45.93 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 1.44 -0.01 2.61 2.01 -0.26 0.23 115.64 121.65 1a6x s THR 90 Ca 0.00 -2.04 0.00 0.00 0.31 0.00 0.00 61.69 59.96 1a6x s THR 90 Cb 0.00 -2.68 0.01 0.00 0.01 0.00 0.00 72.50 69.84 1a6x s THR 90 CO 0.00 -0.12 0.01 0.12 -0.69 0.00 0.00 174.62 173.94 1a6x s PHE 91 N -3.13 0.06 0.22 4.92 2.19 -0.01 -0.60 117.98 121.64 1a6x s PHE 91 Ca 0.33 0.04 0.06 0.00 0.33 0.00 0.00 56.93 57.69 1a6x s PHE 91 Cb 0.07 -0.14 -0.05 0.00 -1.31 0.00 0.00 43.02 41.59 1a6x s PHE 91 CO 0.14 -0.04 -0.08 0.71 1.83 0.00 0.00 175.22 177.78 1a6x s TYR 92 N 0.46 1.67 -0.31 10.12 2.02 0.65 0.01 117.35 131.97 1a6x s TYR 92 Ca -0.04 -0.73 0.11 0.00 -0.37 0.00 0.00 57.07 56.04 1a6x s TYR 92 Cb -0.06 -0.89 -0.14 0.00 -0.40 0.00 0.00 41.96 40.47 1a6x s TYR 92 CO -0.01 0.19 0.37 0.54 -1.57 0.00 0.00 175.55 175.07 1a6x n ARG 93 N -0.42 2.26 -4.28 -0.62 5.12 -1.26 -1.44 116.66 116.02 1a6x n ARG 93 Ca -0.07 -0.04 -0.19 0.00 -1.93 0.00 0.00 57.85 55.62 1a6x n ARG 93 Cb 0.62 -1.10 -0.11 0.00 -1.16 0.00 0.00 32.46 30.71 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 -2.30 1.53 -0.08 0.55 -4.23 -1.26 -1.23 115.64 108.63 1a6x s THR 94 Ca 0.01 -1.85 -0.27 0.00 -1.18 0.00 0.00 61.69 58.40 1a6x s THR 94 Cb 0.08 -1.70 -0.23 0.00 1.34 0.00 0.00 72.50 71.98 1a6x s THR 94 CO 0.44 -0.41 1.01 1.55 -0.54 0.00 0.00 174.62 176.67 1a6x h PRO 95 N 3.31 0.00 -4.89 3.99 0.13 -1.92 -3.46 132.00 129.16 1a6x h PRO 95 Ca -0.40 -0.00 -0.46 0.00 -0.87 0.00 0.00 66.00 64.26 1a6x h PRO 95 Cb 1.20 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.20 1a6x h PRO 95 CO 0.52 0.76 -0.50 -1.12 -0.23 0.00 0.00 178.00 177.43 1a6x s SER 96 N -5.97 1.66 0.56 1.44 0.01 -1.26 -5.13 113.70 105.01 1a6x s SER 96 Ca -0.17 -1.73 -0.17 0.00 1.31 0.00 0.00 55.95 55.18 1a6x s SER 96 Cb -0.01 0.54 -0.05 0.00 0.21 0.00 0.00 66.02 66.71 1a6x s SER 96 CO 0.68 -1.04 1.05 -2.16 0.41 0.00 0.00 173.24 172.18 1a6x s PRO 97 N -3.51 3.51 -1.91 12.44 0.04 -1.26 -3.18 135.00 141.12 1a6x s PRO 97 Ca 0.39 1.22 0.00 0.00 0.04 0.00 0.00 61.00 62.66 1a6x s PRO 97 Cb 0.03 -2.06 0.00 0.00 0.04 0.00 0.00 34.50 32.51 1a6x s PRO 97 CO 0.26 -0.66 0.00 -3.47 0.04 0.00 0.00 177.00 173.17 1a6x n ASP 98 N -1.70 -5.31 -4.59 6.66 -0.08 -1.26 -4.96 116.55 105.31 1a6x n ASP 98 Ca 0.09 0.36 -0.28 0.00 -1.51 0.00 0.00 54.79 53.44 1a6x n ASP 98 Cb 0.53 -4.44 -0.09 0.00 2.34 0.00 0.00 41.12 39.45 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 -2.76 2.99 0.84 -1.67 0.00 -1.19 -5.12 121.76 114.85 1a6x s ALA 99 Ca 0.00 -1.35 -0.11 0.00 0.00 0.00 0.00 51.96 50.49 1a6x s ALA 99 Cb 0.00 -0.85 0.09 0.00 0.00 0.00 0.00 23.12 22.37 1a6x s ALA 99 CO 0.00 0.55 1.09 0.15 0.00 0.00 0.00 175.76 177.55 1a6x s LYS 100 N -2.57 1.73 0.11 0.00 1.02 -1.26 -4.94 119.74 113.84 1a6x s LYS 100 Ca 0.24 0.79 -0.30 0.00 0.02 0.00 0.00 55.97 56.71 1a6x s LYS 100 Cb -0.10 -1.87 -0.06 0.00 -0.52 0.00 0.00 37.83 35.28 1a6x s LYS 100 CO 0.15 -1.90 1.12 0.00 -0.92 0.00 0.00 175.35 173.80 1a6x s ALA 101 N -3.02 3.35 0.30 5.17 0.00 -1.26 -4.59 121.76 121.70 1a6x s ALA 101 Ca 0.62 0.79 0.04 0.00 0.00 0.00 0.00 51.96 53.41 1a6x s ALA 101 Cb -0.16 -3.38 0.77 0.00 0.00 0.00 0.00 23.12 20.34 1a6x s ALA 101 CO 0.56 -0.29 1.65 0.74 0.00 0.00 0.00 175.76 178.42 1a6x h PHE 102 N 5.97 0.45 -3.25 0.00 0.04 -1.51 -3.36 116.94 115.29 1a6x h PHE 102 Ca -0.43 0.05 -0.45 0.00 2.80 0.00 0.00 57.97 59.94 1a6x h PHE 102 Cb 1.21 -0.06 -0.38 0.00 2.20 0.00 0.00 35.95 38.93 1a6x h PHE 102 CO 0.65 -0.20 -0.77 -1.50 -0.60 0.00 0.00 178.31 175.89 1a6x s ILE 103 N -5.89 0.42 -0.32 -0.55 -1.16 -1.26 -4.93 121.20 107.51 1a6x s ILE 103 Ca -0.12 0.08 -0.19 0.00 -0.51 0.00 0.00 60.65 59.91 1a6x s ILE 103 Cb 0.26 -0.58 -0.01 0.00 0.61 0.00 0.00 42.46 42.75 1a6x s ILE 103 CO 0.77 0.26 0.58 -1.61 -2.81 0.00 0.00 174.94 172.13 1a6x s GLU 104 N 1.95 3.81 -0.49 3.50 0.41 -1.26 -4.97 118.70 121.64 1a6x s GLU 104 Ca 0.05 0.12 -0.46 0.00 -0.41 0.00 0.00 54.97 54.28 1a6x s GLU 104 Cb -0.12 -3.75 -0.19 0.00 -1.78 0.00 0.00 34.13 28.28 1a6x s GLU 104 CO -0.06 -0.59 1.80 0.28 -0.49 0.00 0.00 175.26 176.21 1a6x n VAL 105 N 5.40 0.01 0.00 2.63 0.31 -1.26 -1.27 118.33 124.15 1a6x n VAL 105 Ca -0.03 -0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.30 1a6x n VAL 105 Cb 0.49 -0.52 0.00 0.00 -0.91 0.00 0.00 33.84 32.90 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 5.26 1.35 3.74 2.92 0.00 -1.26 -5.11 105.19 112.08 1a6x n GLY 106 Ca 0.40 0.00 -0.26 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 -0.18 2.19 0.24 1.61 0.74 -0.39 -5.01 119.66 118.86 1a6x s GLN 107 Ca 0.00 -1.93 0.08 0.00 0.05 0.00 0.00 55.36 53.57 1a6x s GLN 107 Cb 0.00 -1.92 -0.04 0.00 1.10 0.00 0.00 33.01 32.15 1a6x s GLN 107 CO 0.00 -0.16 0.06 -1.59 -0.55 0.00 0.00 175.29 173.05 1a6x s LYS 108 N -3.91 2.53 -0.01 1.67 -2.85 -1.26 -3.10 119.74 112.82 1a6x s LYS 108 Ca 0.38 -1.23 0.01 0.00 -1.00 0.00 