#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1why s SER 75 N 0.00 5.28 -0.71 1.61 0.01 -1.26 -5.03 113.70 113.61 1why s SER 75 Ca 0.00 -0.16 -0.02 0.00 1.31 0.00 0.00 55.95 57.08 1why s SER 75 Cb 0.00 -1.32 0.43 0.00 0.21 0.00 0.00 66.02 65.34 1why s SER 75 CO 0.00 0.11 2.02 -0.24 0.41 0.00 0.00 173.24 175.55 1why n SER 76 N 0.04 7.63 0.00 2.44 2.88 -1.26 -4.93 113.62 120.43 1why n SER 76 Ca -0.09 -3.80 0.00 0.00 -1.33 0.00 0.00 58.87 53.65 1why n SER 76 Cb 0.54 -0.99 0.00 0.00 -0.75 0.00 0.00 64.21 63.00 1why n SER 76 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1why n GLY 77 N -0.83 2.12 3.66 0.46 0.00 -1.26 -4.92 105.19 104.42 1why n GLY 77 Ca 0.61 -0.72 -0.23 0.00 0.00 0.00 0.00 46.02 45.67 1why n GLY 77 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1why n SER 78 N 0.81 -3.55 -4.81 1.61 7.64 -1.26 -5.00 113.62 109.06 1why n SER 78 Ca 0.00 -0.69 -0.26 0.00 1.01 0.00 0.00 58.87 58.93 1why n SER 78 Cb 0.00 -4.53 -0.05 0.00 -1.01 0.00 0.00 64.21 58.62 1why n SER 78 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1why s SER 79 N -3.86 4.51 -0.05 6.43 0.15 -1.26 -5.16 113.70 114.47 1why s SER 79 Ca 0.30 -1.18 -0.18 0.00 0.70 0.00 0.00 55.95 55.58 1why s SER 79 Cb -0.14 -0.04 0.04 0.00 -1.71 0.00 0.00 66.02 64.16 1why s SER 79 CO 0.78 -0.79 0.41 -0.83 1.20 0.00 0.00 173.24 174.01 1why s GLY 80 N -4.05 -0.27 -0.42 9.45 0.00 -1.26 -5.12 107.32 105.64 1why s GLY 80 Ca 0.34 0.70 0.02 0.00 0.00 0.00 0.00 44.72 45.78 1why s GLY 80 CO 0.20 0.46 0.20 1.25 0.00 0.00 0.00 173.10 175.21 1why s LYS 81 N -1.03 1.28 0.01 2.90 2.20 -1.26 -5.10 119.74 118.75 1why s LYS 81 Ca -0.11 -1.91 0.02 0.00 -0.36 0.00 0.00 55.97 53.62 1why s LYS 81 Cb -0.04 -2.46 -0.01 0.00 -1.51 0.00 0.00 37.83 33.82 1why s LYS 81 CO 0.05 -1.11 -0.08 0.42 -0.36 0.00 0.00 175.35 174.27 1why s ILE 82 N 0.54 0.60 0.00 5.43 -1.09 -1.26 -4.99 121.20 120.43 1why s ILE 82 Ca 0.16 -0.51 0.00 0.00 -2.23 0.00 0.00 60.65 58.07 1why s ILE 82 Cb -0.23 -0.54 0.00 0.00 -1.58 0.00 0.00 42.46 40.11 1why s ILE 82 CO -0.04 0.04 0.00 0.61 -1.23 0.00 0.00 174.94 174.32 1why n GLY 83 N 2.54 0.00 3.02 6.18 0.00 -1.26 -5.15 105.19 110.53 1why n GLY 83 Ca -0.15 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.78 1why n GLY 83 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1why s TYR 84 N 0.00 -0.82 -0.43 1.61 1.13 -1.26 -5.06 117.35 112.52 1why s TYR 84 Ca 0.00 1.06 0.03 0.00 -1.41 0.00 0.00 57.07 56.75 1why s TYR 84 Cb 0.00 0.11 0.27 0.00 -1.10 0.00 0.00 41.96 41.24 1why s TYR 84 CO 0.00 -0.64 1.07 0.41 -2.51 0.00 0.00 175.55 173.88 1why n GLY 85 N 5.37 -0.52 3.86 5.49 0.00 -1.26 -5.15 105.19 112.99 1why n GLY 85 Ca -0.05 0.43 -0.37 0.00 0.00 0.00 0.00 46.02 46.03 1why n GLY 85 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1why s LYS 86 N 0.41 3.65 0.00 1.61 -2.85 -1.26 -4.74 119.74 116.55 1why s LYS 86 Ca 0.28 0.10 0.00 0.00 -1.00 0.00 0.00 55.97 55.35 1why s LYS 86 Cb 0.24 -3.20 0.00 0.00 -2.06 0.00 0.00 37.83 32.81 1why s LYS 86 CO -0.17 0.74 0.00 0.00 0.10 0.00 0.00 175.35 176.02 1why n ALA 87 N 1.90 2.86 -3.64 0.59 0.00 -1.26 -5.10 120.51 115.85 1why n ALA 87 Ca -0.17 