#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gfu n ALA 69 N 0.00 2.81 -2.23 7.82 0.00 -1.26 -5.02 120.51 122.64 2gfu n ALA 69 Ca 0.00 -2.75 -0.42 0.00 0.00 0.00 0.00 53.44 50.27 2gfu n ALA 69 Cb 0.00 -0.74 0.00 0.00 0.00 0.00 0.00 19.45 18.71 2gfu n ALA 69 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2gfu n LYS 70 N -0.26 3.38 -3.66 0.00 5.02 -1.26 -4.95 118.16 116.43 2gfu n LYS 70 Ca 0.11 -3.29 -0.38 0.00 -2.02 0.00 0.00 58.31 52.74 2gfu n LYS 70 Cb 0.93 -3.06 -0.12 0.00 -0.02 0.00 0.00 35.03 32.77 2gfu n LYS 70 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 2gfu s ASN 71 N 1.78 5.61 -0.16 4.39 -0.87 -1.26 -5.06 114.94 119.37 2gfu s ASN 71 Ca 0.42 -0.16 -0.21 0.00 -1.57 0.00 0.00 52.86 51.35 2gfu s ASN 71 Cb 0.10 -2.03 0.05 0.00 -0.02 0.00 0.00 41.25 39.35 2gfu s ASN 71 CO -0.02 -0.07 0.55 -0.22 -2.57 0.00 0.00 177.10 174.77 2gfu s LEU 72 N 1.69 -0.10 -0.12 0.60 1.98 -1.26 -5.08 118.68 116.38 2gfu s LEU 72 Ca 0.06 0.93 0.16 0.00 -2.89 0.00 0.00 54.13 52.40 2gfu s LEU 72 Cb -0.16 1.94 0.26 0.00 0.66 0.00 0.00 46.19 48.90 2gfu s LEU 72 CO 0.07 -0.30 1.14 0.59 -1.89 0.00 0.00 176.35 175.96 2gfu n ASN 73 N 2.28 2.00 0.00 3.68 5.03 -1.26 -5.01 115.26 121.97 2gfu n ASN 73 Ca -0.15 -2.99 0.00 0.00 0.87 0.00 0.00 54.58 52.31 2gfu n ASN 73 Cb 0.56 -0.41 0.00 0.00 -1.02 0.00 0.00 39.78 38.92 2gfu n ASN 73 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2gfu n GLY 74 N -1.22 3.40 0.00 7.41 0.00 -1.26 -5.03 105.19 108.49 2gfu n GLY 74 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 2gfu n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gfu n GLY 75 N -1.64 -3.17 0.06 -0.02 0.00 -1.25 -0.51 105.19 98.65 2gfu n GLY 75 Ca 0.00 0.67 0.13 0.00 0.00 0.00 0.00 46.02 46.82 2gfu n GLY 75 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2gfu n LEU 76 N -1.13 0.56 0.02 0.99 -0.00 -1.26 -3.28 117.00 112.89 2gfu n LEU 76 Ca 0.00 0.39 -0.12 0.00 -0.00 0.00 0.00 56.01 56.28 2gfu n LEU 76 Cb 0.00 -0.32 -0.09 0.00 -0.00 0.00 0.00 43.42 43.01 2gfu n LEU 76 CO 0.00 -0.07 0.48 -0.09 -0.00 0.00 0.00 177.39 177.72 2gfu h ARG 77 N 0.00 -0.12 0.00 1.47 2.43 -1.96 -3.45 114.38 112.75 2gfu h ARG 77 Ca 0.00 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 2gfu h ARG 77 Cb 0.65 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.23 2gfu h ARG 77 CO 0.00 0.39 -0.03 2.89 -1.51 0.00 0.00 179.97 181.71 2gfu n ARG 78 N -4.87 0.80 0.00 0.20 1.85 0.33 -5.09 116.66 109.88 2gfu n ARG 78 Ca -0.08 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.77 2gfu n ARG 78 Cb 0.28 -0.51 0.00 0.00 -1.05 0.00 0.00 32.46 31.18 2gfu n ARG 78 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 177.63 176.49 2gfu n SER 79 N -0.48 0.00 0.02 2.89 3.41 0.24 -4.68 113.62 115.03 2gfu n SER 79 Ca 0.00 0.00 -0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2gfu n SER 79 Cb 0.01 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 63.96 2gfu n SER 79 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2gfu n VAL 80 N 0.00 0.64 -4.20 -3.33 0.31 -1.26 -3.87 118.33 106.61 2gfu n VAL 80 Ca 0.00 0.21 -0.16 0.00 -0.01 0.00 0.00 64.34 64.38 2gfu n VAL 80 Cb 0.00 -1.31 -0.15 0.00 -0.91 0.00 0.00 33.84 31.47 2gfu n VAL 80 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2gfu s ALA 81 N -2.02 0.50 -1.39 3.52 0.00 -1.26 -5.07 121.76 116.04 2gfu s ALA 81 Ca -0.00 -0.25 -0.12 0.00 0.00 0.00 0.00 51.96 51.59 2gfu s ALA 81 Cb 0.00 -0.14 -0.04 0.00 0.00 0.00 0.00 23.12 22.94 2gfu s ALA 81 CO 0.00 0.12 2.47 -0.35 0.00 0.00 0.00 175.76 178.00 2gfu n PRO 82 N 2.98 2.96 0.00 0.00 -0.04 -1.26 -4.45 135.00 135.19 2gfu n PRO 82 Ca -0.13 -2.24 0.00 0.00 -0.04 0.00 0.00 63.50 61.09 2gfu n PRO 82 Cb 0.58 -2.97 0.00 0.00 -0.04 0.00 0.00 33.50 31.07 2gfu n PRO 82 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2gfu n ALA 83 N 5.05 0.00 -3.02 0.55 0.00 -1.26 -4.77 120.51 117.06 2gfu n ALA 83 Ca 0.61 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.68 2gfu n ALA 83 Cb 0.30 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.63 2gfu n ALA 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gfu s ALA 84 N -1.20 3.18 -1.03 0.00 0.00 -1.26 -5.03 121.76 116.42 2gfu s ALA 84 Ca 0.00 -1.30 -0.08 0.00 0.00 0.00 0.00 51.96 50.59 2gfu s ALA 84 Cb 0.00 -2.20 -0.10 0.00 0.00 0.00 0.00 23.12 20.82 2gfu s ALA 84 CO 0.00 -0.74 3.05 -0.35 0.00 0.00 0.00 175.76 177.73 2gfu n PRO 85 N 4.93 3.26 -2.62 0.00 -0.04 -1.26 -4.70 135.00 134.57 2gfu n PRO 85 Ca -0.15 -2.06 -0.30 0.00 -0.04 0.00 0.00 63.50 60.95 2gfu