0.00 55.97 54.13 1a6x s LYS 108 Cb 0.04 -2.34 0.00 0.00 -2.06 0.00 0.00 37.83 33.47 1a6x s LYS 108 CO 0.21 0.40 -0.03 0.14 0.10 0.00 0.00 175.35 176.17 1a6x s VAL 109 N -2.13 0.26 0.09 1.79 -7.23 -0.27 -5.02 120.40 107.88 1a6x s VAL 109 Ca 0.31 -0.10 0.10 0.00 -1.81 0.00 0.00 61.98 60.48 1a6x s VAL 109 Cb -0.08 -0.24 -0.03 0.00 0.56 0.00 0.00 36.38 36.59 1a6x s VAL 109 CO 0.21 0.09 -0.25 0.54 -0.31 0.00 0.00 175.10 175.39 1a6x s ASN 110 N 0.14 3.39 -0.52 4.85 4.22 -1.26 -0.90 114.94 124.86 1a6x s ASN 110 Ca -0.01 -0.63 -0.43 0.00 -2.14 0.00 0.00 52.86 49.65 1a6x s ASN 110 Cb -0.04 -0.33 -0.19 0.00 1.28 0.00 0.00 41.25 41.97 1a6x s ASN 110 CO -0.00 0.22 2.17 0.55 -2.04 0.00 0.00 177.10 177.99 1a6x n VAL 111 N 1.29 0.01 0.00 3.54 3.14 -1.26 0.54 118.33 125.59 1a6x n VAL 111 Ca -0.17 -0.01 0.00 0.00 -2.96 0.00 0.00 64.34 61.20 1a6x n VAL 111 Cb 0.52 -0.54 0.00 0.00 -1.06 0.00 0.00 33.84 32.77 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 1.64 3.75 7.55 0.00 -1.12 -5.03 105.19 119.41 1a6x n GLY 112 Ca 0.55 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 46.17 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 -1.28 7.41 0.65 1.61 1.01 0.19 -4.73 116.67 121.53 1a6x s ASP 113 Ca 0.00 1.68 -0.18 0.00 0.71 0.00 0.00 52.55 54.76 1a6x s ASP 113 Cb 0.00 -2.53 -0.01 0.00 1.01 0.00 0.00 42.92 41.39 1a6x s ASP 113 CO 0.00 0.06 1.25 -0.89 0.21 0.00 0.00 175.17 175.80 1a6x s THR 114 N -0.48 2.26 -0.04 -1.27 2.01 -1.26 0.15 115.64 117.01 1a6x s THR 114 Ca 0.41 0.15 0.01 0.00 0.31 0.00 0.00 61.69 62.57 1a6x s THR 114 Cb -0.23 -2.99 -0.03 0.00 0.01 0.00 0.00 72.50 69.26 1a6x s THR 114 CO 0.27 -0.04 -0.03 0.18 -0.69 0.00 0.00 174.62 174.31 1a6x n LEU 115 N -1.97 2.64 0.00 4.42 4.32 0.33 -4.66 117.00 122.07 1a6x n LEU 115 Ca 0.15 -0.02 0.02 0.00 -0.02 0.00 0.00 56.01 56.13 1a6x n LEU 115 Cb 0.49 -0.12 0.00 0.00 -1.62 0.00 0.00 43.42 42.17 1a6x n LEU 115 CO 0.46 0.51 0.40 0.00 -1.22 0.00 0.00 177.39 177.55 1a6x s ILE 117 N -2.00 1.72 -0.07 0.00 1.01 -0.52 -0.17 121.20 121.16 1a6x s ILE 117 Ca 0.11 -2.20 -0.04 0.00 0.00 0.00 0.00 60.65 58.52 1a6x s ILE 117 Cb -0.00 -2.08 0.03 0.00 0.01 0.00 0.00 42.46 40.43 1a6x s ILE 117 CO -0.01 -0.57 0.16 -0.69 0.00 0.00 0.00 174.94 173.82 1a6x s VAL 118 N -2.99 -0.03 -0.14 2.92 1.01 0.13 -0.25 120.40 121.05 1a6x s VAL 118 Ca 0.23 0.12 -0.18 0.00 0.00 0.00 0.00 61.98 62.15 1a6x s VAL 118 Cb -0.00 -0.25 -0.04 0.00 0.00 0.00 0.00 36.38 36.09 1a6x