#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uap n PRO 25 N 0.00 4.06 -3.13 1.43 -0.04 -1.26 -4.57 135.00 131.49 1uap n PRO 25 Ca 0.00 -2.85 -0.17 0.00 -0.04 0.00 0.00 63.50 60.44 1uap n PRO 25 Cb 0.00 -2.75 -0.02 0.00 -0.04 0.00 0.00 33.50 30.69 1uap n PRO 25 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1uap n ASP 26 N 2.88 0.61 -3.71 3.54 5.75 -1.26 -5.05 116.55 119.32 1uap n ASP 26 Ca 0.68 -3.05 -0.12 0.00 -0.01 0.00 0.00 54.79 52.29 1uap n ASP 26 Cb 0.25 -0.42 -0.13 0.00 -1.03 0.00 0.00 41.12 39.79 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 -2.25 -0.63 0.85 2.12 0.00 -1.26 -5.18 121.76 115.41 1uap s ALA 27 Ca 0.38 1.06 -0.03 0.00 0.00 0.00 0.00 51.96 53.37 1uap s ALA 27 Cb 0.35 -0.77 0.05 0.00 0.00 0.00 0.00 23.12 22.74 1uap s ALA 27 CO -0.07 -0.32 0.28 -0.35 0.00 0.00 0.00 175.76 175.30 1uap n PRO 28 N 4.52 -0.08 -1.23 0.00 -0.04 -1.26 -5.05 135.00 131.85 1uap n PRO 28 Ca -0.20 -0.51 -0.36 0.00 -0.04 0.00 0.00 63.50 62.38 1uap n PRO 28 Cb 0.52 -0.27 0.07 0.00 -0.04 0.00 0.00 33.50 33.78 1uap n PRO 28 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 1uap n THR 29 N -2.22 1.53 -3.01 0.52 -1.04 -1.26 -4.93 114.28 103.87 1uap n THR 29 Ca 0.04 -0.40 -0.40 0.00 -2.04 0.00 0.00 64.05 61.24 1uap n THR 29 Cb 0.13 -0.65 -0.05 0.00 -1.82 0.00 0.00 70.33 67.94 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 1.31 -0.07 0.45 0.00 0.04 -1.26 -4.98 135.00 130.48 1uap s PRO 31 Ca 0.37 0.08 0.25 0.00 0.04 0.00 0.00 61.00 61.74 1uap s PRO 31 Cb -0.17 -1.72 0.61 0.00 0.04 0.00 0.00 34.50 33.26 1uap s PRO 31 CO 0.16 -2.97 1.70 0.87 0.04 0.00 0.00 177.00 176.80 1uap h LYS 32 N -2.05 0.00 -6.69 4.56 6.56 -2.02 -3.46 116.57 113.47 1uap h LYS 32 Ca -0.48 0.00 -0.53 0.00 -1.06 0.00 0.00 60.65 58.58 1uap h LYS 32 Cb 1.30 0.00 0.07 0.00 -0.57 0.00 0.00 32.23 33.03 1uap h LYS 32 CO 0.46 0.09 0.97 0.94 -2.06 0.00 0.00 179.45 179.85 1uap n GLN 33 N -3.14 2.73 -3.00 3.15 7.27 -1.26 -4.96 117.38 118.17 1uap n GLN 33 Ca 0.03 0.98 -0.13 0.00 0.07 0.00 0.00 57.00 57.95 1uap n GLN 33 Cb 0.49 -2.81 -0.03 0.00 2.41 0.00 0.00 30.24 30.31 1uap n GLN 33 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1uap s ARG 35 N 0.50 0.87 0.13 0.00 6.06 -1.26 -5.11 118.95 120.15 1uap s ARG 35 Ca 0.31 -1.26 0.05 0.00 -2.50 0.00 0.00 55.73 52.34 1uap s ARG 35 Cb 0.03 -0.44 -0.04 0.00 0.06 0.00 0.00 34.95 34.56 1uap s ARG 35 CO -0.12 0.05 0.06 0.50 -2.50 0.00 0.00 175.30 173.29 1uap s ARG 36 N -3.26 2.70 0.32 5.12 3.52 -1.26 -5.14 118.95 120.95 1uap s ARG 36 Ca 0.09 -0.88 0.03 0.00 -0.13 0.00 0.00 55.73 54.84 1uap s ARG 36 Cb 0.00 -2.57 -0.04 0.00 -1.56 0.00 0.00 34.95 30.78 1uap s ARG 36 CO -0.01 0.51 0.14 0.95 -0.81 0.00 0.00 175.30 176.07 1uap s THR 37 N -1.56 0.49 0.00 4.11 -4.23 -1.26 -5.11 115.64 108.08 1uap s THR 37 Ca 0.28 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.79 1uap s THR 37 Cb -0.11 -2.53 0.00 0.00 1.34 0.00 0.00 72.50 71.20 1uap s THR 37 CO 0.21 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.90 1uap n GLY 38 N -0.63 0.80 3.44 3.99 0.00 -1.26 -4.89 105.19 106.63 1uap n GLY 38 Ca -0.01 -0.75 -0.21 0.00 0.00 0.00 0.00 46.02 45.05 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 1.27 0.19 2.61 -4.23 -1.26 -5.04 115.64 109.17 1uap s THR 39 Ca 0.00 -2.02 -0.10 0.00 -1.18 0.00 0.00 61.69 58.38 1uap s THR 39 Cb 0.00 -2.69 0.10 0.00 1.34 0.00 0.00 72.50 71.25 1uap s THR 39 CO 0.00 -0.09 1.73 0.25 -0.54 0.00 0.00 174.62 175.97 1uap h LEU 40 N 2.18 0.95 -0.40 4.79 6.46 -1.99 -1.71 115.31 125.60 1uap h LEU 40 Ca -0.40 -0.20 -0.05 0.00 -0.12 0.00 0.00 57.88 57.11 1uap h LEU 40 Cb 1.24 -0.25 -0.02 0.00 -0.73 0.00 0.00 40.66 40.90 1uap h LEU 40 CO 0.69 0.90 0.05 1.56 -0.62 0.00 0.00 178.44 181.02 1uap h GLN 41 N 0.96 0.67 0.08 1.25 4.20 -1.99 0.37 115.11 120.65 1uap h GLN 41 Ca 0.22 -0.19 -0.00 0.00 0.06 0.00 0.00 58.65 58.73 1uap h GLN 41 Cb 0.27 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 27.98 1uap h GLN 41 CO -0.01 0.73 -0.04 0.77 -0.67 0.00 0.00 178.83 179.61 1uap h SER 42 N 0.52 -0.09 -0.72 1.46 0.02 -1.96 -3.15 113.55 109.64 1uap h SER 42 Ca 0.12 -0.28 0.12 0.00 -0.84 0.00 0.00 61.79 60.91 1uap h SER 42 Cb 0.39 0.02 -0.09 0.00 0.14 0.00 0.00 62.40 62.87 1uap h SER 42 CO 0.01 0.24 0.29 0.78 -1.14 0.00 0.00 176.83 177.01 1uap h ASN 43 N -0.43 0.28 -0.86 3.07 2.35 -1.22 -2.46 115.58 116.31 1uap h ASN 43 Ca -0.01 0.10 0.14 0.00 -0.55 0.00 0.00 56.30 55.98 1uap h ASN 43 Cb 0.37 0.07 -0.09 0.00 0.05 0.00 0.00 38.32 38.72 1uap h ASN 43 CO 0.02 0.13 0.45 0.15 -1.65 0.00 0.00 177.43 176.53 1uap h PHE 44 N 0.45 0.80 -0.00 1.19 3.04 -0.87 -1.42 116.94 120.12 1uap h PHE 44 Ca 0.38 0.03 -0.20 0.00 3.98 0.00 0.00 57.97 62.16 1uap h PHE 44 Cb 0.54 -0.22 -0.01 0.00 2.56 0.00 0.00 35.95 38.82 1uap h PHE 44 CO -0.16 0.20 -0.89 0.00 -2.02 0.00 0.00 178.31 175.44 1uap h ALA 46 N 0.90 0.87 -2.57 0.00 0.00 -1.01 -3.43 119.26 114.02 1uap h ALA 46 Ca -0.05 -0.34 -0.53 0.00 0.00 0.00 0.00 54.91 53.99 1uap h ALA 46 Cb 1.51 -0.19 0.03 0.00 0.00 0.00 0.00 17.79 19.14 1uap h ALA 46 CO 0.14 0.64 0.74 -1.54 0.00 0.00 0.00 179.25 179.24 1uap s SER 47 N -6.67 6.79 0.00 0.00 1.04 -0.63 -4.92 113.70 109.32 1uap s SER 47 Ca -0.10 2.38 0.29 0.00 0.48 0.00 0.00 55.95 59.00 1uap s SER 47 Cb 0.13 -2.59 1.22 0.00 0.10 0.00 0.00 66.02 64.88 1uap s SER 47 CO 0.85 -0.67 1.89 -0.24 0.98 0.00 0.00 173.24 176.05 1uap n SER 48 N 3.77 0.13 -3.84 7.02 2.88 -0.19 -4.70 113.62 118.70 1uap n SER 48 Ca 0.11 0.08 -0.23 0.00 -1.33 0.00 0.00 58.87 57.51 1uap n SER 48 Cb 0.42 -0.29 -0.17 0.00 -0.75 0.00 0.00 64.21 63.42 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 -2.81 0.96 -0.10 2.46 2.96 -0.89 -2.23 118.68 119.02 1uap s LEU 49 Ca 0.19 -0.14 -0.02 0.00 -0.22 0.00 0.00 54.13 53.94 1uap s LEU 49 Cb 0.19 -0.52 0.04 0.00 0.50 0.00 0.00 46.19 46.40 1uap s LEU 49 CO 0.53 -0.13 0.03 -0.69 -1.32 0.00 0.00 176.35 174.76 1uap s VAL 50 N 1.55 0.29 0.22 1.68 1.01 -0.65 -0.75 120.40 123.75 1uap s VAL 50 Ca -0.01 -0.00 -0.09 0.00 0.00 0.00 0.00 61.98 61.89 1uap s VAL 50 Cb -0.13 -0.58 -0.02 0.00 0.00 0.00 0.00 36.38 35.65 1uap s VAL 50 CO -0.04 0.10 0.35 0.68 0.00 0.00 0.00 175.10 176.19 1uap s VAL 51 N 1.99 0.01 -0.02 2.92 -7.23 -0.54 -0.74 120.40 116.79 1uap s VAL 51 Ca 0.03 -1.59 0.04 0.00 -1.81 0.00 0.00 61.98 58.65 1uap s VAL 51 Cb -0.14 -2.26 -0.01 0.00 0.56 0.00 0.00 36.38 34.54 1uap s VAL 51 CO -0.06 -0.03 -0.14 0.42 -0.31 0.00 0.00 175.10 174.98 1uap s THR 52 N -4.06 1.14 0.26 5.32 -4.23 -0.03 -0.73 115.64 113.31 1uap s THR 52 Ca 0.27 -0.58 -0.12 0.00 -1.18 0.00 0.00 61.69 60.08 1uap s THR 52 Cb 0.02 -0.97 -0.00 0.00 1.34 0.00 0.00 72.50 72.89 1uap s THR 52 CO 0.09 0.33 0.49 0.00 -0.54 0.00 0.00 174.62 174.99 1uap s ALA 53 N -0.10 -0.17 -0.14 3.99 0.00 -0.16 -0.68 121.76 124.49 1uap s ALA 53 Ca 0.01 -0.93 0.01 0.00 0.00 0.00 0.00 51.96 51.05 1uap s ALA 53 Cb -0.08 1.06 0.00 0.00 0.00 0.00 0.00 23.12 24.11 1uap s ALA 53 CO 0.00 -0.85 -0.18 0.99 0.00 0.00 0.00 175.76 175.72 1uap s THR 54 N -3.88 2.46 -0.26 0.00 2.01 -1.26 -0.83 115.64 113.87 1uap s THR 54 Ca 0.23 -0.85 -0.29 0.00 0.31 0.00 0.00 61.69 61.09 1uap s THR 54 Cb -0.01 -2.01 -0.02 0.00 0.01 0.00 0.00 72.50 70.47 1uap s THR 54 CO 0.10 0.53 1.61 -0.69 -0.69 0.00 0.00 174.62 175.48 1uap s VAL 55 N 0.72 3.70 -0.14 3.82 1.01 -0.62 -3.78 120.40 125.11 1uap s VAL 55 Ca -0.08 0.77 -0.22 0.00 0.00 0.00 0.00 61.98 62.45 1uap s VAL 55 Cb -0.16 -3.77 -0.19 0.00 0.00 0.00 0.00 36.38 32.27 1uap s VAL 55 CO 0.01 -0.37 0.54 0.11 0.00 0.00 0.00 175.10 175.39 1uap h LYS 56 N 11.04 0.00 -4.22 2.72 1.79 -1.11 0.57 116.57 127.36 1uap h LYS 56 Ca -0.33 0.00 -0.19 0.00 -2.18 0.00 0.00 60.65 57.95 1uap h LYS 56 Cb 1.15 0.00 -0.12 0.00 -1.58 0.00 0.00 32.23 31.68 1uap h LYS 56 CO 1.02 0.75 -0.39 -1.12 -1.08 0.00 0.00 179.45 178.63 1uap s SER 57 N -6.10 0.23 -0.03 0.86 0.01 -1.16 -4.57 113.70 102.95 1uap s SER 57 Ca -0.15 -1.26 0.02 0.00 1.31 0.00 0.00 55.95 55.87 1uap s SER 57 Cb -0.02 0.49 0.01 0.00 0.21 0.00 0.00 66.02 66.72 1uap s SER 57 CO 0.52 -1.01 -0.07 -0.04 0.41 0.00 0.00 173.24 173.05 1uap s MET 58 N -3.95 0.80 0.03 12.44 -1.94 -1.26 -0.64 119.30 124.77 1uap s MET 58 Ca 0.32 -0.21 0.06 0.00 -1.71 0.00 0.00 55.69 54.14 1uap s MET 58 Cb 0.03 -0.77 -0.02 0.00 2.01 0.00 0.00 34.83 36.08 1uap s MET 58 CO 0.13 0.05 -0.17 0.08 -0.01 0.00 0.00 175.02 175.10 1uap s VAL 59 N 0.35 1.32 0.24 -6.03 1.01 -0.34 -4.97 120.40 111.98 1uap s VAL 59 Ca -0.05 -0.96 -0.30 0.00 0.00 0.00 0.00 61.98 60.67 1uap s VAL 59 Cb -0.09 -1.15 -0.09 0.00 0.00 0.00 0.00 36.38 35.05 1uap s VAL 59 CO 0.00 0.17 1.23 -0.13 0.00 0.00 0.00 175.10 176.37 1uap s ARG 60 N -0.93 4.47 0.40 2.72 0.52 -1.26 -0.09 118.95 124.77 1uap s ARG 60 Ca 0.05 1.99 0.08 0.00 -0.52 0.00 0.00 55.73 57.32 1uap s ARG 60 Cb -0.08 -3.18 -0.05 0.00 0.52 0.00 0.00 34.95 32.16 1uap s ARG 60 CO 0.01 -0.09 0.13 -1.21 0.02 0.00 0.00 175.30 174.16 1uap s GLU 61 N -0.80 2.19 0.96 3.54 0.41 -1.24 -4.77 118.70 118.99 1uap s GLU 61 Ca 0.51 -1.84 -0.10 0.00 -0.41 0.00 0.00 54.97 53.13 1uap s GLU 61 Cb -0.35 -1.95 0.17 0.00 -1.78 0.00 0.00 34.13 30.22 1uap s GLU 61 CO 0.42 -0.05 1.13 -1.25 -0.49 0.00 0.00 175.26 175.01 1uap s PRO 62 N -3.85 0.67 4.86 0.39 0.04 -1.26 -4.33 135.00 131.51 1uap s PRO 62 Ca 0.39 1.44 0.00 0.00 0.04 0.00 0.00 61.00 62.87 1uap s PRO 62 Cb 0.03 -1.69 0.00 0.00 0.04 0.00 0.00 34.50 32.88 1uap s PRO 62 CO 0.22 -2.84 0.00 0.41 0.04 0.00 0.00 177.00 174.83 1uap n GLY 63 N 0.33 1.83 0.82 0.56 0.00 -1.26 -2.60 105.19 104.88 1uap n GLY 63 Ca 0.10 -0.53 0.04 0.00 0.00 0.00 0.00 46.02 45.63 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 6.89 2.16 -2.10 1.61 4.07 -1.26 -4.95 120.64 127.05 1uap n GLU 64 Ca 0.00 -1.26 -0.28 0.00 -0.06 0.00 0.00 57.16 55.56 1uap n GLU 64 Cb 0.00 -1.50 0.16 0.00 -0.06 0.00 0.00 31.44 30.04 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 -0.72 1.76 -0.17 8.31 0.00 -1.07 -1.38 107.32 114.05 1uap s GLY 65 Ca 0.23 -1.30 -0.16 0.00 0.00 0.00 0.00 44.72 43.49 1uap s GLY 65 CO 0.12 -0.60 0.46 -2.27 0.00 0.00 0.00 173.10 170.80 1uap s LEU 66 N -5.66 0.25 -0.03 0.66 1.98 0.10 -3.60 118.68 112.37 1uap s LEU 66 Ca 0.71 0.91 -0.03 0.00 -2.89 0.00 0.00 54.13 52.83 1uap s LEU 66 Cb -0.05 1.58 -0.04 0.00 0.66 0.00 0.00 46.19 48.34 1uap s LEU 66 CO 0.50 -0.17 0.16 0.00 -1.89 0.00 0.00 176.35 174.95 1uap s ALA 67 N 0.21 3.88 -0.16 5.97 0.00 0.87 -0.87 121.76 131.66 1uap s ALA 67 Ca -0.00 -0.76 0.01 0.00 0.00 0.00 0.00 51.96 51.20 1uap s ALA 67 Cb -0.03 -1.84 0.01 0.00 0.00 0.00 0.00 23.12 21.26 1uap s ALA 67 CO 0.01 0.72 -0.18 0.08 0.00 0.00 0.00 175.76 176.39 1uap s VAL 68 N -1.25 2.35 -0.19 0.00 1.01 -0.61 -1.20 120.40 120.50 1uap s VAL 68 Ca 0.25 -0.86 -0.09 0.00 0.00 0.00 0.00 61.98 61.27 1uap s VAL 68 Cb -0.12 -1.98 -0.05 0.00 0.00 0.00 0.00 36.38 34.23 1uap s VAL 68 CO 0.15 0.53 0.10 -0.89 0.00 0.00 0.00 175.10 174.99 1uap s THR 69 N 1.01 5.14 0.31 3.92 2.01 0.19 -0.68 115.64 127.53 1uap s THR 69 Ca -0.02 0.09 0.05 0.00 0.31 0.00 0.00 61.69 62.12 1uap s THR 69 Cb -0.15 -3.33 -0.03 0.00 0.01 0.00 0.00 72.50 69.00 1uap s THR 69 CO -0.05 0.45 0.21 0.68 -0.69 0.00 0.00 174.62 175.22 1uap s VAL 70 N 0.38 0.12 -0.26 3.82 -7.23 -0.07 -0.46 120.40 116.70 1uap s VAL 70 Ca 0.06 -2.00 0.16 0.00 -1.81 0.00 0.00 61.98 58.39 1uap s VAL 70 Cb -0.12 -2.49 0.49 0.00 0.56 0.00 0.00 36.38 34.82 1uap s VAL 70 CO -0.01 0.00 1.15 -0.24 -0.31 0.00 0.00 175.10 175.69 1uap n SER 71 N -1.15 2.94 -3.03 4.85 2.88 -1.25 -1.73 113.62 117.14 1uap n SER 71 Ca 0.04 -2.77 -0.29 0.00 -1.33 0.00 0.00 58.87 54.52 1uap n SER 71 Cb 0.64 -0.42 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 -0.63 -2.13 0.09 2.46 4.77 -1.10 -4.43 117.00 116.04 1uap n LEU 72 Ca 0.22 -0.08 -0.07 0.00 -0.03 0.00 0.00 56.01 56.05 1uap n LEU 72 Cb 0.88 -1.30 0.05 0.00 -2.33 0.00 0.00 43.42 40.71 1uap n LEU 72 CO 0.20 -0.13 0.34 0.40 -1.33 0.00 0.00 177.39 176.87 1uap h ILE 73 N 1.89 1.46 -3.12 -0.08 1.08 -1.40 -2.58 117.51 114.76 1uap h ILE 73 Ca -0.42 -2.39 -0.02 0.00 -0.39 0.00 0.00 64.86 61.64 1uap h ILE 73 Cb 1.12 2.30 -0.11 0.00 -3.07 0.00 0.00 36.82 37.06 1uap h ILE 73 CO 0.17 0.70 0.13 -0.83 -0.69 0.00 0.00 178.15 177.63 1uap s GLY 74 N -4.45 -0.41 0.02 5.37 0.00 0.14 -4.90 107.32 103.09 1uap s GLY 74 Ca -0.03 0.18 -0.08 0.00 0.00 0.00 0.00 44.72 44.79 1uap s GLY 74 CO 0.81 -0.02 0.16 0.00 0.00 0.00 0.00 173.10 174.05 1uap s ALA 75 N -3.80 -0.31 0.00 3.20 0.00 -1.26 -0.85 121.76 118.74 1uap s ALA 75 Ca 0.04 -0.25 0.00 0.00 0.00 0.00 0.00 51.96 51.75 1uap s ALA 75 Cb -0.01 0.20 0.00 0.00 0.00 0.00 0.00 23.12 23.31 1uap s ALA 75 CO -0.09 -0.29 0.00 0.66 0.00 0.00 0.00 175.76 176.04 1uap n TYR 76 N 1.02 0.00 -3.65 0.00 4.02 0.08 -4.95 117.16 113.67 1uap n TYR 76 Ca -0.20 0.00 -0.13 0.00 -0.01 0.00 0.00 57.90 57.55 1uap n TYR 76 Cb 0.57 0.00 -0.08 0.00 -0.02 0.00 0.00 39.34 39.82 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 -0.46 0.74 -0.43 -0.72 2.20 -1.08 -4.81 119.74 115.18 1uap s LYS 77 Ca 0.00 0.93 0.07 0.00 -0.36 0.00 0.00 55.97 56.60 1uap s LYS 77 Cb 0.00 0.34 0.23 0.00 -1.51 0.00 0.00 37.83 36.89 1uap s LYS 77 CO 0.00 -0.10 0.61 0.25 -0.36 0.00 0.00 175.35 175.75 1uap n THR 78 N 2.91 -0.54 -1.17 3.43 -2.24 -1.26 -1.64 114.28 113.77 1uap n THR 78 Ca -0.15 -3.02 -0.17 0.00 -2.27 0.00 0.00 64.05 58.44 1uap n THR 78 Cb 0.56 -0.77 -0.13 0.00 -2.10 0.00 0.00 70.33 67.89 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 1.82 3.48 0.35 3.38 0.00 -0.95 -4.13 105.19 109.14 1uap n GLY 79 Ca 0.19 -1.45 0.00 0.00 0.00 0.00 0.00 46.02 44.76 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 1.94 -2.12 3.73 -0.02 0.00 -1.26 -4.76 105.19 102.70 1uap n GLY 80 Ca 0.45 0.68 -0.42 0.00 0.00 0.00 0.00 46.02 46.74 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 -3.22 4.36 -1.02 0.99 1.43 -1.26 -4.92 118.68 115.04 1uap s LEU 81 Ca 0.00 2.88 -0.22 0.00 -1.03 0.00 0.00 54.13 55.77 1uap s LEU 81 Cb 0.00 -3.61 0.07 0.00 0.03 0.00 0.00 46.19 42.68 1uap s LEU 81 CO 0.00 -0.95 1.40 1.51 0.23 0.00 0.00 176.35 178.54 1uap s ASP 82 N 0.95 6.56 0.33 2.29 -4.77 -1.26 -4.91 116.67 115.86 1uap s ASP 82 Ca 0.71 -1.67 -0.29 0.00 -3.30 0.00 0.00 52.55 48.00 1uap s ASP 82 Cb -0.49 -2.53 -0.10 0.00 -1.09 0.00 0.00 42.92 38.71 1uap s ASP 82 CO 0.37 -1.38 1.33 -0.76 0.70 0.00 0.00 175.17 175.43 1uap s LEU 83 N 4.36 4.42 0.00 2.11 1.43 -1.26 -5.01 118.68 124.73 1uap s LEU 83 Ca 0.44 2.72 -0.12 0.00 -1.03 0.00 0.00 54.13 56.13 1uap s LEU 83 Cb -0.01 -3.65 0.18 0.00 0.03 0.00 0.00 46.19 42.74 1uap s LEU 83 CO -0.09 -0.57 0.67 -0.81 0.23 0.00 0.00 176.35 175.79 1uap n PRO 84 N 0.83 -2.08 -0.29 1.29 -0.04 -1.26 -4.94 135.00 128.51 1uap n PRO 84 Ca 0.00 -1.07 -0.11 0.00 -0.04 0.00 0.00 63.50 62.28 1uap n PRO 84 Cb 0.41 -0.96 -0.07 0.00 -0.04 0.00 0.00 33.50 32.84 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 -1.90 -1.88 -3.99 3.54 0.87 -2.06 -3.37 113.55 104.76 1uap h SER 85 Ca -0.25 0.29 -0.46 0.00 -1.23 0.00 0.00 61.79 60.14 1uap h SER 85 Cb 0.75 0.83 -0.01 0.00 -0.44 0.00 0.00 62.40 63.52 1uap h SER 85 CO 0.16 -0.31 0.35 -2.16 -0.53 0.00 0.00 176.83 174.35 1uap s PRO 86 N -5.65 4.32 0.00 2.24 0.04 -1.26 -5.07 135.00 129.61 1uap s PRO 86 Ca -0.13 1.26 0.00 0.00 0.04 0.00 0.00 61.00 62.16 1uap s PRO 86 Cb 0.11 -2.43 0.00 0.00 0.04 0.00 0.00 34.50 32.22 1uap s PRO 86 CO 0.63 0.04 0.00 -0.35 0.04 0.00 0.00 177.00 177.36 1uap n PRO 87 N -0.18 1.75 -0.98 0.56 -0.04 -1.26 -4.97 135.00 129.88 1uap n PRO 87 Ca 0.05 0.00 -0.34 0.00 -0.04 0.00 0.00 63.50 63.17 1uap n PRO 87 Cb 0.52 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 33.96 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 -0.25 1.38 0.00 0.52 -1.04 -1.26 -4.51 114.28 109.11 1uap n THR 88 Ca 0.00 -0.34 0.00 0.00 -2.04 0.00 0.00 64.05 61.67 1uap n THR 88 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 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 1.39 -0.30 3.86 3.41 0.00 -0.97 -5.00 105.19 107.58 1uap n GLY 89 Ca 0.13 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.55 3.51 0.46 4.61 0.00 -1.26 -4.72 121.76 123.80 1uap s ALA 90 Ca 0.00 -0.15 -0.21 0.00 0.00 0.00 0.00 51.96 51.61 1uap s ALA 90 Cb 0.00 -2.55 -0.10 0.00 0.00 0.00 0.00 23.12 20.47 1uap s ALA 90 CO 0.00 0.45 1.00 -1.54 0.00 0.00 0.00 175.76 