n PRO 85 Cb 0.50 -2.50 -0.01 0.00 -0.04 0.00 0.00 33.50 31.45 2gfu n PRO 85 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2gfu n THR 86 N 2.78 3.15 -3.53 0.52 -2.24 -1.26 -5.07 114.28 108.63 2gfu n THR 86 Ca 0.64 -5.23 0.01 0.00 -2.27 0.00 0.00 64.05 57.20 2gfu n THR 86 Cb 0.45 -1.34 -0.00 0.00 -2.10 0.00 0.00 70.33 67.33 2gfu n THR 86 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2gfu n SER 87 N -0.36 -1.95 -3.03 3.42 2.88 -1.26 -4.94 113.62 108.39 2gfu n SER 87 Ca 0.38 0.09 -0.14 0.00 -1.33 0.00 0.00 58.87 57.88 2gfu n SER 87 Cb 0.47 -0.26 -0.04 0.00 -0.75 0.00 0.00 64.21 63.63 2gfu n SER 87 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2gfu n SER 88 N -0.55 -2.19 -3.10 -3.46 3.41 -1.26 -4.93 113.62 101.55 2gfu n SER 88 Ca 0.00 -2.68 -0.15 0.00 -0.26 0.00 0.00 58.87 55.78 2gfu n SER 88 Cb 0.04 0.77 -0.04 0.00 -0.26 0.00 0.00 64.21 64.71 2gfu n SER 88 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2gfu s ASP 89 N 0.51 -0.01 -0.13 4.04 -1.08 -1.26 -4.47 116.67 114.27 2gfu s ASP 89 Ca 0.31 -2.23 0.02 0.00 -0.52 0.00 0.00 52.55 50.13 2gfu s ASP 89 Cb 0.02 0.81 0.00 0.00 -1.46 0.00 0.00 42.92 42.29 2gfu s ASP 89 CO -0.11 -0.13 -0.19 -0.36 0.52 0.00 0.00 175.17 174.90 2gfu s PHE 90 N 0.63 2.69 0.37 -5.34 0.08 -1.26 -5.14 117.98 110.01 2gfu s PHE 90 Ca 0.29 -1.10 0.08 0.00 0.12 0.00 0.00 56.93 56.32 2gfu s PHE 90 Cb -0.00 -1.81 -0.04 0.00 -0.57 0.00 0.00 43.02 40.59 2gfu s PHE 90 CO -0.11 -0.48 0.17 -1.54 -0.10 0.00 0.00 175.22 173.16 2gfu s SER 91 N 0.65 4.59 0.01 1.36 1.04 -1.26 -4.95 113.70 115.13 2gfu s SER 91 Ca -0.10 -0.89 -0.37 0.00 0.48 0.00 0.00 55.95 55.07 2gfu s SER 91 Cb -0.16 -0.62 -0.16 0.00 0.10 0.00 0.00 66.02 65.18 2gfu s SER 91 CO 0.02 -0.41 1.44 -2.65 0.98 0.00 0.00 173.24 172.62 2gfu n PRO 92 N -1.20 1.19 -0.16 4.02 -0.02 -1.26 -2.48 135.00 135.09 2gfu n PRO 92 Ca -0.02 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 61.89 2gfu n PRO 92 Cb 0.62 -2.09 0.00 0.00 -0.02 0.00 0.00 33.50 32.02 2gfu n PRO 92 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2gfu n GLY 93 N 2.91 0.62 3.98 -1.23 0.00 -0.16 -4.95 105.19 106.37 2gfu n GLY 93 Ca 0.20 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.02 2gfu n GLY 93 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2gfu s ASP 94 N -2.89 5.43 0.07 1.61 1.01 -1.04 -4.73 116.67 116.14 2gfu s ASP 94 Ca 0.00 -0.07 0.07 0.00 0.71 0.00 0.00 52.55 53.26 2gfu s ASP 94 Cb 0.00 -0.91 -0.04 0.00 1.01 0.00 0.00 42.92 42.98 2gfu s ASP 94 CO 0.00 -1.00 -0.13 -0.76 0.21 0.00 0.00 175.17 173.50 2gfu s LEU 95 N -4.64 2.91 0.17 1.23 2.01 -1.26 -2.52 118.68 116.58 2gfu s LEU 95 Ca 0.55 -0.37 -0.03 0.00 0.01 0.00 0.00 54.13 54.29 2gfu s LEU 95 Cb -0.10 -1.71 -0.03 0.00 0.01 0.00 0.00 46.19 44.36 2gfu s LEU 95 CO 0.37 0.22 0.16 0.54 1.01 0.00 0.00 176.35 178.65 2gfu s VAL 96 N -1.08 0.06 -0.24 -1.59 0.11 -1.07 -1.97 120.40 114.61 2gfu s VAL 96 Ca 0.18 -1.80 -0.04 0.00 -2.93 0.00 0.00 61.98 57.40 2gfu s VAL 96 Cb -0.11 -2.16 0.00 0.00 -1.53 0.00 0.00 36.38 32.59 2gfu s VAL 96 CO 0.10 -0.25 -0.03 0.26 -3.33 0.00 0.00 175.10 171.85 2gfu s TRP 97 N -4.07 3.02 -0.16 1.54 0.52 0.45 -0.87 118.94 119.39 2gfu s TRP 97 Ca 0.27 -1.12 -0.05 0.00 0.02 0.00 0.00 56.10 55.22 2gfu s TRP 97 Cb 0.06 -2.12 -0.04 0.00 -1.15 0.00 0.00 33.47 30.23 2gfu s TRP 97 CO 0.05 -0.61 0.03 0.00 0.02 0.00 0.00 176.95 176.44 2gfu s ALA 98 N 1.44 3.29 -0.12 0.98 0.00 0.18 -0.75 121.76 126.79 2gfu s ALA 98 Ca 0.04 -0.77 -0.03 0.00 0.00 0.00 0.00 51.96 51.20 2gfu s ALA 98 Cb -0.15 -1.75 -0.03 0.00 0.00 0.00 0.00 23.12 21.18 2gfu s ALA 98 CO -0.03 0.27 0.00 0.21 0.00 0.00 0.00 175.76 176.22 2gfu s LYS 99 N 0.11 3.31 0.05 0.00 2.47 -0.56 -2.49 119.74 122.63 2gfu s LYS 99 Ca 0.03 -0.42 0.08 0.00 -1.56 0.00 0.00 55.97 54.10 2gfu s LYS 99 Cb -0.13 -2.89 -0.03 0.00 -1.46 0.00 0.00 37.83 33.32 2gfu s LYS 99 CO 0.01 0.53 -0.22 1.41 0.16 0.00 0.00 175.35 177.24 2gfu s MET 100 N -0.40 1.49 -0.63 4.03 -2.45 -1.26 -4.77 119.30 115.31 2gfu s MET 100 Ca 0.08 -1.00 -0.26 0.00 -1.25 0.00 0.00 55.69 53.25 2gfu s MET 100 Cb -0.12 -1.64 -0.08 0.00 1.25 0.00 0.00 34.83 34.24 2gfu s MET 100 CO 0.02 0.42 2.29 -1.83 1.05 0.00 0.00 175.02 176.97 2gfu s GLU 101 N -1.24 2.07 0.00 4.11 -1.05 -1.26 -1.36 118.70 119.98 2gfu s GLU 101 Ca 0.09 0.89 0.00 0.00 -0.15 0.00 0.00 54.97 55.80 2gfu s GLU 101 Cb -0.09 -4.65 0.00 0.00 -0.44 0.00 0.00 34.13 28.95 2gfu s GLU 101 CO 0.02 -3.54 0.00 0.41 0.95 0.00 0.00 175.26 173.10 2gfu n GLY 102 N 6.25 0.94 3.82 -3.83 