s VAL 118 CO 0.07 0.05 0.49 -0.70 0.00 0.00 0.00 175.10 175.01 1a6x s GLU 119 N 0.87 4.30 0.10 2.72 2.12 0.24 0.23 118.70 129.27 1a6x s GLU 119 Ca -0.07 0.44 -0.26 0.00 0.36 0.00 0.00 54.97 55.44 1a6x s GLU 119 Cb -0.08 -3.47 0.08 0.00 0.26 0.00 0.00 34.13 30.92 1a6x s GLU 119 CO -0.04 0.08 0.99 0.00 -0.54 0.00 0.00 175.26 175.75 1a6x s ALA 120 N 0.89 -1.76 -1.65 6.30 0.00 -0.55 -1.10 121.76 123.89 1a6x s ALA 120 Ca 0.26 0.36 -0.10 0.00 0.00 0.00 0.00 51.96 52.48 1a6x s ALA 120 Cb -0.15 0.56 0.10 0.00 0.00 0.00 0.00 23.12 23.62 1a6x s ALA 120 CO 0.10 -0.98 0.37 0.00 0.00 0.00 0.00 175.76 175.25 1a6x n MET 121 N -0.43 -1.64 -4.19 0.00 0.00 -1.26 0.29 117.12 109.88 1a6x n MET 121 Ca -0.07 0.20 -0.32 0.00 0.00 0.00 0.00 57.70 57.51 1a6x n MET 121 Cb 0.61 -4.32 -0.06 0.00 0.00 0.00 0.00 33.22 29.45 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 -4.37 -1.29 -3.61 3.17 3.00 -1.26 -4.89 118.16 108.91 1a6x n LYS 122 Ca -0.13 0.16 -0.04 0.00 -0.00 0.00 0.00 58.31 58.29 1a6x n LYS 122 Cb 0.59 -3.61 -0.03 0.00 0.00 0.00 0.00 35.03 31.98 1a6x n LYS 122 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.40 178.81 1a6x s MET 123 N -7.20 0.26 0.37 1.64 1.75 0.14 -5.16 119.30 111.11 1a6x s MET 123 Ca 0.09 -0.04 -0.25 0.00 -1.25 0.00 0.00 55.69 54.24 1a6x s MET 123 Cb -0.05 0.12 -0.09 0.00 2.84 0.00 0.00 34.83 37.65 1a6x s MET 123 CO 0.97 -0.10 1.08 1.41 -0.65 0.00 0.00 175.02 177.73 1a6x s MET 124 N -1.85 4.24 -0.30 4.11 1.75 -1.26 -1.48 119.30 124.51 1a6x s MET 124 Ca 0.08 1.64 -0.03 0.00 -1.25 0.00 0.00 55.69 56.13 1a6x s MET 124 Cb -0.01 -2.71 0.10 0.00 2.84 0.00 0.00 34.83 35.05 1a6x s MET 124 CO -0.05 -0.10 0.13 -0.80 -0.65 0.00 0.00 175.02 173.55 1a6x s ASN 125 N -1.33 3.64 0.52 1.11 0.01 0.13 -4.90 114.94 114.12 1a6x s ASN 125 Ca 0.55 -1.43 -0.19 0.00 -0.71 0.00 0.00 52.86 51.08 1a6x s ASN 125 Cb -0.26 -0.49 -0.07 0.00 0.41 0.00 0.00 41.25 40.85 1a6x s ASN 125 CO 0.33 -0.43 1.06 -1.10 -1.51 0.00 0.00 177.10 175.45 1a6x s GLN 126 N 1.92 3.61 -0.22 -0.60 -0.21 -1.26 0.22 119.66 123.12 1a6x s GLN 126 Ca 0.10 1.40 -0.01 0.00 0.02 0.00 0.00 55.36 56.86 1a6x s GLN 126 Cb -0.17 -2.06 0.02 0.00 1.00 0.00 0.00 33.01 31.80 1a6x s GLN 126 CO -0.32 -0.60 -0.10 0.42 -2.12 0.00 0.00 175.29 172.57 1a6x s ILE 127 N -2.01 2.71 -0.23 1.08 1.01 0.76 -4.88 121.20 119.64 1a6x s ILE 127 Ca 0.68 -0.93 -0.14 0.00 0.00 0.00 0.00 60.65 60.25 1a6x s ILE 127 Cb -0.18 -2.30 -0.04 0.00 0.01 0.00 0.00 42.46 