175.67 1uap s SER 91 N -2.16 6.63 0.10 0.00 1.04 -1.26 -2.69 113.70 115.36 1uap s SER 91 Ca 0.46 1.82 -0.09 0.00 0.48 0.00 0.00 55.95 58.63 1uap s SER 91 Cb -0.12 -2.55 -0.00 0.00 0.10 0.00 0.00 66.02 63.45 1uap s SER 91 CO 0.20 -0.58 0.22 -0.76 0.98 0.00 0.00 173.24 173.29 1uap s LEU 92 N -3.32 1.29 -0.16 2.42 1.43 -0.71 -4.96 118.68 114.68 1uap s LEU 92 Ca 0.65 -0.68 -0.00 0.00 -1.03 0.00 0.00 54.13 53.06 1uap s LEU 92 Cb -0.13 1.10 0.03 0.00 0.03 0.00 0.00 46.19 47.22 1uap s LEU 92 CO 0.17 -0.77 -0.08 -0.54 0.23 0.00 0.00 176.35 175.36 1uap s LYS 93 N -3.88 1.72 -0.23 1.70 1.02 -1.26 -0.89 119.74 117.92 1uap s LYS 93 Ca 0.07 -0.53 -0.13 0.00 0.02 0.00 0.00 55.97 55.40 1uap s LYS 93 Cb 0.04 -2.02 -0.05 0.00 -0.52 0.00 0.00 37.83 35.29 1uap s LYS 93 CO -0.09 -0.36 0.25 -0.06 -0.92 0.00 0.00 175.35 174.17 1uap s PHE 94 N 1.58 3.33 -0.30 3.18 0.40 0.14 -4.42 117.98 121.89 1uap s PHE 94 Ca 0.02 0.36 -0.29 0.00 -0.60 0.00 0.00 56.93 56.42 1uap s PHE 94 Cb -0.14 -2.37 -0.00 0.00 0.51 0.00 0.00 43.02 41.01 1uap s PHE 94 CO -0.08 0.01 1.41 -0.47 0.70 0.00 0.00 175.22 176.79 1uap s TYR 95 N 1.23 2.48 -0.29 0.36 6.14 -1.02 -1.57 117.35 124.68 1uap s TYR 95 Ca 0.12 0.75 -0.07 0.00 0.64 0.00 0.00 57.07 58.51 1uap s TYR 95 Cb -0.14 -4.00 0.00 0.00 0.42 0.00 0.00 41.96 38.24 1uap s TYR 95 CO 0.06 -2.07 0.08 0.08 0.64 0.00 0.00 175.55 174.33 1uap s VAL 96 N 4.81 4.00 -2.00 3.14 1.01 -0.04 -0.26 120.40 131.05 1uap s VAL 96 Ca 0.61 -0.62 0.17 0.00 0.00 0.00 0.00 61.98 62.15 1uap s VAL 96 Cb -0.18 -3.03 0.50 0.00 0.00 0.00 0.00 36.38 33.66 1uap s VAL 96 CO 0.26 0.12 1.46 -0.81 0.00 0.00 0.00 175.10 176.13 1uap n PRO 97 N 4.87 0.62 -3.81 2.72 -0.04 -1.26 -0.72 135.00 137.38 1uap n PRO 97 Ca -0.15 0.00 -0.27 0.00 -0.04 0.00 0.00 63.50 63.04 1uap n PRO 97 Cb 0.48 -1.44 -0.17 0.00 -0.04 0.00 0.00 33.50 32.34 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 4.97 0.14 0.07 0.00 2.85 -0.48 -4.02 118.16 121.69 1uap n LYS 99 Ca -0.10 0.10 -0.17 0.00 -1.05 0.00 0.00 58.31 57.10 1uap n LYS 99 Cb 0.48 -1.65 -0.14 0.00 -0.65 0.00 0.00 35.03 33.06 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 0.26 -3.19 -1.58 4.20 -1.95 -3.49 115.11 109.36 1uap h GLN 100 Ca 0.00 -0.45 -0.02 0.00 0.06 0.00 0.00 58.65 58.24 1uap h GLN 100 Cb 0.62 0.17 -0.11 0.00 0.30 0.00 0.00 27.48 28.47 1uap h GLN 100 CO 0.00 1.14 0.09 0.00 -0.67 0.00 0.00 178.83 179.39 1uap s PRO 102 N -3.83 2.65 -0.07 0.00 0.04 -1.26 -4.59 135.00 127.94 1uap s PRO 102 Ca 0.06 1.62 -0.30 0.00 0.04 0.00 0.00 61.00 62.42 1uap s PRO 102 Cb -0.01 -1.91 -0.04 0.00 0.04 0.00 0.00 34.50 32.58 1uap s PRO 102 CO -0.06 -1.41 1.40 -1.25 0.04 0.00 0.00 177.00 175.71 1uap s PRO 103 N -3.81 4.25 0.09 0.56 0.04 -1.26 -5.01 135.00 129.86 1uap s PRO 103 Ca 0.72 1.89 -0.07 0.00 0.04 0.00 0.00 61.00 63.58 1uap s PRO 103 Cb -0.26 -3.72 -0.01 0.00 0.04 0.00 0.00 34.50 30.55 1uap s PRO 103 CO 0.40 -0.66 0.16 1.41 0.04 0.00 0.00 177.00 178.35 1uap s MET 104 N 3.08 0.83 0.02 4.56 1.75 -1.26 -4.91 119.30 123.38 1uap s MET 104 Ca 0.62 -1.02 0.03 0.00 -1.25 0.00 0.00 55.69 54.07 1uap s MET 104 Cb -0.28 0.32 -0.02 0.00 2.84 0.00 0.00 34.83 37.69 1uap s MET 104 CO 0.23 -0.25 -0.09 0.15 -0.65 0.00 0.00 175.02 174.41 1uap s LYS 105 N -3.88 0.60 0.42 4.11 1.02 -1.26 -5.14 119.74 115.61 1uap s LYS 105 Ca 0.07 -0.56 -0.26 0.00 0.02 0.00 0.00 55.97 55.24 1uap s LYS 105 Cb 0.05 -0.50 -0.09 0.00 -0.52 0.00 0.00 37.83 36.78 1uap s LYS 105 CO -0.10 0.12 1.34 0.21 -0.92 0.00 0.00 175.35 176.01 1uap s LYS 106 N -0.96 3.87 -0.85 1.68 2.20 -1.26 -3.48 119.74 120.95 1uap s LYS 106 Ca -0.03 2.24 -0.03 0.00 -0.36 0.00 0.00 55.97 57.80 1uap s LYS 106 Cb -0.07 -2.72 0.00 0.00 -1.51 0.00 0.00 37.83 33.53 1uap s LYS 106 CO 0.00 -0.60 0.34 0.41 -0.36 0.00 0.00 175.35 175.14 1uap n GLY 107 N 0.63 0.03 3.10 5.54 0.00 0.19 -5.00 105.19 109.68 1uap n GLY 107 Ca 0.04 -0.28 -0.07 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.89 0.20 -0.16 1.61 1.01 -1.23 -4.96 120.40 113.98 1uap s VAL 108 Ca 0.17 -1.67 -0.08 0.00 0.00 0.00 0.00 61.98 60.40 1uap