0.00 -1.26 -5.12 105.19 106.00 2gfu n GLY 102 Ca 0.37 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.18 2gfu n GLY 102 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2gfu s TYR 103 N -2.00 2.99 0.89 1.61 1.51 -0.46 -5.14 117.35 116.75 2gfu s TYR 103 Ca 0.00 -0.20 -0.12 0.00 -1.01 0.00 0.00 57.07 55.74 2gfu s TYR 103 Cb 0.00 -1.54 0.13 0.00 -0.11 0.00 0.00 41.96 40.43 2gfu s TYR 103 CO 0.00 0.40 1.10 -1.25 -1.11 0.00 0.00 175.55 174.69 2gfu s PRO 104 N -3.89 1.28 0.05 -1.71 0.04 -1.26 -4.61 135.00 124.90 2gfu s PRO 104 Ca 0.36 0.63 -0.30 0.00 0.04 0.00 0.00 61.00 61.73 2gfu s PRO 104 Cb -0.07 -1.83 -0.09 0.00 0.04 0.00 0.00 34.50 32.55 2gfu s PRO 104 CO 0.25 -2.18 1.95 0.91 0.04 0.00 0.00 177.00 177.98 2gfu n TRP 105 N -3.81 2.54 -3.99 0.56 7.02 -1.26 -4.51 117.44 114.00 2gfu n TRP 105 Ca 0.07 -0.34 -0.30 0.00 -1.02 0.00 0.00 57.50 55.91 2gfu n TRP 105 Cb 0.56 -2.79 -0.16 0.00 -2.42 0.00 0.00 31.31 26.50 2gfu n TRP 105 CO 0.00 0.00 0.00 -1.58 -2.02 0.00 0.00 177.69 174.09 2gfu s TRP 106 N 4.12 2.22 0.12 -5.99 0.23 -1.04 -4.94 118.94 113.66 2gfu s TRP 106 Ca 0.88 -1.37 -0.33 0.00 -2.03 0.00 0.00 56.10 53.24 2gfu s TRP 106 Cb -0.44 -1.57 -0.12 0.00 0.03 0.00 0.00 33.47 31.36 2gfu s TRP 106 CO 0.41 -0.70 1.73 -0.35 0.96 0.00 0.00 176.95 179.00 2gfu n PRO 107 N 4.75 2.46 -4.18 4.98 -0.04 -1.26 -0.65 135.00 141.06 2gfu n PRO 107 Ca -0.15 0.89 -0.11 0.00 -0.04 0.00 0.00 63.50 64.09 2gfu n PRO 107 Cb 0.48 -2.72 -0.10 0.00 -0.04 0.00 0.00 33.50 31.12 2gfu n PRO 107 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2gfu s SER 108 N 1.95 0.52 -0.05 3.54 0.15 -0.05 -2.63 113.70 117.14 2gfu s SER 108 Ca 0.81 -1.22 0.02 0.00 0.70 0.00 0.00 55.95 56.26 2gfu s SER 108 Cb -0.59 0.26 0.01 0.00 -1.71 0.00 0.00 66.02 63.99 2gfu s SER 108 CO 0.39 -0.71 -0.11 -0.22 1.20 0.00 0.00 173.24 173.79 2gfu s LEU 109 N -3.09 1.65 -0.27 3.45 0.20 -1.01 -2.61 118.68 117.00 2gfu s LEU 109 Ca 0.26 -0.25 -0.18 0.00 0.69 0.00 0.00 54.13 54.64 2gfu s LEU 109 Cb 0.07 -0.72 -0.02 0.00 -0.43 0.00 0.00 46.19 45.09 2gfu s LEU 109 CO 0.04 0.04 0.54 0.54 -0.29 0.00 0.00 176.35 177.22 2gfu s VAL 110 N 0.55 5.04 0.16 1.68 0.11 -1.05 -2.40 120.40 124.49 2gfu s VAL 110 Ca -0.11 0.88 0.10 0.00 -2.93 0.00 0.00 61.98 59.91 2gfu s VAL 110 Cb -0.14 -3.87 -0.04 0.00 -1.53 0.00 0.00 36.38 30.80 2gfu s VAL 110 CO 0.02 0.03 -0.21 -0.47 -3.33 0.00 0.00 175.10 171.14 2gfu s TYR 111 N 2.38 2.00 -0.38 1.54 6.14 -0.94 -0.98 117.35 127.10 2gfu s TYR 111 Ca 0.22 -0.42 -0.21 0.00 0.64 0.00 0.00 57.07 57.31 2gfu s TYR 111 Cb -0.15 -1.02 0.01 0.00 0.42 0.00 0.00 41.96 41.22 2gfu s TYR 111 CO 0.10 0.36 0.65 -0.80 0.64 0.00 0.00 175.55 176.49 2gfu s ASN 112 N -2.49 6.40 0.86 4.32 0.01 -1.26 -4.58 114.94 118.21 2gfu s ASN 112 Ca 0.15 0.04 -0.11 0.00 -0.71 0.00 0.00 52.86 52.23 2gfu s ASN 112 Cb -0.07 -2.33 0.11 0.00 0.41 0.00 0.00 41.25 39.36 2gfu s ASN 112 CO 0.07 -0.65 1.10 -1.00 -1.51 0.00 0.00 177.10 175.11 2gfu s HIS 113 N 2.76 2.27 -0.87 2.20 3.76 -1.26 -4.87 115.29 119.28 2gfu s HIS 113 Ca 0.24 1.47 0.00 0.00 -0.15 0.00 0.00 55.06 56.63 2gfu s HIS 113 Cb -0.14 -3.14 0.00 0.00 1.11 0.00 0.00 32.58 30.41 2gfu s HIS 113 CO 0.16 -2.28 0.75 -2.30 -0.85 0.00 0.00 174.74 170.22 2gfu n PRO 114 N -3.84 0.00 -1.29 8.40 -0.02 -1.26 -1.29 135.00 135.70 2gfu n PRO 114 Ca 0.08 0.28 -0.24 0.00 -2.02 0.00 0.00 63.50 61.61 2gfu n PRO 114 Cb 0.54 -1.61 0.12 0.00 -0.02 0.00 0.00 33.50 32.53 2gfu n PRO 114 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 2gfu n PHE 115 N -1.25 2.65 -1.87 6.00 3.72 -1.26 -5.08 117.46 120.37 2gfu n PHE 115 Ca 0.00 -2.29 -0.37 0.00 -0.05 0.00 0.00 57.45 54.75 2gfu n PHE 115 Cb 0.11 -0.94 0.05 0.00 -0.94 0.00 0.00 39.48 37.76 2gfu n PHE 115 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 176.76 176.87 2gfu s ASP 116 N -2.11 4.96 0.00 4.37 -4.77 -0.41 -3.68 116.67 115.03 2gfu s ASP 116 Ca 0.56 2.54 0.00 0.00 -3.30 0.00 0.00 52.55 52.36 2gfu s ASP 116 Cb 0.46 -2.61 0.00 0.00 -1.09 0.00 0.00 42.92 39.68 2gfu s ASP 116 CO 0.03 -1.76 0.00 0.61 0.70 0.00 0.00 175.17 174.75 2gfu n GLY 117 N 0.71 3.35 3.17 2.12 0.00 -1.26 -4.96 105.19 108.32 2gfu n GLY 117 Ca 0.14 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 2gfu n GLY 117 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2gfu s THR 118 N -2.45 2.40 0.00 2.61 -4.23 -1.24 -5.01 115.64 107.72 2gfu s THR 118 Ca 0.00 -0.83 0.00 0.00 -1.18 0.00 0.00 61.69 59.68 2gfu s THR 118 Cb 0.00 -2.04 0.00 0.00 1.34 0.00 0.00 72.50 71.80 2gfu s THR 118 CO 