#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uap s PRO 25 N 0.00 1.85 -1.35 4.33 0.04 -1.26 -4.92 135.00 133.68 1uap s PRO 25 Ca 0.00 1.20 -0.07 0.00 0.04 0.00 0.00 61.00 62.17 1uap s PRO 25 Cb 0.00 -1.85 0.10 0.00 0.04 0.00 0.00 34.50 32.80 1uap s PRO 25 CO 0.00 -1.94 2.35 -0.40 0.04 0.00 0.00 177.00 177.05 1uap n ASP 26 N -3.73 7.48 -4.73 6.66 5.75 -1.26 -4.96 116.55 121.76 1uap n ASP 26 Ca 0.09 -3.07 -0.41 0.00 -0.01 0.00 0.00 54.79 51.39 1uap n ASP 26 Cb 0.53 -1.41 -0.04 0.00 -1.03 0.00 0.00 41.12 39.17 1uap n ASP 26 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1uap s ALA 27 N -0.41 3.25 1.17 2.12 0.00 -1.26 -5.05 121.76 121.58 1uap s ALA 27 Ca 0.53 0.59 -0.19 0.00 0.00 0.00 0.00 51.96 52.89 1uap s ALA 27 Cb 0.17 -3.28 0.27 0.00 0.00 0.00 0.00 23.12 20.28 1uap s ALA 27 CO -0.07 -0.03 1.13 -1.25 0.00 0.00 0.00 175.76 175.53 1uap s PRO 28 N -0.02 -0.99 0.56 0.00 0.04 -1.26 -4.98 135.00 128.35 1uap s PRO 28 Ca 0.47 -0.08 -0.20 0.00 0.04 0.00 0.00 61.00 61.23 1uap s PRO 28 Cb -0.24 -1.62 -0.06 0.00 0.04 0.00 0.00 34.50 32.62 1uap s PRO 28 CO 0.30 -3.55 0.99 2.41 0.04 0.00 0.00 177.00 177.19 1uap n THR 29 N -4.65 3.38 -2.74 1.26 -1.04 -1.26 -4.94 114.28 104.29 1uap n THR 29 Ca 0.13 -0.50 -0.43 0.00 -2.04 0.00 0.00 64.05 61.21 1uap n THR 29 Cb 0.59 -1.18 -0.03 0.00 -1.82 0.00 0.00 70.33 67.89 1uap n THR 29 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1uap s PRO 31 N 4.15 1.52 0.44 0.00 0.04 -1.26 -4.97 135.00 134.93 1uap s PRO 31 Ca 0.38 0.04 0.25 0.00 0.04 0.00 0.00 61.00 61.70 1uap s PRO 31 Cb -0.10 -1.91 0.80 0.00 0.04 0.00 0.00 34.50 33.34 1uap s PRO 31 CO 0.25 -1.89 1.77 0.87 0.04 0.00 0.00 177.00 178.05 1uap h LYS 32 N -1.27 0.00 -7.15 4.56 1.57 -2.03 -3.45 116.57 108.81 1uap h LYS 32 Ca -0.46 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 57.78 1uap h LYS 32 Cb 1.31 0.00 0.16 0.00 0.08 0.00 0.00 32.23 33.78 1uap h LYS 32 CO 0.59 0.18 0.43 -1.14 -0.57 0.00 0.00 179.45 178.95 1uap s GLN 33 N -3.49 2.27 -0.26 3.15 2.00 -1.26 -4.98 119.66 117.09 1uap s GLN 33 Ca 0.02 1.86 -0.03 0.00 -2.00 0.00 0.00 55.36 55.21 1uap s GLN 33 Cb 0.09 -1.84 0.09 0.00 0.80 0.00 0.00 33.01 32.15 1uap s GLN 33 CO 0.64 -1.76 0.10 0.00 -0.50 0.00 0.00 175.29 173.77 1uap s ARG 35 N 1.94 1.26 0.07 0.00 3.52 -1.26 -5.14 118.95 119.33 1uap s ARG 35 Ca 0.07 -1.64 0.08 0.00 -0.13 0.00 0.00 55.73 54.11 1uap s ARG 35 Cb -0.16 -0.37 -0.03 0.00 -1.56 0.00 0.00 34.95 32.83 1uap s ARG 35 CO -0.26 -0.16 -0.23 0.50 -0.81 0.00 0.00 175.30 174.34 1uap s ARG 36 N -3.93 1.43 0.25 5.12 3.52 -1.26 -5.04 118.95 119.04 1uap s ARG 36 Ca 0.29 -1.07 0.02 0.00 -0.13 0.00 0.00 55.73 54.83 1uap s ARG 36 Cb 0.06 -1.64 -0.04 0.00 -1.56 0.00 0.00 34.95 31.77 1uap s ARG 36 CO 0.08 0.41 0.15 0.95 -0.81 0.00 0.00 175.30 176.08 1uap s THR 37 N -0.90 0.16 0.00 4.11 -4.23 -1.26 -5.13 115.64 108.38 1uap s THR 37 Ca 0.09 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.60 1uap s THR 37 Cb -0.09 -2.52 0.00 0.00 1.34 0.00 0.00 72.50 71.22 1uap s THR 37 CO 0.03 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.72 1uap n GLY 38 N -0.42 0.07 3.52 3.99 0.00 -1.26 -4.93 105.19 106.16 1uap n GLY 38 Ca 0.02 -1.00 -0.24 0.00 0.00 0.00 0.00 46.02 44.80 1uap n GLY 38 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1uap s THR 39 N 0.00 1.37 0.14 2.61 -4.23 -1.26 -5.00 115.64 109.27 1uap s THR 39 Ca 0.00 -2.00 -0.15 0.00 -1.18 0.00 0.00 61.69 58.36 1uap s THR 39 Cb 0.00 -2.78 0.01 0.00 1.34 0.00 0.00 72.50 71.08 1uap s THR 39 CO 0.00 0.00 1.68 0.25 -0.54 0.00 0.00 174.62 176.01 1uap h LEU 40 N 1.94 0.64 -0.07 4.79 6.46 -1.99 -0.57 115.31 126.53 1uap h LEU 40 Ca -0.41 -0.19 -0.00 0.00 -0.12 0.00 0.00 57.88 57.15 1uap h LEU 40 Cb 1.25 -0.17 -0.00 0.00 -0.73 0.00 0.00 40.66 41.01 1uap h LEU 40 CO 0.72 0.66 0.03 1.56 -0.62 0.00 0.00 178.44 180.79 1uap h GLN 41 N 0.59 0.10 -0.47 1.25 4.20 -1.97 -0.13 115.11 118.68 1uap h GLN 41 Ca 0.15 -0.01 0.06 0.00 0.06 0.00 0.00 58.65 58.90 1uap h GLN 41 Cb 0.24 -0.02 -0.05 0.00 0.30 0.00 0.00 27.48 27.95 1uap h GLN 41 CO -0.01 0.19 0.19 0.77 -0.67 0.00 0.00 178.83 179.30 1uap h SER 42 N -0.02 0.22 -0.08 1.46 0.02 -1.92 -2.82 113.55 