#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gyr n PRO 38 N 0.00 0.00 -1.21 0.00 -0.01 -1.26 -2.26 135.00 130.26 3gyr n PRO 38 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 63.50 63.49 3gyr n PRO 38 Cb 0.00 -1.41 0.00 0.00 -0.01 0.00 0.00 33.50 32.08 3gyr n PRO 38 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 3gyr n GLY 39 N 3.68 0.47 3.54 -1.23 0.00 -1.26 -5.07 105.19 105.33 3gyr n GLY 39 Ca 0.29 -0.92 -0.27 0.00 0.00 0.00 0.00 46.02 45.11 3gyr n GLY 39 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3gyr s GLU 40 N -2.45 1.96 0.24 1.61 2.02 -0.96 -4.81 118.70 116.30 3gyr s GLU 40 Ca 0.00 -1.31 -0.28 0.00 0.02 0.00 0.00 54.97 53.41 3gyr s GLU 40 Cb 0.00 -2.10 -0.09 0.00 0.10 0.00 0.00 34.13 32.04 3gyr s GLU 40 CO 0.00 0.43 0.89 -0.51 0.02 0.00 0.00 175.26 176.09 3gyr s LEU 41 N -2.77 4.56 -0.26 1.80 1.43 -1.26 -4.89 118.68 117.30 3gyr s LEU 41 Ca 0.24 1.82 -0.27 0.00 -1.03 0.00 0.00 54.13 54.89 3gyr s LEU 41 Cb -0.09 -3.61 0.01 0.00 0.03 0.00 0.00 46.19 42.53 3gyr s LEU 41 CO 0.14 0.12 0.96 -0.89 0.23 0.00 0.00 176.35 176.92 3gyr s THR 42 N -1.27 4.70 0.58 5.49 2.01 -1.26 -5.03 115.64 120.87 3gyr s THR 42 Ca 0.42 1.76 -0.17 0.00 0.31 0.00 0.00 61.69 64.01 3gyr s THR 42 Cb -0.23 -4.26 -0.04 0.00 0.01 0.00 0.00 72.50 67.98 3gyr s THR 42 CO 0.28 -0.21 1.07 -2.16 -0.69 0.00 0.00 174.62 172.92 3gyr s PRO 43 N 3.16 3.29 -1.19 4.92 0.04 -1.26 -3.77 135.00 140.18 3gyr s PRO 43 Ca 0.41 1.32 -0.06 0.00 0.04 0.00 0.00 61.00 62.71 3gyr s PRO 43 Cb -0.14 -2.02 0.01 0.00 0.04 0.00 0.00 34.50 32.38 3gyr s PRO 43 CO 0.09 -0.85 1.03 1.19 0.04 0.00 0.00 177.00 178.50 3gyr n PHE 44 N -1.84 -2.45 0.41 0.56 0.99 0.45 -4.93 117.46 110.64 3gyr n PHE 44 Ca 0.10 0.91 0.11 0.00 -0.00 0.00 0.00 57.45 58.56 3gyr n PHE 44 Cb 0.52 -4.73 -0.01 0.00 -1.00 0.00 0.00 39.48 34.26 3gyr n PHE 44 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 3gyr n ALA 45 N -4.51 3.19 -2.75 4.37 0.00 -1.25 -4.68 120.51 114.88 3gyr n ALA 45 Ca -0.07 -0.40 -0.16 0.00 0.00 0.00 0.00 53.44 52.81 3gyr n ALA 45 Cb 0.58 -0.96 -0.14 0.00 0.00 0.00 0.00 19.45 18.94 3gyr n ALA 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3gyr s ALA 46 N -3.27 0.58 0.65 0.00 0.00 -1.26 -4.95 121.76 113.52 3gyr s ALA 46 Ca 0.01 -0.39 -0.17 0.00 0.00 0.00 0.00 51.96 51.41 3gyr s ALA 46 Cb 0.13 -0.11 -0.00 0.00 0.00 0.00 0.00 23.12 23.14 3gyr s ALA 46 CO 0.82 0.11 1.20 -1.25 0.00 0.00 0.00 175.76 176.64 3gyr s PRO 47 N -0.44 2.63 0.35 0.00 0.04 -1.26 -1.98 135.00 134.34 3gyr s PRO 47 Ca 0.00 1.75 -0.28 0.00 0.04 0.00 0.00 61.00 62.51 3gyr s PRO 47 Cb -0.04 -1.89 -0.11 0.00 0.04 0.00 0.00 34.50 32.50 3gyr s PRO 47 CO -0.00 -1.45 1.40 -1.17 0.04 0.00 0.00 177.00 175.82 3gyr s LEU 48 N -4.59 4.37 0.31 -3.56 2.96 0.24 -4.71 118.68 113.70 3gyr s LEU 48 Ca 0.75 2.88 0.08 0.00 -0.22 0.00 0.00 54.13 57.62 3gyr s LEU 48 Cb -0.29 -3.66 -0.04 0.00 0.50 0.00 0.00 46.19 42.71 3gyr s LEU 48 CO 0.39 -0.72 0.14 0.42 -1.32 0.00 0.00 176.35 175.26 3gyr s THR 49 N -1.09 3.35 0.05 3.68 -4.23 -1.26 -4.98 115.64 111.16 3gyr s THR 49 Ca 0.51 -1.67 0.09 0.00 -1.18 0.00 0.00 61.69 59.44 3gyr s THR 49 Cb -0.43 -3.03 -0.03 0.00 1.34 0.00 0.00 72.50 70.35 3gyr s THR 49 CO 0.58 -0.24 -0.24 0.68 -0.54 0.00 0.00 174.62 174.85 3gyr s VAL 50 N -2.35 1.98 0.90 2.29 -7.23 -1.26 -4.76 120.40 109.97 3gyr s VAL 50 Ca 0.36 -1.34 -0.10 0.00 -1.81 0.00 0.00 61.98 59.09 3gyr s VAL 50 Cb -0.04 -1.71 0.14 0.00 0.56 0.00 0.00 36.38 35.33 3gyr s VAL 50 CO 0.23 0.30 1.16 -2.84 -0.31 0.00 0.00 175.10 173.64 3gyr s PRO 51 N -1.25 1.06 0.75 4.82 0.02 -1.26 -4.98 135.00 134.16 3gyr s PRO 51 Ca 0.10 1.60 -0.11 0.00 0.02 0.00 0.00 61.00 62.61 3gyr s PRO 51 Cb -0.10 -1.73 0.04 0.00 0.02 0.00 0.00 34.50 32.74 3gyr s PRO 51 CO 0.02 -2.61 1.08 -1.25 -0.33 0.00 0.00 177.00 173.91 3gyr s PRO 52 N -4.56 2.47 -0.18 5.54 0.04 -1.26 -4.56 135.00 132.49 3gyr s PRO 52 Ca 0.68 0.79 -0.14 0.00 0.04 0.00 0.00 61.00 62.37 3gyr s PRO 52 Cb -0.24 -1.95 -0.05 0.00 0.04 0.00 0.00 34.50 32.31 3gyr s PRO 52 CO 0.57 -1.39 0.30 0.08 0.04 0.00 0.00 177.00 176.60 3gyr s VAL 53 N -3.10 5.29 -0.12 -0.36 1.01 -1.26 -1.35 120.40 120.52 3gyr s VAL 53 Ca 0.60 0.54 -0.00 0.00 0.00 0.00 0.00 61.98 63.12 3gyr s VAL 53 Cb -0.14 -3.64 -0.02 0.00 0.00 0.00 0.00 36.38 32.58 3gyr s VAL 53 CO 0.55 0.36 -0.10 -0.22 0.00 0.00 0.00 175.10 175.68 3gyr s LEU 54 N 0.68 2.89 -0.34 3.92 2.96 0.31 -4.93 118.68 124.16 3gyr s LEU 54 Ca 0.16 -0.23 0.03 0.00 -0.22 0.00 0.00 54.13 53.87 3gyr s LEU 54 Cb -0.13 -1.65 0.10 0.00 0.50 0.00 0.00 46.19 45.01 3gyr s LEU 54 CO 0.05 0.21 0.07 -0.13 -1.32 0.00 0.00 176.35 175.22 3gyr s ARG 55 N 0.08 1.38 0.00 1.98 0.52 -1.26 -0.76 118.95 120.89 3gyr s ARG 55 Ca -0.04 -1.78 0.25 0.00 -0.52 0.00 0.00 55.73 53.64 3gyr s ARG 55 Cb -0.14 -3.02 0.80 0.00 0.52 0.00 0.00 34.95 33.11 3gyr s ARG 55 CO 0.04 -0.96 1.59 -0.35 0.02 0.00 0.00 175.30 175.65 3gyr n PRO 56 N 4.29 1.83 -2.01 3.54 -0.04 -1.26 -4.91 135.00 136.44 3gyr n PRO 56 Ca 0.03 -1.23 -0.38 0.00 -0.04 0.00 0.00 63.50 61.88 3gyr n PRO 56 Cb 0.42 -1.45 0.01 0.00 -0.04 0.00 0.00 33.50 32.44 3gyr n PRO 56 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3gyr s ALA 57 N -1.89 2.97 0.26 0.55 0.00 -1.26 -4.85 121.76 117.54 3gyr s ALA 57 Ca 0.35 1.17 -0.18 0.00 0.00 0.00 0.00 51.96 53.30 3gyr s ALA 57 Cb 0.20 -3.48 0.01 0.00 0.00 0.00 0.00 23.12 19.85 3gyr s ALA 57 CO 0.31 -1.00 0.62 -1.54 0.00 0.00 0.00 175.76 174.15 3gyr s SER 58 N -1.06 -0.20 0.38 0.00 1.04 -1.26 -5.03 113.70 107.57 3gyr s SER 58 Ca 0.66 -0.71 0.21 0.00 0.48 0.00 0.00 55.95 56.58 3gyr s SER 58 Cb -0.36 0.66 0.60 0.00 0.10 0.00 0.00 66.02 67.03 3gyr s SER 58 CO 0.43 -1.25 1.69 0.44 0.98 0.00 0.00 173.24 175.53 3gyr h ASP 59 N 2.11 0.00 -3.52 7.02 3.32 -1.98 -3.40 116.42 119.96 3gyr h ASP 59 Ca -0.22 0.00 -0.71 0.00 0.02 0.00 0.00 57.03 56.11 3gyr h ASP 59 Cb 1.25 0.00 -0.27 0.00 0.22 0.00 0.00 39.33 40.53 3gyr h ASP 59 CO 0.29 0.32 -0.50 -1.61 -1.72 0.00 0.00 179.24 176.01 3gyr s GLU 60 N -3.42 2.67 0.39 3.56 2.02 -1.26 -4.94 118.70 117.73 3gyr s GLU 60 Ca 0.02 -1.31 0.20 0.00 0.02 0.00 0.00 54.97 53.90 3gyr s GLU 60 Cb 0.09 -3.72 0.77 0.00 0.10 0.00 0.00 34.13 31.37 3gyr s GLU 60 CO 0.68 -0.84 1.77 -0.24 0.02 0.00 0.00 175.26 176.65 3gyr h VAL 61 N 6.03 0.84 0.00 2.63 3.04 -1.90 -1.71 116.25 125.17 3gyr h VAL 61 Ca -0.24 -1.39 0.00 0.00 -1.01 0.00 0.00 66.70 64.07 3gyr h VAL 61 Cb 1.09 1.85 0.00 0.00 -2.01 0.00 0.00 31.29 32.22 3gyr h VAL 61 CO 0.71 0.33 0.00 0.35 -1.01 0.00 0.00 177.57 177.95 3gyr n THR 62 N -3.55 0.43 -3.02 3.17 -2.24 -1.26 -4.57 114.28 103.23 3gyr n THR 62 Ca -0.00 0.10 -0.43 0.00 -2.27 0.00 0.00 64.05 61.44 3gyr n THR 62 Cb 0.47 -0.71 -0.06 0.00 -2.10 0.00 0.00 70.33 67.94 3gyr n THR 62 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 3gyr s ARG 63 N -3.01 3.26 0.55 -0.78 3.52 -0.65 -5.03 118.95 116.82 3gyr s ARG 63 Ca 0.11 -0.48 -0.16 0.00 -0.13 0.00 0.00 55.73 55.07 3gyr s ARG 63 Cb 0.15 -4.03 -0.06 0.00 -1.56 0.00 0.00 34.95 29.44 3gyr s ARG 63 CO 0.42 -1.25 1.01 -1.21 -0.81 0.00 0.00 175.30 173.46 3gyr s GLU 64 N 3.18 3.71 -0.31 5.12 2.02 -1.26 -4.83 118.70 126.33 3gyr s GLU 64 Ca 0.23 1.01 -0.19 0.00 0.02 0.00 0.00 54.97 56.04 3gyr s GLU 64 Cb -0.15 -2.10 -0.01 0.00 0.10 0.00 0.00 34.13 31.97 3gyr s GLU 64 CO 0.17 -0.47 0.55 0.99 0.02 0.00 0.00 175.26 176.52 3gyr s THR 65 N -2.64 5.00 -0.03 3.63 2.01 -0.76 -4.93 115.64 117.93 3gyr s THR 65 Ca 0.60 0.68 -0.30 0.00 0.31 0.00 0.00 61.69 62.98 3gyr s THR 65 Cb -0.12 -3.93 -0.03 0.00 0.01 0.00 0.00 72.50 68.43 3gyr s THR 65 CO 0.36 -0.10 1.12 -0.70 -0.69 0.00 0.00 174.62 174.61 3gyr s GLU 66 N 2.45 4.42 -0.25 4.92 2.12 -1.26 -1.17 118.70 129.93 3gyr s GLU 66 Ca 0.22 1.59 -0.00 0.00 0.36 0.00 0.00 54.97 57.13 3gyr s GLU 66 Cb -0.15 -3.49 0.04 0.00 0.26 0.00 0.00 34.13 30.78 3gyr s GLU 66 CO 0.12 -0.31 -0.08 0.42 -0.54 0.00 0.00 175.26 174.87 3gyr s ILE 67 N 1.71 2.65 -0.24 -3.70 1.01 -0.37 -4.92 121.20 117.34 3gyr s ILE 67 Ca 0.54 -1.20 -0.09 0.00 0.00 0.00 0.00 60.65 59.90 3gyr s ILE 67 Cb -0.24 -2.39 -0.04 0.00 0.01 0.00 0.00 42.46 39.80 3gyr s ILE 67 CO 0.24 0.14 0.12 0.00 0.00 0.00 0.00 174.94 175.44 3gyr s ALA 68 N 1.26 3.40 -0.13 9.38 0.00 -1.26 -0.59 121.76 133.83 3gyr s ALA 68 Ca -0.02 -1.00 -0.29 0.00 0.00 0.00 0.00 51.96 50.65 3gyr s ALA 68 Cb -0.17 -2.21 -0.01 0.00 0.00 0.00 0.00 23.12 20.73 3gyr s ALA 68 CO -0.05 -0.32 1.00 -0.51 0.00 0.00 0.00 175.76 175.88 3gyr s LEU 69 N 1.31 4.22 0.07 0.00 1.02 -0.25 0.82 118.68 125.86 3gyr s LEU 69 Ca 0.06 1.48 0.00 0.00 0.02 0.00 0.00 54.13 55.69 3gyr s LEU 69 Cb -0.15 -3.52 -0.04 0.00 0.02 0.00 0.00 46.19 42.50 3gyr s LEU 69 CO 0.05 -0.47 -0.04 -0.13 0.02 0.00 0.00 176.35 175.78 3gyr s ARG 70 N 2.19 0.69 0.64 1.70 0.52 -0.82 -0.98 118.95 122.88 3gyr s ARG 70 Ca 0.47 -1.25 -0.14 0.00 -0.52 0.00 0.00 55.73 54.29 3gyr s ARG 70 Cb -0.18 0.06 -0.02 0.00 0.52 0.00 0.00 34.95 35.33 3gyr s ARG 70 CO 0.16 -0.07 1.06 -2.14 0.02 0.00 0.00 175.30 174.33 3gyr s PRO 71 N -3.84 3.12 -0.15 3.54 0.02 -1.26 -0.84 135.00 135.58 3gyr s PRO 71 Ca 0.08 1.15 -0.29 0.00 0.02 0.00 0.00 61.00 61.96 3gyr s PRO 71 Cb 0.07 -2.01 0.09 0.00 0.02 0.00 0.00 34.50 32.67 3gyr s PRO 71 CO -0.08 -0.97 0.79 -0.08 -0.33 0.00 0.00 177.00 176.33 3gyr s THR 72 N -2.63 0.00 -0.12 0.99 -1.32 0.96 -4.82 115.64 108.70 3gyr s THR 72 Ca 0.62 0.00 -0.03 0.00 -1.21 0.00 0.00 61.69 61.07 3gyr s THR 72 Cb -0.16 -1.00 -0.03 0.00 -1.51 0.00 0.00 72.50 69.80 3gyr s THR 72 CO 0.43 0.00 -0.02 0.26 -2.21 0.00 0.00 174.62 173.08 3gyr s TRP 73 N -0.65 3.07 -0.03 9.09 0.52 -1.26 -0.48 118.94 129.20 3gyr s TRP 73 Ca -0.05 -0.06 0.01 0.00 0.02 0.00 0.00 56.10 56.02 3gyr s TRP 73 Cb -0.02 -1.87 0.01 0.00 -1.15 0.00 0.00 33.47 30.44 3gyr s TRP 73 CO 0.05 0.20 -0.04 0.08 0.02 0.00 0.00 176.95 177.25 3gyr s VAL 74 N -0.22 0.47 -0.74 4.03 1.01 -0.37 -4.88 120.40 119.70 3gyr s VAL 74 Ca 0.04 -0.13 -0.18 0.00 0.00 0.00 0.00 61.98 61.71 3gyr s VAL 74 Cb -0.13 -0.47 0.13 0.00 0.00 0.00 0.00 36.38 35.91 3gyr s VAL 74 CO 0.02 0.19 0.86 -0.60 0.00 0.00 0.00 175.10 175.57 3gyr s ARG 75 N 0.61 3.30 0.50 2.72 6.06 -1.26 -0.55 118.95 130.32 3gyr s ARG 75 Ca -0.08 -1.59 0.15 0.00 -2.50 0.00 0.00 55.73 51.71 3gyr s ARG 75 Cb -0.11 -4.47 1.18 0.00 0.06 0.00 0.00 34.95 31.61 3gyr s ARG 75 CO -0.00 -1.59 2.12 -0.07 -2.50 0.00 0.00 175.30 173.25 3gyr h LEU 76 N 9.87 0.05 -7.00 -0.88 3.38 -1.83 -3.45 115.31 115.45 3gyr h LEU 76 Ca -0.10 -0.00 0.03 0.00 0.09 0.00 0.00 57.88 57.90 3gyr h LEU 76 Cb 1.06 -0.01 -0.23 0.00 0.09 0.00 0.00 40.66 41.56 3gyr h LEU 76 CO 1.05 0.07 0.38 -2.28 0.09 0.00 0.00 178.44 177.75 3gyr s HIS 77 N -5.05 -0.53 0.54 1.13 5.04 -1.26 -0.84 115.29 114.31 3gyr s HIS 77 Ca -0.05 1.14 0.23 0.00 -1.54 0.00 0.00 55.06 54.84 3gyr s HIS 77 Cb 0.17 0.38 1.41 0.00 0.04 0.00 0.00 32.58 34.57 3gyr s HIS 77 CO 0.68 -0.35 2.06 -1.35 -2.34 0.00 0.00 174.74 173.44 3gyr h PRO 78 N 3.69 0.00 -0.29 2.88 0.11 -1.92 -1.19 132.00 135.28 3gyr h PRO 78 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 3gyr h PRO 78 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3gyr h PRO 78 CO 0.20 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 179.03 3gyr n GLN 79 N -4.32 1.79 -4.23 1.05 6.02 -1.26 -4.85 117.38 111.58 3gyr n GLN 79 Ca 0.04 -1.21 -0.27 0.00 -0.01 0.00 0.00 57.00 55.55 3gyr n GLN 79 Cb 0.40 -1.32 -0.08 0.00 1.02 0.00 0.00 30.24 30.26 3gyr n GLN 79 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3gyr s LEU 80 N -1.19 3.18 0.92 1.08 1.43 -0.45 -5.04 118.68 