0.00 0.51 0.00 2.22 -0.54 0.00 0.00 174.62 176.81 2gfu n PHE 119 N 4.67 0.00 -3.56 3.99 -1.74 -1.26 -4.87 117.46 114.69 2gfu n PHE 119 Ca -0.20 0.00 -0.21 0.00 -0.56 0.00 0.00 57.45 56.48 2gfu n PHE 119 Cb 0.50 0.02 -0.03 0.00 1.52 0.00 0.00 39.48 41.50 2gfu n PHE 119 CO 0.00 0.00 0.00 0.96 -0.56 0.00 0.00 176.76 177.16 2gfu s ILE 120 N 0.00 2.84 0.03 1.97 -4.36 -1.26 -4.04 121.20 116.37 2gfu s ILE 120 Ca 0.00 -1.32 -0.27 0.00 -0.26 0.00 0.00 60.65 58.80 2gfu s ILE 120 Cb 0.00 -3.03 0.07 0.00 1.25 0.00 0.00 42.46 40.74 2gfu s ILE 120 CO 0.00 -0.03 0.63 -0.60 0.24 0.00 0.00 174.94 175.18 2gfu s ARG 121 N -4.13 1.11 -0.21 0.37 3.52 -1.10 -4.97 118.95 113.55 2gfu s ARG 121 Ca 0.48 -0.03 -0.10 0.00 -0.13 0.00 0.00 55.73 55.94 2gfu s ARG 121 Cb -0.04 0.52 0.07 0.00 -1.56 0.00 0.00 34.95 33.94 2gfu s ARG 121 CO 0.28 -0.40 0.48 -1.83 -0.81 0.00 0.00 175.30 173.02 2gfu s GLU 122 N -2.12 0.45 -0.50 5.12 1.03 -1.26 -0.29 118.70 121.13 2gfu s GLU 122 Ca -0.07 0.98 0.01 0.00 0.03 0.00 0.00 54.97 55.92 2gfu s GLU 122 Cb -0.00 0.15 0.13 0.00 -0.80 0.00 0.00 34.13 33.60 2gfu s GLU 122 CO 0.02 -0.18 0.27 0.15 -1.33 0.00 0.00 175.26 174.18 2gfu s LYS 123 N 1.83 2.06 0.00 -4.83 -0.14 -0.39 -4.94 119.74 113.33 2gfu s LYS 123 Ca -0.08 -2.35 0.00 0.00 -1.36 0.00 0.00 55.97 52.19 2gfu s LYS 123 Cb -0.09 -3.46 0.00 0.00 -1.68 0.00 0.00 37.83 32.60 2gfu s LYS 123 CO -0.15 -1.09 0.00 0.41 -0.76 0.00 0.00 175.35 173.76 2gfu n GLY 124 N 3.64 1.08 0.00 -3.33 0.00 -1.26 -0.74 105.19 104.58 2gfu n GLY 124 Ca 0.05 0.39 0.01 0.00 0.00 0.00 0.00 46.02 46.46 2gfu n GLY 124 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2gfu n LYS 125 N 0.00 2.59 -2.40 1.61 3.00 -1.26 -4.88 118.16 116.82 2gfu n LYS 125 Ca 0.00 -0.01 -0.43 0.00 -0.00 0.00 0.00 58.31 57.87 2gfu n LYS 125 Cb 0.00 -0.85 0.00 0.00 0.00 0.00 0.00 35.03 34.18 2gfu n LYS 125 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.40 177.83 2gfu n SER 126 N -1.34 4.77 -4.56 3.14 7.64 0.08 -4.80 113.62 118.54 2gfu n SER 126 Ca -0.00 -2.96 -0.42 0.00 1.01 0.00 0.00 58.87 56.50 2gfu n SER 126 Cb 0.03 -1.62 -0.06 0.00 -1.01 0.00 0.00 64.21 61.55 2gfu n SER 126 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2gfu s VAL 127 N 2.47 4.77 0.20 0.44 0.11 -1.26 -1.26 120.40 125.87 2gfu s VAL 127 Ca 0.46 0.59 0.05 0.00 -2.93 0.00 0.00 61.98 60.16 2gfu s VAL 127 Cb 0.06 -4.20 -0.04 0.00 -1.53 0.00 0.00 36.38 30.68 2gfu s VAL 127 CO 0.00 -0.49 0.19 -0.13 -3.33 0.00 0.00 175.10 171.35 2gfu s ARG 128 N 3.00 3.02 0.16 1.54 0.52 0.60 0.14 118.95 127.93 2gfu s ARG 128 Ca 0.28 -0.90 -0.11 0.00 -0.52 0.00 0.00 55.73 54.48 2gfu s ARG 128 Cb -0.13 -2.67 0.00 0.00 0.52 0.00 0.00 34.95 32.66 2gfu s ARG 128 CO 0.18 0.45 0.32 0.14 0.02 0.00 0.00 175.30 176.41 2gfu s VAL 129 N -1.91 0.07 -0.33 3.52 -7.23 -1.20 -2.73 120.40 110.60 2gfu s VAL 129 Ca 0.32 -1.21 -0.21 0.00 -1.81 0.00 0.00 61.98 59.07 2gfu s VAL 129 Cb -0.09 -1.70 -0.00 0.00 0.56 0.00 0.00 36.38 35.14 2gfu s VAL 129 CO 0.25 -0.31 0.64 -1.00 -0.31 0.00 0.00 175.10 174.37 2gfu s HIS 130 N -3.93 3.18 0.05 2.82 0.09 -1.26 -2.39 115.29 113.85 2gfu s HIS 130 Ca 0.14 0.50 -0.05 0.00 -0.00 0.00 0.00 55.06 55.64 2gfu s HIS 130 Cb 0.03 -3.07 -0.02 0.00 -0.00 0.00 0.00 32.58 29.52 2gfu s HIS 130 CO -0.02 -0.55 0.08 0.14 -0.00 0.00 0.00 174.74 174.39 2gfu s VAL 131 N 2.68 0.15 0.17 -0.90 -7.23 -1.22 -2.22 120.40 111.83 2gfu s VAL 131 Ca 0.25 -1.26 0.08 0.00 -1.81 0.00 0.00 61.98 59.24 2gfu s VAL 131 Cb -0.15 -1.08 -0.04 0.00 0.56 0.00 0.00 36.38 35.67 2gfu s VAL 131 CO 0.13 -0.69 -0.06 0.00 -0.31 0.00 0.00 175.10 174.17 2gfu s GLN 132 N -3.06 2.21 -0.24 4.82 -2.07 -1.01 -3.67 119.66 116.64 2gfu s GLN 132 Ca -0.01 -1.17 -0.02 0.00 -1.82 0.00 0.00 55.36 52.34 2gfu s GLN 132 Cb 0.02 -2.26 0.02 0.00 -1.09 0.00 0.00 33.01 29.70 2gfu s GLN 132 CO -0.07 0.45 -0.07 -0.06 -1.32 0.00 0.00 175.29 174.23 2gfu s PHE 133 N -1.66 3.03 -0.91 9.60 0.40 -0.05 -2.40 117.98 126.01 2gfu s PHE 133 Ca 0.26 -1.49 -0.15 0.00 -0.60 0.00 0.00 56.93 54.95 2gfu s PHE 133 Cb -0.09 -2.05 -0.10 0.00 0.51 0.00 0.00 43.02 41.29 2gfu s PHE 133 CO 0.16 -0.71 2.05 1.19 0.70 0.00 0.00 175.22 178.61 2gfu n PHE 134 N 4.68 1.82 0.00 0.36 3.72 -1.08 -2.53 117.46 124.43 2gfu n PHE 134 Ca -0.17 -2.00 0.00 0.00 -0.05 0.00 0.00 57.45 55.23 2gfu n PHE 134 Cb 0.48 -1.78 0.00 0.00 -0.94 0.00 0.00 39.48 37.23 2gfu n PHE 134 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 2gfu n ASP 135 N 5.96 0.00 -0.08 4.37 2.03 -1.26 -4.19 116.55 123.38 2gfu n ASP 135 