110.41 1uap h SER 42 Ca 0.02 0.05 -0.14 0.00 -0.84 0.00 0.00 61.79 60.88 1uap h SER 42 Cb 0.13 0.02 0.01 0.00 0.14 0.00 0.00 62.40 62.69 1uap h SER 42 CO -0.00 0.16 -0.49 0.78 -1.14 0.00 0.00 176.83 176.14 1uap h ASN 43 N 0.37 0.57 -0.69 3.07 2.35 -1.02 -2.83 115.58 117.41 1uap h ASN 43 Ca 0.22 -0.66 0.09 0.00 -0.55 0.00 0.00 56.30 55.40 1uap h ASN 43 Cb 0.20 -0.17 -0.07 0.00 0.05 0.00 0.00 38.32 38.33 1uap h ASN 43 CO -0.20 1.14 0.33 0.15 -1.65 0.00 0.00 177.43 177.20 1uap h PHE 44 N 0.03 0.60 0.00 1.19 3.04 -0.91 -0.14 116.94 120.75 1uap h PHE 44 Ca -0.04 0.03 -0.05 0.00 3.98 0.00 0.00 57.97 61.89 1uap h PHE 44 Cb 1.14 -0.17 -0.01 0.00 2.56 0.00 0.00 35.95 39.48 1uap h PHE 44 CO 0.12 0.21 -0.23 0.00 -2.02 0.00 0.00 178.31 176.40 1uap h ALA 46 N 1.77 0.04 -2.62 0.00 0.00 -0.83 -3.45 119.26 114.17 1uap h ALA 46 Ca -0.00 -0.51 -0.53 0.00 0.00 0.00 0.00 54.91 53.87 1uap h ALA 46 Cb 0.76 0.02 0.03 0.00 0.00 0.00 0.00 17.79 18.61 1uap h ALA 46 CO 0.03 0.19 0.69 -1.54 0.00 0.00 0.00 179.25 178.62 1uap s SER 47 N -6.49 6.85 0.12 0.00 1.04 -0.32 -4.93 113.70 109.97 1uap s SER 47 Ca -0.15 2.38 0.27 0.00 0.48 0.00 0.00 55.95 58.93 1uap s SER 47 Cb 0.02 -2.60 0.90 0.00 0.10 0.00 0.00 66.02 64.44 1uap s SER 47 CO 0.77 -0.60 1.77 -0.24 0.98 0.00 0.00 173.24 175.92 1uap n SER 48 N 3.24 0.50 -4.11 7.02 2.88 -0.69 -4.75 113.62 117.72 1uap n SER 48 Ca 0.09 0.46 -0.30 0.00 -1.33 0.00 0.00 58.87 57.79 1uap n SER 48 Cb 0.42 -0.55 -0.17 0.00 -0.75 0.00 0.00 64.21 63.17 1uap n SER 48 CO 0.00 0.00 0.00 -0.22 -1.23 0.00 0.00 175.04 173.59 1uap s LEU 49 N -3.88 1.90 -0.13 2.46 2.96 -0.70 -2.30 118.68 119.00 1uap s LEU 49 Ca 0.11 -0.51 -0.04 0.00 -0.22 0.00 0.00 54.13 53.47 1uap s LEU 49 Cb 0.15 -1.26 0.05 0.00 0.50 0.00 0.00 46.19 45.63 1uap s LEU 49 CO 0.59 0.04 0.11 -0.69 -1.32 0.00 0.00 176.35 175.08 1uap s VAL 50 N 0.92 -0.14 0.18 1.68 1.01 -0.14 -0.88 120.40 123.03 1uap s VAL 50 Ca -0.07 0.07 -0.08 0.00 0.00 0.00 0.00 61.98 61.90 1uap s VAL 50 Cb -0.15 -0.43 -0.01 0.00 0.00 0.00 0.00 36.38 35.79 1uap s VAL 50 CO -0.02 -0.09 0.30 0.68 0.00 0.00 0.00 175.10 175.97 1uap s VAL 51 N 2.19 0.05 0.09 2.92 -7.23 -0.71 -1.13 120.40 116.58 1uap s VAL 51 Ca 0.04 -1.48 0.09 0.00 -1.81 0.00 0.00 61.98 58.81 1uap s VAL 51 Cb -0.14 -2.00 -0.03 0.00 0.56 0.00 0.00 36.38 34.76 1uap s VAL 51 CO -0.07 -0.21 -0.22 0.42 -0.31 0.00 0.00 175.10 174.71 1uap s THR 52 N -4.00 1.80 0.29 5.32 -4.23 0.07 -0.73 115.64 114.16 1uap s THR 52 Ca 0.21 -1.51 -0.19 0.00 -1.18 0.00 0.00 61.69 59.02 1uap s THR 52 Cb 0.03 -1.62 0.02 0.00 1.34 0.00 0.00 72.50 72.28 1uap s THR 52 CO 0.03 0.02 0.70 0.00 -0.54 0.00 0.00 174.62 174.84 1uap s ALA 53 N -1.07 -1.04 -0.10 3.99 0.00 -0.43 -0.66 121.76 122.45 1uap s ALA 53 Ca 0.08 -0.43 0.03 0.00 0.00 0.00 0.00 51.96 51.63 1uap s ALA 53 Cb -0.10 0.85 0.01 0.00 0.00 0.00 0.00 23.12 23.88 1uap s ALA 53 CO 0.04 -1.01 -0.18 0.99 0.00 0.00 0.00 175.76 175.60 1uap s THR 54 N -3.72 1.63 -0.31 0.00 2.01 -1.26 -0.53 115.64 113.46 1uap s THR 54 Ca 0.13 -0.75 -0.29 0.00 0.31 0.00 0.00 61.69 61.09 1uap s THR 54 Cb -0.05 -1.45 -0.00 0.00 0.01 0.00 0.00 72.50 71.00 1uap s THR 54 CO 0.08 0.47 1.39 -0.69 -0.69 0.00 0.00 174.62 175.18 1uap s VAL 55 N 0.68 3.99 -0.02 3.82 1.01 -0.65 -3.63 120.40 125.60 1uap s VAL 55 Ca -0.13 1.09 -0.08 0.00 0.00 0.00 0.00 61.98 62.86 1uap s VAL 55 Cb -0.16 -4.08 -0.30 0.00 0.00 0.00 0.00 36.38 31.84 1uap s VAL 55 CO 0.03 -0.51 0.79 0.11 0.00 0.00 0.00 175.10 175.52 1uap h LYS 56 N 9.96 0.35 -3.63 2.72 1.79 -1.19 -0.30 116.57 126.28 1uap h LYS 56 Ca -0.28 -0.61 -0.06 0.00 -2.18 0.00 0.00 60.65 57.52 1uap h LYS 56 Cb 1.11 0.23 -0.11 0.00 -1.58 0.00 0.00 32.23 31.88 1uap h LYS 56 CO 1.04 1.25 -0.16 -1.12 -1.08 0.00 0.00 179.45 179.39 1uap s SER 57 N -7.20 -0.09 -0.08 0.86 0.01 -1.03 -4.81 113.70 101.36 1uap s SER 57 Ca -0.12 -0.74 -0.03 0.00 1.31 0.00 0.00 55.95 56.37 1uap s SER 57 Cb 0.06 0.51 0.04 0.00 0.21 0.00 0.00 66.02 66.85 1uap s SER 57 CO 0.87 -0.99 0.16 -0.04 0.41 0.00 0.00 173.24 173.64 1uap s MET 58 N -3.94 0.07 0.02 12.44 -1.94 -1.26 -0.34 119.30 124.35 1uap s MET 58 Ca 0.15 0.49 0.02 0.00 -1.71 0.00 0.00 55.69 54.64 1uap s MET 58 Cb 