#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vyr n VAL 2 N 0.00 0.94 -4.36 6.31 0.31 -1.26 -4.19 118.33 116.08 2vyr n VAL 2 Ca 0.00 -0.23 -0.23 0.00 -0.01 0.00 0.00 64.34 63.87 2vyr n VAL 2 Cb 0.00 -1.78 -0.17 0.00 -0.91 0.00 0.00 33.84 30.99 2vyr n VAL 2 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 2vyr s GLN 3 N -0.37 1.34 -0.06 5.55 -1.52 0.28 -4.96 119.66 119.93 2vyr s GLN 3 Ca 0.66 -0.28 0.01 0.00 -1.95 0.00 0.00 55.36 53.81 2vyr s GLN 3 Cb -0.56 -1.20 0.02 0.00 -0.22 0.00 0.00 33.01 31.05 2vyr s GLN 3 CO 0.48 -0.04 -0.06 -0.51 -0.25 0.00 0.00 175.29 174.90 2vyr s LEU 4 N 0.86 1.35 -0.12 2.90 1.43 -1.26 -1.53 118.68 122.31 2vyr s LEU 4 Ca -0.11 -0.19 -0.02 0.00 -1.03 0.00 0.00 54.13 52.78 2vyr s LEU 4 Cb -0.15 -0.58 0.04 0.00 0.03 0.00 0.00 46.19 45.53 2vyr s LEU 4 CO 0.01 -0.05 0.01 -0.22 0.23 0.00 0.00 176.35 176.34 2vyr s LEU 5 N 0.99 0.85 0.36 1.79 0.20 -0.73 -4.17 118.68 117.97 2vyr s LEU 5 Ca -0.09 -0.39 -0.12 0.00 0.69 0.00 0.00 54.13 54.21 2vyr s LEU 5 Cb -0.14 -0.52 -0.08 0.00 -0.43 0.00 0.00 46.19 45.02 2vyr s LEU 5 CO -0.00 -0.23 0.74 -1.61 -0.29 0.00 0.00 176.35 174.96 2vyr s GLU 6 N 1.91 3.88 0.20 1.98 8.01 -1.26 -1.24 118.70 132.18 2vyr s GLU 6 Ca 0.03 0.55 -0.14 0.00 0.01 0.00 0.00 54.97 55.41 2vyr s GLU 6 Cb -0.14 -2.42 0.01 0.00 -4.31 0.00 0.00 34.13 27.27 2vyr s GLU 6 CO -0.07 0.07 0.45 -1.54 0.01 0.00 0.00 175.26 174.18 2vyr s SER 7 N -2.73 -0.14 0.00 -0.19 1.04 0.37 -4.78 113.70 107.27 2vyr s SER 7 Ca 0.52 -0.68 0.00 0.00 0.48 0.00 0.00 55.95 56.28 2vyr s SER 7 Cb -0.10 0.54 0.00 0.00 0.10 0.00 0.00 66.02 66.56 2vyr s SER 7 CO 0.25 -1.03 0.00 0.61 0.98 0.00 0.00 173.24 174.05 2vyr n GLY 8 N -0.31 0.61 3.82 7.32 0.00 -1.26 -1.19 105.19 114.18 2vyr n GLY 8 Ca -0.08 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.63 2vyr n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2vyr s GLY 9 N -0.78 1.86 0.00 -0.02 0.00 -1.26 -4.60 107.32 102.52 2vyr s GLY 9 Ca 0.00 0.19 0.00 0.00 0.00 0.00 0.00 44.72 44.91 2vyr s GLY 9 CO 0.00 0.50 0.00 0.61 0.00 0.00 0.00 173.10 174.21 2vyr n GLY 10 N -1.64 0.97 3.72 0.20 0.00 -0.70 -4.88 105.19 102.86 2vyr n GLY 10 Ca 0.08 -0.72 -0.35 0.00 0.00 0.00 0.00 46.02 45.03 2vyr n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2vyr s LEU 11 N 0.00 4.10 0.01 0.99 0.20 -1.26 -1.27 118.68 121.44 2vyr s LEU 11 Ca 0.00 0.21 -0.12 0.00 0.69 0.00 0.00 54.13 54.92 2vyr s LEU 11 Cb 0.00 -2.04 0.01 0.00 -0.43 0.00 0.00 46.19 43.73 2vyr s LEU 11 CO 0.00 0.21 0.25 -0.69 -0.29 0.00 0.00 176.35 175.83 2vyr s VAL 12 N 0.15 0.08 0.37 1.68 1.01 -0.49 -4.99 120.40 118.20 2vyr s VAL 12 Ca 0.08 -0.63 -0.13 0.00 0.00 0.00 0.00 61.98 61.29 2vyr s VAL 12 Cb -0.12 -0.67 -0.08 0.00 0.00 0.00 0.00 36.38 35.52 2vyr s VAL 12 CO -0.01 -0.35 0.76 -1.10 0.00 0.00 0.00 175.10 174.41 2vyr s GLN 13 N -1.74 3.90 0.29 2.72 -0.21 -1.23 -0.89 119.66 122.51 2vyr s GLN 13 Ca -0.11 0.59 -0.29 0.00 0.02 0.00 0.00 55.36 55.57 2vyr s GLN 13 Cb -0.04 -2.40 -0.13 0.00 1.00 0.00 0.00 33.01 31.43 2vyr s GLN 13 CO 0.01 0.05 1.26 -2.30 -2.12 0.00 0.00 175.29 172.19 2vyr n PRO 14 N -0.84 1.88 -0.01 2.91 -0.02 -1.26 -0.84 135.00 136.82 2vyr n PRO 14 Ca 0.03 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 62.17 2vyr n PRO 14 Cb 0.54 -2.22 0.00 0.00 -0.02 0.00 0.00 33.50 31.80 2vyr n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2vyr n GLY 15 N 1.35 1.83 0.87 -1.23 0.00 0.15 -4.91 105.19 103.26 2vyr n GLY 15 Ca 0.08 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.04 2vyr n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vyr n GLY 16 N -2.00 -1.33 3.12 -0.02 0.00 -0.02 -4.17 105.19 100.77 2vyr n GLY 16 Ca 0.00 -1.66 -0.08 0.00 0.00 0.00 0.00 46.02 44.28 2vyr n GLY 16 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2vyr s SER 17 N -2.11 0.39 0.03 1.61 1.04 -1.26 -1.79 113.70 111.61 2vyr s SER 17 Ca 0.17 -1.03 -0.16 0.00 0.48 0.00 0.00 55.95 55.41 2vyr s SER 17 Cb -0.01 0.25 0.03 0.00 0.10 0.00 0.00 66.02 66.39 2vyr s SER 17 CO 0.12 -0.66 