Ca 0.49 0.00 -0.16 0.00 0.52 0.00 0.00 54.79 55.64 2gfu n ASP 135 Cb 0.29 0.00 -0.05 0.00 -0.72 0.00 0.00 41.12 40.64 2gfu n ASP 135 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 2gfu n ASP 136 N 0.00 1.39 -0.06 1.67 5.68 -1.26 -4.83 116.55 119.15 2gfu n ASP 136 Ca 0.00 0.24 -0.14 0.00 -0.50 0.00 0.00 54.79 54.39 2gfu n ASP 136 Cb 0.00 -0.56 -0.07 0.00 -1.14 0.00 0.00 41.12 39.35 2gfu n ASP 136 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 2gfu h SER 137 N -0.66 0.55 -3.37 -1.12 0.02 -1.98 -3.48 113.55 103.51 2gfu h SER 137 Ca -0.33 -0.54 -0.21 0.00 -0.84 0.00 0.00 61.79 59.87 2gfu h SER 137 Cb 1.19 -0.16 0.07 0.00 0.14 0.00 0.00 62.40 63.65 2gfu h SER 137 CO -0.20 0.98 0.15 -0.81 -1.14 0.00 0.00 176.83 175.81 2gfu n PRO 138 N -4.38 -0.33 -3.41 3.45 -0.04 -1.26 -5.13 135.00 123.90 2gfu n PRO 138 Ca -0.06 -1.10 -0.38 0.00 -0.04 0.00 0.00 63.50 61.92 2gfu n PRO 138 Cb 0.47 -0.55 -0.08 0.00 -0.04 0.00 0.00 33.50 33.30 2gfu n PRO 138 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 2gfu s THR 139 N -2.06 5.21 0.01 0.52 2.01 -1.05 -4.97 115.64 115.30 2gfu s THR 139 Ca 0.35 0.62 -0.11 0.00 0.31 0.00 0.00 61.69 62.86 2gfu s THR 139 Cb -0.01 -3.70 0.01 0.00 0.01 0.00 0.00 72.50 68.81 2gfu s THR 139 CO 0.24 0.23 0.23 -0.60 -0.69 0.00 0.00 174.62 174.03 2gfu s ARG 140 N 1.50 0.63 0.00 4.92 3.00 -1.26 -0.87 118.95 126.87 2gfu s ARG 140 Ca 0.17 -0.38 0.00 0.00 -1.00 0.00 0.00 55.73 54.52 2gfu s ARG 140 Cb -0.15 0.27 0.00 0.00 0.00 0.00 0.00 34.95 35.07 2gfu s ARG 140 CO 0.08 -0.17 0.00 0.41 0.00 0.00 0.00 175.30 175.62 2gfu n GLY 141 N 1.14 1.34 3.92 8.12 0.00 -1.24 -5.04 105.19 113.42 2gfu n GLY 141 Ca -0.21 -0.48 -0.26 0.00 0.00 0.00 0.00 46.02 45.07 2gfu n GLY 141 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2gfu s TRP 142 N -1.67 3.53 0.37 1.61 0.52 -1.26 -3.39 118.94 118.64 2gfu s TRP 142 Ca 0.00 0.67 0.04 0.00 0.02 0.00 0.00 56.10 56.84 2gfu s TRP 142 Cb 0.00 -2.22 -0.06 0.00 -1.15 0.00 0.00 33.47 30.04 2gfu s TRP 142 CO 0.00 -0.21 0.05 0.14 0.02 0.00 0.00 176.95 176.95 2gfu s VAL 143 N -2.64 1.36 -0.33 4.03 -7.23 -1.01 -4.86 120.40 109.73 2gfu s VAL 143 Ca 0.46 -2.00 -0.12 0.00 -1.81 0.00 0.00 61.98 58.50 2gfu s VAL 143 Cb -0.10 -2.77 -0.02 0.00 0.56 0.00 0.00 36.38 34.04 2gfu s VAL 143 CO 0.43 0.00 0.23 -0.44 -0.31 0.00 0.00 175.10 175.00 2gfu s SER 144 N -3.58 6.05 0.00 4.85 0.01 -1.26 -3.21 113.70 116.55 2gfu s SER 144 Ca 0.33 -0.33 0.13 0.00 1.31 0.00 0.00 55.95 57.39 2gfu s SER 144 Cb 0.08 -2.13 0.62 0.00 0.21 0.00 0.00 66.02 64.80 2gfu s SER 144 CO 0.15 -0.19 1.33 2.29 0.41 0.00 0.00 173.24 177.23 2gfu n LYS 145 N 5.09 0.15 0.15 12.44 2.85 0.12 -1.83 118.16 137.13 2gfu n LYS 145 Ca -0.13 0.19 0.13 0.00 -1.05 0.00 0.00 58.31 57.44 2gfu n LYS 145 Cb 0.50 -1.50 0.51 0.00 -0.65 0.00 0.00 35.03 33.89 2gfu n LYS 145 CO 0.00 0.00 0.00 0.07 -0.05 0.00 0.00 177.40 177.42 2gfu h ARG 146 N 0.00 0.00 -0.23 -1.58 0.11 -1.78 -2.77 114.38 108.12 2gfu h ARG 146 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2gfu h ARG 146 Cb 0.13 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.21 2gfu h ARG 146 CO 0.00 0.00 0.00 1.28 0.10 0.00 0.00 179.97 181.35 2gfu n LEU 147 N -2.35 3.25 -4.66 0.08 4.77 -0.76 -4.92 117.00 112.41 2gfu n LEU 147 Ca 0.02 -1.29 -0.38 0.00 -0.03 0.00 0.00 56.01 54.33 2gfu n LEU 147 Cb 0.26 -0.14 -0.08 0.00 -2.33 0.00 0.00 43.42 41.12 2gfu n LEU 147 CO 0.22 0.64 0.08 -0.76 -1.33 0.00 0.00 177.39 176.23 2gfu s LEU 148 N -1.68 4.13 0.19 2.23 1.02 -1.05 -1.50 118.68 122.03 2gfu s LEU 148 Ca 0.34 0.45 0.11 0.00 0.02 0.00 0.00 54.13 55.05 2gfu s LEU 148 Cb 0.21 -2.47 -0.04 0.00 0.02 0.00 0.00 46.19 43.91 2gfu s LEU 148 CO 0.31 -0.08 -0.19 -0.54 0.02 0.00 0.00 176.35 175.86 2gfu s LYS 149 N 1.41 1.70 0.52 1.70 1.02 0.07 -4.69 119.74 121.47 2gfu s LYS 149 Ca 0.18 -1.44 -0.17 0.00 0.02 0.00 0.00 55.97 54.56 2gfu s LYS 149 Cb -0.15 -1.95 -0.08 0.00 -0.52 0.00 0.00 37.83 35.14 2gfu s LYS 149 CO 0.08 0.41 1.00 -1.25 -0.92 0.00 0.00 175.35 174.67 2gfu s PRO 150 N -2.71 3.85 0.00 -1.68 0.04 -1.26 -0.41 135.00 132.83 2gfu s PRO 150 Ca 0.22 1.06 0.00 0.00 0.04 0.00 0.00 61.00 62.32 2gfu s PRO 150 Cb -0.08 -2.12 0.00 0.00 0.04 0.00 0.00 34.50 32.34 2gfu s PRO 150 CO 0.11 -0.36 0.00 2.48 0.04 0.00 0.00 177.00 179.28 2gfu n TYR 151 N -1.49 0.00 0.00 0.56 4.11 -0.83 -4.62 117.16 114.89 2gfu n TYR 151 Ca 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.97 2gfu n TYR 151 Cb 0.54 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.88 2gfu n