39.95 1a6x s ILE 127 CO 0.24 0.32 0.34 -0.70 0.00 0.00 0.00 174.94 175.15 1a6x s GLU 128 N 1.33 4.10 0.06 2.79 2.12 -1.26 -0.52 118.70 127.33 1a6x s GLU 128 Ca 0.02 0.05 -0.36 0.00 0.36 0.00 0.00 54.97 55.04 1a6x s GLU 128 Cb -0.15 -3.58 -0.19 0.00 0.26 0.00 0.00 34.13 30.47 1a6x s GLU 128 CO -0.07 -0.10 0.92 0.00 -0.54 0.00 0.00 175.26 175.48 1a6x n ALA 129 N 4.72 -3.31 -0.56 6.30 0.00 0.12 -4.81 120.51 122.98 1a6x n ALA 129 Ca -0.10 0.55 0.04 0.00 0.00 0.00 0.00 53.44 53.93 1a6x n ALA 129 Cb 0.51 -1.73 0.06 0.00 0.00 0.00 0.00 19.45 18.29 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 1.67 2.02 -2.92 0.00 9.92 -1.26 -2.77 116.55 123.21 1a6x n ASP 130 Ca 0.19 -2.44 -0.02 0.00 -0.53 0.00 0.00 54.79 52.00 1a6x n ASP 130 Cb 0.14 -0.19 0.00 0.00 -0.64 0.00 0.00 41.12 40.43 1a6x n ASP 130 CO 0.00 0.00 0.00 -0.75 0.13 0.00 0.00 177.20 176.58 1a6x s LYS 131 N -1.75 0.81 0.23 -1.24 2.20 -1.26 -5.00 119.74 113.73 1a6x s LYS 131 Ca 0.14 -0.58 -0.26 0.00 -0.36 0.00 0.00 55.97 54.91 1a6x s LYS 131 Cb 0.12 0.02 -0.16 0.00 -1.51 0.00 0.00 37.83 36.30 1a6x s LYS 131 CO 0.01 -1.06 0.41 -1.13 -0.36 0.00 0.00 175.35 173.22 1a6x n SER 132 N 3.52 -1.52 0.00 1.43 3.41 -1.26 -4.90 113.62 114.30 1a6x n SER 132 Ca 0.14 1.02 0.00 0.00 -0.26 0.00 0.00 58.87 59.77 1a6x n SER 132 Cb 0.58 -0.90 0.00 0.00 -0.26 0.00 0.00 64.21 63.63 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 1.99 -1.34 3.52 5.00 0.00 -0.08 -4.96 105.19 109.31 1a6x n GLY 133 Ca 0.16 -0.96 -0.30 0.00 0.00 0.00 0.00 46.02 44.91 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 -2.58 3.12 1.00 2.61 2.01 -1.21 -1.11 115.64 119.48 1a6x s THR 134 Ca 0.00 -1.20 -0.17 0.00 0.31 0.00 0.00 61.69 60.62 1a6x s THR 134 Cb 0.00 -2.39 -0.13 0.00 0.01 0.00 0.00 72.50 69.99 1a6x s THR 134 CO 0.00 0.23 -0.73 0.55 -0.69 0.00 0.00 174.62 173.98 1a6x n VAL 135 N 1.14 0.00 0.00 3.82 3.14 -1.18 0.19 118.33 125.44 1a6x n VAL 135 Ca -0.15 -0.42 0.00 0.00 -2.96 0.00 0.00 64.34 60.81 1a6x n VAL 135 Cb 0.52 -0.07 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 1.99 0.00 0.00 1.45 4.81 0.19 -3.89 118.16 122.71 1a6x n LYS 136 Ca -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.43 1a6x n LYS 136 Cb 0.57 -0.04 0.00 0.00 0.02 0.00 0.00 35.03 35.58 1a6x n LYS 136 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1a6x n ALA 137 N -2.40 0.00 -2.61 3.14 0.00 0.18 -4.96 120.51 113.86 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 -0.11 0.00 0.00 0.00 0.00 19.45 19.34 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 5.28 -0.14 0.00 1.01 -1.26 0.16 121.20 125.94 1a6x s ILE 138 Ca 0.00 0.16 -0.14 0.00 0.00 0.00 0.00 60.65 60.67 1a6x s ILE 138 Cb 0.00 -3.51 -0.24 0.00 0.01 0.00 0.00 42.46 38.72 1a6x s ILE 138 CO 0.00 0.25 0.36 -0.07 0.00 0.00 0.00 174.94 175.49 1a6x h LEU 139 N 8.36 0.27-10.34 2.97 3.38 -1.13 -3.47 115.31 115.34 1a6x h LEU 139 Ca -0.35 -0.78 -0.51 0.00 0.09 0.00 0.00 57.88 56.33 1a6x h LEU 139 Cb 1.19 -0.09 0.05 0.00 0.09 0.00 0.00 40.66 41.90 1a6x h LEU 139 CO 0.55 1.68 0.35 0.54 0.09 0.00 0.00 178.44 181.66 1a6x s VAL 140 N -2.48 4.75 0.49 1.22 0.11 0.11 -5.04 120.40 119.56 1a6x s VAL 140 Ca -0.24 0.73 0.03 0.00 -2.93 0.00 0.00 61.98 59.57 1a6x s VAL 140 Cb 0.06 -3.87 -0.02 0.00 -1.53 0.00 0.00 36.38 31.02 1a6x s VAL 140 CO 0.71 -1.08 0.06 -0.70 -3.33 0.00 0.00 175.10 170.76 1a6x s GLU 141 N -5.07 2.17 -0.77 1.54 2.12 -1.26 -4.95 118.70 112.47 1a6x s GLU 141 Ca 0.53 -2.28 -0.26 0.00 0.36 0.00 0.00 54.97 53.32 1a6x s GLU 141 Cb -0.11 -1.64 0.02 0.00 0.26 0.00 0.00 34.13 32.67 1a6x s GLU 141 CO 0.52 -0.33 1.42 -1.54 -0.54 0.00 0.00 175.26 174.79 1a6x s SER 142 N -3.90 6.05 0.00 -1.70 1.04 -1.26 -3.01 113.70 110.92 1a6x s SER 142 Ca 0.15 -0.51 0.00 0.00 0.48 0.00 0.00 55.95 56.07 1a6x s SER 142 Cb 0.03 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.59 1a6x s SER 142 CO 0.08 -1.90 0.00 0.61 0.98 0.00 0.00 173.24 173.02 1a6x n GLY 143 N 5.74 2.58 3.40 7.32 0.00 0.10 -4.91 105.19 119.42 1a6x n GLY 143 Ca 0.12 -0.77 -0.38 0.00 0.00 0.00 0.00 46.02 44.99 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 0.35 -1.52 1.61 6.02 -1.16 -4.36 117.38 118.31 1a6x n GLN 144 Ca 0.00 0.14 -0.30 0.00 -0.01 0.00 0.00 57.00 56.83 1a6x n GLN 144 Cb 0.00 -1.50 0.19 0.00 1.02 0.00 0.00 30.24 29.96 1a6x n GLN 144 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 1a6x s PRO 145 N -1.80 0.06 0.06 -1.09 0.04 -1.26 -0.83 135.00 130.18 1a6x s PRO 145 Ca 0.65 -0.12 -0.10 0.00 0.04 0.00 0.00 61.00 61.47 1a6x s PRO 145 Cb -0.45 -1.75 0.01 0.00 0.04 0.00 0.00 34.50 32.34 1a6x s PRO 145 CO 0.58 -2.85 0.22 0.14 0.04 0.00 0.00 177.00 175.12 1a6x s VAL 146 N -3.42 0.12 0.07 -0.36 -7.23 0.13 -4.55 120.40 105.16 1a6x s VAL 146 Ca 0.70 -0.95 -0.01 0.00 -1.81 0.00 0.00 61.98 59.91 1a6x s VAL 146 Cb -0.09 -1.07 -0.04 0.00 0.56 0.00 0.00 36.38 35.74 1a6x s VAL 146 CO 0.54 -0.53 -0.02 -0.70 -0.31 0.00 0.00 175.10 