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.19 1why n ALA 87 Cb 0.54 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.92 1why n ALA 87 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1why s ASN 88 N -4.09 -0.33 0.29 0.00 2.20 -1.26 -5.09 114.94 106.65 1why s ASN 88 Ca 0.00 0.63 -0.29 0.00 -0.94 0.00 0.00 52.86 52.26 1why s ASN 88 Cb 0.00 0.64 -0.10 0.00 -2.00 0.00 0.00 41.25 39.79 1why s ASN 88 CO 0.00 -0.12 1.24 -2.16 -2.94 0.00 0.00 177.10 173.13 1why s PRO 89 N 0.12 4.45 -0.05 3.55 0.04 -1.26 -4.35 135.00 137.49 1why s PRO 89 Ca 0.04 2.05 -0.31 0.00 0.04 0.00 0.00 61.00 62.83 1why s PRO 89 Cb -0.05 -3.13 0.11 0.00 0.04 0.00 0.00 34.50 31.47 1why s PRO 89 CO -0.09 -0.08 1.08 -0.08 0.04 0.00 0.00 177.00 177.87 1why s THR 90 N -0.86 0.00 0.36 1.26 -1.32 -1.26 -5.02 115.64 108.79 1why s THR 90 Ca 0.49 -0.13 0.04 0.00 -1.21 0.00 0.00 61.69 60.89 1why s THR 90 Cb -0.37 -1.29 0.22 0.00 -1.51 0.00 0.00 72.50 69.56 1why s THR 90 CO 0.46 0.00 1.97 0.71 -2.21 0.00 0.00 174.62 175.55 1why h THR 91 N 2.00 1.16 -3.80 5.08 1.35 -1.84 -3.42 112.91 113.44 1why h THR 91 Ca -0.19 -0.46 -0.50 0.00 -0.55 0.00 0.00 66.41 64.71 1why h THR 91 Cb 1.21 0.57 0.01 0.00 -1.73 0.00 0.00 68.15 68.21 1why h THR 91 CO 0.27 0.19 0.44 -0.60 -0.25 0.00 0.00 175.52 175.57 1why s ARG 92 N -5.38 4.69 0.04 4.72 3.52 -1.26 -3.33 118.95 121.96 1why s ARG 92 Ca -0.09 1.72 0.03 0.00 -0.13 0.00 0.00 55.73 57.26 1why s ARG 92 Cb 0.17 -3.20 -0.02 0.00 -1.56 0.00 0.00 34.95 30.34 1why s ARG 92 CO 0.76 0.28 -0.09 -0.51 -0.81 0.00 0.00 175.30 174.93 1why s LEU 93 N -1.41 2.23 -0.32 -0.88 1.43 -0.79 -3.96 118.68 114.98 1why s LEU 93 Ca 0.44 -0.51 -0.10 0.00 -1.03 0.00 0.00 54.13 52.92 1why s LEU 93 Cb -0.30 -0.29 -0.01 0.00 0.03 0.00 0.00 46.19 45.62 1why s LEU 93 CO 0.38 -0.13 0.18 0.86 0.23 0.00 0.00 176.35 177.87 1why s TRP 94 N -1.19 3.19 -0.23 0.29 -0.00 -0.57 -1.96 118.94 118.47 1why s TRP 94 Ca -0.06 -0.47 -0.02 0.00 -0.00 0.00 0.00 56.10 55.55 1why s TRP 94 Cb -0.09 -2.39 0.01 0.00 -0.00 0.00 0.00 33.47 31.01 1why s TRP 94 CO 0.01 -0.43 -0.08 0.08 -0.00 0.00 0.00 176.95 176.53 1why s VAL 95 N 1.64 2.92 0.00 5.86 1.01 0.34 -2.01 120.40 130.16 1why s VAL 95 Ca 0.05 -0.81 0.00 0.00 0.00 0.00 0.00 61.98 61.22 1why s VAL 95 Cb -0.17 -2.38 0.00 0.00 0.00 0.00 0.00 36.38 33.83 1why s VAL 95 CO 0.07 0.34 0.00 0.61 0.00 0.00 0.00 175.10 176.13 1why n GLY 96 N 4.71 5.81 3.23 4.51 0.00 -0.91 -0.29 105.19 122.24 1why n GLY 96 Ca -0.18 -2.08 -0.15 0.00 0.00 0.00 0.00 46.02 43.61 1why n GLY 96 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1why n GLY 97 N 5.00 -0.65 3.74 -0.02 0.00 -1.25 -4.20 105.19 107.81 1why n GLY 97 Ca 0.00 0.28 -0.26 0.00 0.00 0.00 0.00 46.02 46.04 1why n GLY 97 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1why s LEU 98 N -5.73 3.59 0.37 0.99 1.43 -1.25 -4.91 118.68 113.18 1why s LEU 98 Ca 0.20 -0.26 0.05 0.00 -1.03 0.00 0.00 54.13 53.09 1why s LEU 98 Cb -0.03 -2.21 -0.03 0.00 0.03 0.00 0.00 46.19 43.96 1why s LEU 98 CO 0.69 0.07 0.20 -0.83 0.23 0.00 0.00 176.35 176.71 1why s GLY 99 N -3.11 2.50 0.00 -3.19 0.00 -1.26 -4.96 107.32 97.30 1why s GLY 99 Ca 0.30 -1.61 0.15 0.00 