TYR 151 CO 0.00 0.00 0.00 -2.37 -0.00 0.00 0.00 176.86 174.49 2gfu n THR 152 N 0.00 0.00 -4.62 -3.48 5.66 -1.26 -4.85 114.28 105.72 2gfu n THR 152 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 2gfu n THR 152 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 2gfu n THR 152 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2gfu n GLY 153 N 0.00 0.69 0.42 1.09 0.00 -1.26 -4.22 105.19 101.91 2gfu n GLY 153 Ca 0.00 -0.77 0.19 0.00 0.00 0.00 0.00 46.02 45.45 2gfu n GLY 153 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2gfu h SER 154 N 8.76 0.00 0.61 1.61 0.02 -1.85 -1.51 113.55 121.18 2gfu h SER 154 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2gfu h SER 154 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 2gfu h SER 154 CO 0.00 0.00 -0.24 2.29 -1.14 0.00 0.00 176.83 177.74 2gfu n LYS 155 N -3.22 0.21 -2.71 3.45 2.85 -1.26 -4.57 118.16 112.90 2gfu n LYS 155 Ca 0.11 -0.08 -0.30 0.00 -1.05 0.00 0.00 58.31 56.98 2gfu n LYS 155 Cb 0.97 -1.50 -0.02 0.00 -0.65 0.00 0.00 35.03 33.83 2gfu n LYS 155 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 2gfu s SER 156 N -2.85 6.47 0.30 -5.58 0.15 -0.57 -5.00 113.70 106.62 2gfu s SER 156 Ca 0.17 1.17 0.06 0.00 0.70 0.00 0.00 55.95 58.05 2gfu s SER 156 Cb 0.19 -2.34 0.46 0.00 -1.71 0.00 0.00 66.02 62.62 2gfu s SER 156 CO 0.58 -0.48 1.71 0.50 1.20 0.00 0.00 173.24 176.76 2gfu h LYS 157 N 0.97 0.27 0.00 5.44 3.64 -1.90 -1.37 116.57 123.62 2gfu h LYS 157 Ca -0.47 -0.12 0.00 0.00 -1.27 0.00 0.00 60.65 58.79 2gfu h LYS 157 Cb 1.19 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.00 2gfu h LYS 157 CO 0.63 0.62 0.00 -0.85 -2.27 0.00 0.00 179.45 177.58 2gfu n GLU 158 N -4.05 0.09 -0.14 1.90 0.00 -1.26 -3.06 120.64 114.12 2gfu n GLU 158 Ca -0.01 0.18 0.12 0.00 0.00 0.00 0.00 57.16 57.45 2gfu n GLU 158 Cb 0.46 -1.63 0.18 0.00 0.00 0.00 0.00 31.44 30.45 2gfu n GLU 158 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2gfu n ALA 159 N -1.61 2.43 -2.61 -1.84 0.00 -0.54 -2.80 120.51 113.54 2gfu n ALA 159 Ca 0.05 -0.91 -0.28 0.00 0.00 0.00 0.00 53.44 52.30 2gfu n ALA 159 Cb 0.30 -0.83 -0.10 0.00 0.00 0.00 0.00 19.45 18.82 2gfu n ALA 159 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 2gfu s GLN 160 N -1.58 1.96 0.07 0.00 1.03 -1.08 -4.73 119.66 115.31 2gfu s GLN 160 Ca 0.35 -2.16 -0.30 0.00 0.04 0.00 0.00 55.36 53.28 2gfu s GLN 160 Cb 0.22 -1.32 -0.09 0.00 0.03 0.00 0.00 33.01 31.85 2gfu s GLN 160 CO 0.30 -0.22 1.85 0.21 -2.54 0.00 0.00 175.29 174.89 2gfu s LYS 161 N -3.80 4.15 0.00 9.60 2.20 -1.26 -0.69 119.74 129.94 2gfu s LYS 161 Ca 0.26 2.53 0.00 0.00 -0.36 0.00 0.00 55.97 58.40 2gfu s LYS 161 Cb 0.06 -3.86 0.00 0.00 -1.51 0.00 0.00 37.83 32.53 2gfu s LYS 161 CO 0.13 -0.87 0.00 0.41 -0.36 0.00 0.00 175.35 174.65 2gfu n GLY 162 N 4.32 1.49 3.87 5.54 0.00 -1.26 -5.09 105.19 114.05 2gfu n GLY 162 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 2gfu n GLY 162 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2gfu s GLY 163 N -2.31 1.92 0.23 -0.02 0.00 0.13 -4.97 107.32 102.30 2gfu s GLY 163 Ca 0.00 -0.11 -0.07 0.00 0.00 0.00 0.00 44.72 44.55 2gfu s GLY 163 CO 0.00 0.11 1.88 0.84 0.00 0.00 0.00 173.10 175.93 2gfu h HIS 164 N 0.95 1.03 -0.64 1.90 2.76 -1.81 -3.12 115.15 116.23 2gfu h HIS 164 Ca -0.47 0.03 -0.15 0.00 -2.20 0.00 0.00 60.37 57.58 2gfu h HIS 164 Cb 1.19 -0.34 -0.09 0.00 1.55 0.00 0.00 27.41 29.71 2gfu h HIS 164 CO 0.62 0.59 0.18 1.97 -1.30 0.00 0.00 177.93 179.98 2gfu n PHE 165 N -4.56 2.17 -3.17 5.26 1.16 -1.12 -5.00 117.46 112.19 2gfu n PHE 165 Ca 0.11 -1.11 -0.24 0.00 -1.87 0.00 0.00 57.45 54.34 2gfu n PHE 165 Cb 0.10 -0.61 -0.00 0.00 -1.61 0.00 0.00 39.48 37.36 2gfu n PHE 165 CO 0.00 0.00 0.00 -0.47 -1.87 0.00 0.00 176.76 174.42 2gfu s TYR 166 N -2.96 3.43 0.00 2.97 5.04 -1.18 -4.82 117.35 119.83 2gfu s TYR 166 Ca 0.53 0.37 0.00 0.00 -2.44 0.00 0.00 57.07 55.53 2gfu s TYR 166 Cb 0.43 -2.07 0.00 0.00 0.35 0.00 0.00 41.96 40.67 2gfu s TYR 166 CO 0.13 -0.07 0.00 0.43 -1.34 0.00 0.00 175.55 174.70 2gfu n SER 167 N -1.93 0.00 -3.61 4.32 7.64 -1.26 -5.04 113.62 113.74 2gfu n SER 167 Ca -0.02 0.00 -0.29 0.00 1.01 0.00 0.00 58.87 59.57 2gfu n SER 167 Cb 0.56 0.00 -0.15 0.00 -1.01 0.00 0.00 64.21 63.61 2gfu n SER 167 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2gfu s ALA 168 N -2.00 0.83 0.01 -0.43 0.00 -1.26 -4.99 121.76 113.91 2gfu s ALA 168 Ca 0.00 -1.07 0.09 0.00 0.00 0.00 0.00 51.96 50.97 2gfu s ALA 168 Cb 0.00 -1.37 -0.02 0.00 0.00 0.00 0.00 23.12 21.72 2gfu s ALA 168 CO 