118.62 3gyr s LEU 80 Ca 0.27 -0.45 -0.11 0.00 -1.03 0.00 0.00 54.13 52.80 3gyr s LEU 80 Cb 0.14 -1.86 0.14 0.00 0.03 0.00 0.00 46.19 44.65 3gyr s LEU 80 CO 0.20 0.10 1.09 -2.16 0.23 0.00 0.00 176.35 175.81 3gyr s PRO 81 N -2.82 1.04 0.88 1.29 0.04 -1.26 -4.79 135.00 129.38 3gyr s PRO 81 Ca 0.26 1.00 -0.11 0.00 0.04 0.00 0.00 61.00 62.18 3gyr s PRO 81 Cb -0.09 -1.77 0.13 0.00 0.04 0.00 0.00 34.50 32.80 3gyr s PRO 81 CO 0.17 -2.44 1.17 -2.14 0.04 0.00 0.00 177.00 173.80 3gyr s PRO 82 N -4.81 1.19 -0.11 0.56 0.02 -1.26 -4.68 135.00 125.90 3gyr s PRO 82 Ca 0.64 1.64 0.03 0.00 0.02 0.00 0.00 61.00 63.33 3gyr s PRO 82 Cb -0.20 -1.74 -0.00 0.00 0.02 0.00 0.00 34.50 32.58 3gyr s PRO 82 CO 0.58 -2.53 -0.22 0.99 -0.33 0.00 0.00 177.00 175.50 3gyr s THR 83 N -2.47 2.27 0.05 0.99 2.01 0.28 -4.84 115.64 113.94 3gyr s THR 83 Ca 0.69 -0.94 -0.31 0.00 0.31 0.00 0.00 61.69 61.44 3gyr s THR 83 Cb -0.25 -1.89 -0.06 0.00 0.01 0.00 0.00 72.50 70.31 3gyr s THR 83 CO 0.56 0.55 1.37 -0.22 -0.69 0.00 0.00 174.62 176.19 3gyr s LEU 84 N 0.38 4.34 0.19 4.42 2.96 -1.26 -1.23 118.68 128.48 3gyr s LEU 84 Ca -0.16 2.18 -0.02 0.00 -0.22 0.00 0.00 54.13 55.91 3gyr s LEU 84 Cb -0.17 -3.57 -0.04 0.00 0.50 0.00 0.00 46.19 42.91 3gyr s LEU 84 CO 0.08 -0.66 0.14 -0.04 -1.32 0.00 0.00 176.35 174.55 3gyr s MET 85 N 1.72 1.16 -0.21 1.98 -1.94 0.37 -4.79 119.30 117.59 3gyr s MET 85 Ca 0.63 -1.55 -0.06 0.00 -1.71 0.00 0.00 55.69 53.01 3gyr s MET 85 Cb -0.33 0.28 -0.03 0.00 2.01 0.00 0.00 34.83 36.76 3gyr s MET 85 CO 0.28 -0.38 0.03 -1.58 -0.01 0.00 0.00 175.02 173.36 3gyr s TRP 86 N -4.12 3.08 0.02 -0.03 0.51 -0.33 -0.03 118.94 118.04 3gyr s TRP 86 Ca 0.34 -0.37 0.04 0.00 -2.12 0.00 0.00 56.10 53.99 3gyr s TRP 86 Cb 0.06 -2.12 -0.02 0.00 -0.81 0.00 0.00 33.47 30.59 3gyr s TRP 86 CO 0.09 -0.21 -0.13 0.20 -0.51 0.00 0.00 176.95 176.39 3gyr s GLY 87 N 1.07 0.69 0.08 0.98 0.00 -0.02 -3.30 107.32 106.82 3gyr s GLY 87 Ca 0.03 -0.68 -0.31 0.00 0.00 0.00 0.00 44.72 43.76 3gyr s GLY 87 CO 0.02 -0.63 1.80 -0.19 0.00 0.00 0.00 173.10 174.10 3gyr s TYR 88 N -0.60 2.04 -1.08 1.90 2.02 -1.18 -1.43 117.35 119.02 3gyr s TYR 88 Ca 0.03 -0.00 -0.01 0.00 -0.37 0.00 0.00 57.07 56.71 3gyr s TYR 88 Cb -0.06 -4.12 0.01 0.00 -0.40 0.00 0.00 41.96 37.39 3gyr s TYR 88 CO 0.00 -4.67 0.08 -0.25 -1.57 0.00 0.00 175.55 169.14 3gyr n ASP 89 N 6.11 -3.89 -1.10 2.29 8.00 0.24 -1.47 116.55 126.73 3gyr n ASP 89 Ca 0.18 0.11 -0.14 0.00 0.71 0.00 0.00 54.79 55.65 3gyr n ASP 89 Cb 0.40 -3.29 -0.05 0.00 -0.02 0.00 0.00 41.12 38.15 3gyr n ASP 89 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3gyr n GLY 90 N -0.87 1.22 3.32 0.44 0.00 -0.51 -4.99 105.19 103.80 3gyr n GLY 90 Ca -0.13 -0.38 -0.31 0.00 0.00 0.00 0.00 46.02 45.20 3gyr n GLY 90 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3gyr s GLN 91 N -3.33 2.23 -0.20 1.61 -1.52 -0.54 -4.84 119.66 113.07 3gyr s GLN 91 Ca 0.00 -0.90 0.00 0.00 -1.95 0.00 0.00 55.36 52.52 3gyr s GLN 91 Cb 0.00 -2.10 0.05 0.00 -0.22 0.00 0.00 33.01 30.73 3gyr s GLN 91 CO 0.00 0.54 -0.07 0.08 -0.25 0.00 0.00 175.29 175.59 3gyr s VAL 92 N -0.55 1.41 1.04 1.09 1.01 -1.26 -2.66 120.40 120.48 3gyr s VAL 92 Ca 0.08 -0.93 -0.13 0.00 0.00 0.00 0.00 61.98 61.01 3gyr s VAL 92 Cb -0.11 -1.58 0.22 0.00 0.00 0.00 0.00 36.38 34.91 3gyr s VAL 92 CO -0.00 0.07 1.08 -2.84 0.00 0.00 0.00 175.10 173.41 3gyr s PRO 93 N 1.49 0.05 1.04 2.72 0.02 -1.26 -4.25 135.00 134.80 3gyr s PRO 93 Ca -0.02 0.58 -0.12 0.00 0.02 0.00 0.00 61.00 61.45 3gyr s PRO 93 Cb -0.17 -1.69 0.21 0.00 0.02 0.00 0.00 34.50 32.88 3gyr s PRO 93 CO -0.07 -3.00 1.08 0.20 -0.33 0.00 0.00 177.00 174.87 3gyr s GLY 94 N -3.24 1.56 0.42 0.52 0.00 0.04 -4.79 107.32 101.84 3gyr s GLY 94 Ca 0.66 -0.30 -0.24 0.00 0.00 0.00 0.00 44.72 44.85 3gyr s GLY 94 CO 0.59 0.34 0.92 -1.05 0.00 0.00 0.00 173.10 173.90 3gyr n PRO 95 N -4.37 1.16 -2.55 2.90 -0.02 -1.26 -4.55 135.00 126.31 3gyr n PRO 95 Ca 0.05 0.42 -0.43 0.00 -2.02 0.00 0.00 63.50 61.52 3gyr n PRO 95 Cb 0.56 -1.93 -0.02 0.00 -0.02 0.00 0.00 33.50 32.10 3gyr n PRO 95 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3gyr s THR 96 N -1.31 4.16 0.02 3.45 2.01 -0.45 -4.27 115.64 119.25 3gyr s THR 96 Ca 0.64 1.20 -0.28 0.00 0.31 0.00 0.00 61.69 63.56 3gyr s THR 96 Cb -0.57 -4.51 -0.04 0.00 0.01 0.00 0.00 72.50 67.39 3gyr s THR 96 CO 0.57 -0.91 0.90 -0.63 -0.69 0.00 0.00 174.62 173.85 3gyr s ILE 97 N 4.59 4.78 -0.07 1.82 1.01 -0.77 -0.53 121.20 132.04 3gyr s ILE 97 Ca 0.51 1.90 0.03 0.00 0.00 0.00 0.00 60.65 63.09 3gyr s ILE 97 Cb -0.09 -4.25 0.00 0.00 0.01 0.00 0.00 42.46 38.14 3gyr s ILE 97 CO 0.31 0.24 -0.17 -0.70 0.00 0.00 0.00 174.94 174.62 3gyr s GLU 98 N 0.56 2.16 0.09 2.79 2.12 0.07 0.08 118.70 126.56 3gyr s GLU 98 Ca 0.46 -0.62 -0.02 0.00 0.36 0.00 0.00 54.97 55.16 3gyr s GLU 98 Cb -0.21 -1.74 -0.04 0.00 0.26 0.00 0.00 34.13 32.40 3gyr s GLU 98 CO 0.26 0.14 0.02 0.14 -0.54 0.00 0.00 175.26 175.29 3gyr s VAL 99 N 0.37 0.16 0.02 3.70 -7.23 -0.74 -4.38 120.40 112.30 3gyr s VAL 99 Ca -0.13 -1.81 -0.03 0.00 -1.81 0.00 0.00 61.98 58.19 3gyr s VAL 99 Cb -0.15 -1.74 -0.04 0.00 0.56 0.00 0.00 36.38 35.00 3gyr s VAL 99 CO 0.05 -0.74 0.22 -0.13 -0.31 0.00 0.00 175.10 174.19 3gyr s ARG 100 N -3.97 3.49 0.12 4.82 0.52 -1.26 -0.63 118.95 122.03 3gyr s ARG 100 Ca 0.14 -0.26 -0.35 0.00 -0.52 0.00 0.00 55.73 54.75 3gyr s ARG 100 Cb 0.08 -3.07 -0.17 0.00 0.52 0.00 0.00 34.95 32.31 3gyr s ARG 100 CO -0.05 0.64 1.14 -2.13 0.02 0.00 0.00 175.30 174.92 3gyr n ARG 101 N 0.83 0.86 -0.13 3.54 0.63 0.46 -1.34 116.66 121.52 3gyr n ARG 101 Ca -0.09 0.31 0.00 0.00 -0.92 0.00 0.00 57.85 57.14 3gyr n ARG 101 Cb 0.52 -1.80 0.00 0.00 0.45 0.00 0.00 32.46 31.63 3gyr n ARG 101 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3gyr n GLY 102 N 2.04 