0.00 0.00 0.00 44.72 43.56 1why s GLY 99 CO 0.21 -1.66 1.40 -1.55 0.00 0.00 0.00 173.10 171.51 1why n PRO 100 N -0.78 0.24 -0.13 2.90 -0.04 -1.26 -3.18 135.00 132.75 1why n PRO 100 Ca 0.00 0.13 -0.28 0.00 -0.04 0.00 0.00 63.50 63.31 1why n PRO 100 Cb 0.64 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.49 1why n PRO 100 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1why n ASN 101 N -1.25 1.94 -4.49 3.54 2.85 -1.26 -4.98 115.26 111.61 1why n ASN 101 Ca 0.08 0.35 -0.45 0.00 -0.11 0.00 0.00 54.58 54.45 1why n ASN 101 Cb 0.11 -0.84 -0.02 0.00 1.24 0.00 0.00 39.78 40.27 1why n ASN 101 CO 0.00 0.00 0.00 0.41 -2.11 0.00 0.00 177.26 175.56 1why n THR 102 N -4.28 1.91 -4.39 -0.44 -1.04 -1.19 -4.99 114.28 99.86 1why n THR 102 Ca -0.51 -0.50 -0.23 0.00 -2.04 0.00 0.00 64.05 60.78 1why n THR 102 Cb 0.85 -0.53 -0.11 0.00 -1.82 0.00 0.00 70.33 68.72 1why n THR 102 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 1why s SER 103 N -0.81 3.06 0.05 8.00 0.01 -1.26 -4.85 113.70 117.91 1why s SER 103 Ca 0.61 -0.94 -0.22 0.00 1.31 0.00 0.00 55.95 56.71 1why s SER 103 Cb -0.76 -0.21 -0.14 0.00 0.21 0.00 0.00 66.02 65.12 1why s SER 103 CO 0.58 -0.01 1.48 0.25 0.41 0.00 0.00 173.24 175.96 1why h LEU 104 N 2.83 0.16 -0.68 2.44 6.46 -2.00 -3.09 115.31 121.44 1why h LEU 104 Ca -0.42 -0.30 0.14 0.00 -0.12 0.00 0.00 57.88 57.18 1why h LEU 104 Cb 1.22 -0.04 -0.10 0.00 -0.73 0.00 0.00 40.66 41.01 1why h LEU 104 CO 0.55 0.42 0.17 0.00 -0.62 0.00 0.00 178.44 178.96 1why h ALA 105 N 0.75 0.85 0.00 1.25 0.00 -1.97 0.37 119.26 120.51 1why h ALA 105 Ca 0.03 0.15 0.03 0.00 0.00 0.00 0.00 54.91 55.12 1why h ALA 105 Cb 0.33 0.19 -0.05 0.00 0.00 0.00 0.00 17.79 18.26 1why h ALA 105 CO 0.00 -0.31 -0.38 0.00 0.00 0.00 0.00 179.25 178.57 1why h ALA 106 N 1.55 -0.58 0.26 0.00 0.00 -1.97 -0.58 119.26 117.94 1why h ALA 106 Ca 0.37 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.24 1why h ALA 106 Cb 0.59 0.66 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1why h ALA 106 CO -0.45 -0.90 -0.13 -0.07 0.00 0.00 0.00 179.25 177.70 1why h LEU 107 N -0.53 -0.30 -0.72 0.00 3.38 -1.31 -2.40 115.31 113.43 1why h LEU 107 Ca 0.05 0.01 0.22 0.00 0.09 0.00 0.00 57.88 58.26 1why h LEU 107 Cb 0.62 0.08 -0.13 0.00 0.09 0.00 0.00 40.66 41.31 1why h LEU 107 CO -0.29 -0.12 0.10 0.00 0.09 0.00 0.00 178.44 178.22 1why n ALA 108 N -2.32 0.46 0.03 1.53 0.00 0.12 0.13 120.51 120.47 1why n ALA 108 Ca -0.04 0.76 -0.13 0.00 0.00 0.00 0.00 53.44 54.03 1why n ALA 108 Cb 0.14 -0.60 -0.09 0.00 0.00 0.00 0.00 19.45 18.90 1why n ALA 108 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1why h ARG 109 N 0.00 -0.07 0.35 0.00 9.65 -1.12 -2.15 114.38 121.03 1why h ARG 109 Ca 0.48 0.00 -0.01 0.00 -1.10 0.00 0.00 59.98 59.35 1why h ARG 109 Cb 1.07 0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 29.66 1why h ARG 109 CO -0.65 0.25 -0.25 0.93 2.80 0.00 0.00 179.97 183.05 1why h GLU 110 N -0.39 -0.55 -1.09 0.20 4.39 0.17 -2.56 114.58 114.74 1why h GLU 110 Ca -0.01 0.04 0.32 0.00 0.34 0.00 0.00 59.36 60.05 1why h GLU 110 Cb 0.35 0.13 -0.12 0.00 -0.10 0.00 0.00 28.75 29.01 1why h GLU 110 CO 0.01 -0.37 0.68 0.74 -1.16 