0.00 -1.55 -0.26 0.21 0.00 0.00 0.00 175.76 174.16 2gfu s LYS 169 N 1.98 1.98 0.48 0.00 2.20 -1.26 -5.07 119.74 120.05 2gfu s LYS 169 Ca 0.07 -1.01 0.15 0.00 -0.36 0.00 0.00 55.97 54.82 2gfu s LYS 169 Cb -0.16 -2.02 1.13 0.00 -1.51 0.00 0.00 37.83 35.27 2gfu s LYS 169 CO -0.28 0.54 2.07 -1.00 -0.36 0.00 0.00 175.35 176.31 2gfu h PRO 170 N 5.17 0.22 -0.23 4.03 0.13 -1.99 -2.44 132.00 136.89 2gfu h PRO 170 Ca -0.45 -0.01 -0.14 0.00 -0.87 0.00 0.00 66.00 64.53 2gfu h PRO 170 Cb 1.13 -0.05 -0.01 0.00 0.13 0.00 0.00 31.00 32.20 2gfu h PRO 170 CO 0.46 0.15 -0.43 0.93 -0.23 0.00 0.00 178.00 178.87 2gfu h GLU 171 N 0.23 0.57 -0.22 0.86 4.39 -1.90 -1.72 114.58 116.78 2gfu h GLU 171 Ca 0.14 -0.30 -0.15 0.00 0.34 0.00 0.00 59.36 59.39 2gfu h GLU 171 Cb 0.26 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.91 2gfu h GLU 171 CO -0.03 0.89 -0.47 0.82 -1.16 0.00 0.00 179.01 179.06 2gfu h ILE 172 N 0.46 1.31 0.32 3.13 1.08 -1.69 -2.29 117.51 119.84 2gfu h ILE 172 Ca 0.03 -1.68 -0.02 0.00 -0.39 0.00 0.00 64.86 62.81 2gfu h ILE 172 Cb 0.94 1.65 0.00 0.00 -3.07 0.00 0.00 36.82 36.34 2gfu h ILE 172 CO 0.08 0.53 -0.16 -0.07 -0.69 0.00 0.00 178.15 177.84 2gfu h LEU 173 N 0.46 -0.37 -1.58 1.44 3.38 -1.36 -2.37 115.31 114.90 2gfu h LEU 173 Ca 0.03 -0.07 0.07 0.00 0.09 0.00 0.00 57.88 58.00 2gfu h LEU 173 Cb 1.00 0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.81 2gfu h LEU 173 CO 0.09 -0.15 0.39 -0.09 0.09 0.00 0.00 178.44 178.77 2gfu h ARG 174 N -0.57 0.48 -0.14 1.13 2.43 -1.31 0.11 114.38 116.52 2gfu h ARG 174 Ca -0.04 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.08 2gfu h ARG 174 Cb 0.42 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 29.86 2gfu h ARG 174 CO 0.07 0.32 0.00 0.00 -1.51 0.00 0.00 179.97 178.86 2gfu h ALA 175 N 1.69 0.18 -0.16 2.80 0.00 -1.42 0.10 119.26 122.46 2gfu h ALA 175 Ca 0.26 -0.18 -0.11 0.00 0.00 0.00 0.00 54.91 54.88 2gfu h ALA 175 Cb 0.37 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 2gfu h ALA 175 CO -0.07 -0.13 -0.36 0.52 0.00 0.00 0.00 179.25 179.21 2gfu h MET 176 N -0.02 0.34 -0.06 0.00 2.86 -0.77 0.03 114.93 117.31 2gfu h MET 176 Ca 0.04 -0.15 -0.15 0.00 -2.06 0.00 0.00 59.70 57.38 2gfu h MET 176 Cb 0.35 -0.01 0.01 0.00 0.06 0.00 0.00 31.60 32.01 2gfu h MET 176 CO 0.01 0.66 -0.55 1.96 1.06 0.00 0.00 176.91 180.04 2gfu h GLN 177 N 0.29 0.49 -0.10 1.72 4.20 -0.77 0.15 115.11 121.09 2gfu h GLN 177 Ca 0.03 -0.44 -0.03 0.00 0.06 0.00 0.00 58.65 58.28 2gfu h GLN 177 Cb 0.78 0.10 -0.00 0.00 0.30 0.00 0.00 27.48 28.66 2gfu h GLN 177 CO 0.06 1.08 -0.05 -0.09 -0.67 0.00 0.00 178.83 179.16 2gfu h ARG 178 N 0.05 0.21 -0.30 1.46 2.43 -0.88 -2.77 114.38 114.58 2gfu h ARG 178 Ca -0.05 -0.09 0.00 0.00 -0.81 0.00 0.00 59.98 59.03 2gfu h ARG 178 Cb 1.22 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.75 2gfu h ARG 178 CO 0.11 0.56 0.19 0.00 -1.51 0.00 0.00 179.97 179.33 2gfu h ALA 179 N 0.64 0.37 -0.46 2.80 0.00 -1.08 -2.88 119.26 118.65 2gfu h ALA 179 Ca 0.02 -0.02 0.07 0.00 0.00 0.00 0.00 54.91 54.98 2gfu h ALA 179 Cb 0.50 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.11 2gfu h ALA 179 CO 0.01 -0.16 0.11 0.22 0.00 0.00 0.00 179.25 179.44 2gfu h ASP 180 N 0.40 0.05 -0.44 0.00 3.58 -0.97 0.16 116.42 119.19 2gfu h ASP 180 Ca 0.11 0.07 -0.07 0.00 0.42 0.00 0.00 57.03 57.57 2gfu h ASP 180 Cb -0.04 0.09 -0.02 0.00 1.72 0.00 0.00 39.33 41.08 2gfu h ASP 180 CO -0.02 0.06 0.02 -0.08 -2.88 0.00 0.00 179.24 176.33 2gfu h GLU 181 N 0.25 0.77 0.00 0.28 4.57 -1.53 -2.14 114.58 116.78 2gfu h GLU 181 Ca 0.23 -0.24 -0.15 0.00 -1.18 0.00 0.00 59.36 58.02 2gfu h GLU 181 Cb 0.28 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.77 2gfu h GLU 181 CO -0.28 0.83 -0.73 0.00 -1.18 0.00 0.00 179.01 177.65 2gfu h ALA 182 N 0.91 0.70 0.07 2.92 0.00 -1.30 -2.64 119.26 119.92 2gfu h ALA 182 Ca 0.13 -0.66 -0.24 0.00 0.00 0.00 0.00 54.91 54.13 2gfu h ALA 182 Cb 0.47 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2gfu h ALA 182 CO 0.02 0.91 -1.13 1.37 0.00 0.00 0.00 179.25 180.43 2gfu h LEU 183 N 0.00 0.22 0.06 0.00 8.10 -0.74 -3.15 115.31 119.79 2gfu h LEU 183 Ca -0.01 -0.24 -0.32 0.00 0.11 0.00 0.00 57.88 57.42 2gfu h LEU 183 Cb 1.37 -0.07 -0.03 0.00 -0.44 0.00 0.00 40.66 41.48 2gfu h LEU 183 CO 0.09 1.19 -1.80 -0.55 -4.11 0.00 0.00 178.44 173.26 2gfu h ASN 184 N 0.04 0.19 0.00 0.17 -1.07 -1.47 -3.46 115.58 109.98 2gfu h ASN 184 Ca -0.07 -0.41 0.00 0.00 0.07 0.00 0.00 56.30 55.89 2gfu h ASN 184 Cb 1.88 -0.06 0.00 0.00 -2.07 0.00 0.00 38.32 38.06 