0.37 -0.76 0.98 0.00 0.00 173.24 173.29 2vyr s LEU 18 N -2.95 0.61 -0.15 2.42 1.43 -0.14 -5.01 118.68 114.88 2vyr s LEU 18 Ca 0.12 -0.04 0.00 0.00 -1.03 0.00 0.00 54.13 53.19 2vyr s LEU 18 Cb 0.07 1.56 0.03 0.00 0.03 0.00 0.00 46.19 47.88 2vyr s LEU 18 CO -0.06 -0.61 -0.11 -0.60 0.23 0.00 0.00 176.35 175.19 2vyr s ARG 19 N -2.31 1.97 0.23 1.70 3.52 -1.26 0.12 118.95 122.91 2vyr s ARG 19 Ca -0.06 -0.51 -0.04 0.00 -0.13 0.00 0.00 55.73 54.98 2vyr s ARG 19 Cb -0.01 -2.00 -0.05 0.00 -1.56 0.00 0.00 34.95 31.32 2vyr s ARG 19 CO -0.01 -0.29 0.47 -0.51 -0.81 0.00 0.00 175.30 174.14 2vyr s LEU 20 N 1.55 4.16 0.06 -0.88 1.43 0.29 -4.63 118.68 120.66 2vyr s LEU 20 Ca 0.04 0.61 0.01 0.00 -1.03 0.00 0.00 54.13 53.76 2vyr s LEU 20 Cb -0.13 -3.39 -0.03 0.00 0.03 0.00 0.00 46.19 42.67 2vyr s LEU 20 CO -0.09 -0.08 -0.06 -0.94 0.23 0.00 0.00 176.35 175.40 2vyr s SER 21 N -2.93 0.79 -0.13 2.29 1.04 -0.33 -1.48 113.70 112.94 2vyr s SER 21 Ca 0.42 -0.73 -0.02 0.00 0.48 0.00 0.00 55.95 56.10 2vyr s SER 21 Cb -0.11 0.08 0.04 0.00 0.10 0.00 0.00 66.02 66.14 2vyr s SER 21 CO 0.28 -0.35 0.02 0.00 0.98 0.00 0.00 173.24 174.17 2vyr s ALA 23 N 1.93 3.44 0.03 0.00 0.00 -0.37 -1.31 121.76 125.48 2vyr s ALA 23 Ca 0.02 0.08 0.08 0.00 0.00 0.00 0.00 51.96 52.14 2vyr s ALA 23 Cb -0.15 -3.15 -0.03 0.00 0.00 0.00 0.00 23.12 19.79 2vyr s ALA 23 CO -0.07 -0.47 -0.22 0.00 0.00 0.00 0.00 175.76 175.00 2vyr s ALA 24 N 1.71 2.42 0.25 0.00 0.00 -0.77 -1.77 121.76 123.58 2vyr s ALA 24 Ca 0.39 -1.21 -0.21 0.00 0.00 0.00 0.00 51.96 50.92 2vyr s ALA 24 Cb -0.17 -0.62 0.05 0.00 0.00 0.00 0.00 23.12 22.37 2vyr s ALA 24 CO 0.15 0.55 0.86 -1.54 0.00 0.00 0.00 175.76 175.78 2vyr s SER 25 N -1.24 -0.14 0.00 0.00 1.04 -0.58 -4.86 113.70 107.91 2vyr s SER 25 Ca 0.13 -0.66 0.00 0.00 0.48 0.00 0.00 55.95 55.90 2vyr s SER 25 Cb -0.10 0.64 0.00 0.00 0.10 0.00 0.00 66.02 66.66 2vyr s SER 25 CO 0.03 -1.22 0.00 0.61 0.98 0.00 0.00 173.24 173.64 2vyr n GLY 26 N -0.51 0.82 3.71 7.32 0.00 -1.26 -0.55 105.19 114.72 2vyr n GLY 26 Ca -0.05 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.87 2vyr n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2vyr s PHE 27 N -3.24 0.29 -0.96 1.61 -0.12 -1.26 -4.03 117.98 110.25 2vyr s PHE 27 Ca 0.00 -0.76 -0.21 0.00 -0.05 0.00 0.00 56.93 55.90 2vyr s PHE 27 Cb 0.00 0.50 0.09 0.00 -0.63 0.00 0.00 43.02 42.98 2vyr s PHE 27 CO 0.00 -1.30 1.29 0.99 -0.05 0.00 0.00 175.22 176.15 2vyr s THR 28 N -3.15 4.28 0.22 -4.49 2.01 -1.26 -4.87 115.64 108.39 2vyr s THR 28 Ca 0.19 -1.08 -0.07 0.00 0.31 0.00 0.00 61.69 61.03 2vyr s THR 28 Cb -0.04 -4.92 0.18 0.00 0.01 0.00 0.00 72.50 67.73 2vyr s THR 28 CO 0.12 -1.73 1.73 0.15 -0.69 0.00 0.00 174.62 174.19 2vyr h PHE 29 N 9.37 0.38 0.00 4.92 3.57 -1.94 -1.58 116.94 131.66 2vyr h PHE 29 Ca 0.16 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.69 2vyr h PHE 29 Cb 1.02 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 39.69 2vyr h PHE 29 CO 1.22 0.04 0.00 -0.85 -2.23 0.00 0.00 178.31 176.49 2vyr n GLU 30 N -5.04 0.11 0.00 1.11 0.28 -1.26 -2.00 120.64 113.84 2vyr n GLU 30 Ca 0.11 0.40 0.12 0.00 -0.16 0.00 0.00 57.16 57.63 2vyr n GLU 30 Cb 0.35 -1.73 0.18 0.00 1.43 0.00 0.00 31.44 31.66 2vyr n GLU 30 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 2vyr n GLU 31 N -1.94 0.43 -5.05 3.44 1.02 -0.60 -4.45 120.64 113.50 2vyr n GLU 31 Ca 0.02 -0.29 -0.32 0.00 -0.02 0.00 0.00 57.16 56.55 2vyr n GLU 31 Cb 0.17 -1.49 -0.15 0.00 -0.02 0.00 0.00 31.44 29.95 2vyr n GLU 31 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 2vyr s TYR 32 N -2.78 2.58 0.84 -0.32 1.51 -0.85 -4.76 117.35 113.58 2vyr s TYR 32 Ca 0.15 -0.42 -0.13 0.00 -1.01 0.00 0.00 57.07 55.66 2vyr s TYR 32 Cb 0.18 -1.63 0.08 0.00 -0.11 0.00 0.00 41.96 40.48 2vyr s TYR 32 CO 0.66 -0.01 1.01 0.00 -1.11 0.00 0.00 175.55 176.10 2vyr n ALA 33 N 2.67 -0.70 -2.23 3.71 0.00 -0.01 -3.90 120.51 120.06 2vyr n ALA 33 Ca -0.17 -0.41 -0.10 0.00 0.00 0.00 0.00 53.44 52.76 2vyr n ALA 33 Cb 0.52 -2.14 -0.10 0.00 0.00 0.00 0.00 