0.01 -0.22 -0.02 0.00 2.01 0.00 0.00 34.83 36.62 1uap s MET 58 CO 0.01 -0.24 -0.06 0.08 -0.01 0.00 0.00 175.02 174.79 1uap s VAL 59 N 1.78 0.43 0.65 -6.03 1.01 -0.32 -4.99 120.40 112.93 1uap s VAL 59 Ca -0.03 -0.72 -0.17 0.00 0.00 0.00 0.00 61.98 61.06 1uap s VAL 59 Cb -0.12 -0.46 -0.01 0.00 0.00 0.00 0.00 36.38 35.79 1uap s VAL 59 CO -0.06 -0.20 1.18 -0.13 0.00 0.00 0.00 175.10 175.89 1uap s ARG 60 N -1.00 2.70 0.26 2.72 3.00 -1.26 -0.25 118.95 125.12 1uap s ARG 60 Ca -0.06 1.70 0.01 0.00 0.00 0.00 0.00 55.73 57.39 1uap s ARG 60 Cb -0.07 -1.91 -0.05 0.00 0.00 0.00 0.00 34.95 32.92 1uap s ARG 60 CO 0.00 -1.39 0.09 -1.21 0.00 0.00 0.00 175.30 172.79 1uap s GLU 61 N -3.66 1.40 0.08 3.54 0.41 -0.67 -4.64 118.70 115.15 1uap s GLU 61 Ca 0.74 -1.76 -0.33 0.00 -0.41 0.00 0.00 54.97 53.22 1uap s GLU 61 Cb -0.28 -0.28 -0.17 0.00 -1.78 0.00 0.00 34.13 31.62 1uap s GLU 61 CO 0.38 -0.29 0.79 -2.30 -0.49 0.00 0.00 175.26 173.35 1uap n PRO 62 N -0.46 0.00 0.00 0.39 -0.02 -1.26 -2.62 135.00 131.02 1uap n PRO 62 Ca -0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1uap n PRO 62 Cb 0.66 -1.21 0.00 0.00 -0.02 0.00 0.00 33.50 32.94 1uap n PRO 62 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1uap n GLY 63 N 1.58 4.10 1.22 -1.23 0.00 -1.26 -1.29 105.19 108.32 1uap n GLY 63 Ca 0.18 0.06 -0.00 0.00 0.00 0.00 0.00 46.02 46.25 1uap n GLY 63 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1uap n GLU 64 N 13.98 2.42 -2.07 1.61 4.07 -1.26 -4.97 120.64 134.42 1uap n GLU 64 Ca 0.00 -1.37 -0.28 0.00 -0.06 0.00 0.00 57.16 55.45 1uap n GLU 64 Cb 0.00 -1.76 0.05 0.00 -0.06 0.00 0.00 31.44 29.68 1uap n GLU 64 CO 0.00 0.00 0.00 0.20 -0.06 0.00 0.00 177.13 177.27 1uap s GLY 65 N -0.25 1.62 -0.16 8.31 0.00 -0.41 0.02 107.32 116.44 1uap s GLY 65 Ca 0.24 -0.57 -0.14 0.00 0.00 0.00 0.00 44.72 44.25 1uap s GLY 65 CO 0.06 -0.20 0.43 -2.27 0.00 0.00 0.00 173.10 171.12 1uap s LEU 66 N -5.28 0.30 -0.16 0.66 1.98 0.06 -1.67 118.68 114.56 1uap s LEU 66 Ca 0.58 0.87 -0.04 0.00 -2.89 0.00 0.00 54.13 52.65 1uap s LEU 66 Cb -0.11 1.45 -0.03 0.00 0.66 0.00 0.00 46.19 48.17 1uap s LEU 66 CO 0.48 -0.16 -0.04 0.00 -1.89 0.00 0.00 176.35 174.75 1uap s ALA 67 N 0.40 2.96 -0.24 5.97 0.00 0.65 -0.27 121.76 131.24 1uap s ALA 67 Ca -0.01 -0.86 -0.09 0.00 0.00 0.00 0.00 51.96 50.99 1uap s ALA 67 Cb -0.04 -1.56 -0.04 0.00 0.00 0.00 0.00 23.12 21.48 1uap s ALA 67 CO -0.01 0.15 0.12 0.08 0.00 0.00 0.00 175.76 176.10 1uap s VAL 68 N 0.48 4.94 -0.20 0.00 1.01 -0.37 -1.17 120.40 125.09 1uap s VAL 68 Ca -0.04 0.04 -0.17 0.00 0.00 0.00 0.00 61.98 61.81 1uap s VAL 68 Cb -0.14 -3.30 -0.04 0.00 0.00 0.00 0.00 36.38 32.89 1uap s VAL 68 CO 0.03 0.34 0.44 -0.89 0.00 0.00 0.00 175.10 175.02 1uap s THR 69 N 1.26 5.17 0.43 3.92 2.01 0.53 -0.38 115.64 128.58 1uap s THR 69 Ca 0.06 0.79 0.04 0.00 0.31 0.00 0.00 61.69 62.89 1uap s THR 69 Cb -0.14 -3.77 -0.05 0.00 0.01 0.00 0.00 72.50 68.55 1uap s THR 69 CO 0.05 0.23 0.03 0.68 -0.69 0.00 0.00 174.62 174.93 1uap s VAL 70 N 1.38 1.35 -0.27 3.82 -7.23 -0.12 -0.61 120.40 118.73 1uap s VAL 70 Ca 0.21 -2.00 0.19 0.00 -1.81 0.00 0.00 61.98 58.57 1uap s VAL 70 Cb -0.15 -2.57 0.50 0.00 0.56 0.00 0.00 36.38 34.72 1uap s VAL 70 CO 0.09 0.00 1.12 -0.24 -0.31 0.00 0.00 175.10 175.76 1uap n SER 71 N -1.08 2.36 -3.37 4.85 2.88 -1.24 -2.47 113.62 115.56 1uap n SER 71 Ca -0.10 -2.45 -0.33 0.00 -1.33 0.00 0.00 58.87 54.66 1uap n SER 71 Cb 0.67 -0.45 0.03 0.00 -0.75 0.00 0.00 64.21 63.71 1uap n SER 71 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1uap n LEU 72 N -0.61 -2.10 0.20 2.46 4.77 -0.62 -3.42 117.00 117.68 1uap n LEU 72 Ca 0.16 -0.31 0.08 0.00 -0.03 0.00 0.00 56.01 55.91 1uap n LEU 72 Cb 0.84 -1.44 0.29 0.00 -2.33 0.00 0.00 43.42 40.78 1uap n LEU 72 CO 0.15 0.09 0.71 0.40 -1.33 0.00 0.00 177.39 177.41 1uap h ILE 73 N 1.46 0.52 -2.45 -0.08 1.08 -1.21 0.36 117.51 117.19 1uap h ILE 73 Ca -0.54 -1.41 0.06 0.00 -0.39 0.00 0.00 64.86 62.59 1uap h ILE 73 Cb 1.28 2.00 -0.15 0.00 -3.07 0.00 0.00 36.82 36.88 1uap h ILE 73 CO 0.23 0.25 0.40 -0.83 -0.69 0.00 0.00 178.15 177.52 1uap s GLY 74 N -4.32 -0.51 -0.01 5.37 0.00 -0.49 -4.83 107.32 102.54 1uap s GLY 74 Ca 0.03 