174.09 1a6x s GLU 147 N -3.05 0.68 0.13 4.82 2.12 -1.26 -1.35 118.70 120.78 1a6x s GLU 147 Ca -0.01 -1.27 -0.31 0.00 0.36 0.00 0.00 54.97 53.74 1a6x s GLU 147 Cb 0.01 0.20 -0.10 0.00 0.26 0.00 0.00 34.13 34.50 1a6x s GLU 147 CO -0.07 -0.13 1.71 0.12 -0.54 0.00 0.00 175.26 176.35 1a6x s PHE 148 N -3.93 2.52 -0.05 5.30 2.19 -1.26 -0.71 117.98 122.05 1a6x s PHE 148 Ca 0.10 0.26 0.00 0.00 0.33 0.00 0.00 56.93 57.62 1a6x s PHE 148 Cb 0.08 -4.06 0.00 0.00 -1.31 0.00 0.00 43.02 37.73 1a6x s PHE 148 CO -0.08 -4.21 0.00 -3.47 1.83 0.00 0.00 175.22 169.29 1a6x n ASP 149 N 5.05 -3.18 -4.78 6.13 -0.08 -1.13 -5.01 116.55 113.54 1a6x n ASP 149 Ca 0.16 0.01 -0.38 0.00 -1.51 0.00 0.00 54.79 53.07 1a6x n ASP 149 Cb 0.38 -0.72 -0.06 0.00 2.34 0.00 0.00 41.12 43.06 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 -0.75 4.13 0.30 -0.67 2.56 0.11 -4.89 118.70 119.49 1a6x s GLU 150 Ca 0.00 0.41 -0.29 0.00 0.00 0.00 0.00 54.97 55.10 1a6x s GLU 150 Cb 0.00 -3.33 -0.09 0.00 2.00 0.00 0.00 34.13 32.71 1a6x s GLU 150 CO 0.00 0.44 1.08 -1.25 -0.56 0.00 0.00 175.26 174.96 1a6x s PRO 151 N -0.27 4.58 0.00 4.30 0.04 -1.26 0.24 135.00 142.63 1a6x s PRO 151 Ca 0.24 1.73 0.00 0.00 0.04 0.00 0.00 61.00 63.01 1a6x s PRO 151 Cb -0.16 -3.09 0.00 0.00 0.04 0.00 0.00 34.50 31.30 1a6x s PRO 151 CO 0.12 0.18 0.00 1.28 0.04 0.00 0.00 177.00 178.61 1a6x n LEU 152 N 1.00 0.00 -4.23 -3.56 4.77 0.26 -4.55 117.00 110.69 1a6x n LEU 152 Ca -0.00 0.00 -0.23 0.00 -0.03 0.00 0.00 56.01 55.74 1a6x n LEU 152 Cb 0.46 -0.08 -0.13 0.00 -2.33 0.00 0.00 43.42 41.34 1a6x n LEU 152 CO 0.52 -0.24 -0.50 -0.69 -1.33 0.00 0.00 177.39 175.15 1a6x s VAL 153 N -0.49 1.51 -0.20 4.08 1.01 -1.23 -0.50 120.40 124.58 1a6x s VAL 153 Ca 0.00 -1.23 -0.06 0.00 0.00 0.00 0.00 61.98 60.68 1a6x s VAL 153 Cb 0.00 -1.34 -0.03 0.00 0.00 0.00 0.00 36.38 35.01 1a6x s VAL 153 CO 0.00 0.07 0.03 -0.69 0.00 0.00 0.00 175.10 174.51 1a6x s VAL 154 N -0.92 4.32 0.32 2.92 1.01 0.42 -0.85 120.40 127.62 1a6x s VAL 154 Ca 0.05 -0.19 0.08 0.00 0.00 0.00 0.00 61.98 61.92 1a6x s VAL 154 Cb -0.09 -2.96 -0.04 0.00 0.00 0.00 0.00 36.38 33.29 1a6x s VAL 154 CO 0.02 0.42 0.15 -0.63 0.00 0.00 0.00 175.10 175.07 1a6x s ILE 155 N 0.85 3.28 -2.16 2.22 1.01 0.11 -0.64 121.20 125.87 1a6x s ILE 155 Ca 0.02 -1.64 0.17 0.00 0.00 0.00 0.00 60.65 59.20 1a6x s ILE 155 Cb -0.14 -3.03 0.14 0.00 0.01 0.00 0.00 42.46 39.44 1a6x s ILE 155 CO 0.02 -0.22 1.05 1.21 0.00 0.00 0.00 174.94 177.00