19.45 17.73 2vyr n ALA 33 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2vyr s MET 34 N -4.01 0.74 0.07 0.00 -1.94 -0.48 -4.34 119.30 109.33 2vyr s MET 34 Ca 0.69 -1.24 0.04 0.00 -1.71 0.00 0.00 55.69 53.46 2vyr s MET 34 Cb -0.27 -0.10 -0.03 0.00 2.01 0.00 0.00 34.83 36.43 2vyr s MET 34 CO 0.55 -0.04 -0.11 -0.51 -0.01 0.00 0.00 175.02 174.91 2vyr s LEU 35 N -2.86 2.31 -0.11 -0.03 1.43 -0.29 -1.63 118.68 117.49 2vyr s LEU 35 Ca 0.08 -0.65 0.02 0.00 -1.03 0.00 0.00 54.13 52.55 2vyr s LEU 35 Cb 0.04 -0.32 -0.01 0.00 0.03 0.00 0.00 46.19 45.93 2vyr s LEU 35 CO -0.06 -0.18 -0.17 0.26 0.23 0.00 0.00 176.35 176.44 2vyr s TRP 36 N -1.65 2.70 0.26 0.29 0.52 0.36 -0.90 118.94 120.52 2vyr s TRP 36 Ca -0.03 -0.70 0.05 0.00 0.02 0.00 0.00 56.10 55.45 2vyr s TRP 36 Cb -0.08 -1.77 -0.06 0.00 -1.15 0.00 0.00 33.47 30.42 2vyr s TRP 36 CO 0.01 -0.22 -0.04 0.14 0.02 0.00 0.00 176.95 176.86 2vyr s VAL 37 N 0.19 1.42 0.06 4.03 -7.23 -0.34 -0.88 120.40 117.64 2vyr s VAL 37 Ca -0.10 -2.09 -0.00 0.00 -1.81 0.00 0.00 61.98 57.98 2vyr s VAL 37 Cb -0.16 -2.40 -0.04 0.00 0.56 0.00 0.00 36.38 34.35 2vyr s VAL 37 CO 0.06 -0.32 -0.03 0.00 -0.31 0.00 0.00 175.10 174.49 2vyr s ARG 38 N -3.77 0.66 -0.18 4.82 1.70 0.82 -0.04 118.95 122.96 2vyr s ARG 38 Ca 0.29 -1.25 -0.05 0.00 -0.47 0.00 0.00 55.73 54.25 2vyr s ARG 38 Cb 0.04 0.13 0.06 0.00 -0.57 0.00 0.00 34.95 34.62 2vyr s ARG 38 CO 0.10 -0.10 0.08 -1.14 -1.08 0.00 0.00 175.30 173.17 2vyr s GLN 39 N -3.91 0.17 0.47 3.89 0.74 -0.51 -0.17 119.66 120.34 2vyr s GLN 39 Ca 0.08 -0.15 -0.20 0.00 0.05 0.00 0.00 55.36 55.14 2vyr s GLN 39 Cb 0.07 -1.87 -0.09 0.00 1.10 0.00 0.00 33.01 32.22 2vyr s GLN 39 CO -0.09 -0.67 0.99 0.00 -0.55 0.00 0.00 175.29 174.97 2vyr s ALA 40 N 2.09 2.97 -0.72 1.58 0.00 -1.26 -1.67 121.76 124.75 2vyr s ALA 40 Ca 0.02 0.44 -0.22 0.00 0.00 0.00 0.00 51.96 52.20 2vyr s ALA 40 Cb -0.16 -3.18 -0.16 0.00 0.00 0.00 0.00 23.12 19.61 2vyr s ALA 40 CO -0.09 -0.11 1.92 -2.30 0.00 0.00 0.00 175.76 175.18 2vyr n PRO 41 N -0.94 0.00 0.00 0.00 -0.02 -1.26 -2.05 135.00 130.74 2vyr n PRO 41 Ca 0.08 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.56 2vyr n PRO 41 Cb 0.53 -1.07 0.00 0.00 -0.02 0.00 0.00 33.50 32.95 2vyr n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2vyr n GLY 42 N 4.64 1.78 0.00 -1.23 0.00 -1.26 -4.91 105.19 104.21 2vyr n GLY 42 Ca 0.47 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 46.26 2vyr n GLY 42 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2vyr n LYS 43 N 0.00 0.00 -0.15 1.61 4.81 -0.87 -4.74 118.16 118.82 2vyr n LYS 43 Ca 0.00 0.00 0.02 0.00 -0.87 0.00 0.00 58.31 57.46 2vyr n LYS 43 Cb 0.00 0.00 -0.01 0.00 0.02 0.00 0.00 35.03 35.04 2vyr n LYS 43 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2vyr n GLY 44 N 0.00 -1.43 3.76 3.14 0.00 -1.26 -4.83 105.19 104.57 2vyr n GLY 44 Ca 0.00 -1.49 -0.39 0.00 0.00 0.00 0.00 46.02 44.13 2vyr n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2vyr s LEU 45 N -2.90 4.54 -0.06 0.99 1.43 -1.26 -4.10 118.68 117.32 2vyr s LEU 45 Ca 0.00 2.01 -0.01 0.00 -1.03 0.00 0.00 54.13 55.11 2vyr s LEU 45 Cb 0.00 -3.72 0.03 0.00 0.03 0.00 0.00 46.19 42.53 2vyr s LEU 45 CO 0.00 0.01 -0.01 -0.70 0.23 0.00 0.00 176.35 175.88 2vyr s GLU 46 N -1.48 0.66 0.24 1.70 2.12 0.76 -4.97 118.70 117.73 2vyr s GLU 46 Ca 0.44 0.05 -0.30 0.00 0.36 0.00 0.00 54.97 55.53 2vyr s GLU 46 Cb -0.26 -0.94 -0.10 0.00 0.26 0.00 0.00 34.13 33.10 2vyr s GLU 46 CO 0.32 -0.25 1.43 -0.46 -0.54 0.00 0.00 175.26 175.76 2vyr s TRP 47 N 1.69 3.06 -0.12 5.30 -0.00 -1.26 -0.12 118.94 127.49 2vyr s TRP 47 Ca 0.01 1.04 -0.08 0.00 -0.00 0.00 0.00 56.10 57.07 2vyr s TRP 47 Cb -0.13 -3.79 -0.05 0.00 -0.00 0.00 0.00 33.47 29.50 2vyr s TRP 47 CO -0.04 -2.58 -0.19 0.28 -0.00 0.00 0.00 176.95 174.43 2vyr n VAL 48 N 2.48 0.98 -3.45 5.86 0.31 -0.06 -4.64 118.33 119.81 2vyr n VAL 48 Ca 0.07 -0.05 -0.12 0.00 -0.01 0.00 0.00 64.34 64.22 2vyr n VAL 48 Cb 0.41 -1.79 -0.03 0.00 -0.91 0.00 0.00 33.84 31.52 2vyr n VAL 48 