s VAL 108 Cb -0.08 -1.41 -0.04 0.00 0.00 0.00 0.00 36.38 34.85 1uap s VAL 108 CO 0.21 -0.92 0.11 -0.44 0.00 0.00 0.00 175.10 174.05 1uap s SER 109 N -2.81 6.05 0.16 3.32 0.01 -1.26 -1.59 113.70 117.58 1uap s SER 109 Ca 0.05 0.26 0.00 0.00 1.31 0.00 0.00 55.95 57.57 1uap s SER 109 Cb 0.06 -2.01 -0.04 0.00 0.21 0.00 0.00 66.02 64.24 1uap s SER 109 CO -0.09 0.26 0.04 -0.31 0.41 0.00 0.00 173.24 173.54 1uap s TYR 110 N -0.14 1.08 -0.20 2.43 1.51 -0.01 -1.47 117.35 120.56 1uap s TYR 110 Ca 0.09 -1.14 -0.04 0.00 -1.01 0.00 0.00 57.07 54.97 1uap s TYR 110 Cb -0.12 -0.61 -0.02 0.00 -0.11 0.00 0.00 41.96 41.10 1uap s TYR 110 CO 0.01 -0.37 -0.02 -1.17 -1.11 0.00 0.00 175.55 172.89 1uap s LEU 111 N -3.13 3.17 -0.18 -1.29 1.98 0.23 -0.99 118.68 118.48 1uap s LEU 111 Ca 0.25 -0.23 0.01 0.00 -2.89 0.00 0.00 54.13 51.27 1uap s LEU 111 Cb 0.07 -1.80 0.02 0.00 0.66 0.00 0.00 46.19 45.14 1uap s LEU 111 CO 0.04 0.06 -0.18 -0.76 -1.89 0.00 0.00 176.35 173.62 1uap s LEU 112 N 0.99 2.07 -0.23 -0.68 2.01 0.09 -2.75 118.68 120.18 1uap s LEU 112 Ca 0.01 -0.64 0.02 0.00 0.01 0.00 0.00 54.13 53.53 1uap s LEU 112 Cb -0.14 -1.40 0.05 0.00 0.01 0.00 0.00 46.19 44.70 1uap s LEU 112 CO 0.01 -0.02 -0.13 -0.04 1.01 0.00 0.00 176.35 177.18 1uap s MET 113 N 1.33 2.40 0.00 1.70 -1.94 -0.87 -1.46 119.30 120.46 1uap s MET 113 Ca 0.04 -1.14 0.00 0.00 -1.71 0.00 0.00 55.69 52.89 1uap s MET 113 Cb -0.13 -2.74 0.00 0.00 2.01 0.00 0.00 34.83 33.97 1uap s MET 113 CO -0.12 -0.46 0.00 0.41 -0.01 0.00 0.00 175.02 174.84 1uap n GLY 114 N 4.52 4.74 3.34 -0.03 0.00 0.07 -2.27 105.19 115.56 1uap n GLY 114 Ca -0.16 -0.55 -0.20 0.00 0.00 0.00 0.00 46.02 45.12 1uap n GLY 114 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1uap s GLN 115 N 4.77 1.68 -0.05 1.61 -1.52 -1.13 -1.02 119.66 124.00 1uap s GLN 115 Ca 0.00 -1.98 0.02 0.00 -1.95 0.00 0.00 55.36 51.46 1uap s GLN 115 Cb 0.00 -0.01 0.01 0.00 -0.22 0.00 0.00 33.01 32.80 1uap s GLN 115 CO 0.00 -0.52 -0.11 0.08 -0.25 0.00 0.00 175.29 174.49 1uap s VAL 116 N -3.52 0.97 -0.33 1.09 1.01 -1.26 -2.39 120.40 115.97 1uap s VAL 116 Ca 0.36 -0.41 -0.09 0.00 0.00 0.00 0.00 61.98 61.83 1uap s VAL 116 Cb 0.04 -0.89 0.01 0.00 0.00 0.00 0.00 36.38 35.53 1uap s VAL 116 CO 0.20 0.31 0.15 -1.61 0.00 0.00 0.00 175.10 174.16 1uap s GLU 117 N 0.52 3.14 -1.57 2.72 2.02 -0.54 -4.88 118.70 120.11 1uap s GLU 117 Ca -0.10 -0.85 -0.11 0.00 0.02 0.00 0.00 54.97 53.92 1uap s GLU 117 Cb -0.13 -3.58 -0.04 0.00 0.10 0.00 0.00 34.13 30.48 1uap s GLU 117 CO 0.02 -0.51 2.70 -1.91 0.02 0.00 0.00 175.26 175.59 1uap n GLU 118 N 4.96 3.41 0.00 1.61 2.13 -1.26 -1.34 120.64 130.15 1uap n GLU 118 Ca -0.13 -2.35 0.00 0.00 0.66 0.00 0.00 57.16 55.34 1uap n GLU 118 Cb 0.48 -2.97 0.00 0.00 0.27 0.00 0.00 31.44 29.22 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 4.46 0.00 0.00 4.31 5.15 -1.26 -4.97 115.26 122.96 1uap n ASN 119 Ca 0.69 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.67 1uap n ASN 119 Cb 0.29 0.12 0.00 0.00 -0.53 0.00 0.00 39.78 39.66 1uap n ASN 119 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1uap n ARG 120 N -1.75 1.69 0.00 1.20 1.74 -1.07 -5.14 116.66 113.33 1uap n ARG 120 Ca 0.00 -0.20 0.00 0.00 -0.77 0.00 0.00 57.85 56.88 1uap n ARG 120 Cb 0.00 -0.63 0.00 0.00 -1.02 0.00 0.00 32.46 30.81 1uap n ARG 120 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1uap n GLY 121 N 0.30 -0.30 3.75 -0.13 0.00 -0.45 -4.96 105.19 103.40 1uap n GLY 121 Ca 0.00 -1.87 -0.41 0.00 0.00 0.00 0.00 46.02 43.74 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 4.50 0.18 1.61 0.04 -1.26 -1.46 135.00 138.60 1uap s PRO 122 Ca 0.00 1.94 0.11 0.00 0.04 0.00 0.00 61.00 63.09 1uap s PRO 122 Cb 0.00 -3.19 -0.04 0.00 0.04 0.00 0.00 34.50 31.31 1uap s PRO 122 CO 0.00 -0.04 -0.25 0.54 0.04 0.00 0.00 177.00 177.29 1uap s VAL 123 N -0.55 2.33 -0.46 -0.36 0.11 -1.01 -2.45 120.40 118.01 1uap s VAL 123 Ca 0.50 -1.96 0.04 0.00 -2.93 0.00 0.00 61.98 57.63 1uap s VAL 123 Cb -0.34 -2.09 0.17 0.00 -1.53 0.00 0.00 36.38 32.59 1uap s VAL 123 CO 0.41 -0.06 0.37 -0.22 -3.33 0.00 