2gfu h ASN 184 CO 0.17 1.37 0.00 0.29 0.07 0.00 0.00 177.43 179.32 2gfu n LYS 185 N -3.25 0.00 -4.10 4.14 5.02 -0.99 -5.09 118.16 113.90 2gfu n LYS 185 Ca -0.22 0.00 -0.13 0.00 -2.02 0.00 0.00 58.31 55.94 2gfu n LYS 185 Cb 1.05 0.00 -0.11 0.00 -0.02 0.00 0.00 35.03 35.95 2gfu n LYS 185 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2gfu s ASP 186 N -0.95 0.99 0.46 4.39 1.01 -1.25 -5.03 116.67 116.29 2gfu s ASP 186 Ca 0.00 -0.66 0.23 0.00 0.71 0.00 0.00 52.55 52.84 2gfu s ASP 186 Cb 0.00 0.04 1.25 0.00 1.01 0.00 0.00 42.92 45.22 2gfu s ASP 186 CO 0.00 -0.25 1.85 0.07 0.21 0.00 0.00 175.17 177.05 2gfu h LYS 187 N 4.14 0.24 -0.75 8.23 2.10 -1.83 -1.96 116.57 126.74 2gfu h LYS 187 Ca -0.36 -0.01 0.22 0.00 -2.00 0.00 0.00 60.65 58.49 2gfu h LYS 187 Cb 1.19 -0.05 -0.03 0.00 -0.90 0.00 0.00 32.23 32.44 2gfu h LYS 187 CO 0.46 0.16 0.64 0.97 -2.00 0.00 0.00 179.45 179.67 2gfu h ILE 188 N 0.25 0.42 -0.19 0.07 2.10 -1.95 0.23 117.51 118.45 2gfu h ILE 188 Ca 0.48 0.00 -0.21 0.00 1.08 0.00 0.00 64.86 66.22 2gfu h ILE 188 Cb 1.47 0.53 0.01 0.00 -1.09 0.00 0.00 36.82 37.73 2gfu h ILE 188 CO -0.13 0.00 -0.70 0.11 -1.08 0.00 0.00 178.15 176.35 2gfu h LYS 189 N 0.00 0.77 -0.03 2.19 6.56 -1.69 -2.02 116.57 122.35 2gfu h LYS 189 Ca 0.36 -0.58 -0.20 0.00 -1.06 0.00 0.00 60.65 59.17 2gfu h LYS 189 Cb 1.62 0.10 -0.01 0.00 -0.57 0.00 0.00 32.23 33.38 2gfu h LYS 189 CO -0.00 1.20 -0.81 0.07 -2.06 0.00 0.00 179.45 177.84 2gfu h ARG 190 N 0.55 0.33 0.00 3.15 -0.00 -1.26 -3.29 114.38 113.86 2gfu h ARG 190 Ca -0.03 -0.31 -0.04 0.00 -0.00 0.00 0.00 59.98 59.60 2gfu h ARG 190 Cb 1.31 0.08 -0.01 0.00 -0.00 0.00 0.00 29.97 31.36 2gfu h ARG 190 CO 0.14 0.98 -0.19 -0.07 -0.00 0.00 0.00 179.97 180.83 2gfu h LEU 191 N 0.21 0.00 -0.44 0.08 3.38 -1.12 -2.50 115.31 114.92 2gfu h LEU 191 Ca -0.04 0.00 0.03 0.00 0.09 0.00 0.00 57.88 57.95 2gfu h LEU 191 Cb 1.41 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.13 2gfu h LEU 191 CO 0.13 0.19 0.24 -0.08 0.09 0.00 0.00 178.44 179.02 2gfu h GLU 192 N 0.00 0.47 -0.48 1.13 4.81 -1.43 -3.05 114.58 116.02 2gfu h GLU 192 Ca -0.00 -0.03 -0.08 0.00 -0.13 0.00 0.00 59.36 59.12 2gfu h GLU 192 Cb 0.94 -0.11 -0.05 0.00 0.63 0.00 0.00 28.75 30.17 2gfu h GLU 192 CO 0.03 0.31 0.07 1.47 -0.73 0.00 0.00 179.01 180.16 2gfu n LEU 193 N -4.87 5.00 -4.56 1.64 -0.00 -1.22 -5.08 117.00 107.91 2gfu n LEU 193 Ca 0.02 -3.13 -0.43 0.00 -0.00 0.00 0.00 56.01 52.47 2gfu n LEU 193 Cb 0.09 -0.65 -0.01 0.00 -0.00 0.00 0.00 43.42 42.86 2gfu n LEU 193 CO 0.31 0.76 0.47 0.00 -0.00 0.00 0.00 177.39 178.92 2gfu n ALA 194 N -0.20 -0.46 -1.08 1.47 0.00 -0.94 -4.94 120.51 114.36 2gfu n ALA 194 Ca 0.30 0.32 -0.16 0.00 0.00 0.00 0.00 53.44 53.90 2gfu n ALA 194 Cb 1.13 -1.98 -0.10 0.00 0.00 0.00 0.00 19.45 18.50 2gfu n ALA 194 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 2gfu n VAL 195 N -0.14 2.97 -2.92 0.00 3.14 -1.26 -4.37 118.33 115.75 2gfu n VAL 195 Ca 0.10 -1.85 -0.30 0.00 -2.96 0.00 0.00 64.34 59.33 2gfu n VAL 195 Cb 0.35 -1.77 -0.03 0.00 -1.06 0.00 0.00 33.84 31.32 2gfu n VAL 195 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 2gfu n SER 196 N 1.73 5.04 -4.85 6.55 3.41 -1.26 -5.03 113.62 119.22 2gfu n SER 196 Ca 0.39 -3.67 -0.38 0.00 -0.26 0.00 0.00 58.87 54.96 2gfu n SER 196 Cb 0.74 -0.70 -0.06 0.00 -0.26 0.00 0.00 64.21 63.92 2gfu n SER 196 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 2gfu s ASP 197 N -2.95 6.66 0.05 4.04 -4.77 -1.26 -5.12 116.67 113.32 2gfu s ASP 197 Ca 0.46 0.79 -0.05 0.00 -3.30 0.00 0.00 52.55 50.45 2gfu s ASP 197 Cb 0.25 -2.19 -0.02 0.00 -1.09 0.00 0.00 42.92 39.87 2gfu s ASP 197 CO -0.12 0.35 0.07 -1.83 0.70 0.00 0.00 175.17 174.34 2gfu s GLU 198 N -1.03 0.65 -1.41 2.11 -1.05 -1.26 -5.07 118.70 111.64 2gfu s GLU 198 Ca 0.21 -0.97 -0.13 0.00 -0.15 0.00 0.00 54.97 53.93 2gfu s GLU 198 Cb -0.15 0.25 -0.02 0.00 -0.44 0.00 0.00 34.13 33.77 2gfu s GLU 198 CO 0.10 -0.16 2.40 -0.35 0.95 0.00 0.00 175.26 178.20 2gfu n PRO 199 N 0.34 2.91 -1.38 -4.83 -0.04 -1.26 -4.44 135.00 126.31 2gfu n PRO 199 Ca -0.16 -2.35 -0.01 0.00 -0.04 0.00 0.00 63.50 60.94 2gfu n PRO 199 Cb 0.60 -3.07 0.10 0.00 -0.04 0.00 0.00 33.50 31.10 2gfu n PRO 199 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2gfu n SER 200 N 5.43 2.12 0.00 3.54 2.88 -1.26 -5.39 113.62 120.94 2gfu n SER 200 Ca 0.59 -3.15 0.00 0.00 -1.33 0.00 0.00 58.87 54.98 2gfu n SER 200 Cb 0.33 -0.43 0.00 0.00 -0.75 0.00 0.00 64.21 63.37 2gfu n SER 200 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97