0.92 -0.01 0.00 0.00 0.00 0.00 44.72 45.66 1uap s GLY 74 CO 0.67 0.35 0.02 0.00 0.00 0.00 0.00 173.10 174.14 1uap s ALA 75 N -3.12 -0.05 0.00 3.20 0.00 -1.26 -0.75 121.76 119.77 1uap s ALA 75 Ca 0.03 -0.00 0.00 0.00 0.00 0.00 0.00 51.96 51.99 1uap s ALA 75 Cb -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 23.12 23.09 1uap s ALA 75 CO -0.09 -0.03 0.00 0.66 0.00 0.00 0.00 175.76 176.30 1uap n TYR 76 N 2.87 0.00 -3.69 0.00 4.02 -0.28 -4.98 117.16 115.10 1uap n TYR 76 Ca -0.14 0.00 -0.11 0.00 -0.01 0.00 0.00 57.90 57.64 1uap n TYR 76 Cb 0.59 0.00 -0.12 0.00 -0.02 0.00 0.00 39.34 39.79 1uap n TYR 76 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 176.86 176.06 1uap s LYS 77 N -1.23 0.26 -0.39 -0.72 2.20 -0.58 -4.71 119.74 114.56 1uap s LYS 77 Ca 0.00 0.76 0.12 0.00 -0.36 0.00 0.00 55.97 56.49 1uap s LYS 77 Cb 0.00 0.02 0.36 0.00 -1.51 0.00 0.00 37.83 36.70 1uap s LYS 77 CO 0.00 -0.22 0.79 0.25 -0.36 0.00 0.00 175.35 175.81 1uap n THR 78 N 4.80 0.40 -0.18 3.43 -2.24 -1.26 -0.96 114.28 118.27 1uap n THR 78 Ca -0.16 -4.54 -0.06 0.00 -2.27 0.00 0.00 64.05 57.03 1uap n THR 78 Cb 0.52 -0.31 0.02 0.00 -2.10 0.00 0.00 70.33 68.46 1uap n THR 78 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1uap n GLY 79 N 0.16 2.86 0.00 3.38 0.00 -0.97 -3.87 105.19 106.75 1uap n GLY 79 Ca 0.24 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1uap n GLY 79 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uap n GLY 80 N 0.73 0.00 3.52 -0.02 0.00 -1.26 -4.95 105.19 103.21 1uap n GLY 80 Ca 0.11 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.87 1uap n GLY 80 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1uap s LEU 81 N -0.53 2.80 -0.88 0.99 1.43 -1.25 -4.45 118.68 116.78 1uap s LEU 81 Ca 0.00 -0.70 -0.25 0.00 -1.03 0.00 0.00 54.13 52.15 1uap s LEU 81 Cb 0.00 -1.47 0.03 0.00 0.03 0.00 0.00 46.19 44.78 1uap s LEU 81 CO 0.00 0.10 1.44 1.51 0.23 0.00 0.00 176.35 179.63 1uap s ASP 82 N -2.88 6.20 0.20 2.29 -4.77 -1.26 -4.95 116.67 111.50 1uap s ASP 82 Ca 0.24 -0.91 -0.31 0.00 -3.30 0.00 0.00 52.55 48.27 1uap s ASP 82 Cb -0.08 -2.56 -0.10 0.00 -1.09 0.00 0.00 42.92 39.08 1uap s ASP 82 CO 0.14 -1.77 1.54 -0.76 0.70 0.00 0.00 175.17 175.02 1uap s LEU 83 N 5.87 4.37 0.00 2.11 1.43 -1.26 -4.99 118.68 126.21 1uap s LEU 83 Ca 0.45 2.66 -0.17 0.00 -1.03 0.00 0.00 54.13 56.04 1uap s LEU 83 Cb -0.04 -3.60 0.24 0.00 0.03 0.00 0.00 46.19 42.81 1uap s LEU 83 CO 0.02 -0.81 1.07 -0.81 0.23 0.00 0.00 176.35 176.05 1uap n PRO 84 N 3.45 -2.06 0.20 1.29 -0.04 -1.26 -4.98 135.00 131.60 1uap n PRO 84 Ca 0.12 -1.68 -0.17 0.00 -0.04 0.00 0.00 63.50 61.73 1uap n PRO 84 Cb 0.39 -1.34 -0.09 0.00 -0.04 0.00 0.00 33.50 32.42 1uap n PRO 84 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1uap h SER 85 N -2.06 -1.36 -2.52 3.54 0.87 -2.07 -3.38 113.55 106.57 1uap h SER 85 Ca -0.37 0.13 -0.56 0.00 -1.23 0.00 0.00 61.79 59.76 1uap h SER 85 Cb 1.08 0.48 -0.01 0.00 -0.44 0.00 0.00 62.40 63.51 1uap h SER 85 CO 0.25 -0.58 1.21 -2.16 -0.53 0.00 0.00 176.83 175.02 1uap s PRO 86 N -5.87 3.82 0.00 2.24 0.04 -1.26 -5.00 135.00 128.96 1uap s PRO 86 Ca -0.17 2.01 0.00 0.00 0.04 0.00 0.00 61.00 62.88 1uap s PRO 86 Cb 0.06 -4.11 0.00 0.00 0.04 0.00 0.00 34.50 30.49 1uap s PRO 86 CO 0.62 -1.29 0.00 -0.35 0.04 0.00 0.00 177.00 176.02 1uap n PRO 87 N 7.73 2.41 -1.09 0.56 -0.04 -1.26 -4.79 135.00 138.52 1uap n PRO 87 Ca 0.21 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 63.24 1uap n PRO 87 Cb 0.44 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.84 1uap n PRO 87 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 1uap n THR 88 N -0.02 0.00 0.00 0.52 -1.04 -1.26 -3.48 114.28 108.99 1uap n THR 88 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1uap n THR 88 Cb 0.00 -0.21 0.00 0.00 -1.82 0.00 0.00 70.33 68.30 1uap n THR 88 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1uap n GLY 89 N 2.02 1.57 3.79 3.41 0.00 0.12 -4.97 105.19 111.13 1uap n GLY 89 Ca 0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 1uap n GLY 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uap s ALA 90 N -1.28 2.81 0.23 4.61 0.00 -1.23 -4.36 121.76 122.54 1uap s ALA 90 Ca 0.00 0.61 -0.18 0.00 0.00 0.00 0.00 51.96 52.39 1uap s ALA 90 Cb 0.00 -3.27 -0.08 0.00 0.00 0.00 0.00 23.12 19.77 1uap s ALA 90 CO 0.00 -0.49 0.72 -1.54 0.00 0.00 0.00 175.76 174.45 1uap s SER 91 N -2.08 6.99 0.15 0.00 1.04 -1.26 -1.59 113.70 116.95 1uap s SER 91 Ca 0.68 1.37 -0.08 0.00 0.48 0.00 0.00 55.95 58.40 1uap s SER 91 Cb -0.18 -2.40 -0.01 0.00 0.10 0.00 0.00 66.02 63.53 1uap s SER 91 CO 0.24 -0.01 0.25 -0.76 0.98 0.00 0.00 173.24 173.95 1uap s LEU 92 N -2.15 1.11 -0.25 2.42 1.43 -1.03 -4.97 118.68 115.23 1uap s LEU 92 Ca 0.45 -0.85 0.00 0.00 -1.03 0.00 0.00 54.13 52.70 1uap s LEU 92 Cb -0.15 1.10 0.04 0.00 0.03 0.00 0.00 46.19 47.21 1uap s LEU 92 CO 0.20 -0.85 -0.09 -0.54 0.23 0.00 0.00 176.35 175.30 1uap s LYS 93 N -3.95 2.59 -0.27 1.70 1.02 -1.26 -0.94 119.74 118.62 1uap s LYS 93 Ca 0.15 -1.13 -0.21 0.00 0.02 0.00 0.00 55.97 54.81 1uap s LYS 93 Cb 0.04 -2.91 -0.01 0.00 -0.52 0.00 0.00 37.83 34.43 1uap s LYS 93 CO -0.02 -0.46 0.66 -0.06 -0.92 0.00 0.00 175.35 174.55 1uap s PHE 94 N 1.23 3.26 -0.37 3.18 0.40 0.48 -4.26 117.98 121.90 1uap s PHE 94 Ca -0.03 0.78 -0.29 0.00 -0.60 0.00 0.00 56.93 56.79 1uap s PHE 94 Cb -0.18 -2.92 0.02 0.00 0.51 0.00 0.00 43.02 40.45 1uap s PHE 94 CO -0.06 -0.39 1.11 -0.47 0.70 0.00 0.00 175.22 176.12 1uap s TYR 95 N 2.59 3.00 -0.30 0.36 5.04 -0.40 -1.24 117.35 126.40 1uap s TYR 95 Ca 0.27 1.01 -0.07 0.00 -2.44 0.00 0.00 57.07 55.84 1uap s TYR 95 Cb -0.15 -3.97 0.01 0.00 0.35 0.00 0.00 41.96 38.20 1uap s TYR 95 CO 0.09 -1.00 0.09 0.08 -1.34 0.00 0.00 175.55 173.48 1uap s VAL 96 N 3.99 4.00 -1.56 3.14 1.01 0.63 0.02 120.40 131.62 1uap s VAL 96 Ca 0.47 -0.73 0.15 0.00 0.00 0.00 0.00 61.98 61.87 1uap s VAL 96 Cb -0.11 -3.09 0.30 0.00 0.00 0.00 0.00 36.38 33.49 1uap s VAL 96 CO 0.22 0.04 1.40 -0.81 0.00 0.00 0.00 175.10 175.95 1uap n PRO 97 N 4.87 0.27 -3.67 2.72 -0.04 -1.26 -0.76 135.00 137.13 1uap n PRO 97 Ca -0.14 0.11 -0.25 0.00 -0.04 0.00 0.00 63.50 63.18 1uap n PRO 97 Cb 0.48 -1.50 -0.17 0.00 -0.04 0.00 0.00 33.50 32.26 1uap n PRO 97 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1uap n LYS 99 N 5.22 0.18 -0.06 0.00 2.85 0.10 -3.50 118.16 122.95 1uap n LYS 99 Ca -0.07 0.11 -0.05 0.00 -1.05 0.00 0.00 58.31 57.26 1uap n LYS 99 Cb 0.49 -1.50 -0.04 0.00 -0.65 0.00 0.00 35.03 33.33 1uap n LYS 99 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 177.40 179.31 1uap h GLN 100 N 0.00 0.00 -3.47 -1.58 4.20 -1.95 -3.50 115.11 108.81 1uap h GLN 100 Ca 0.00 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.65 1uap h GLN 100 Cb 0.27 0.00 -0.13 0.00 0.30 0.00 0.00 27.48 27.92 1uap h GLN 100 CO 0.00 0.29 -0.12 0.00 -0.67 0.00 0.00 178.83 178.33 1uap s PRO 102 N -3.82 1.39 0.37 0.00 0.04 -1.26 -4.54 135.00 127.17 1uap s PRO 102 Ca 0.04 1.28 -0.28 0.00 0.04 0.00 0.00 61.00 62.08 1uap s PRO 102 Cb 0.02 -1.79 -0.11 0.00 0.04 0.00 0.00 34.50 32.66 1uap s PRO 102 CO -0.11 -2.28 1.48 -0.35 0.04 0.00 0.00 177.00 175.77 1uap n PRO 103 N -3.97 2.63 -3.68 0.56 -0.04 -1.26 -5.03 135.00 124.22 1uap n PRO 103 Ca 0.10 0.92 -0.14 0.00 -0.04 0.00 0.00 63.50 64.34 1uap n PRO 103 Cb 0.53 -2.64 -0.07 0.00 -0.04 0.00 0.00 33.50 31.27 1uap n PRO 103 CO 0.00 0.00 0.00 1.41 -0.04 0.00 0.00 175.50 176.87 1uap s MET 104 N -2.01 0.82 0.01 0.54 1.75 -1.26 -4.82 119.30 114.33 1uap s MET 104 Ca 0.54 -0.11 -0.07 0.00 -1.25 0.00 0.00 55.69 54.80 1uap s MET 104 Cb -0.48 0.37 -0.00 0.00 2.84 0.00 0.00 34.83 37.56 1uap s MET 104 CO 0.63 -0.25 0.12 0.15 -0.65 0.00 0.00 175.02 175.03 1uap s LYS 105 N -1.53 0.50 0.22 4.11 -0.14 -1.26 -5.15 119.74 116.49 1uap s LYS 105 Ca -0.11 -0.47 -0.30 0.00 -1.36 0.00 0.00 55.97 53.73 1uap s LYS 105 Cb -0.03 0.20 -0.08 0.00 -1.68 0.00 0.00 37.83 36.24 1uap s LYS 105 CO 0.04 -0.12 0.97 0.21 -0.76 0.00 0.00 175.35 175.70 1uap s LYS 106 N -1.60 4.79 -0.76 1.68 2.20 -1.26 -4.00 119.74 120.80 1uap s LYS 106 Ca -0.13 1.53 -0.03 0.00 -0.36 0.00 0.00 55.97 56.98 1uap s LYS 106 Cb -0.07 -3.29 0.00 0.00 -1.51 0.00 0.00 37.83 32.97 1uap s LYS 106 CO 0.00 0.40 0.65 0.41 -0.36 0.00 0.00 175.35 176.45 1uap n GLY 107 N 1.64 0.03 3.10 5.54 0.00 -0.12 -5.00 105.19 110.39 1uap n GLY 107 Ca -0.01 -0.13 -0.09 0.00 0.00 0.00 0.00 