0.00 0.00 179.01 178.91 1why h PHE 111 N -0.57 0.74 -1.08 4.33 -1.00 -1.07 0.39 116.94 118.67 1why h PHE 111 Ca -0.05 0.03 0.29 0.00 2.81 0.00 0.00 57.97 61.06 1why h PHE 111 Cb 0.47 -0.20 -0.10 0.00 3.61 0.00 0.00 35.95 39.73 1why h PHE 111 CO -0.06 -0.06 0.69 0.22 -1.61 0.00 0.00 178.31 177.49 1why h ASP 112 N 0.33 0.43 -0.94 2.17 1.82 -0.95 -0.97 116.42 118.30 1why h ASP 112 Ca 0.69 0.10 0.22 0.00 -0.39 0.00 0.00 57.03 57.65 1why h ASP 112 Cb 1.76 0.04 -0.18 0.00 0.68 0.00 0.00 39.33 41.63 1why h ASP 112 CO -0.42 0.03 -0.12 -2.11 -1.61 0.00 0.00 179.24 175.01 1why n ARG 113 N -4.67 -0.08 0.15 0.28 1.85 0.14 -1.57 116.66 112.75 1why n ARG 113 Ca 0.28 1.44 -0.06 0.00 -1.00 0.00 0.00 57.85 58.51 1why n ARG 113 Cb 0.96 -2.21 -0.03 0.00 -1.05 0.00 0.00 32.46 30.13 1why n ARG 113 CO 0.00 0.00 0.00 0.74 -0.01 0.00 0.00 177.63 178.36 1why h PHE 114 N 0.00 -0.37 -4.22 2.89 -1.00 -1.37 -3.48 116.94 109.38 1why h PHE 114 Ca 0.50 -0.01 -0.24 0.00 2.81 0.00 0.00 57.97 61.04 1why h PHE 114 Cb 0.90 0.12 -0.11 0.00 3.61 0.00 0.00 35.95 40.48 1why h PHE 114 CO -0.62 -0.23 -0.32 0.20 -1.61 0.00 0.00 178.31 175.73 1why s GLY 115 N -2.03 1.34 -0.19 -1.45 0.00 -0.61 -4.97 107.32 99.42 1why s GLY 115 Ca -0.06 -1.48 -0.29 0.00 0.00 0.00 0.00 44.72 42.89 1why s GLY 115 CO 0.18 -1.07 1.28 -0.56 0.00 0.00 0.00 173.10 172.93 1why s SER 116 N -3.18 6.89 -0.06 1.64 0.01 -1.26 -4.06 113.70 113.67 1why s SER 116 Ca 0.32 1.61 -0.30 0.00 1.31 0.00 0.00 55.95 58.89 1why s SER 116 Cb 0.02 -2.54 -0.02 0.00 0.21 0.00 0.00 66.02 63.69 1why s SER 116 CO 0.16 -0.83 1.07 -0.63 0.41 0.00 0.00 173.24 173.42 1why s ILE 117 N 3.68 4.61 -0.03 1.44 1.01 -1.26 -2.70 121.20 127.95 1why s ILE 117 Ca 0.55 1.88 -0.23 0.00 0.00 0.00 0.00 60.65 62.86 1why s ILE 117 Cb -0.21 -4.21 -0.17 0.00 0.01 0.00 0.00 42.46 37.88 1why s ILE 117 CO 0.16 0.04 1.05 -0.09 0.00 0.00 0.00 174.94 176.11 1why h ARG 118 N 7.10 -0.24 -2.18 2.79 2.43 -1.26 -3.49 114.38 119.54 1why h ARG 118 Ca -0.35 0.02 0.09 0.00 -0.81 0.00 0.00 59.98 58.93 1why h ARG 118 Cb 1.17 0.06 -0.17 0.00 -0.42 0.00 0.00 29.97 30.61 1why h ARG 118 CO 0.84 0.16 0.48 -0.08 -1.51 0.00 0.00 179.97 179.85 1why s THR 119 N -3.95 0.00 -0.00 0.20 -1.32 -1.26 -5.06 115.64 104.24 1why s THR 119 Ca -0.14 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.35 1why s THR 119 Cb 0.01 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 70.00 1why s THR 119 CO 0.53 0.00 -0.01 -0.63 -2.21 0.00 0.00 174.62 172.30 1why s ILE 120 N -2.72 0.06 -0.17 5.08 1.01 -1.26 -3.26 121.20 119.95 1why s ILE 120 Ca 0.03 -0.01 -0.18 0.00 0.00 0.00 0.00 60.65 60.49 1why s ILE 120 Cb -0.01 -0.08 -0.04 0.00 0.01 0.00 0.00 42.46 42.35 1why s ILE 120 CO -0.06 0.03 0.47 1.51 0.00 0.00 0.00 174.94 176.89 1why s ASP 121 N 0.11 6.58 -0.29 3.58 -4.77 -1.25 -5.01 116.67 115.63 1why s ASP 121 Ca -0.01 0.69 -0.07 0.00 -3.30 0.00 0.00 52.55 49.87 1why s ASP 121 Cb -0.02 -2.27 0.01 0.00 -1.09 0.00 0.00 42.92 39.54 1why s ASP 121 CO -0.00 -0.08 0.07 -2.28 0.70 0.00 0.00 175.17 173.58 1why s HIS 122 N 1.14 3.13 0.02 2.11 2.46 -1.26 -4.23 115.29 118.66 1why s HIS 122 Ca 0.24 -0.94 0.02 0.00 0.47 0.00 0.00 