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 2vyr s SER 49 N -6.20 -0.55 0.11 4.52 0.15 -0.97 -0.85 113.70 109.91 2vyr s SER 49 Ca -0.19 0.05 -0.12 0.00 0.70 0.00 0.00 55.95 56.39 2vyr s SER 49 Cb 0.06 0.58 0.01 0.00 -1.71 0.00 0.00 66.02 64.97 2vyr s SER 49 CO 0.25 -0.92 0.28 -0.83 1.20 0.00 0.00 173.24 173.21 2vyr s GLY 50 N -2.60 -0.04 -0.07 9.45 0.00 -0.65 -0.49 107.32 112.93 2vyr s GLY 50 Ca -0.00 -0.40 -0.10 0.00 0.00 0.00 0.00 44.72 44.22 2vyr s GLY 50 CO -0.11 -0.61 0.25 -1.50 0.00 0.00 0.00 173.10 171.14 2vyr s ILE 51 N -3.84 0.02 0.89 0.90 2.07 -0.65 -0.84 121.20 119.76 2vyr s ILE 51 Ca 0.05 -0.21 -0.12 0.00 -1.41 0.00 0.00 60.65 58.96 2vyr s ILE 51 Cb 0.04 -0.43 0.13 0.00 0.13 0.00 0.00 42.46 42.33 2vyr s ILE 51 CO -0.11 -0.11 1.10 0.54 -1.91 0.00 0.00 174.94 174.44 2vyr s ASN 52 N -0.39 3.53 0.25 4.50 4.22 -0.66 -1.39 114.94 125.01 2vyr s ASN 52 Ca -0.05 1.39 -0.02 0.00 -2.14 0.00 0.00 52.86 52.04 2vyr s ASN 52 Cb -0.03 -2.07 0.50 0.00 1.28 0.00 0.00 41.25 40.92 2vyr s ASN 52 CO 0.01 -2.59 1.75 0.00 -2.04 0.00 0.00 177.10 174.24 2vyr h ALA 53 N -1.51 1.19 -0.01 3.54 0.00 -1.82 -1.64 119.26 119.00 2vyr h ALA 53 Ca -0.50 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.51 2vyr h ALA 53 Cb 1.29 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.10 2vyr h ALA 53 CO 0.56 -0.13 -0.11 0.54 0.00 0.00 0.00 179.25 180.11 2vyr n ARG 54 N -4.91 1.22 -1.36 0.00 1.74 -1.26 -4.75 116.66 107.34 2vyr n ARG 54 Ca 0.16 -0.68 0.00 0.00 -0.77 0.00 0.00 57.85 56.56 2vyr n ARG 54 Cb 0.42 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.37 2vyr n ARG 54 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2vyr n GLY 55 N 1.25 0.47 0.06 -0.13 0.00 -0.62 -4.95 105.19 101.27 2vyr n GLY 55 Ca 0.16 -0.92 0.01 0.00 0.00 0.00 0.00 46.02 45.28 2vyr n GLY 55 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 2vyr n TYR 56 N -3.32 0.00 -4.80 1.61 0.18 -1.26 -4.87 117.16 104.71 2vyr n TYR 56 Ca 0.00 0.00 -0.30 0.00 1.88 0.00 0.00 57.90 59.48 2vyr n TYR 56 Cb 0.22 0.00 -0.17 0.00 -0.38 0.00 0.00 39.34 39.01 2vyr n TYR 56 CO 0.00 0.00 0.00 0.99 -2.08 0.00 0.00 176.86 175.77 2vyr s THR 57 N -0.73 1.71 0.16 -3.48 2.01 -1.26 -5.04 115.64 109.01 2vyr s THR 57 Ca 0.02 -0.79 0.10 0.00 0.31 0.00 0.00 61.69 61.33 2vyr s THR 57 Cb 0.02 -1.51 -0.04 0.00 0.01 0.00 0.00 72.50 70.98 2vyr s THR 57 CO 0.07 0.48 -0.22 0.42 -0.69 0.00 0.00 174.62 174.69 2vyr s THR 58 N 0.65 2.06 0.00 -0.82 -4.23 -1.26 -1.64 115.64 110.40 2vyr s THR 58 Ca -0.13 -1.89 0.02 0.00 -1.18 0.00 0.00 61.69 58.51 2vyr s THR 58 Cb -0.16 -1.92 -0.01 0.00 1.34 0.00 0.00 72.50 71.75 2vyr s THR 58 CO 0.03 -0.15 -0.06 -0.31 -0.54 0.00 0.00 174.62 173.59 2vyr s TYR 59 N -1.65 0.50 0.03 3.99 1.51 -0.02 -4.99 117.35 116.71 2vyr s TYR 59 Ca 0.16 -0.13 0.02 0.00 -1.01 0.00 0.00 57.07 56.11 2vyr s TYR 59 Cb -0.08 -0.32 -0.02 0.00 -0.11 0.00 0.00 41.96 41.44 2vyr s TYR 59 CO 0.07 -0.02 -0.07 0.71 -1.11 0.00 0.00 175.55 175.14 2vyr s TYR 60 N -0.25 0.64 0.31 2.71 1.51 -1.26 -1.64 117.35 119.36 2vyr s TYR 60 Ca 0.01 -0.36 -0.29 0.00 -1.01 0.00 0.00 57.07 55.42 2vyr s TYR 60 Cb -0.03 -0.39 -0.10 0.00 -0.11 0.00 0.00 41.96 41.33 2vyr s TYR 60 CO -0.00 -0.05 1.26 0.00 -1.11 0.00 0.00 175.55 175.65 2vyr s ALA 61 N -0.93 3.48 0.51 3.71 0.00 -0.03 -4.87 121.76 123.62 2vyr s ALA 61 Ca -0.05 1.17 0.31 0.00 0.00 0.00 0.00 51.96 53.38 2vyr s ALA 61 Cb -0.07 -3.44 1.43 0.00 0.00 0.00 0.00 23.12 21.03 2vyr s ALA 61 CO 0.00 -0.52 1.82 -0.44 0.00 0.00 0.00 175.76 176.62 2vyr h ASP 62 N 3.61 0.10 0.97 0.00 3.32 -1.94 0.30 116.42 122.78 2vyr h ASP 62 Ca -0.48 0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.59 2vyr h ASP 62 Cb 1.