2.38 3.60 5.14 0.00 0.62 -4.96 105.19 114.01 3gyr n GLY 102 Ca 0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 3gyr n GLY 102 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3gyr s GLN 103 N -0.13 3.71 -0.13 1.61 -0.21 -0.45 -4.91 119.66 119.15 3gyr s GLN 103 Ca 0.00 0.69 -0.29 0.00 0.02 0.00 0.00 55.36 55.77 3gyr s GLN 103 Cb 0.00 -3.93 -0.01 0.00 1.00 0.00 0.00 33.01 30.07 3gyr s GLN 103 CO 0.00 -1.40 1.13 0.50 -2.12 0.00 0.00 175.29 173.40 3gyr s ARG 104 N 4.53 4.33 -0.01 2.91 3.52 -1.25 -4.45 118.95 128.52 3gyr s ARG 104 Ca 0.51 1.53 0.05 0.00 -0.13 0.00 0.00 55.73 57.69 3gyr s ARG 104 Cb -0.09 -3.61 -0.01 0.00 -1.56 0.00 0.00 34.95 29.67 3gyr s ARG 104 CO 0.31 -0.51 -0.15 0.08 -0.81 0.00 0.00 175.30 174.22 3gyr s VAL 105 N 2.64 1.20 -0.07 7.11 1.01 -0.94 -4.73 120.40 126.62 3gyr s VAL 105 Ca 0.51 -0.65 0.06 0.00 0.00 0.00 0.00 61.98 61.90 3gyr s VAL 105 Cb -0.20 -1.00 -0.01 0.00 0.00 0.00 0.00 36.38 35.16 3gyr s VAL 105 CO 0.16 0.34 -0.25 -0.13 0.00 0.00 0.00 175.10 175.22 3gyr s ARG 106 N -0.34 2.67 -0.06 2.72 0.52 -1.26 -0.85 118.95 122.35 3gyr s ARG 106 Ca 0.05 -0.90 0.03 0.00 -0.52 0.00 0.00 55.73 54.39 3gyr s ARG 106 Cb -0.06 -2.19 0.01 0.00 0.52 0.00 0.00 34.95 33.23 3gyr s ARG 106 CO -0.00 0.33 -0.13 0.42 0.02 0.00 0.00 175.30 175.93 3gyr s ILE 107 N -0.03 1.20 -0.77 1.52 1.01 0.25 -1.82 121.20 122.56 3gyr s ILE 107 Ca -0.08 -0.54 -0.15 0.00 0.00 0.00 0.00 60.65 59.88 3gyr s ILE 107 Cb -0.15 -1.08 0.18 0.00 0.01 0.00 0.00 42.46 41.43 3gyr s ILE 107 CO 0.05 0.36 0.76 0.00 0.00 0.00 0.00 174.94 176.11 3gyr s ALA 108 N 0.48 3.85 -0.49 9.38 0.00 -0.31 -0.90 121.76 133.77 3gyr s ALA 108 Ca -0.12 -3.01 -0.28 0.00 0.00 0.00 0.00 51.96 48.56 3gyr s ALA 108 Cb -0.14 -3.54 -0.01 0.00 0.00 0.00 0.00 23.12 19.43 3gyr s ALA 108 CO 0.03 -2.32 1.72 -1.58 0.00 0.00 0.00 175.76 173.61 3gyr s TRP 109 N 0.97 1.88 -0.25 0.00 0.52 0.13 -1.23 118.94 120.97 3gyr s TRP 109 Ca 0.16 0.67 -0.01 0.00 0.02 0.00 0.00 56.10 56.95 3gyr s TRP 109 Cb -0.14 -4.17 0.03 0.00 -1.15 0.00 0.00 33.47 28.03 3gyr s TRP 109 CO -0.05 -2.43 -0.08 0.99 0.02 0.00 0.00 176.95 175.40 3gyr s THR 110 N 7.50 2.69 -0.43 2.01 2.01 0.24 -0.53 115.64 129.14 3gyr s THR 110 Ca 0.68 -1.13 -0.29 0.00 0.31 0.00 0.00 61.69 61.27 3gyr s THR 110 Cb -0.16 -2.38 0.01 0.00 0.01 0.00 0.00 72.50 69.98 3gyr s THR 110 CO 0.27 0.18 1.43 0.21 -0.69 0.00 0.00 174.62 176.02 3gyr s ASN 111 N 1.28 6.29 -0.23 3.53 3.84 -0.59 -1.09 114.94 127.98 3gyr s ASN 111 Ca -0.01 0.77 0.10 0.00 0.21 0.00 0.00 52.86 53.93 3gyr s ASN 111 Cb -0.17 -2.54 0.43 0.00 -0.55 0.00 0.00 41.25 38.42 3gyr s ASN 111 CO -0.05 -1.48 1.23 0.54 -2.79 0.00 0.00 177.10 174.54 3gyr n ARG 112 N 8.17 1.96 -3.09 0.43 1.74 -0.15 -0.31 116.66 125.41 3gyr n ARG 112 Ca 0.16 -3.46 -0.43 0.00 -0.77 0.00 0.00 57.85 53.36 3gyr n ARG 112 Cb 0.48 -1.75 -0.07 0.00 -1.02 0.00 0.00 32.46 30.11 3gyr n ARG 112 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3gyr s ILE 113 N -3.49 4.82 0.56 0.55 1.01 -1.15 -4.68 121.20 118.83 3gyr s ILE 113 Ca 0.41 0.29 -0.21 0.00 0.00 0.00 0.00 60.65 61.14 3gyr s ILE 113 Cb 0.38 -4.18 -0.04 0.00 0.01 0.00 0.00 42.46 38.62 3gyr s ILE 113 CO -0.05 -0.53 1.29 -2.65 0.00 0.00 0.00 174.94 173.00 3gyr n PRO 114 N 6.26 1.49 -1.63 2.79 -0.02 -1.26 -4.55 135.00 138.07 3gyr n PRO 114 Ca -0.01 0.55 -0.39 0.00 -2.02 0.00 0.00 63.50 61.63 3gyr n PRO 114 Cb 0.48 -2.50 0.04 0.00 -0.02 0.00 0.00 33.50 31.50 3gyr n PRO 114 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 3gyr n LYS 115 N -1.12 1.20 0.00 -0.52 5.02 -1.26 -1.80 118.16 119.68 3gyr n LYS 115 Ca 0.12 0.44 0.00 0.00 -2.02 0.00 0.00 58.31 56.85 3gyr n LYS 115 Cb 0.45 -2.18 0.00 0.00 -0.02 0.00 0.00 35.03 33.28 3gyr n LYS 115 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3gyr n GLY 116 N 1.17 2.76 3.53 0.72 0.00 -1.26 -5.02 105.19 107.09 3gyr n GLY 116 Ca 0.11 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.70 3gyr n GLY 116 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3gyr n SER 117 N 0.00 0.37 -4.76 1.61 7.64 -0.75 -4.92 113.62 112.82 3gyr n SER 117 Ca 0.00 1.08 -0.41 0.00 1.01 0.00 0.00 58.87 60.55 3gyr n SER 117 Cb 0.00 -1.21 -0.02 0.00 -1.01 0.00 0.00 64.21 61.97 3gyr n SER 117 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 3gyr s GLU 118 N -1.56 4.33 0.01 1.43 2.12 -1.26 -4.93 118.70 118.84 3gyr s GLU 118 Ca 0.61 2.22 -0.30 0.00 0.36 0.00 0.00 54.97 57.86 3gyr s GLU 118 Cb -0.68 -3.10 -0.05 0.00 0.26 0.00 0.00 34.13 30.56 3gyr s GLU 118 CO 0.58 -0.27 1.27 -0.47 -0.54 0.00 0.00 175.26 175.84 3gyr s TYR 119 N -0.61 3.16 0.26 5.30 5.04 -1.26 -4.93 117.35 124.31 3gyr s TYR 119 Ca 0.53 1.10 0.34 0.00 -2.44 0.00 0.00 57.07 56.60 3gyr s TYR 119 Cb -0.40 -3.51 1.54 0.00 0.35 0.00 0.00 41.96 39.94 3gyr s TYR 119 CO 0.48 -1.71 2.06 -1.35 -1.34 0.00 0.00 175.55 173.68 3gyr h PRO 120 N 7.34 0.00 -5.16 4.97 0.11 -1.93 -3.42 132.00 133.90 3gyr h PRO 120 Ca -0.38 0.00 -0.65 0.00 0.11 0.00 0.00 66.00 65.08 3gyr h PRO 120 Cb 1.18 0.00 -0.25 0.00 0.11 0.00 0.00 31.00 32.05 3gyr h PRO 120 CO 0.87 0.04 -0.70 0.08 -0.21 0.00 0.00 178.00 178.08 3gyr s VAL 121 N -3.84 3.59 0.04 3.15 1.01 -1.26 -4.10 120.40 118.99 3gyr s VAL 121 Ca -0.01 -0.44 -0.24 0.00 0.00 0.00 0.00 61.98 61.29 3gyr s VAL 121 Cb 0.10 -2.59 -0.06 0.00 0.00 0.00 0.00 36.38 33.83 3gyr s VAL 121 CO 0.53 0.46 0.72 -0.89 0.00 0.00 0.00 175.10 175.93 3gyr s THR 122 N 0.87 4.75 -0.13 3.92 2.01 -0.52 -4.69 115.64 121.84 3gyr s THR 122 Ca -0.01 1.54 0.00 0.00 0.31 0.00 0.00 61.69 63.53 3gyr s THR 122 Cb -0.15 -4.07 -0.01 0.00 0.01 0.00 0.00 72.50 68.28 3gyr s THR 122 CO 0.01 0.39 -0.14 -0.55 -0.69 0.00 0.00 174.62 173.64 3gyr s SER 123 N -0.18 3.88 0.05 3.53 0.15 -1.26 0.42 113.70 120.28 3gyr s SER 123 Ca 0.36 -0.37 