55.06 54.85 1why s HIS 122 Cb -0.15 -2.24 -0.01 0.00 -0.13 0.00 0.00 32.58 30.04 1why s HIS 122 CO 0.09 -0.56 -0.08 0.08 -2.47 0.00 0.00 174.74 171.80 1why s VAL 123 N 1.51 0.61 -0.14 0.89 1.01 -1.26 -5.07 120.40 117.94 1why s VAL 123 Ca 0.03 -0.64 -0.10 0.00 0.00 0.00 0.00 61.98 61.27 1why s VAL 123 Cb -0.17 -0.57 -0.05 0.00 0.00 0.00 0.00 36.38 35.59 1why s VAL 123 CO 0.02 -0.04 -0.08 0.50 0.00 0.00 0.00 175.10 175.50 1why h LYS 124 N 5.35 0.00 0.19 2.72 3.64 -1.98 -3.34 116.57 123.15 1why h LYS 124 Ca -0.32 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.06 1why h LYS 124 Cb 1.19 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.98 1why h LYS 124 CO 0.46 0.14 -0.44 0.78 -2.27 0.00 0.00 179.45 178.13 1why h GLY 125 N -1.00 -1.18 -0.72 5.01 0.00 -1.98 -1.77 103.07 101.44 1why h GLY 125 Ca -0.04 0.61 0.35 0.00 0.00 0.00 0.00 47.33 48.25 1why h GLY 125 CO -0.03 -0.32 0.53 -0.55 0.00 0.00 0.00 176.54 176.18 1why h ASP 126 N -0.69 0.39 -1.14 0.19 3.32 -2.01 -3.44 116.42 113.04 1why h ASP 126 Ca -0.02 0.22 -0.21 0.00 0.02 0.00 0.00 57.03 57.04 1why h ASP 126 Cb 0.66 0.20 -0.04 0.00 0.22 0.00 0.00 39.33 40.38 1why h ASP 126 CO -0.19 -0.26 -0.24 -0.24 -1.72 0.00 0.00 179.24 176.59 1why n SER 127 N -5.15 -3.77 -3.44 6.45 2.88 -0.67 -4.99 113.62 104.93 1why n SER 127 Ca 0.33 0.09 -0.12 0.00 -1.33 0.00 0.00 58.87 57.85 1why n SER 127 Cb 1.08 -2.72 -0.03 0.00 -0.75 0.00 0.00 64.21 61.79 1why n SER 127 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 1why s PHE 128 N -2.48 0.66 0.11 0.66 -0.12 -1.26 -3.77 117.98 111.78 1why s PHE 128 Ca 0.00 -1.02 -0.22 0.00 -0.05 0.00 0.00 56.93 55.65 1why s PHE 128 Cb 0.00 0.17 0.06 0.00 -0.63 0.00 0.00 43.02 42.62 1why s PHE 128 CO 0.00 -1.17 0.54 0.00 -0.05 0.00 0.00 175.22 174.54 1why s ALA 129 N -3.24 -1.39 -0.04 1.99 0.00 0.60 -4.22 121.76 115.46 1why s ALA 129 Ca 0.25 0.43 0.05 0.00 0.00 0.00 0.00 51.96 52.70 1why s ALA 129 Cb -0.01 0.68 -0.02 0.00 0.00 0.00 0.00 23.12 23.76 1why s ALA 129 CO 0.15 -0.66 -0.19 0.71 0.00 0.00 0.00 175.76 175.77 1why s TYR 130 N -3.32 2.55 -0.16 0.00 2.02 -1.26 -0.50 117.35 116.68 1why s TYR 130 Ca -0.01 -0.34 -0.04 0.00 -0.37 0.00 0.00 57.07 56.32 1why s TYR 130 Cb -0.00 -1.59 -0.03 0.00 -0.40 0.00 0.00 41.96 39.94 1why s TYR 130 CO -0.09 0.05 -0.04 0.42 -1.57 0.00 0.00 175.55 174.32 1why s ILE 131 N -0.57 3.90 -0.21 2.71 -1.09 -0.83 -3.78 121.20 121.33 1why s ILE 131 Ca 0.08 -0.35 -0.04 0.00 -2.23 0.00 0.00 60.65 58.11 1why s ILE 131 Cb -0.11 -2.71 -0.01 0.00 -1.58 0.00 0.00 42.46 38.04 1why s ILE 131 CO 0.01 0.49 -0.03 -1.58 -1.23 0.00 0.00 174.94 172.60 1why s GLN 132 N 0.38 3.46 0.21 2.79 2.00 -1.20 -1.89 119.66 125.42 1why s GLN 132 Ca -0.04 -0.59 0.06 0.00 -2.00 0.00 0.00 55.36 52.79 1why s GLN 132 Cb -0.14 -3.02 -0.04 0.00 0.80 0.00 0.00 33.01 30.61 1why s GLN 132 CO 0.03 -0.11 0.19 0.71 -0.50 0.00 0.00 175.29 175.61 1why s TYR 133 N 1.27 3.16 0.30 1.67 2.02 -1.21 -0.76 117.35 123.80 1why s TYR 133 Ca 0.03 -0.06 0.10 0.00 -0.37 0.00 0.00 57.07 56.77 1why s TYR 133 Cb -0.14 -1.46 0.46 0.00 -0.40 0.00 0.00 41.96 40.41 1why s TYR 133 CO -0.01 0.52 1.68 0.93 -1.57 0.00 0.00 175.55 177.10 