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.77 2vyr h ASP 62 CO 0.67 0.02 0.00 0.77 -1.72 0.00 0.00 179.24 178.98 2vyr h SER 63 N 0.09 0.00 0.00 6.45 4.64 -1.96 -3.12 113.55 119.65 2vyr h SER 63 Ca 0.53 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.85 2vyr h SER 63 Cb 1.92 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.01 2vyr h SER 63 CO -0.07 0.00 0.00 1.33 -0.87 0.00 0.00 176.83 177.22 2vyr n VAL 64 N -2.78 0.13 -1.70 0.95 0.24 0.04 -5.02 118.33 110.20 2vyr n VAL 64 Ca 0.01 -0.56 -0.42 0.00 -2.04 0.00 0.00 64.34 61.33 2vyr n VAL 64 Cb 0.29 0.95 -0.03 0.00 -1.47 0.00 0.00 33.84 33.58 2vyr n VAL 64 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 2vyr n LYS 65 N -0.07 2.80 -0.29 7.34 4.81 -0.89 -1.71 118.16 130.16 2vyr n LYS 65 Ca 0.00 1.02 0.00 0.00 -0.87 0.00 0.00 58.31 58.46 2vyr n LYS 65 Cb 0.04 -2.90 0.00 0.00 0.02 0.00 0.00 35.03 32.19 2vyr n LYS 65 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2vyr n GLY 66 N 4.16 0.73 0.00 3.14 0.00 -1.26 -4.82 105.19 107.14 2vyr n GLY 66 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 2vyr n GLY 66 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2vyr n ARG 67 N -2.00 1.73 -4.13 1.61 1.74 -0.69 -5.04 116.66 109.89 2vyr n ARG 67 Ca 0.00 0.00 -0.31 0.00 -0.77 0.00 0.00 57.85 56.77 2vyr n ARG 67 Cb 0.00 -0.79 -0.07 0.00 -1.02 0.00 0.00 32.46 30.58 2vyr n ARG 67 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2vyr s PHE 68 N -1.58 3.12 -0.06 -1.55 0.40 -0.71 -0.95 117.98 116.65 2vyr s PHE 68 Ca 0.00 0.07 -0.01 0.00 -0.60 0.00 0.00 56.93 56.39 2vyr s PHE 68 Cb 0.00 -1.62 0.03 0.00 0.51 0.00 0.00 43.02 41.93 2vyr s PHE 68 CO 0.00 0.50 -0.01 0.99 0.70 0.00 0.00 175.22 177.40 2vyr s THR 69 N -1.28 0.40 0.02 0.64 2.01 0.43 -4.89 115.64 112.97 2vyr s THR 69 Ca 0.25 0.07 -0.07 0.00 0.31 0.00 0.00 61.69 62.26 2vyr s THR 69 Cb -0.12 -0.53 -0.05 0.00 0.01 0.00 0.00 72.50 71.81 2vyr s THR 69 CO 0.17 0.25 0.28 -0.51 -0.69 0.00 0.00 174.62 174.12 2vyr s ILE 70 N 1.71 5.29 0.29 1.82 2.07 -1.26 -0.49 121.20 130.62 2vyr s ILE 70 Ca 0.01 0.17 -0.21 0.00 -1.41 0.00 0.00 60.65 59.21 2vyr s ILE 70 Cb -0.13 -3.57 0.03 0.00 0.13 0.00 0.00 42.46 38.92 2vyr s ILE 70 CO -0.04 0.35 0.75 -0.94 -1.91 0.00 0.00 174.94 173.15 2vyr s SER 71 N -1.74 -0.22 0.11 4.50 1.04 -1.00 -5.00 113.70 111.40 2vyr s SER 71 Ca 0.28 -0.67 -0.08 0.00 0.48 0.00 0.00 55.95 55.96 2vyr s SER 71 Cb -0.13 0.73 -0.01 0.00 0.10 0.00 0.00 66.02 66.71 2vyr s SER 71 CO 0.17 -1.37 0.21 0.00 0.98 0.00 0.00 173.24 173.22 2vyr s ARG 72 N -3.64 0.94 -0.33 4.02 1.70 -1.26 -0.15 118.95 120.24 2vyr s ARG 72 Ca 0.12 -1.07 0.01 0.00 -0.47 0.00 0.00 55.73 54.32 2vyr s ARG 72 Cb -0.06 0.34 0.10 0.00 -0.57 0.00 0.00 34.95 34.77 2vyr s ARG 72 CO 0.07 -0.31 0.09 0.34 -1.08 0.00 0.00 175.30 174.41 2vyr s ASP 73 N -2.91 4.21 0.57 -2.89 3.68 -0.05 -4.99 116.67 114.29 2vyr s ASP 73 Ca 0.10 -1.83 0.35 0.00 2.13 0.00 0.00 52.55 53.30 2vyr s ASP 73 Cb 0.05 -1.08 1.62 0.00 -1.45 0.00 0.00 42.92 42.06 2vyr s ASP 73 CO -0.07 -0.40 2.09 0.78 0.13 0.00 0.00 175.17 177.70 2vyr h ASN 74 N 7.89 0.00 1.12 -0.34 2.35 -1.94 -0.74 115.58 123.92 2vyr h ASN 74 Ca -0.10 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.65 2vyr h ASN 74 Cb 1.01 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.38 2vyr h ASN 74 CO 0.49 0.04 0.00 -1.54 -1.65 0.00 0.00 177.43 174.76 2vyr n SER 75 N -3.20 0.43 -0.09 5.81 3.41 -1.26 -3.25 113.62 115.46 2vyr n SER 75 Ca -0.01 0.55 0.01 0.00 -0.26 0.00 0.00 58.87 59.17 2vyr n SER 75 Cb 0.25 -0.66 0.01 0.00 -0.26 0.00 0.00 64.21 63.54 2vyr n SER 75 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2vyr n LYS 76 N -1.92 0.14 -3.81 4.33 5.02 -0.38 -5.01 118.16 116.53 2vyr n LYS 76 Ca 0.05 -0.58 -0.26 0.00 -2.02 0.00 0.00 58.31 55.50 2vyr n LYS 76 Cb 0.35 -1.00 0.03 0.00 -0.02 0.00 0.00 35.03 34.39 2vyr n LYS 76 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2vyr n ASN 77 N 0.01 -3.47 -4.08 4.39 4.13 -0.64 -4.90 115.26 110.70 2vyr n ASN 77 Ca 0.01 -0.78 -0.21 0.00 1.68 0.00 0.00 54.58 55.28 2vyr n ASN 77 Cb 0.06 -4.02 -0.15 0.00 -1.54 0.00 0.00 39.78 34.13 2vyr n ASN 77 CO 0.00 0.00 0.00 0.42 0.28 0.00 0.00 177.26 177.96 2vyr s THR 78 N -3.45 1.00 -0.06 3.41 -4.23 -1.10 -1.85 115.64 109.36 2vyr s THR 78 Ca 0.40 -0.53 0.01 0.00 -1.18 0.00 0.00 61.69 60.40 2vyr s THR 78 Cb -0.20 -0.84 -0.03 0.00 1.34 0.00 0.00 72.50 72.77 2vyr s THR 78 CO 0.82 0.29 -0.08 -0.22 -0.54 0.00 0.00 174.62 174.88 2vyr s LEU 79 N -0.22 3.09 0.14 4.79 0.20 -0.43 -0.87 118.68 125.38 2vyr s LEU 79 Ca 0.03 -0.06 0.09 0.00 0.69 0.00 0.00 54.13 54.88 2vyr s LEU 79 Cb -0.06 -1.67 -0.04 0.00 -0.43 0.00 0.00 46.19 43.99 2vyr s LEU 79 CO -0.00 0.36 -0.21 -0.31 -0.29 0.00 0.00 176.35 175.90 2vyr s TYR 80 N -0.81 1.88 -0.18 5.38 1.51 0.79 -0.00 117.35 125.92 2vyr s TYR 80 Ca 0.12 -0.43 -0.02 0.00 -1.01 0.00 0.00 57.07 55.74 2vyr s TYR 80 Cb -0.11 -0.98 0.05 0.00 -0.11 0.00 0.00 41.96 40.81 2vyr s TYR 80 CO 0.02 0.29 0.01 -1.17 -1.11 0.00 0.00 175.55 173.58 2vyr s LEU 81 N -2.29 1.35 -0.24 -1.29 2.96 -0.55 -2.38 118.68 116.25 2vyr s LEU 81 Ca 0.12 -0.75 -0.17 0.00 -0.22 0.00 0.00 54.13 53.11 2vyr s LEU 81 Cb -0.08 -0.70 -0.03 0.00 0.50 0.00 0.00 46.19 45.88 2vyr s LEU 81 CO 0.06 -0.26 0.46 -1.58 -1.32 0.00 0.00 176.35 173.70 2vyr s GLN 82 N 1.78 4.10 -0.27 1.98 2.00 0.36 -0.55 119.66 129.06 2vyr s GLN 82 Ca -0.01 0.25 -0.01 0.00 -2.00 0.00 0.00 55.36 53.60 2vyr s GLN 82 Cb -0.16 -3.61 0.04 0.00 0.80 0.00 0.00 33.01 30.08 2vyr s GLN 82 CO -0.07 -0.23 -0.04 -1.64 -0.50 0.00 0.00 175.29 172.81 2vyr s MET 83 N 1.90 2.59 0.42 1.67 -1.94 0.12 -0.43 119.30 123.63 2vyr s MET 83 Ca 0.20 -1.15 0.07 0.00 -1.71 0.00 0.00 55.69 53.10 2vyr s MET 83 Cb -0.15 -3.05 -0.04 0.00 2.01 0.00 0.00 34.83 33.60 2vyr s MET 83 CO 0.09 -0.51 0.22 -0.80 -0.01 0.00 0.00 175.02 174.01 2vyr s ASN 84 N 1.26 4.53 -0.45 3.03 0.01 -0.13 -0.97 114.94 122.23 2vyr s ASN 84 Ca -0.03 -1.05 -0.11 0.00 -0.71 0.00 0.00 52.86 50.96 2vyr s ASN 84 Cb -0.18 -0.41 0.02 0.00 0.41 0.00 0.00 41.25 41.08 2vyr s ASN 84 CO -0.03 -0.61 0.26 -1.54 -1.51 0.00 0.00 177.10 173.67 2vyr n SER 85 N -1.32 -1.66 -4.75 -1.22 3.41 -1.16 -4.69 113.62 102.22 2vyr n SER 85 Ca -0.01 -0.49 -0.37 0.00 -0.26 0.00 0.00 58.87 57.75 2vyr n SER 85 Cb 0.64 -0.62 0.04 0.00 -0.26 0.00 0.00 64.21 64.01 2vyr n SER 85 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2vyr s LEU 86 N -5.38 3.71 0.11 1.04 1.43 -0.74 -4.62 118.68 114.24 2vyr s LEU 86 Ca 0.15 2.51 0.08 0.00 -1.03 0.00 0.00 54.13 55.84 2vyr s LEU 86 Cb -0.09 -4.51 -0.04 0.00 0.03 0.00 0.00 46.19 41.59 2vyr s LEU 86 CO 0.38 -1.62 -0.19 -0.13 0.23 0.00 0.00 176.35 175.01 2vyr s ARG 87 N -3.20 1.11 0.32 1.70 0.52 -1.26 0.33 118.95 118.47 2vyr s ARG 87 Ca 0.76 -1.18 0.09 0.00 -0.52 0.00 0.00 55.73 54.89 2vyr s ARG 87 Cb -0.34 -1.30 0.90 0.00 0.52 0.00 0.00 34.95 34.74 2vyr s ARG 87 CO 0.38 0.29 1.69 1.15 0.02 0.00 0.00 175.30 178.83 2vyr h THR 88 N 3.96 0.43 0.00 0.02 2.02 -1.97 0.32 112.91 117.68 2vyr h THR 88 Ca -0.45 -0.15 0.00 0.00 0.77 0.00 0.00 66.41 66.58 2vyr h THR 88 Cb 1.19 -0.04 0.00 0.00 -1.74 0.00 0.00 68.15 67.56 2vyr h THR 88 CO 0.42 0.08 0.00 -1.84 0.37 0.00 0.00 175.52 174.55 2vyr n GLU 89 N -5.00 0.96 0.00 6.66 0.00 -1.26 -1.99 120.64 120.00 2vyr n GLU 89 Ca 0.27 0.00 0.14 0.00 0.00 0.00 0.00 57.16 57.57 2vyr n GLU 89 Cb 0.80 -1.17 0.62 0.00 0.00 0.00 0.00 31.44 31.69 2vyr n GLU 89 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 2vyr n ASP 90 N -0.67 0.57 -4.71 -1.84 10.43 0.11 -4.90 116.55 115.55 2vyr n ASP 90 Ca 0.08 -0.73 -0.42 0.00 2.57 0.00 0.00 54.79 56.29 2vyr n ASP 90 Cb 0.04 -0.04 -0.03 0.00 1.84 0.00 0.00 41.12 42.92 2vyr n ASP 90 CO 0.00 0.00 0.00 -0.89 -1.07 0.00 0.00 177.20 175.24 2vyr s THR 91 N -2.38 2.44 0.00 -3.53 2.01 -0.84 -4.87 115.64 108.47 2vyr s THR 91 Ca 0.31 0.20 0.00 0.00 0.31 0.00 0.00 61.69 62.51 2vyr s THR 91 Cb 0.20 -3.13 0.00 0.00 0.01 0.00 0.00 72.50 69.59 2vyr s THR 91 CO 0.45 0.01 0.00 0.00 -0.69 0.00 0.00 174.62 174.39 2vyr n ALA 92 N 4.61 0.00 -2.69 7.40 0.00 -0.08 -4.44 120.51 125.31 2vyr n ALA 92 Ca 0.16 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.19 2vyr n ALA 92 Cb 0.37 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.78 2vyr n ALA 92 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2vyr s VAL 93 N -2.00 4.97 -0.15 0.00 1.01 -0.67 -0.85 120.40 