0.02 0.00 0.70 0.00 0.00 55.95 56.67 3gyr s SER 123 Cb -0.20 -1.59 -0.03 0.00 -1.71 0.00 0.00 66.02 62.49 3gyr s SER 123 CO 0.22 0.15 -0.07 0.68 1.20 0.00 0.00 173.24 175.42 3gyr s VAL 124 N 0.42 0.55 0.05 4.45 -7.23 -0.62 -0.11 120.40 117.92 3gyr s VAL 124 Ca -0.11 -1.23 0.09 0.00 -1.81 0.00 0.00 61.98 58.92 3gyr s VAL 124 Cb -0.16 -0.79 -0.03 0.00 0.56 0.00 0.00 36.38 35.96 3gyr s VAL 124 CO 0.05 -0.48 -0.24 -1.61 -0.31 0.00 0.00 175.10 172.52 3gyr s GLU 125 N -1.99 1.84 -0.02 4.82 2.02 -1.26 -1.90 118.70 122.21 3gyr s GLU 125 Ca -0.06 -1.10 -0.01 0.00 0.02 0.00 0.00 54.97 53.82 3gyr s GLU 125 Cb -0.07 -2.03 0.01 0.00 0.10 0.00 0.00 34.13 32.14 3gyr s GLU 125 CO -0.01 0.51 0.05 0.08 0.02 0.00 0.00 175.26 175.91 3gyr s VAL 126 N -0.87 -0.02 0.91 2.63 1.01 -0.91 -4.93 120.40 118.22 3gyr s VAL 126 Ca 0.13 0.06 -0.10 0.00 0.00 0.00 0.00 61.98 62.07 3gyr s VAL 126 Cb -0.10 -0.08 0.14 0.00 0.00 0.00 0.00 36.38 36.34 3gyr s VAL 126 CO 0.04 0.03 1.13 -2.84 0.00 0.00 0.00 175.10 173.45 3gyr s PRO 127 N 0.35 1.08 0.22 2.72 0.02 -1.26 -0.40 135.00 137.73 3gyr s PRO 127 Ca -0.03 1.43 -0.07 0.00 0.02 0.00 0.00 61.00 62.35 3gyr s PRO 127 Cb -0.04 -1.74 0.35 0.00 0.02 0.00 0.00 34.50 33.09 3gyr s PRO 127 CO -0.01 -2.55 1.74 -0.07 -0.33 0.00 0.00 177.00 175.78 3gyr h LEU 128 N -1.81 0.28 -0.02 -5.54 3.38 -1.95 -3.44 115.31 106.21 3gyr h LEU 128 Ca -0.44 0.09 0.01 0.00 0.09 0.00 0.00 57.88 57.63 3gyr h LEU 128 Cb 1.27 0.06 -0.01 0.00 0.09 0.00 0.00 40.66 42.07 3gyr h LEU 128 CO 0.44 0.14 -0.04 0.61 0.09 0.00 0.00 178.44 179.68 3gyr n GLY 129 N -1.31 -2.29 3.70 0.83 0.00 -1.26 -4.46 105.19 100.40 3gyr n GLY 129 Ca 0.11 -1.46 -0.34 0.00 0.00 0.00 0.00 46.02 44.33 3gyr n GLY 129 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3gyr s PRO 130 N -2.52 1.68 0.50 1.61 0.02 -1.26 -4.96 135.00 130.06 3gyr s PRO 130 Ca 0.00 1.79 -0.20 0.00 0.02 0.00 0.00 61.00 62.61 3gyr s PRO 130 Cb 0.00 -1.78 -0.08 0.00 0.02 0.00 0.00 34.50 32.66 3gyr s PRO 130 CO 0.00 -2.19 1.06 -2.14 -0.33 0.00 0.00 177.00 173.39 3gyr s PRO 131 N -4.08 3.72 0.00 5.54 0.02 -1.26 -3.60 135.00 135.35 3gyr s PRO 131 Ca 0.74 1.41 0.00 0.00 0.02 0.00 0.00 61.00 63.17 3gyr s PRO 131 Cb -0.30 -2.08 0.00 0.00 0.02 0.00 0.00 34.50 32.14 3gyr s PRO 131 CO 0.50 -0.51 0.00 0.41 -0.33 0.00 0.00 177.00 177.07 3gyr n GLY 132 N -0.16 0.46 3.64 0.52 0.00 -1.26 -5.03 105.19 103.35 3gyr n GLY 132 Ca 0.10 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.89 3gyr n GLY 132 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3gyr s THR 133 N -2.22 3.40 0.29 2.61 -4.23 -1.24 -5.07 115.64 109.19 3gyr s THR 133 Ca 0.00 -1.94 -0.30 0.00 -1.18 0.00 0.00 61.69 58.28 3gyr s THR 133 Cb 0.00 -2.82 -0.12 0.00 1.34 0.00 0.00 72.50 70.90 3gyr s THR 133 CO 0.00 -0.37 1.48 -2.65 -0.54 0.00 0.00 174.62 172.54 3gyr n PRO 134 N -0.87 2.40 -1.10 3.99 -0.02 -1.26 -4.89 135.00 133.25 3gyr n PRO 134 Ca -0.06 0.85 -0.34 0.00 -2.02 0.00 0.00 63.50 61.92 3gyr n PRO 134 Cb 0.59 -2.56 0.10 0.00 -0.02 0.00 0.00 33.50 31.61 3gyr n PRO 134 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3gyr n ALA 135 N 1.63 -1.28 0.28 3.55 0.00 -1.26 -4.88 120.51 118.55 3gyr n ALA 135 Ca 0.08 -0.36 0.18 0.00 0.00 0.00 0.00 53.44 53.34 3gyr n ALA 135 Cb 0.35 -1.97 0.90 0.00 0.00 0.00 0.00 19.45 18.73 3gyr n ALA 135 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3gyr h PRO 136 N -0.83 0.00 -0.03 0.00 0.11 -1.88 -2.23 132.00 127.15 3gyr h PRO 136 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3gyr h PRO 136 Cb 1.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.43 3gyr h PRO 136 CO 0.42 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.48 3gyr n ASN 137 N -2.76 0.55 -0.32 -2.05 0.23 -1.26 -1.93 115.26 107.71 3gyr n ASN 137 Ca -0.02 -1.31 0.15 0.00 -0.53 0.00 0.00 54.58 52.87 3gyr n ASN 137 Cb 0.11 -0.01 0.64 0.00 -2.08 0.00 0.00 39.78 38.44 3gyr n ASN 137 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 3gyr n THR 138 N -0.51 0.00 -4.50 5.53 -2.24 -0.84 -4.01 114.28 107.71 3gyr n THR 138 Ca 0.19 -0.17 -0.23 0.00 -2.27 0.00 0.00 64.05 61.57 3gyr n THR 138 Cb 0.18 0.19 -0.14 0.00 -2.10 0.00 0.00 70.33 68.47 3gyr n THR 138 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3gyr s GLU 139 N -2.03 1.20 0.86 -0.78 2.02 -0.81 -4.74 118.70 114.41 3gyr s GLU 139 Ca 0.40 -0.90 -0.11 0.00 0.02 0.00 0.00 54.97 54.39 3gyr s GLU 139 Cb 0.21 -1.29 0.11 0.00 0.10 0.00 0.00 34.13 33.26 3gyr s GLU 139 CO 0.36 0.32 1.11 -1.25 0.02 0.00 0.00 175.26 175.81 3gyr s PRO 140 N -1.24 1.49 0.00 0.39 0.04 -1.26 -4.93 135.00 129.49 3gyr s PRO 140 Ca 0.05 1.22 0.00 0.00 0.04 0.00 0.00 61.00 62.31 3gyr s PRO 140 Cb -0.09 -1.81 0.00 0.00 0.04 0.00 0.00 34.50 32.65 3gyr s PRO 140 CO 0.02 -2.19 0.00 0.41 0.04 0.00 0.00 177.00 175.27 3gyr n GLY 141 N -0.61 0.38 0.70 0.56 0.00 -0.09 -4.77 105.19 101.36 3gyr n GLY 141 Ca 0.09 -1.79 0.12 0.00 0.00 0.00 0.00 46.02 44.45 3gyr n GLY 141 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gyr n ARG 142 N 0.53 1.94 0.00 1.61 1.74 -1.26 -4.92 116.66 116.30 3gyr n ARG 142 Ca 0.00 -1.39 0.00 0.00 -0.77 0.00 0.00 57.85 55.69 3gyr n ARG 142 Cb 0.00 -1.45 0.00 0.00 -1.02 0.00 0.00 32.46 29.99 3gyr n ARG 142 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3gyr n GLY 143 N 1.24 3.53 0.51 -0.13 0.00 -1.26 -1.53 105.19 107.55 3gyr n GLY 143 Ca 0.17 -0.12 0.12 0.00 0.00 0.00 0.00 46.02 46.19 3gyr n GLY 143 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gyr n GLY 144 N 0.00 0.03 3.73 -0.02 0.00 -1.26 -5.02 105.19 102.66 3gyr n GLY 144 Ca 0.00 -0.60 -0.41 0.00 0.00 0.00 0.00 46.02 45.00 3gyr n GLY 144 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gyr s VAL 145 N -2.41 3.54 0.54 1.61 1.01 -0.58 -4.99 120.40 119.11 3gyr s VAL 145 Ca 0.21 1.23 -0.21 0.00 0.00 0.00 0.00 61.98 63.21 3gyr s VAL 145 Cb 0.19 -3.79 -0.05 0.00 0.00 0.00 0.00 36.38 32.73 3gyr s VAL 145 CO 0.53 0.17 1.25 -1.61 0.00 0.00 0.00 175.10 175.44 3gyr s GLU 146 N 0.13 3.24 0.37 2.72 0.41 -1.26 -4.86 118.70 119.45 3gyr s GLU 146 Ca 0.56 1.97 -0.28 0.00 -0.41 0.00 0.00 54.97 56.80 3gyr s GLU 146 Cb -0.33 -2.18 -0.11 0.00 -1.78 0.00 0.00 34.13 29.72 3gyr s GLU 146 CO 0.35 -1.03 1.49 -2.30 -0.49 0.00 0.00 175.26 173.28 3gyr n PRO 147 N -1.08 2.66 -1.81 0.39 -0.02 -1.26 -4.78 135.00 129.10 3gyr n PRO 147 Ca 0.11 0.93 -0.43 0.00 -2.02 0.00 0.00 63.50 62.09 3gyr n PRO 147 Cb 0.47 -2.66 -0.03 0.00 -0.02 0.00 0.00 33.50 31.26 3gyr n PRO 147 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 3gyr s ASN 148 N -0.10 5.97 0.44 2.55 3.84 0.85 -4.89 114.94 123.60 3gyr s ASN 148 Ca 0.54 1.91 0.17 0.00 0.21 0.00 0.00 52.86 55.69 3gyr s ASN 148 Cb -0.48 -2.52 1.00 0.00 -0.55 0.00 0.00 41.25 38.70 3gyr s ASN 148 CO 0.63 -1.54 1.95 0.11 -2.79 0.00 0.00 177.10 175.45 3gyr h LYS 149 N 12.65 0.00 -0.46 0.43 1.79 -1.91 -2.39 116.57 126.68 3gyr h LYS 149 Ca -0.40 0.00 -0.06 0.00 -2.18 0.00 0.00 60.65 58.01 3gyr h LYS 149 Cb 1.21 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.83 3gyr h LYS 149 CO 0.98 0.23 0.02 -0.44 -1.08 0.00 0.00 179.45 179.16 3gyr h ASP 150 N 0.00 0.71 0.06 0.86 3.45 -1.99 -0.93 116.42 118.58 3gyr h ASP 150 Ca -0.00 -0.16 -0.00 0.00 0.43 0.00 0.00 57.03 57.30 3gyr h ASP 150 Cb 0.45 -0.19 0.00 0.00 -0.56 0.00 0.00 39.33 39.04 3gyr h ASP 150 CO 0.03 0.77 -0.03 0.58 -1.57 0.00 0.00 179.24 179.02 3gyr h VAL 151 N 0.70 1.23 -0.68 -1.35 2.07 -1.84 -3.03 116.25 113.36 3gyr h VAL 151 Ca 0.14 -1.07 0.20 0.00 0.82 0.00 0.00 66.70 66.78 3gyr h VAL 151 Cb 0.40 1.93 -0.03 0.00 -1.52 0.00 0.00 31.29 32.07 3gyr h VAL 151 CO 0.01 0.26 0.51 0.00 0.02 0.00 0.00 177.57 178.38 3gyr h ALA 152 N 0.32 2.61 -0.00 1.67 0.00 -1.47 0.58 119.26 122.96 3gyr h ALA 152 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3gyr h ALA 152 Cb 0.49 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.34 3gyr h ALA 152 CO 0.01 -0.85 -0.02 0.00 0.00 0.00 0.00 179.25 178.39 3gyr n ALA 153 N -2.63 2.49 -1.68 0.00 0.00 -0.36 -4.47 120.51 113.86 3gyr n ALA 153 Ca 0.13 -0.15 -0.45 0.00 0.00 0.00 0.00 53.44 52.97 3gyr n ALA 153 Cb 0.77 -1.46 -0.04 0.00 0.00 0.00 0.00 19.45 18.71 3gyr n ALA 153 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3gyr n LEU 154 N -1.33 3.33 -4.90 0.00 4.77 0.19 -5.00 117.00 114.07 3gyr n LEU 154 Ca 0.12 1.06 -0.29 0.00 -0.03 0.00 0.00 56.01 56.87 3gyr n LEU 154 Cb 0.28 -1.45 0.08 0.00 -2.33 0.00 0.00 43.42 39.99 3gyr n LEU 154 CO 0.25 -0.16 0.78 -2.16 -1.33 0.00 0.00 177.39 174.76 3gyr s PRO 155 N 1.34 2.17 -0.17 3.23 0.04 -1.26 -4.66 135.00 135.69 3gyr s PRO 155 Ca 0.80 0.19 -0.29 0.00 0.04 0.00 0.00 61.00 61.73 3gyr s PRO 155 Cb -0.64 -1.97 -0.03 0.00 0.04 0.00 0.00 34.50 31.90 3gyr s PRO 155 CO 0.38 -1.46 1.59 0.00 0.04 0.00 0.00 177.00 177.55 3gyr s ALA 156 N -3.52 3.41 -0.25 8.56 0.00 -1.26 -4.96 121.76 123.73 3gyr s ALA 156 Ca 0.61 0.60 -0.02 0.00 0.00 0.00 0.00 51.96 53.15 3gyr s ALA 156 Cb -0.11 -3.80 0.12 0.00 0.00 0.00 0.00 23.12 19.33 3gyr s ALA 156 CO 0.50 -1.72 0.29 -0.46 0.00 0.00 0.00 175.76 174.37 3gyr s TRP 157 N 4.72 -0.50 -0.01 0.00 -0.00 -1.26 -4.10 118.94 117.79 3gyr s TRP 157 Ca 0.70 0.18 -0.01 0.00 -0.00 0.00 0.00 56.10 56.97 3gyr s TRP 157 Cb -0.27 -0.32 -0.00 0.00 -0.00 0.00 0.00 33.47 32.88 3gyr s TRP 157 CO 0.28 -0.78 0.03 0.45 -0.00 0.00 0.00 176.95 176.93 3gyr s SER 158 N 2.39 0.02 -0.01 5.86 0.15 -1.05 -4.80 113.70 116.27 3gyr s SER 158 Ca 0.09 -0.05 0.01 0.00 0.70 0.00 0.00 55.95 56.71 3gyr s SER 158 Cb -0.15 0.09 -0.00 0.00 -1.71 0.00 0.00 66.02 64.25 3gyr s SER 158 CO -0.23 -0.09 -0.04 0.54 1.20 0.00 0.00 173.24 174.62 3gyr s VAL 159 N -0.35 0.33 -0.15 4.45 0.11 -1.26 -1.15 120.40 122.39 3gyr s VAL 159 Ca -0.04 -0.17 -0.04 0.00 -2.93 0.00 0.00 61.98 58.81 3gyr s VAL 159 Cb -0.03 -0.30 -0.03 0.00 -1.53 0.00 0.00 36.38 34.50 3gyr s VAL 159 CO -0.00 0.10 -0.03 -0.89 -3.33 0.00 0.00 175.10 170.96 3gyr s THR 160 N -0.01 4.01 -0.14 5.04 2.01 -1.26 -0.16 115.64 125.14 3gyr s THR 160 Ca 0.01 -0.32 0.02 0.00 0.31 0.00 0.00 61.69 61.70 3gyr s THR 160 Cb -0.03 -2.75 0.00 0.00 0.01 0.00 0.00 72.50 69.73 3gyr s THR 160 CO -0.00 0.51 -0.19 -2.28 -0.69 0.00 0.00 174.62 171.96 3gyr s HIS 161 N 0.19 2.70 -0.64 4.92 5.04 -0.56 -4.07 115.29 122.87 3gyr s HIS 161 Ca -0.01 -1.14 -0.23 0.00 -1.54 0.00 0.00 55.06 52.14 3gyr s HIS 161 Cb -0.14 -1.83 0.07 0.00 0.04 0.00 0.00 32.58 30.72 3gyr s HIS 161 CO 0.03 -0.50 0.96 -1.17 -2.34 0.00 0.00 174.74 171.71 3gyr s LEU 162 N 0.71 4.35 -0.16 8.88 2.96 -1.26 -2.44 118.68 131.72 3gyr s LEU 162 Ca -0.08 -0.91 -0.29 0.00 -0.22 0.00 0.00 54.13 52.62 3gyr s LEU 162 Cb -0.16 -2.47 -0.01 0.00 0.50 0.00 0.00 46.19 44.06 3gyr s LEU 162 CO 0.01 -1.41 1.09 -2.28 -1.32 0.00 0.00 176.35 172.44 3gyr s HIS 163 N 4.04 3.29 0.00 5.38 5.65 0.19 -1.72 115.29 132.12 3gyr s HIS 163 Ca 0.23 1.40 0.00 0.00 0.25 0.00 0.00 55.06 56.94 3gyr s HIS 163 Cb -0.16 -3.30 0.00 0.00 -1.18 0.00 0.00 32.58 27.93 3gyr s HIS 163 CO 0.11 -0.71 0.00 0.41 -0.65 0.00 0.00 174.74 173.90 3gyr n GLY 164 N 3.31 0.40 3.78 1.59 0.00 -1.26 -2.87 105.19 110.14 3gyr n GLY 164 Ca 0.11 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.77 3gyr n GLY 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gyr s ALA 165 N -2.12 3.06 -0.54 4.61 0.00 -0.70 -4.88 121.76 121.19 3gyr s ALA 165 Ca 0.00 0.74 -0.18 0.00 0.00 0.00 0.00 51.96 52.52 3gyr s ALA 165 Cb 0.00 -3.29 0.09 0.00 0.00 0.00 0.00 23.12 19.91 3gyr s ALA 165 CO 0.00 -0.30 0.62 -1.14 0.00 0.00 0.00 175.76 174.94 3gyr s GLN 166 N -2.56 3.06 0.13 0.00 0.74 -1.26 -4.15 119.66 115.61 3gyr