1why h GLU 134 N 1.85 0.06 -5.21 -0.62 4.39 -1.87 -3.45 114.58 109.74 1why h GLU 134 Ca -0.48 -0.04 -0.38 0.00 0.34 0.00 0.00 59.36 58.80 1why h GLU 134 Cb 1.22 0.00 -0.19 0.00 -0.10 0.00 0.00 28.75 29.69 1why h GLU 134 CO 0.62 0.57 -0.75 -1.12 -1.16 0.00 0.00 179.01 177.17 1why s SER 135 N -6.88 1.70 0.13 1.42 0.01 -1.26 -5.05 113.70 103.76 1why s SER 135 Ca -0.02 -0.76 -0.13 0.00 1.31 0.00 0.00 55.95 56.34 1why s SER 135 Cb 0.13 -0.03 -0.03 0.00 0.21 0.00 0.00 66.02 66.30 1why s SER 135 CO 0.76 -0.17 1.52 0.25 0.41 0.00 0.00 173.24 176.00 1why h LEU 136 N 3.73 0.84 0.05 2.44 6.46 -1.91 -3.11 115.31 123.81 1why h LEU 136 Ca -0.39 -0.39 0.02 0.00 -0.12 0.00 0.00 57.88 57.00 1why h LEU 136 Cb 1.19 -0.23 -0.05 0.00 -0.73 0.00 0.00 40.66 40.84 1why h LEU 136 CO 0.49 1.04 -0.51 -0.78 -0.62 0.00 0.00 178.44 178.06 1why h ASP 137 N 0.63 -1.56 -0.91 1.25 3.58 -1.97 -1.19 116.42 116.25 1why h ASP 137 Ca 0.09 0.17 0.21 0.00 0.42 0.00 0.00 57.03 57.93 1why h ASP 137 Cb 0.71 0.59 -0.12 0.00 1.72 0.00 0.00 39.33 42.23 1why h ASP 137 CO 0.05 -0.53 0.45 0.00 -2.88 0.00 0.00 179.24 176.34 1why h ALA 138 N -0.39 1.49 -0.29 -0.78 0.00 -1.93 -0.18 119.26 117.19 1why h ALA 138 Ca 0.01 0.14 0.04 0.00 0.00 0.00 0.00 54.91 55.10 1why h ALA 138 Cb 0.73 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.56 1why h ALA 138 CO -0.32 -0.27 0.05 0.00 0.00 0.00 0.00 179.25 178.70 1why h ALA 139 N 1.68 0.29 -0.11 0.00 0.00 -1.17 -2.47 119.26 117.48 1why h ALA 139 Ca 0.56 0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.56 1why h ALA 139 Cb 1.02 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.86 1why h ALA 139 CO -0.48 -0.37 -0.05 1.96 0.00 0.00 0.00 179.25 180.31 1why h GLN 140 N 0.15 -0.04 -0.27 0.00 4.20 -0.28 0.17 115.11 119.04 1why h GLN 140 Ca 0.13 0.00 0.05 0.00 0.06 0.00 0.00 58.65 58.89 1why h GLN 140 Cb 0.15 0.01 -0.08 0.00 0.30 0.00 0.00 27.48 27.86 1why h GLN 140 CO -0.18 -0.03 -0.50 0.00 -0.67 0.00 0.00 178.83 177.45 1why h ALA 141 N 1.06 -0.70 -0.20 3.87 0.00 -1.08 -2.08 119.26 120.12 1why h ALA 141 Ca 0.06 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1why h ALA 141 Cb 0.13 0.97 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 1why h ALA 141 CO -0.14 -1.00 0.11 0.00 0.00 0.00 0.00 179.25 178.22 1why h ALA 142 N 0.01 0.26 -1.03 0.00 0.00 -1.29 -1.25 119.26 115.96 1why h ALA 142 Ca 0.08 -0.06 0.42 0.00 0.00 0.00 0.00 54.91 55.34 1why h ALA 142 Cb 0.63 -0.08 -0.17 0.00 0.00 0.00 0.00 17.79 18.17 1why h ALA 142 CO -0.50 -0.21 0.57 0.00 0.00 0.00 0.00 179.25 179.11 1why h ALA 144 N 1.96 0.00 -0.54 0.00 0.00 -1.09 -3.25 119.26 116.34 1why h ALA 144 Ca 0.84 -0.24 0.06 0.00 0.00 0.00 0.00 54.91 55.57 1why h ALA 144 Cb 2.26 0.14 -0.09 0.00 0.00 0.00 0.00 17.79 20.10 1why h ALA 144 CO -0.73 0.14 -0.55 0.87 0.00 0.00 0.00 179.25 178.98 1why h LYS 145 N -0.41 -0.28 -0.67 0.00 6.56 -0.80 0.05 116.57 121.01 1why h LYS 145 Ca 0.00 0.02 0.14 0.00 -1.06 0.00 0.00 60.65 59.75 1why h LYS 145 Cb 0.14 0.06 -0.11 0.00 -0.57 0.00 0.00 32.23 31.75 1why h LYS 145 CO 0.00 -0.19 0.01 0.52 -2.06 0.00 0.00 179.45 177.74 1why h MET 146 N -0.29 0.12 -5.63 3.15 2.86 -0.21 -3.40 114.93 