0.00 175.10 172.27 1uap s LEU 124 N -2.50 1.98 1.19 2.54 1.98 0.64 -2.86 118.68 121.65 1uap s LEU 124 Ca 0.19 -3.19 -0.14 0.00 -2.89 0.00 0.00 54.13 48.09 1uap s LEU 124 Cb -0.08 -0.64 0.29 0.00 0.66 0.00 0.00 46.19 46.42 1uap s LEU 124 CO 0.09 -0.16 1.02 -2.16 -1.89 0.00 0.00 176.35 173.25 1uap s PRO 125 N -0.19 -1.16 0.56 0.98 0.04 -1.26 -4.17 135.00 129.81 1uap s PRO 125 Ca 0.31 0.68 0.37 0.00 0.04 0.00 0.00 61.00 62.40 1uap s PRO 125 Cb 0.02 -1.54 1.82 0.00 0.04 0.00 0.00 34.50 34.84 1uap s PRO 125 CO -0.19 -3.84 2.12 -1.00 0.04 0.00 0.00 177.00 174.12 1uap h PRO 126 N -2.70 0.00 -0.91 0.56 0.13 -1.97 -2.09 132.00 125.02 1uap h PRO 126 Ca -0.60 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.48 1uap h PRO 126 Cb 1.34 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.44 1uap h PRO 126 CO 0.49 0.00 0.07 0.39 -0.23 0.00 0.00 178.00 178.72 1uap n GLU 127 N -2.94 2.02 -3.10 0.86 1.02 -1.26 -4.91 120.64 112.33 1uap n GLU 127 Ca -0.01 -1.03 -0.39 0.00 -0.02 0.00 0.00 57.16 55.70 1uap n GLU 127 Cb 0.17 -1.64 -0.05 0.00 -0.02 0.00 0.00 31.44 29.90 1uap n GLU 127 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1uap s SER 128 N -0.10 6.91 -0.34 1.62 0.01 -0.79 -4.92 113.70 116.09 1uap s SER 128 Ca 0.18 1.10 -0.29 0.00 1.31 0.00 0.00 55.95 58.26 1uap s SER 128 Cb 0.15 -2.38 0.02 0.00 0.21 0.00 0.00 66.02 64.01 1uap s SER 128 CO 0.05 -0.10 1.06 0.12 0.41 0.00 0.00 173.24 174.78 1uap s PHE 129 N 0.82 3.10 -0.13 2.43 2.19 -0.96 -4.90 117.98 120.53 1uap s PHE 129 Ca 0.35 1.09 -0.01 0.00 0.33 0.00 0.00 56.93 58.69 1uap s PHE 129 Cb -0.17 -3.77 0.03 0.00 -1.31 0.00 0.00 43.02 37.81 1uap s PHE 129 CO 0.16 -0.83 -0.04 0.08 1.83 0.00 0.00 175.22 176.43 1uap s VAL 130 N 3.72 0.83 0.18 3.12 1.01 -1.26 -2.06 120.40 125.94 1uap s VAL 130 Ca 0.45 -0.31 -0.07 0.00 0.00 0.00 0.00 61.98 62.05 1uap s VAL 130 Cb -0.12 -0.98 -0.02 0.00 0.00 0.00 0.00 36.38 35.26 1uap s VAL 130 CO 0.18 0.21 0.25 0.68 0.00 0.00 0.00 175.10 176.41 1uap s VAL 131 N 1.77 0.04 0.28 2.92 -7.23 -1.11 -4.87 120.40 112.21 1uap s VAL 131 Ca 0.03 -1.62 -0.30 0.00 -1.81 0.00 0.00 61.98 58.29 1uap s VAL 131 Cb -0.14 -2.10 -0.10 0.00 0.56 0.00 0.00 36.38 34.60 1uap s VAL 131 CO -0.07 -0.19 1.43 -0.76 -0.31 0.00 0.00 175.10 175.19 1uap s LEU 132 N -3.04 4.38 0.43 1.32 1.02 -1.26 -0.60 118.68 120.94 1uap s LEU 132 Ca 0.24 2.73 -0.25 0.00 0.02 0.00 0.00 54.13 56.88 1uap s LEU 132 Cb 0.04 -3.63 -0.08 0.00 0.02 0.00 0.00 46.19 42.54 1uap s LEU 132 CO 0.05 -0.70 1.24 -2.28 0.02 0.00 0.00 176.35 174.68 1uap s HIS 133 N -0.35 2.83 -0.01 0.29 5.65 -0.54 -4.67 115.29 118.49 1uap s HIS 133 Ca 0.57 1.47 -0.15 0.00 0.25 0.00 0.00 55.06 57.20 1uap s HIS 133 Cb -0.42 -3.55 0.02 0.00 -1.18 0.00 0.00 32.58 27.45 1uap s HIS 133 CO 0.48 -1.86 0.32 1.03 -0.65 0.00 0.00 174.74 174.06 1uap s ARG 134 N -2.44 0.69 0.29 2.88 1.81 -1.26 -4.90 118.95 116.02 1uap s ARG 134 Ca 0.60 -0.20 0.03 0.00 -1.72 0.00 0.00 55.73 54.45 1uap s ARG 134 Cb -0.34 0.31 0.46 0.00 -0.45 0.00 0.00 34.95 34.92 1uap s ARG 134 CO 0.43 -0.19 1.75 -1.00 -0.68 0.00 0.00 175.30 175.60 1uap h PRO 135 N 3.80 0.45 -0.63 3.54 0.13 -1.98 -0.34 132.00 136.97 1uap h PRO 135 Ca -0.30 -0.16 -0.01 0.00 -0.87 0.00 0.00 66.00 64.66 1uap h PRO 135 Cb 1.18 -0.03 -0.03 0.00 0.13 0.00 0.00 31.00 32.24 1uap h PRO 135 CO 0.40 0.65 0.35 -0.97 -0.23 0.00 0.00 178.00 178.20 1uap h ASN 136 N 0.41 0.79 -0.34 1.44 -1.24 -1.99 -1.55 115.58 113.09 1uap h ASN 136 Ca 0.06 -0.09 -0.12 0.00 0.71 0.00 0.00 56.30 56.86 1uap h ASN 136 Cb 0.62 -0.20 -0.01 0.00 0.73 0.00 0.00 38.32 39.46 1uap h ASN 136 CO 0.04 0.65 -0.27 1.56 -1.29 0.00 0.00 177.43 178.12 1uap h GLN 137 N 0.86 0.78 -0.35 6.67 4.20 -1.85 -2.46 115.11 122.96 1uap h GLN 137 Ca 0.22 -0.39 0.07 0.00 0.06 0.00 0.00 58.65 58.61 1uap h GLN 137 Cb 0.04 0.00 -0.09 0.00 0.30 0.00 0.00 27.48 27.74 1uap h GLN 137 CO -0.04 1.02 -0.39 0.22 -0.67 0.00 0.00 178.83 178.97 1uap h ASP 138 N 0.56 -1.27 -0.69 1.46 3.58 -0.83 -0.71 116.42 118.52 1uap h ASP 138 Ca 0.06 0.20 0.08 0.00 0.42 0.00 0.00 57.03 57.79 1uap h ASP 