s GLN 166 Ca 0.59 -1.21 -0.25 0.00 0.05 0.00 0.00 55.36 54.55 3gyr s GLN 166 Cb -0.23 -4.19 0.07 0.00 1.10 0.00 0.00 33.01 29.76 3gyr s GLN 166 CO 0.29 -1.34 0.72 -0.08 -0.55 0.00 0.00 175.29 174.32 3gyr s THR 167 N 2.42 0.00 0.97 -0.34 -1.32 -1.26 -4.46 115.64 111.66 3gyr s THR 167 Ca 0.11 -0.15 -0.11 0.00 -1.21 0.00 0.00 61.69 60.34 3gyr s THR 167 Cb -0.23 -1.17 0.18 0.00 -1.51 0.00 0.00 72.50 69.77 3gyr s THR 167 CO 0.08 0.00 1.10 0.61 -2.21 0.00 0.00 174.62 174.20 3gyr n GLY 168 N -0.36 -0.76 0.28 6.08 0.00 -1.26 -4.75 105.19 104.43 3gyr n GLY 168 Ca -0.13 -0.81 0.13 0.00 0.00 0.00 0.00 46.02 45.21 3gyr n GLY 168 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3gyr h GLY 169 N -2.07 0.00 2.00 -0.02 0.00 -1.30 -0.52 103.07 101.17 3gyr h GLY 169 Ca -0.47 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 46.84 3gyr h GLY 169 CO 0.42 0.00 -0.08 -1.33 0.00 0.00 0.00 176.54 175.55 3gyr h GLY 170 N 0.45 0.00 0.00 4.60 0.00 -1.88 -2.76 103.07 103.48 3gyr h GLY 170 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3gyr h GLY 170 CO 0.01 0.00 -0.68 0.70 0.00 0.00 0.00 176.54 176.57 3gyr n ASN 171 N -3.33 0.68 0.26 0.19 3.02 -0.28 -4.65 115.26 111.16 3gyr n ASN 171 Ca -0.01 -0.83 0.16 0.00 -0.03 0.00 0.00 54.58 53.88 3gyr n ASN 171 Cb 0.27 1.01 0.62 0.00 -0.61 0.00 0.00 39.78 41.06 3gyr n ASN 171 CO 0.00 0.00 0.00 -0.78 -2.62 0.00 0.00 177.26 173.86 3gyr h ASP 172 N 0.00 0.00 -1.50 6.41 -0.00 -1.04 -3.45 116.42 116.85 3gyr h ASP 172 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.03 3gyr h ASP 172 Cb 0.34 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.67 3gyr h ASP 172 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 179.24 179.85 3gyr n GLY 173 N 0.16 0.51 3.57 -0.78 0.00 -1.26 -4.09 105.19 103.31 3gyr n GLY 173 Ca 0.01 -0.35 -0.55 0.00 0.00 0.00 0.00 46.02 45.13 3gyr n GLY 173 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 3gyr n TRP 174 N -0.75 1.22 0.04 1.61 -0.00 -1.26 -4.70 117.44 113.60 3gyr n TRP 174 Ca 0.00 0.80 0.06 0.00 -0.00 0.00 0.00 57.50 58.36 3gyr n TRP 174 Cb 0.35 -2.25 0.48 0.00 -0.00 0.00 0.00 31.31 29.90 3gyr n TRP 174 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 3gyr h ALA 175 N 4.12 1.82 0.00 5.87 0.00 -1.96 -1.16 119.26 127.95 3gyr h ALA 175 Ca -0.49 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.39 3gyr h ALA 175 Cb 1.37 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 3gyr h ALA 175 CO 0.74 0.15 -0.07 -0.44 0.00 0.00 0.00 179.25 179.63 3gyr h ASP 176 N 0.42 0.00 -0.62 0.00 3.32 -1.89 -0.31 116.42 117.34 3gyr h ASP 176 Ca 0.14 0.00 -0.35 0.00 0.02 0.00 0.00 57.03 56.84 3gyr h ASP 176 Cb 0.05 0.00 -0.19 0.00 0.22 0.00 0.00 39.33 39.41 3gyr h ASP 176 CO -0.03 0.07 0.45 0.59 -1.72 0.00 0.00 179.24 178.60 3gyr n ASN 177 N -3.17 4.44 -4.75 6.45 5.03 -0.44 -4.90 115.26 117.93 3gyr n ASN 177 Ca 0.01 -3.08 -0.34 0.00 0.87 0.00 0.00 54.58 52.04 3gyr n ASN 177 Cb 0.40 -0.81 0.06 0.00 -1.02 0.00 0.00 39.78 38.41 3gyr n ASN 177 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3gyr s ALA 178 N -2.14 2.38 0.11 5.41 0.00 -1.25 -4.74 121.76 121.51 3gyr s ALA 178 Ca 0.37 0.79 0.07 0.00 0.00 0.00 0.00 51.96 53.19 3gyr s ALA 178 Cb 0.30 -3.41 -0.03 0.00 0.00 0.00 0.00 23.12 19.98 3gyr s ALA 178 CO 0.05 -1.43 -0.18 0.14 0.00 0.00 0.00 175.76 174.33 3gyr s VAL 179 N -2.00 1.56 0.57 0.00 -7.23 -0.30 -4.76 120.40 108.24 3gyr s VAL 179 Ca 0.72 -1.56 0.01 0.00 -1.81 0.00 0.00 61.98 59.35 3gyr s VAL 179 Cb -0.26 -1.48 0.11 0.00 0.56 0.00 0.00 36.38 35.31 3gyr s VAL 179 CO 0.40 -0.16 0.78 0.61 -0.31 0.00 0.00 175.10 176.42 3gyr n GLY 180 N 0.97 0.93 3.59 2.32 0.00 -1.26 -2.52 105.19 109.22 3gyr n GLY 180 Ca -0.19 -2.06 -0.51 0.00 0.00 0.00 0.00 46.02 43.27 3gyr n GLY 180 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3gyr n PHE 181 N -2.48 1.47 0.00 1.61 7.35 -1.26 -1.98 117.46 122.18 3gyr n PHE 181 Ca 0.13 0.64 0.00 0.00 -0.76 0.00 0.00 57.45 57.46 3gyr n PHE 181 Cb 0.48 -2.32 0.00 0.00 0.35 0.00 0.00 39.48 37.99 3gyr n PHE 181 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3gyr n GLY 182 N 2.37 3.06 3.94 7.13 0.00 0.58 -5.02 105.19 117.25 3gyr n GLY 182 Ca 0.17 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.95 3gyr n GLY 182 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3gyr s ASP 183 N 0.28 6.32 0.29 1.61 1.01 -0.84 -4.87 116.67 120.47 3gyr s ASP 183 Ca 0.00 0.43 0.11 0.00 0.71 0.00 0.00 52.55 53.80 3gyr s ASP 183 Cb 0.00 -2.02 -0.05 0.00 1.01 0.00 0.00 42.92 41.85 3gyr s ASP 183 CO 0.00 -0.25 -0.16 0.00 0.21 0.00 0.00 175.17 174.97 3gyr s ALA 184 N -2.23 2.84 -0.18 5.23 0.00 -1.26 -1.54 121.76 124.62 3gyr s ALA 184 Ca 0.40 -1.91 -0.02 0.00 0.00 0.00 0.00 51.96 50.43 3gyr s ALA 184 Cb -0.10 -0.26 -0.01 0.00 0.00 0.00 0.00 23.12 22.76 3gyr s ALA 184 CO 0.34 0.23 -0.10 -1.14 0.00 0.00 0.00 175.76 175.09 3gyr s GLN 185 N -3.55 3.33 -0.15 0.00 0.74 0.31 -4.95 119.66 115.39 3gyr s GLN 185 Ca 0.31 -0.68 -0.06 0.00 0.05 0.00 0.00 55.36 54.98 3gyr s GLN 185 Cb -0.03 -2.79 -0.04 0.00 1.10 0.00 0.00 33.01 31.24 3gyr s GLN 185 CO 0.16 -0.03 0.07 -0.51 -0.55 0.00 0.00 175.29 174.43 3gyr s LEU 186 N 0.99 3.91 -0.03 3.68 1.43 -1.26 -0.69 118.68 126.71 3gyr s LEU 186 Ca -0.01 0.18 0.03 0.00 -1.03 0.00 0.00 54.13 53.30 3gyr s LEU 186 Cb -0.15 -1.97 -0.00 0.00 0.03 0.00 0.00 46.19 44.11 3gyr s LEU 186 CO -0.01 0.26 -0.11 -0.44 0.23 0.00 0.00 176.35 176.28 3gyr s SER 187 N -0.16 1.41 -0.14 2.29 0.01 -0.08 -4.77 113.70 112.26 3gyr s SER 187 Ca 0.08 -0.22 -0.04 0.00 1.31 0.00 0.00 55.95 57.07 3gyr s SER 187 Cb -0.12 -0.34 -0.03 0.00 0.21 0.00 0.00 66.02 65.73 3gyr s SER 187 CO 0.01 0.10 0.01 -0.70 0.41 0.00 0.00 173.24 173.07 3gyr s GLU 188 N 0.08 3.50 -0.33 12.44 2.12 -1.26 -0.59 118.70 134.67 3gyr s GLU 188 