111.53 1why h MET 146 Ca 0.09 -0.01 -0.61 0.00 -2.06 0.00 0.00 59.70 57.12 1why h MET 146 Cb 0.53 -0.03 -0.04 0.00 0.06 0.00 0.00 31.60 32.13 1why h MET 146 CO -0.66 0.08 1.54 -2.13 1.06 0.00 0.00 176.91 176.79 1why n ARG 147 N -5.29 0.53 -0.89 1.72 0.63 0.00 -1.05 116.66 112.31 1why n ARG 147 Ca 0.11 0.10 0.00 0.00 -0.92 0.00 0.00 57.85 57.13 1why n ARG 147 Cb 0.40 -2.13 0.00 0.00 0.45 0.00 0.00 32.46 31.18 1why n ARG 147 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1why n GLY 148 N 6.65 0.78 3.76 5.14 0.00 -0.04 -4.97 105.19 116.50 1why n GLY 148 Ca 0.51 -0.23 -0.39 0.00 0.00 0.00 0.00 46.02 45.91 1why n GLY 148 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1why s PHE 149 N -2.13 3.82 -2.00 1.61 5.36 -0.22 -4.78 117.98 119.64 1why s PHE 149 Ca 0.00 1.84 0.06 0.00 -0.96 0.00 0.00 56.93 57.87 1why s PHE 149 Cb 0.00 -3.02 0.33 0.00 -0.34 0.00 0.00 43.02 39.99 1why s PHE 149 CO 0.00 0.20 0.79 -0.35 -1.46 0.00 0.00 175.22 174.40 1why n PRO 150 N 1.14 0.49 -1.52 10.12 -0.04 -1.26 -3.21 135.00 140.71 1why n PRO 150 Ca -0.01 0.00 -0.45 0.00 -0.04 0.00 0.00 63.50 63.00 1why n PRO 150 Cb 0.48 -1.18 -0.02 0.00 -0.04 0.00 0.00 33.50 32.74 1why n PRO 150 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 1why n LEU 151 N -0.68 0.76 0.00 1.53 7.94 -1.26 -3.36 117.00 121.94 1why n LEU 151 Ca 0.04 1.14 0.00 0.00 -1.11 0.00 0.00 56.01 56.08 1why n LEU 151 Cb 0.02 -1.18 0.00 0.00 0.53 0.00 0.00 43.42 42.79 1why n LEU 151 CO 0.03 -1.99 0.00 0.61 -1.11 0.00 0.00 177.39 174.93 1why n GLY 152 N 1.49 1.88 1.67 -3.96 0.00 -1.26 -4.52 105.19 100.49 1why n GLY 152 Ca 0.12 0.20 -0.07 0.00 0.00 0.00 0.00 46.02 46.27 1why n GLY 152 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1why n GLY 153 N 0.00 2.48 0.00 -0.02 0.00 -1.21 -4.99 105.19 101.45 1why n GLY 153 Ca 0.00 -1.45 0.07 0.00 0.00 0.00 0.00 46.02 44.64 1why n GLY 153 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1why n PRO 154 N -0.28 0.09 -0.08 1.61 -0.04 -1.26 -3.25 135.00 131.79 1why n PRO 154 Ca -0.00 0.21 -0.14 0.00 -0.04 0.00 0.00 63.50 63.53 1why n PRO 154 Cb 0.29 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.18 1why n PRO 154 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1why n ASP 155 N -1.41 2.11 -4.57 3.54 -0.08 -1.26 -4.84 116.55 110.04 1why n ASP 155 Ca 0.05 0.04 -0.29 0.00 -1.51 0.00 0.00 54.79 53.07 1why n ASP 155 Cb 0.14 -0.34 -0.05 0.00 2.34 0.00 0.00 41.12 43.21 1why n ASP 155 CO 0.00 0.00 0.00 -0.13 0.12 0.00 0.00 177.20 177.19 1why s ARG 156 N -2.30 2.72 -0.18 -0.67 0.52 -1.20 -4.94 118.95 112.90 1why s ARG 156 Ca -0.22 -0.69 -0.09 0.00 -0.52 0.00 0.00 55.73 54.21 1why s ARG 156 Cb 0.07 -5.17 -0.05 0.00 0.52 0.00 0.00 34.95 30.33 1why s ARG 156 CO 0.33 -3.35 0.13 -0.98 0.02 0.00 0.00 175.30 171.44 1why s ARG 157 N 6.51 4.00 0.15 3.54 1.70 -1.26 -4.15 118.95 129.44 1why s ARG 157 Ca 0.66 -0.21 -0.31 0.00 -0.47 0.00 0.00 55.73 55.40 1why s ARG 157 Cb -0.04 -3.35 -0.10 0.00 -0.57 0.00 0.00 34.95 30.89 1why s ARG 157 CO 0.02 0.41 1.62 -0.51 -1.08 0.00 0.00 175.30 175.77 1why s LEU 158 N 0.04 4.37 -0.43 -1.89 1.43 -1.20 -4.79 118.68 116.21 1why s LEU 158 Ca 0.09 2.63 -0.17 0.00 -1.03 0.00 0.00 54.13 55.65 1why s LEU 158 Cb -0.11 -3.59 0.03 0.00 0.03 0.00 0.00 46.19 42.55 1why s LEU 158 CO -0.01 -0.87 0.45 -0.60 0.23 0.00 0.00 176.35 175.55 1why s ARG 159 N 1.58 3.09 -0.14 1.70 6.06 -1.26 -0.86 118.95 129.11 1why s ARG 159 Ca 0.72 -0.80 0.02 0.00 -2.50 0.00 0.00 55.73 53.17 1why s ARG 159 Cb -0.44 -3.98 0.01 0.00 0.06 0.00 0.00 34.95 30.60 1why s ARG 159 CO 0.32 -0.88 -0.22 0.08 -2.50 0.00 0.00 175.30 172.10 1why s VAL 160 N 2.14 2.04 -0.04 7.11 1.01 -1.26 -2.15 120.40 129.25 1why s VAL 160 Ca 0.12 -0.96 -0.04 0.00 0.00 0.00 0.00 61.98 61.10 1why s VAL 160 Cb -0.18 -1.81 0.01 0.00 0.00 0.00 0.00 36.38 34.41 1why s VAL 160 CO 0.13 0.54 0.10 -0.62 0.00 0.00 0.00 175.10 175.26 1why s ASP 161 N 0.88 -0.11 0.76 3.32 2.15 -0.85 -4.74 116.67 118.08 1why s ASP 161 Ca -0.06 0.21 -0.16 0.00 0.43 0.00 0.00 52.55 52.98 1why s ASP 161 Cb -0.15 0.21 -0.02 0.00 -0.30 0.00 0.00 42.92 42.66 1why s ASP 161 CO -0.03 -0.04 0.53 0.49 -0.17 0.00 0.00 175.17 175.95 1why n PHE 162 N 3.02 -0.83 -5.06 -5.34 3.72 -1.26 -1.51 117.46 110.19 1why n PHE 162 Ca -0.12 0.33 -0.32 0.00 -0.05 0.00 0.00 57.45 57.29 1why n PHE 162 Cb 0.59 -1.90 -0.14 0.00 -0.94 0.00 0.00 39.48 37.09 1why n PHE 162 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1why s ALA 163 N -1.99 2.46 -0.88 4.37 0.00 -1.25 -4.66 121.76 119.81 1why s ALA 163 Ca 0.64 -1.04 -0.25 0.00 0.00 0.00 0.00 51.96 51.32 1why s ALA 163 Cb -0.33 -0.80 -0.06 0.00 0.00 0.00 0.00 23.12 21.93 1why s ALA 163 CO 0.59 0.54 2.03 -1.59 0.00 0.00 0.00 175.76 177.33 1why s LYS 164 N -0.66 2.39 -0.07 0.00 -2.85 -1.26 -4.73 119.74 112.55 1why s LYS 164 Ca 0.10 -0.15 -0.16 0.00 -1.00 0.00 0.00 55.97 54.77 1why s LYS 164 Cb -0.10 -5.01 -0.29 0.00 -2.06 0.00 0.00 37.83 30.36 1why s LYS 164 CO -0.00 -3.57 0.67 0.66 0.10 0.00 0.00 175.35 173.22 1why h SER 165 N 11.54 0.49 -5.43 0.03 4.64 -1.95 -3.49 113.55 119.38 1why h SER 165 Ca 0.08 -0.90 -0.20 0.00 -0.47 0.00 0.00 61.79 60.30 1why h SER 165 Cb 1.00 -0.16 0.01 0.00 -0.31 0.00 0.00 62.40 62.95 1why h SER 165 CO 1.17 1.63 -0.89 0.61 -0.87 0.00 0.00 176.83 178.48 1why n GLY 166 N 1.76 0.10 0.23 -0.77 0.00 -1.26 -4.82 105.19 100.43 1why n GLY 166 Ca -0.23 0.60 0.10 0.00 0.00 0.00 0.00 46.02 46.49 1why n GLY 166 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1why h PRO 167 N 2.11 0.00 0.01 1.61 0.13 -2.01 -3.30 132.00 130.55 1why h PRO 167 Ca -0.30 0.00 -0.39 0.00 -0.87 0.00 0.00 66.00 64.45 1why h PRO 167 Cb 0.99 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.06 1why h PRO 167 CO 0.12 0.23 -2.13 0.43 -0.23 0.00 0.00 178.00 176.41 1why n SER 168 N -3.50 1.94 -4.77 1.44 7.64 -1.26 -4.93 113.62 110.18 1why n SER 168 Ca -0.00 0.32 -0.39 0.00 1.01 0.00 0.00 58.87 59.81 1why n SER 168 Cb 0.39 -0.84 -0.06 0.00 -1.01 0.00 0.00 64.21 62.70 1why n SER 168 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1why s SER 169 N -7.22 6.98 0.00 6.43 0.15 -1.24 -5.29 113.70 113.51 1why s SER 169 Ca -0.35 1.16 0.00 0.00 0.70 0.00 0.00 55.95 57.46 1why s SER 169 Cb 0.11 -2.36 0.00 0.00 -1.71 0.00 0.00 66.02 62.06 1why s SER 169 CO 0.54 0.12 0.00 0.61 1.20 0.00 0.00 173.24 175.71