46.02 45.79 1uap n GLY 107 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1uap s VAL 108 N -3.20 0.15 -0.20 1.61 1.01 -1.26 -4.95 120.40 113.58 1uap s VAL 108 Ca 0.20 -1.27 -0.08 0.00 0.00 0.00 0.00 61.98 60.84 1uap s VAL 108 Cb -0.09 -1.02 -0.04 0.00 0.00 0.00 0.00 36.38 35.23 1uap s VAL 108 CO 0.43 -0.70 0.08 -0.44 0.00 0.00 0.00 175.10 174.47 1uap s SER 109 N -2.32 5.73 0.36 3.32 0.01 -1.26 -1.64 113.70 117.90 1uap s SER 109 Ca -0.02 0.08 0.04 0.00 1.31 0.00 0.00 55.95 57.36 1uap s SER 109 Cb 0.01 -2.00 -0.06 0.00 0.21 0.00 0.00 66.02 64.18 1uap s SER 109 CO -0.06 0.15 0.05 -0.31 0.41 0.00 0.00 173.24 173.48 1uap s TYR 110 N 0.54 2.04 -0.15 2.43 1.51 0.31 -1.27 117.35 122.76 1uap s TYR 110 Ca 0.04 -0.94 0.02 0.00 -1.01 0.00 0.00 57.07 55.18 1uap s TYR 110 Cb -0.13 -1.38 0.01 0.00 -0.11 0.00 0.00 41.96 40.36 1uap s TYR 110 CO 0.01 0.06 -0.21 -1.17 -1.11 0.00 0.00 175.55 173.13 1uap s LEU 111 N -3.56 2.08 -0.24 -1.29 1.98 0.15 -1.32 118.68 116.48 1uap s LEU 111 Ca 0.33 -0.60 0.01 0.00 -2.89 0.00 0.00 54.13 50.98 1uap s LEU 111 Cb 0.08 -1.42 0.04 0.00 0.66 0.00 0.00 46.19 45.55 1uap s LEU 111 CO 0.15 0.05 -0.11 -0.76 -1.89 0.00 0.00 176.35 173.79 1uap s LEU 112 N 0.96 3.07 -0.26 -0.68 2.01 0.09 -2.65 118.68 121.23 1uap s LEU 112 Ca -0.04 -1.05 -0.00 0.00 0.01 0.00 0.00 54.13 53.05 1uap s LEU 112 Cb -0.15 -1.57 0.04 0.00 0.01 0.00 0.00 46.19 44.52 1uap s LEU 112 CO -0.05 -0.13 -0.07 -0.04 1.01 0.00 0.00 176.35 177.07 1uap s MET 113 N 1.22 2.60 0.00 1.70 -1.94 -0.72 -1.74 119.30 120.42 1uap s MET 113 Ca -0.03 -1.13 0.00 0.00 -1.71 0.00 0.00 55.69 52.83 1uap s MET 113 Cb -0.17 -2.96 0.00 0.00 2.01 0.00 0.00 34.83 33.71 1uap s MET 113 CO -0.07 -0.47 0.00 0.41 -0.01 0.00 0.00 175.02 174.88 1uap n GLY 114 N 4.59 4.25 3.18 -0.03 0.00 -0.06 -1.82 105.19 115.30 1uap n GLY 114 Ca -0.16 -0.46 -0.25 0.00 0.00 0.00 0.00 46.02 45.16 1uap n GLY 114 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1uap n GLN 115 N 0.00 0.66 -4.09 1.61 1.13 -0.57 -1.70 117.38 114.42 1uap n GLN 115 Ca 0.00 -3.26 -0.14 0.00 -1.94 0.00 0.00 57.00 51.66 1uap n GLN 115 Cb 0.00 1.58 -0.12 0.00 0.11 0.00 0.00 30.24 31.81 1uap n GLN 115 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 1uap s VAL 116 N -2.92 0.50 -0.20 5.09 1.01 -1.26 -1.92 120.40 120.70 1uap s VAL 116 Ca 0.15 -0.84 0.01 0.00 0.00 0.00 0.00 61.98 61.30 1uap s VAL 116 Cb 0.01 -0.54 0.05 0.00 0.00 0.00 0.00 36.38 35.90 1uap s VAL 116 CO 0.11 -0.24 -0.08 -1.61 0.00 0.00 0.00 175.10 173.27 1uap s GLU 117 N -1.17 1.82 -1.50 2.72 2.02 -0.47 -4.86 118.70 117.26 1uap s GLU 117 Ca -0.07 -0.81 -0.11 0.00 0.02 0.00 0.00 54.97 54.00 1uap s GLU 117 Cb -0.08 -2.38 -0.05 0.00 0.10 0.00 0.00 34.13 31.73 1uap s GLU 117 CO 0.00 -0.47 2.64 -1.91 0.02 0.00 0.00 175.26 175.55 1uap n GLU 118 N 4.72 3.26 0.00 1.61 2.13 -1.26 -1.10 120.64 129.99 1uap n GLU 118 Ca -0.13 -2.27 0.00 0.00 0.66 0.00 0.00 57.16 55.42 1uap n GLU 118 Cb 0.46 -2.94 0.00 0.00 0.27 0.00 0.00 31.44 29.23 1uap n GLU 118 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 1uap n ASN 119 N 4.56 0.00 0.00 4.31 2.85 -1.26 -4.98 115.26 120.74 1uap n ASN 119 Ca 0.67 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 55.14 1uap n ASN 119 Cb 0.28 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.30 1uap n ASN 119 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 1uap n ARG 120 N -0.05 1.77 0.00 1.20 3.00 -0.88 -5.16 116.66 116.55 1uap n ARG 120 Ca 0.00 -0.05 0.00 0.00 -0.01 0.00 0.00 57.85 57.79 1uap n ARG 120 Cb 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 32.46 32.15 1uap n ARG 120 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1uap n GLY 121 N 0.27 -1.81 3.73 -0.13 0.00 -0.26 -4.96 105.19 102.03 1uap n GLY 121 Ca 0.00 -1.98 -0.41 0.00 0.00 0.00 0.00 46.02 43.62 1uap n GLY 121 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1uap s PRO 122 N 0.00 4.42 -0.07 1.61 0.04 -1.26 -1.37 135.00 138.37 1uap s PRO 122 Ca 0.00 1.98 0.05 0.00 0.04 0.00 0.00 61.00 63.07 1uap s PRO 122 Cb 0.00 -3.22 -0.01 0.00 0.04 0.00 0.00 34.50 31.31 1uap s PRO 122 CO 0.00 -0.22 -0.23 0.54 0.04 0.00 0.00 177.00 177.13 1uap s VAL 123 N 0.22 2.25 -0.68 -0.36 0.11 -0.81 -1.27 120.40 119.86 1uap s VAL 123 Ca 0.56 -0.99 0.05 0.00 -2.93 0.00 0.00 61.98 58.68 1uap s VAL 123 Cb -0.35 -1.84 0.20 0.00 -1.53 0.00 0.00 36.38 32.86 1uap s VAL 123 CO 0.36 0.57 0.60 -0.11 -3.33 0.00 0.00 175.10 173.19 1uap n LEU 124 N 2.99 3.34 -4.56 2.54 -0.00 0.10 -1.51 117.00 119.90 1uap n LEU 124 Ca -0.18 -5.31 -0.29 0.00 -0.00 0.00 0.00 56.01 50.24 1uap n LEU 124 Cb 0.52 -0.73 0.23 0.00 -0.00 0.00 0.00 43.42 43.44 1uap n LEU 124 CO 0.26 1.88 0.58 -2.16 -0.00 0.00 0.00 177.39 177.94 1uap s PRO 125 N -1.88 -0.77 0.34 1.96 0.04 -1.26 -4.26 135.00 129.17 1uap s PRO 125 Ca 0.31 0.39 0.05 0.00 0.04 0.00 0.00 61.00 61.78 1uap s PRO 125 Cb 0.03 -1.61 0.62 0.00 0.04 0.00 0.00 34.50 33.58 1uap s PRO 125 CO -0.11 -3.51 1.88 -1.00 0.04 0.00 0.00 177.00 174.30 1uap h PRO 126 N -2.45 0.51 -0.94 0.56 0.13 -1.94 -2.78 132.00 125.10 1uap h PRO 126 Ca -0.53 -0.11 -0.05 0.00 -0.87 0.00 0.00 66.00 64.44 1uap h PRO 126 Cb 1.33 -0.08 -0.03 0.00 0.13 0.00 0.00 31.00 32.35 1uap h PRO 126 CO 0.47 0.54 0.06 0.39 -0.23 0.00 0.00 178.00 179.23 1uap n GLU 127 N -4.29 1.69 -3.08 0.86 -0.58 -1.26 -4.70 120.64 109.28 1uap n GLU 127 Ca 0.01 -0.75 -0.35 0.00 -0.42 0.00 0.00 57.16 55.66 1uap n GLU 127 Cb 0.24 -1.53 -0.06 0.00 -0.57 0.00 0.00 31.44 29.52 1uap n GLU 127 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 1uap s SER 128 N 0.06 6.96 -0.37 1.62 0.01 -1.05 -5.01 113.70 115.91 1uap s SER 128 Ca 0.13 1.40 -0.20 0.00 1.31 0.00 0.00 55.95 58.59 1uap s SER 128 Cb 0.11 -2.42 0.01 0.00 0.21 0.00 0.00 66.02 63.93 1uap s SER 128 CO 0.03 -0.09 0.63 0.12 0.41 0.00 0.00 173.24 174.35 1uap s PHE 129 N -1.74 3.13 -0.16 2.43 5.36 -0.75 -4.95 117.98 121.30 1uap s PHE 129 Ca 0.49 0.25 -0.01 0.00 -0.96 0.00 0.00 56.93 56.70 1uap s PHE 129 Cb -0.14 -3.17 0.05 0.00 -0.34 0.00 0.00 43.02 39.42 1uap s PHE 129 CO 0.19 -0.67 -0.01 0.08 -1.46 0.00 0.00 175.22 173.35 1uap s VAL 130 N 2.71 0.77 0.16 3.12 1.01 -1.26 -1.76 120.40 125.15 1uap s VAL 130 Ca 0.24 -0.49 -0.07 0.00 0.00 0.00 0.00 61.98 61.65 1uap s VAL 130 Cb -0.14 -1.07 -0.02 0.00 0.00 0.00 0.00 36.38 35.14 1uap s VAL 130 CO 0.16 0.01 0.24 0.68 0.00 0.00 0.00 175.10 176.19 1uap s VAL 131 N 1.77 0.07 0.54 2.92 -7.23 -1.08 -4.71 120.40 112.68 1uap s VAL 131 Ca 0.01 -1.52 -0.21 0.00 -1.81 0.00 0.00 61.98 58.45 1uap s VAL 131 Cb -0.16 -1.92 -0.05 0.00 0.56 0.00 0.00 36.38 34.82 1uap s VAL 131 CO -0.07 -0.31 1.24 -0.76 -0.31 0.00 0.00 175.10 174.89 1uap s LEU 132 N -2.99 3.83 0.56 1.32 1.02 -1.26 -0.67 118.68 120.47 1uap s LEU 132 Ca 0.20 2.49 -0.20 0.00 0.02 0.00 0.00 54.13 56.64 1uap s LEU 132 Cb 0.04 -4.39 -0.05 0.00 0.02 0.00 0.00 46.19 41.81 1uap s LEU 132 CO 0.01 -1.39 1.17 -2.28 0.02 0.00 0.00 176.35 173.88 1uap s HIS 133 N -1.48 2.56 0.02 0.29 2.46 -0.39 -4.62 115.29 114.12 1uap s HIS 133 Ca 0.71 1.53 -0.15 0.00 0.47 0.00 0.00 55.06 57.63 1uap s HIS 133 Cb -0.33 -3.39 0.02 0.00 -0.13 0.00 0.00 32.58 28.75 1uap s HIS 133 CO 0.38 -1.86 0.31 1.03 -2.47 0.00 0.00 174.74 172.13 1uap s ARG 134 N -3.24 0.75 0.21 2.88 1.81 -1.26 -4.97 118.95 115.13 1uap s ARG 134 Ca 0.74 -0.35 -0.02 0.00 -1.72 0.00 0.00 55.73 54.38 1uap s ARG 134 Cb -0.27 0.33 0.18 0.00 -0.45 0.00 0.00 34.95 34.74 1uap s ARG 134 CO 0.30 -0.23 1.57 -1.00 -0.68 0.00 0.00 175.30 175.26 1uap h PRO 135 N 3.51 0.56 -0.05 3.54 0.13 -1.98 -1.20 132.00 136.50 1uap h PRO 135 Ca -0.31 -0.30 -0.00 0.00 -0.87 0.00 0.00 66.00 64.52 1uap h PRO 135 Cb 1.19 0.02 -0.00 0.00 0.13 0.00 0.00 31.00 32.33 1uap h PRO 135 CO 0.43 0.90 0.03 -0.97 -0.23 0.00 0.00 178.00 178.15 1uap h ASN 136 N 0.45 0.06 0.07 1.44 -1.24 -2.00 -1.33 115.58 113.04 1uap h ASN 136 Ca 0.03 -0.09 0.02 0.00 0.71 0.00 0.00 56.30 56.98 1uap h ASN 136 Cb 0.96 -0.02 -0.04 0.00 0.73 0.00 0.00 38.32 39.96 1uap h ASN 136 CO 0.09 0.13 -0.26 1.56 -1.29 0.00 0.00 177.43 177.66 1uap h GLN 137 N -0.01 -0.42 -0.63 6.67 4.20 -1.96 -2.58 115.11 120.38 1uap h GLN 137 Ca 0.02 0.03 0.10 0.00 0.06 0.00 0.00 58.65 58.86 1uap h GLN 137 Cb 0.08 0.10 -0.12 0.00 0.30 0.00 0.00 27.48 27.84 1uap h GLN 137 CO -0.00 -0.28 -0.38 0.22 -0.67 0.00 0.00 178.83 177.72 1uap h ASP 138 N -0.44 -1.31 -0.70 1.46 3.58 -1.04 -0.66 