138 Cb 0.84 0.56 -0.06 0.00 1.72 0.00 0.00 39.33 42.39 1uap h ASP 138 CO 0.07 -0.36 0.35 -0.61 -2.88 0.00 0.00 179.24 175.81 1uap h GLN 139 N -0.33 0.60 -0.07 0.28 4.15 -1.29 -0.84 115.11 117.61 1uap h GLN 139 Ca 0.14 -0.04 -0.00 0.00 0.77 0.00 0.00 58.65 59.52 1uap h GLN 139 Cb 0.57 -0.14 -0.00 0.00 0.21 0.00 0.00 27.48 28.12 1uap h GLN 139 CO -0.52 0.40 0.04 0.82 -1.93 0.00 0.00 178.83 177.64 1uap h ILE 140 N 0.62 1.08 -0.72 2.39 2.04 -0.82 -0.10 117.51 122.00 1uap h ILE 140 Ca 0.33 -0.22 -0.04 0.00 1.00 0.00 0.00 64.86 65.93 1uap h ILE 140 Cb 0.30 1.09 -0.03 0.00 -0.74 0.00 0.00 36.82 37.44 1uap h ILE 140 CO -0.24 0.07 0.29 -0.07 0.00 0.00 0.00 178.15 178.20 1uap h LEU 141 N 0.03 1.00 -0.66 1.44 3.38 -0.69 0.34 115.31 120.15 1uap h LEU 141 Ca 0.03 -0.17 0.02 0.00 0.09 0.00 0.00 57.88 57.84 1uap h LEU 141 Cb 0.07 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.53 1uap h LEU 141 CO -0.00 0.90 0.43 0.74 0.09 0.00 0.00 178.44 180.59 1uap h THR 142 N 1.04 1.13 -0.52 0.22 2.02 -0.97 0.12 112.91 115.94 1uap h THR 142 Ca 0.24 -0.29 -0.11 0.00 0.77 0.00 0.00 66.41 67.02 1uap h THR 142 Cb 0.21 0.20 -0.02 0.00 -1.74 0.00 0.00 68.15 66.81 1uap h THR 142 CO -0.02 0.16 -0.11 0.78 0.37 0.00 0.00 175.52 176.70 1uap h ASN 143 N 0.86 0.99 -0.19 4.18 2.35 -0.52 -2.31 115.58 120.94 1uap h ASN 143 Ca 0.25 -0.35 -0.03 0.00 -0.55 0.00 0.00 56.30 55.62 1uap h ASN 143 Cb -0.05 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.03 1uap h ASN 143 CO -0.07 1.12 0.03 -0.07 -1.65 0.00 0.00 177.43 176.78 1uap h LEU 144 N 0.86 0.38 -0.95 1.61 3.38 -0.52 -0.86 115.31 119.20 1uap h LEU 144 Ca 0.13 -0.05 -0.08 0.00 0.09 0.00 0.00 57.88 57.97 1uap h LEU 144 Cb 0.67 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.31 1uap h LEU 144 CO 0.05 0.42 -0.13 -1.28 0.09 0.00 0.00 178.44 177.59 1uap h SER 145 N 0.40 0.61 -0.00 -0.43 0.87 -0.26 -2.84 113.55 111.90 1uap h SER 145 Ca 0.09 -0.17 -0.25 0.00 -1.23 0.00 0.00 61.79 60.23 1uap h SER 145 Cb 0.22 -0.16 0.02 0.00 -0.44 0.00 0.00 62.40 62.04 1uap h SER 145 CO 0.00 0.76 -0.98 0.11 -0.53 0.00 0.00 176.83 176.20 1uap h LYS 146 N 0.57 0.66 -7.37 2.24 1.57 -0.97 -3.45 116.57 109.82 1uap h LYS 146 Ca 0.10 -0.71 -0.42 0.00 -1.87 0.00 0.00 60.65 57.75 1uap h LYS 146 Cb 0.55 0.20 0.19 0.00 0.08 0.00 0.00 32.23 33.25 1uap h LYS 146 CO 0.03 1.30 0.13 1.03 -0.57 0.00 0.00 179.45 181.37 1uap s ARG 147 N -3.31 -1.02 -0.01 3.15 0.52 -0.37 -5.09 118.95 112.81 1uap s ARG 147 Ca -0.10 0.05 0.01 0.00 -0.52 0.00 0.00 55.73 55.17 1uap s ARG 147 Cb 0.06 -1.61 0.00 0.00 0.52 0.00 0.00 34.95 33.93 1uap s ARG 147 CO 0.91 -3.60 -0.05 -1.59 0.02 0.00 0.00 175.30 170.99 1uap s LYS 148 N -5.30 0.45 0.50 3.54 -2.85 -1.26 -4.89 119.74 109.93 1uap s LYS 148 Ca 0.70 -0.15 -0.22 0.00 -1.00 0.00 0.00 55.97 55.30 1uap s LYS 148 Cb -0.12 -0.46 -0.06 0.00 -2.06 0.00 0.00 37.83 35.13 1uap s LYS 148 CO 0.56 0.07 1.19 0.00 0.10 0.00 0.00 175.35 177.27 1uap s PRO 150 N -2.92 3.13 -0.42 0.00 0.04 -1.26 -4.86 135.00 128.71 1uap s PRO 150 Ca 0.68 -0.04 0.07 0.00 0.04 0.00 0.00 61.00 61.75 1uap s PRO 150 Cb -0.29 -4.20 0.22 0.00 0.04 0.00 0.00 34.50 30.28 1uap s PRO 150 CO 0.34 -2.19 0.56 0.43 0.04 0.00 0.00 177.00 176.18 1uap n SER 151 N 9.83 -0.85 -4.22 6.66 7.64 -1.26 -5.10 113.62 126.32 1uap n SER 151 Ca 0.06 -2.75 -0.35 0.00 1.01 0.00 0.00 58.87 56.84 1uap n SER 151 Cb 0.49 0.04 -0.14 0.00 -1.01 0.00 0.00 64.21 63.59 1uap n SER 151 CO 0.00 0.00 0.00 -1.58 -3.01 0.00 0.00 175.04 170.45 1uap s GLN 152 N -0.38 2.73 0.00 1.43 2.00 -1.26 -5.10 119.66 119.08 1uap s GLN 152 Ca 0.34 -1.06 0.00 0.00 -2.00 0.00 0.00 55.36 52.63 1uap s GLN 152 Cb 0.14 -3.15 0.00 0.00 0.80 0.00 0.00 33.01 30.80 1uap s GLN 152 CO -0.15 -0.50 0.00 -0.35 -0.50 0.00 0.00 175.29 173.79 1uap n PRO 153 N 4.70 2.83 0.00 1.67 -0.04 -1.26 -5.33 135.00 137.57 1uap n PRO 153 Ca -0.15 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.31 1uap n PRO 153 Cb 0.46 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.92 1uap n PRO 153 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01