122.71 2vyr s VAL 93 Ca 0.00 1.49 -0.10 0.00 0.00 0.00 0.00 61.98 63.37 2vyr s VAL 93 Cb 0.00 -4.07 -0.05 0.00 0.00 0.00 0.00 36.38 32.27 2vyr s VAL 93 CO 0.00 0.14 0.18 -0.31 0.00 0.00 0.00 175.10 175.11 2vyr s TYR 94 N 1.52 3.51 -0.04 5.22 1.51 0.13 -1.42 117.35 127.79 2vyr s TYR 94 Ca 0.37 0.49 0.06 0.00 -1.01 0.00 0.00 57.07 56.98 2vyr s TYR 94 Cb -0.17 -2.11 -0.01 0.00 -0.11 0.00 0.00 41.96 39.56 2vyr s TYR 94 CO 0.15 0.48 -0.23 0.71 -1.11 0.00 0.00 175.55 175.55 2vyr s TYR 95 N -0.27 2.19 -0.03 2.71 1.51 0.95 -0.86 117.35 123.55 2vyr s TYR 95 Ca 0.13 -0.55 -0.23 0.00 -1.01 0.00 0.00 57.07 55.41 2vyr s TYR 95 Cb -0.12 -1.43 -0.04 0.00 -0.11 0.00 0.00 41.96 40.26 2vyr s TYR 95 CO 0.02 -0.13 0.70 0.00 -1.11 0.00 0.00 175.55 175.03 2vyr s ALA 97 N 0.46 0.48 -0.17 0.00 0.00 -0.08 -0.85 121.76 121.60 2vyr s ALA 97 Ca 0.37 -0.04 -0.16 0.00 0.00 0.00 0.00 51.96 52.12 2vyr s ALA 97 Cb -0.18 -0.28 -0.04 0.00 0.00 0.00 0.00 23.12 22.62 2vyr s ALA 97 CO 0.19 0.02 0.41 0.21 0.00 0.00 0.00 175.76 176.59 2vyr s LYS 98 N 0.57 4.24 0.64 0.00 2.20 -0.11 -1.14 119.74 126.13 2vyr s LYS 98 Ca -0.07 0.27 -0.14 0.00 -0.36 0.00 0.00 55.97 55.68 2vyr s LYS 98 Cb -0.10 -3.49 -0.02 0.00 -1.51 0.00 0.00 37.83 32.72 2vyr s LYS 98 CO -0.00 0.06 1.06 -1.25 -0.36 0.00 0.00 175.35 174.85 2vyr s PRO 99 N 0.98 3.14 0.14 4.03 0.04 -1.26 0.23 135.00 142.30 2vyr s PRO 99 Ca 0.21 1.10 -0.13 0.00 0.04 0.00 0.00 61.00 62.22 2vyr s PRO 99 Cb -0.15 -2.01 0.01 0.00 0.04 0.00 0.00 34.50 32.39 2vyr s PRO 99 CO 0.08 -0.95 1.61 2.35 0.04 0.00 0.00 177.00 180.14 2vyr h TRP 100 N -0.07 0.86 -3.28 0.56 -0.00 -0.85 -3.40 115.95 109.78 2vyr h TRP 100 Ca -0.45 -0.13 -0.65 0.00 -0.00 0.00 0.00 58.89 57.66 2vyr h TRP 100 Cb 1.22 -0.23 -0.17 0.00 -0.00 0.00 0.00 29.16 29.98 2vyr h TRP 100 CO 0.60 0.81 -0.61 0.71 -0.00 0.00 0.00 178.44 179.95 2vyr s TYR 101 N -5.12 3.17 0.63 2.65 2.02 -1.26 -4.99 117.35 114.44 2vyr s TYR 101 Ca -0.13 0.04 0.35 0.00 -0.37 0.00 0.00 57.07 56.96 2vyr s TYR 101 Cb 0.11 -1.93 1.96 0.00 -0.40 0.00 0.00 41.96 41.70 2vyr s TYR 101 CO 0.80 0.25 2.20 -1.35 -1.57 0.00 0.00 175.55 175.89 2vyr h PRO 102 N 6.02 0.00 -0.01 -1.71 0.11 -1.86 -2.44 132.00 132.12 2vyr h PRO 102 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 2vyr h PRO 102 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2vyr h PRO 102 CO 0.62 0.00 -0.44 1.97 -0.21 0.00 0.00 178.00 179.94 2vyr n PHE 103 N -3.45 0.00 -2.84 0.65 1.16 -1.26 -0.83 117.46 110.89 2vyr n PHE 103 Ca -0.01 0.00 -0.43 0.00 -1.87 0.00 0.00 57.45 55.14 2vyr n PHE 103 Cb 0.19 -0.11 -0.04 0.00 -1.61 0.00 0.00 39.48 37.91 2vyr n PHE 103 CO 0.00 0.00 0.00 -1.64 -1.87 0.00 0.00 176.76 173.25 2vyr s MET 104 N -2.66 3.37 0.00 3.97 1.00 -0.92 -4.83 119.30 119.23 2vyr s MET 104 Ca 0.18 -0.18 0.03 0.00 0.00 0.00 0.00 55.69 55.72 2vyr s MET 104 Cb 0.18 -4.02 -0.01 0.00 0.00 0.00 0.00 34.83 30.98 2vyr s MET 104 CO 0.61 -1.42 0.31 0.00 0.00 0.00 0.00 175.02 174.52 2vyr n ALA 105 N 7.37 2.43 -2.01 3.03 0.00 -1.26 -4.69 120.51 125.38 2vyr n ALA 105 Ca 0.03 -0.25 -0.22 0.00 0.00 0.00 0.00 53.44 52.99 2vyr n ALA 105 Cb 0.48 -0.11 0.09 0.00 0.00 0.00 0.00 19.45 19.90 2vyr n ALA 105 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2vyr s SER 106 N -0.90 4.67 0.26 0.00 0.01 -1.26 -3.66 113.70 112.83 2vyr s SER 106 Ca 0.02 -0.58 -0.30 0.00 1.31 0.00 0.00 55.95 56.39 2vyr s SER 106 Cb 0.02 0.13 -0.13 0.00 0.21 0.00 0.00 66.02 66.25 2vyr s SER 106 CO 0.09 -1.64 1.34 0.29 0.41 0.00 0.00 173.24 173.73 2vyr n LYS 107 N -2.57 1.94 -0.75 12.44 4.01 -1.26 -2.51 118.16 129.45 2vyr n LYS 107 Ca 0.15 0.69 0.00 0.00 -0.51 0.00 0.00 58.31 58.64 2vyr n LYS 107 Cb 0.61 -2.30 0.00 0.00 -0.51 0.00 0.00 35.03 32.83 2vyr n LYS 107 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2vyr n GLY 108 N 1.81 0.60 3.72 0.72 0.00 -1.26 -5.02 105.19 105.77 2vyr n GLY 108 Ca 0.10 -0.26 -0.42 0.00 0.00 0.00 0.00 46.02 45.44 2vyr n GLY 108 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2vyr s SER 109 N -2.24 