116.42 117.31 1uap h ASP 138 Ca 0.04 0.24 0.07 0.00 0.42 0.00 0.00 57.03 57.80 1uap h ASP 138 Cb 0.49 0.63 -0.06 0.00 1.72 0.00 0.00 39.33 42.11 1uap h ASP 138 CO -0.18 -0.31 0.39 -0.61 -2.88 0.00 0.00 179.24 175.65 1uap h GLN 139 N -0.17 0.68 -0.60 0.28 5.75 -1.10 -2.17 115.11 117.79 1uap h GLN 139 Ca 0.22 -0.04 -0.10 0.00 -0.15 0.00 0.00 58.65 58.58 1uap h GLN 139 Cb 0.56 -0.15 -0.02 0.00 1.07 0.00 0.00 27.48 28.93 1uap h GLN 139 CO -0.72 0.45 -0.01 0.82 -2.65 0.00 0.00 178.83 176.72 1uap h ILE 140 N 0.70 1.27 -0.70 2.39 2.04 -0.75 0.36 117.51 122.82 1uap h ILE 140 Ca 0.32 -1.17 0.03 0.00 1.00 0.00 0.00 64.86 65.04 1uap h ILE 140 Cb 0.24 0.82 -0.04 0.00 -0.74 0.00 0.00 36.82 37.09 1uap h ILE 140 CO -0.20 0.42 0.44 -0.07 0.00 0.00 0.00 178.15 178.74 1uap h LEU 141 N 0.97 0.73 -0.72 1.44 3.38 -0.87 -0.76 115.31 119.48 1uap h LEU 141 Ca 0.17 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.11 1uap h LEU 141 Cb 0.58 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.13 1uap h LEU 141 CO 0.03 0.51 0.36 0.74 0.09 0.00 0.00 178.44 180.18 1uap h THR 142 N 0.87 1.23 -0.71 0.22 2.02 -0.80 0.22 112.91 115.96 1uap h THR 142 Ca 0.28 -0.62 0.05 0.00 0.77 0.00 0.00 66.41 66.89 1uap h THR 142 Cb 0.00 0.32 -0.05 0.00 -1.74 0.00 0.00 68.15 66.68 1uap h THR 142 CO -0.10 0.26 0.42 0.78 0.37 0.00 0.00 175.52 177.25 1uap h ASN 143 N 1.00 0.66 1.28 4.18 2.35 -0.21 -1.67 115.58 123.17 1uap h ASN 143 Ca 0.25 0.02 -0.07 0.00 -0.55 0.00 0.00 56.30 55.94 1uap h ASN 143 Cb 0.09 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.33 1uap h ASN 143 CO -0.03 0.44 -0.34 -0.07 -1.65 0.00 0.00 177.43 175.78 1uap h LEU 144 N 0.79 0.00 -0.32 1.61 3.38 -0.76 -1.99 115.31 118.03 1uap h LEU 144 Ca 0.30 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 58.07 1uap h LEU 144 Cb 0.12 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.87 1uap h LEU 144 CO -0.15 0.34 -0.80 -1.28 0.09 0.00 0.00 178.44 176.64 1uap h SER 145 N 0.00 0.52 0.07 -0.43 0.87 0.03 -3.36 113.55 111.25 1uap h SER 145 Ca -0.00 -0.36 -0.00 0.00 -1.23 0.00 0.00 61.79 60.19 1uap h SER 145 Cb 1.07 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 62.88 1uap h SER 145 CO 0.04 1.12 -0.04 0.11 -0.53 0.00 0.00 176.83 177.54 1uap h LYS 146 N 0.27 -0.10 -7.12 2.24 1.57 -1.32 -3.47 116.57 108.64 1uap h LYS 146 Ca -0.05 0.01 -0.52 0.00 -1.87 0.00 0.00 60.65 58.22 1uap h LYS 146 Cb 1.39 0.02 0.11 0.00 0.08 0.00 0.00 32.23 33.84 1uap h LYS 146 CO 0.14 -0.06 0.44 1.03 -0.57 0.00 0.00 179.45 180.42 1uap s ARG 147 N -1.76 2.88 0.39 3.15 0.52 -0.75 -4.98 118.95 118.39 1uap s ARG 147 Ca -0.01 1.72 -0.25 0.00 -0.52 0.00 0.00 55.73 56.66 1uap s ARG 147 Cb 0.00 -1.93 -0.09 0.00 0.52 0.00 0.00 34.95 33.46 1uap s ARG 147 CO 0.04 -1.25 1.11 -1.59 0.02 0.00 0.00 175.30 173.63 1uap s LYS 148 N -3.53 4.16 -0.07 3.54 -2.85 -1.26 -4.74 119.74 114.98 1uap s LYS 148 Ca 0.75 1.70 -0.30 0.00 -1.00 0.00 0.00 55.97 57.12 1uap s LYS 148 Cb -0.28 -2.68 -0.03 0.00 -2.06 0.00 0.00 37.83 32.79 1uap s LYS 148 CO 0.35 -0.19 1.18 0.00 0.10 0.00 0.00 175.35 176.79 1uap s PRO 150 N 2.32 4.18 -0.51 0.00 0.04 -1.26 -4.91 135.00 134.86 1uap s PRO 150 Ca 0.55 2.28 0.07 0.00 0.04 0.00 0.00 61.00 63.94 1uap s PRO 150 Cb -0.23 -3.90 0.29 0.00 0.04 0.00 0.00 34.50 30.69 1uap s PRO 150 CO 0.20 -0.83 0.73 -1.13 0.04 0.00 0.00 177.00 176.02 1uap n SER 151 N 6.76 2.51 -3.70 6.66 3.41 -1.26 -5.02 113.62 122.97 1uap n SER 151 Ca 0.17 -3.23 -0.18 0.00 -0.26 0.00 0.00 58.87 55.36 1uap n SER 151 Cb 0.42 -0.63 -0.17 0.00 -0.26 0.00 0.00 64.21 63.57 1uap n SER 151 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 1uap s GLN 152 N -2.38 -0.06 -0.09 4.33 2.00 -1.26 -5.13 119.66 117.07 1uap s GLN 152 Ca 0.41 0.33 -0.30 0.00 -2.00 0.00 0.00 55.36 53.80 1uap s GLN 152 Cb 0.22 -0.42 -0.04 0.00 0.80 0.00 0.00 33.01 33.57 1uap s GLN 152 CO -0.08 -0.28 1.43 -1.25 -0.50 0.00 0.00 175.29 174.61 1uap s PRO 153 N 1.84 4.23 0.00 1.67 0.04 -1.26 -5.30 135.00 136.22 1uap s PRO 153 Ca 0.01 1.91 0.00 0.00 0.04 0.00 0.00 61.00 62.96 1uap s PRO 153 Cb -0.12 -3.80 0.00 0.00 0.04 0.00 0.00 34.50 30.61 1uap s PRO 153 CO -0.03 -0.73 0.00 0.28 0.04 0.00 0.00 177.00 176.56