6.69 0.05 1.61 0.01 -1.04 -4.94 113.70 113.84 2vyr s SER 109 Ca 0.00 2.52 -0.30 0.00 1.31 0.00 0.00 55.95 59.47 2vyr s SER 109 Cb 0.00 -2.60 -0.08 0.00 0.21 0.00 0.00 66.02 63.55 2vyr s SER 109 CO 0.00 -0.73 1.68 -1.61 0.41 0.00 0.00 173.24 172.98 2vyr s GLU 110 N 0.83 4.19 0.40 12.44 2.02 -1.26 -4.95 118.70 132.38 2vyr s GLU 110 Ca 0.66 2.33 -0.25 0.00 0.02 0.00 0.00 54.97 57.73 2vyr s GLU 110 Cb -0.41 -3.69 -0.08 0.00 0.10 0.00 0.00 34.13 30.05 2vyr s GLU 110 CO 0.33 -0.77 1.13 -0.06 0.02 0.00 0.00 175.26 175.92 2vyr s PHE 111 N 2.96 3.11 -0.19 1.61 2.99 -1.26 -0.26 117.98 126.94 2vyr s PHE 111 Ca 0.75 1.58 -0.13 0.00 0.00 0.00 0.00 56.93 59.13 2vyr s PHE 111 Cb -0.39 -3.32 -0.08 0.00 0.00 0.00 0.00 43.02 39.23 2vyr s PHE 111 CO 0.33 -1.14 -0.29 -3.47 -0.00 0.00 0.00 175.22 170.65 2vyr n ASP 112 N -0.01 1.68 -4.02 1.36 4.64 0.13 -4.47 116.55 115.87 2vyr n ASP 112 Ca 0.05 0.29 -0.08 0.00 -1.38 0.00 0.00 54.79 53.66 2vyr n ASP 112 Cb 0.47 -0.67 -0.09 0.00 -1.04 0.00 0.00 41.12 39.79 2vyr n ASP 112 CO 0.00 0.00 0.00 -0.31 -0.82 0.00 0.00 177.20 176.07 2vyr s TYR 113 N -2.54 0.43 0.14 -0.67 1.51 -1.07 -5.02 117.35 110.13 2vyr s TYR 113 Ca -0.29 -0.92 -0.13 0.00 -1.01 0.00 0.00 57.07 54.73 2vyr s TYR 113 Cb 0.09 -0.28 0.01 0.00 -0.11 0.00 0.00 41.96 41.67 2vyr s TYR 113 CO 0.38 -0.46 0.34 1.67 -1.11 0.00 0.00 175.55 176.37 2vyr s TRP 114 N -3.92 0.06 0.80 2.71 -2.14 -1.26 -0.93 118.94 114.26 2vyr s TRP 114 Ca 0.09 -0.42 -0.14 0.00 2.66 0.00 0.00 56.10 58.29 2vyr s TRP 114 Cb 0.07 0.12 0.19 0.00 -3.10 0.00 0.00 33.47 30.74 2vyr s TRP 114 CO -0.09 -0.70 1.05 0.41 -2.66 0.00 0.00 176.95 174.96 2vyr n GLY 115 N -0.20 -1.54 0.22 3.67 0.00 -0.03 -4.75 105.19 102.55 2vyr n GLY 115 Ca -0.12 -1.68 0.12 0.00 0.00 0.00 0.00 46.02 44.33 2vyr n GLY 115 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2vyr h GLN 116 N 0.00 0.00 0.00 1.61 4.15 -1.92 -3.46 115.11 115.49 2vyr h GLN 116 Ca -0.34 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.08 2vyr h GLN 116 Cb 0.95 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.64 2vyr h GLN 116 CO 0.24 0.07 0.00 0.41 -1.93 0.00 0.00 178.83 177.62 2vyr n GLY 117 N 0.93 2.27 2.91 2.39 0.00 -1.26 -5.03 105.19 107.40 2vyr n GLY 117 Ca 0.03 -1.89 -0.19 0.00 0.00 0.00 0.00 46.02 43.97 2vyr n GLY 117 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2vyr s THR 118 N -2.92 0.53 0.02 2.61 -1.32 -0.04 -4.76 115.64 109.76 2vyr s THR 118 Ca 0.00 -0.15 -0.30 0.00 -1.21 0.00 0.00 61.69 60.04 2vyr s THR 118 Cb 0.00 -0.53 -0.03 0.00 -1.51 0.00 0.00 72.50 70.42 2vyr s THR 118 CO 0.00 0.21 0.97 -0.22 -2.21 0.00 0.00 174.62 173.37 2vyr s LEU 119 N 0.72 4.39 -0.21 9.08 2.96 -1.26 -0.69 118.68 133.67 2vyr s LEU 119 Ca -0.10 1.67 0.02 0.00 -0.22 0.00 0.00 54.13 55.50 2vyr s LEU 119 Cb -0.13 -3.56 0.04 0.00 0.50 0.00 0.00 46.19 43.04 2vyr s LEU 119 CO 0.00 -0.22 -0.15 -0.69 -1.32 0.00 0.00 176.35 173.97 2vyr s VAL 120 N 0.84 1.99 -0.24 1.68 1.01 -0.03 -1.71 120.40 123.93 2vyr s VAL 120 Ca 0.51 -1.17 -0.03 0.00 0.00 0.00 0.00 61.98 61.30 2vyr s VAL 120 Cb -0.21 -1.95 0.01 0.00 0.00 0.00 0.00 36.38 34.23 2vyr s VAL 120 CO 0.28 0.28 -0.05 -0.89 0.00 0.00 0.00 175.10 174.72 2vyr s THR 121 N 1.26 3.08 -0.36 3.92 2.01 -0.40 -0.90 115.64 124.24 2vyr s THR 121 Ca -0.01 -0.84 -0.10 0.00 0.31 0.00 0.00 61.69 61.06 2vyr s THR 121 Cb -0.16 -2.51 0.02 0.00 0.01 0.00 0.00 72.50 69.87 2vyr s THR 121 CO -0.09 0.27 0.19 -0.69 -0.69 0.00 0.00 174.62 173.60 2vyr s VAL 122 N 1.38 4.47 0.22 3.82 1.01 -1.26 -1.40 120.40 128.65 2vyr s VAL 122 Ca 0.02 -0.84 -0.21 0.00 0.00 0.00 0.00 61.98 60.96 2vyr s VAL 122 Cb -0.16 -3.47 0.07 0.00 0.00 0.00 0.00 36.38 32.82 2vyr s VAL 122 CO -0.04 -0.19 0.98 -0.94 0.00 0.00 0.00 175.10 174.91 2vyr s SER 123 N 1.54 -0.02 0.00 3.32 1.04 -0.06 -4.41 113.70 115.11 2vyr s SER 123 Ca 0.02 -0.74 0.00 0.00 0.48 0.00 0.00 55.95 55.71 2vyr s SER 123 Cb -0.19 0.57 0.00 0.00 0.10 0.00 0.00 66.02 66.50 2vyr s SER 123 CO 0.06 -1.13 0.46 -1.54 0.98 0.00 0.00 173.24 172.07