Ca -0.02 -0.41 0.02 0.00 0.36 0.00 0.00 54.97 54.92 3gyr s GLU 188 Cb -0.08 -2.97 0.10 0.00 0.26 0.00 0.00 34.13 31.44 3gyr s GLU 188 CO 0.01 0.44 0.08 0.71 -0.54 0.00 0.00 175.26 175.96 3gyr s TYR 189 N -0.15 2.73 0.46 5.30 2.02 -0.03 -4.74 117.35 122.95 3gyr s TYR 189 Ca 0.05 -2.38 0.26 0.00 -0.37 0.00 0.00 57.07 54.62 3gyr s TYR 189 Cb -0.12 -2.32 1.47 0.00 -0.40 0.00 0.00 41.96 40.58 3gyr s TYR 189 CO 0.02 -0.91 2.11 -1.35 -1.57 0.00 0.00 175.55 173.84 3gyr h PRO 190 N 7.82 0.00 -2.05 -1.71 0.11 -1.83 -2.50 132.00 131.84 3gyr h PRO 190 Ca -0.09 0.00 -0.36 0.00 0.11 0.00 0.00 66.00 65.67 3gyr h PRO 190 Cb 1.01 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.07 3gyr h PRO 190 CO 0.50 0.10 -0.42 0.09 -0.21 0.00 0.00 178.00 178.06 3gyr n ASN 191 N -3.81 -5.17 -4.37 -2.05 5.03 -1.26 -3.95 115.26 99.69 3gyr n ASN 191 Ca -0.02 0.11 -0.43 0.00 0.87 0.00 0.00 54.58 55.11 3gyr n ASN 191 Cb 0.20 -4.25 0.00 0.00 -1.02 0.00 0.00 39.78 34.71 3gyr n ASN 191 CO 0.00 0.00 0.00 -0.67 -1.83 0.00 0.00 177.26 174.76 3gyr n ASP 192 N -1.24 4.86 -3.54 6.41 4.64 -1.26 -0.28 116.55 126.14 3gyr n ASP 192 Ca -0.20 -2.94 -0.18 0.00 -1.38 0.00 0.00 54.79 50.10 3gyr n ASP 192 Cb 0.64 -1.67 -0.06 0.00 -1.04 0.00 0.00 41.12 38.99 3gyr n ASP 192 CO 0.00 0.00 0.00 -2.28 -0.82 0.00 0.00 177.20 174.10 3gyr s HIS 193 N 3.10 -0.65 0.98 -0.67 2.46 -1.26 -4.97 115.29 114.28 3gyr s HIS 193 Ca 0.49 1.16 -0.11 0.00 0.47 0.00 0.00 55.06 57.07 3gyr s HIS 193 Cb 0.04 0.39 0.18 0.00 -0.13 0.00 0.00 32.58 33.06 3gyr s HIS 193 CO 0.03 -0.58 1.09 1.14 -2.47 0.00 0.00 174.74 173.94 3gyr s GLN 194 N -1.07 0.58 0.27 2.88 -2.07 -1.26 -4.65 119.66 114.34 3gyr s GLN 194 Ca -0.10 1.01 -0.30 0.00 -1.82 0.00 0.00 55.36 54.14 3gyr s GLN 194 Cb -0.01 -1.72 -0.13 0.00 -1.09 0.00 0.00 33.01 30.07 3gyr s GLN 194 CO 0.09 -2.76 1.42 0.00 -1.32 0.00 0.00 175.29 172.72 3gyr n ALA 195 N -4.27 1.45 -3.84 2.60 0.00 -1.26 -4.90 120.51 110.29 3gyr n ALA 195 Ca 0.07 0.39 -0.03 0.00 0.00 0.00 0.00 53.44 53.87 3gyr n ALA 195 Cb 0.54 -2.31 0.01 0.00 0.00 0.00 0.00 19.45 17.69 3gyr n ALA 195 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 3gyr s THR 196 N -0.28 0.00 -0.33 0.00 -1.32 -0.96 -4.18 115.64 108.57 3gyr s THR 196 Ca 0.64 -0.61 -0.10 0.00 -1.21 0.00 0.00 61.69 60.42 3gyr s THR 196 Cb -0.60 -2.66 0.01 0.00 -1.51 0.00 0.00 72.50 67.73 3gyr s THR 196 CO 0.52 0.00 0.16 -1.58 -2.21 0.00 0.00 174.62 171.52 3gyr s GLN 197 N -2.43 3.13 0.60 7.08 0.74 -1.26 -0.60 119.66 126.91 3gyr s GLN 197 Ca 0.19 -0.86 0.08 0.00 0.05 0.00 0.00 55.36 54.82 3gyr s GLN 197 Cb -0.02 -3.61 0.10 0.00 1.10 0.00 0.00 33.01 30.58 3gyr s GLN 197 CO 0.05 -0.52 0.83 -1.58 -0.55 0.00 0.00 175.29 173.51 3gyr s TRP 198 N 1.58 1.37 -0.06 1.67 0.51 -0.17 -4.84 118.94 119.00 3gyr s TRP 198 Ca 0.03 -0.68 -0.29 0.00 -2.12 0.00 0.00 56.10 53.04 3gyr s TRP 198 Cb -0.18 -2.30 0.06 0.00 -0.81 0.00 0.00 33.47 30.24 3gyr s TRP 198 CO 0.06 -1.25 0.64 1.67 -0.51 0.00 0.00 176.95 177.56 3gyr s TRP 199 N -2.74 -0.62 0.12 -1.98 1.48 -1.14 -2.05 118.94 112.01 3gyr s TRP 199 Ca 0.63 1.10 0.09 0.00 -1.06 0.00 0.00 56.10 56.86 3gyr s TRP 199 Cb -0.05 0.36 -0.04 0.00 -1.16 0.00 0.00 33.47 32.58 3gyr s TRP 199 CO 0.40 -0.57 -0.22 1.52 -4.06 0.00 0.00 176.95 174.02 3gyr s TYR 200 N -1.07 1.94 0.10 1.66 -0.85 0.18 0.56 117.35 119.86 3gyr s TYR 200 Ca -0.10 -0.41 -0.26 0.00 -0.52 0.00 0.00 57.07 55.78 3gyr s TYR 200 Cb -0.01 -1.05 0.08 0.00 0.38 0.00 0.00 41.96 41.36 3gyr s TYR 200 CO 0.09 0.26 0.87 -3.38 -1.52 0.00 0.00 175.55 171.87 3gyr s HIS 201 N -1.22 -0.27 0.59 -3.49 -3.43 -1.02 -0.56 115.29 105.89 3gyr s HIS 201 Ca 0.09 0.03 -0.20 0.00 -0.80 0.00 0.00 55.06 54.18 3gyr s HIS 201 Cb -0.10 0.59 -0.03 0.00 -1.43 0.00 0.00 32.58 31.62 3gyr s HIS 201 CO 0.05 -0.75 1.34 0.34 -2.00 0.00 0.00 174.74 173.73 3gyr s ASP 202 N -2.73 4.96 -0.01 7.38 -1.08 -0.98 -1.49 116.67 122.72 3gyr s ASP 202 Ca 0.08 2.74 0.13 0.00 -0.52 0.00 0.00 52.55 54.97 3gyr s ASP 202 Cb -0.02 -2.63 0.22 0.00 -1.46 0.00 0.00 42.92 39.03 3gyr s ASP 202 CO -0.04 -1.78 1.09 1.57 0.52 0.00 0.00 175.17 176.53 3gyr n HIS 203 N -1.40 0.00 -1.71 -5.34 -0.00 0.78 -4.78 115.22 102.77 3gyr n HIS 203 Ca 0.13 -0.28 -0.42 0.00 0.46 0.00 0.00 57.72 57.60 3gyr n HIS 203 Cb 0.46 -0.10 -0.03 0.00 -0.12 0.00 0.00 29.99 30.20 3gyr n HIS 203 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 3gyr n ALA 204 N 0.19 2.67 -1.69 1.57 0.00 -1.26 -4.22 120.51 117.78 3gyr n ALA 204 Ca 0.03 0.40 -0.56 0.00 0.00 0.00 0.00 53.44 53.32 3gyr n ALA 204 Cb 0.91 -2.51 -0.07 0.00 0.00 0.00 0.00 19.45 17.78 3gyr n ALA 204 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 3gyr n MET 205 N 4.03 1.27 0.00 0.00 1.56 -0.13 -2.10 117.12 121.76 3gyr n MET 205 Ca 0.16 0.47 0.00 0.00 -0.27 0.00 0.00 57.70 58.06 3gyr n MET 205 Cb 0.34 -2.16 0.00 0.00 2.15 0.00 0.00 33.22 33.55 3gyr n MET 205 CO 0.00 0.00 0.00 0.09 -0.73 0.00 0.00 175.97 175.33 3gyr n ASN 206 N 5.09 0.00 0.00 6.12 3.02 -1.26 -4.70 115.26 123.53 3gyr n ASN 206 Ca 0.25 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.80 3gyr n ASN 206 Cb 0.16 -0.02 0.00 0.00 -0.61 0.00 0.00 39.78 39.30 3gyr n ASN 206 CO 0.00 0.00 0.00 2.30 -2.62 0.00 0.00 177.26 176.94 3gyr n ILE 207 N -1.99 0.36 -0.32 2.41 -5.35 -0.89 -4.78 119.36 108.80 3gyr n ILE 207 Ca 0.00 -0.38 0.14 0.00 -0.27 0.00 0.00 62.75 62.24 3gyr n ILE 207 Cb 0.00 0.86 0.32 0.00 -1.74 0.00 0.00 39.64 39.08 3gyr n ILE 207 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 3gyr h THR 208 N 1.75 0.53 0.00 7.28 2.02 -1.74 -0.22 112.91 122.54 3gyr h THR 208 Ca 0.00 -0.17 -0.01 0.00 0.77 0.00 0.00 66.41 67.01 3gyr h THR 208 Cb 0.77 -0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 67.18 3gyr h THR 208 CO 0.00 0.09 -0.03 0.08 0.37 0.00 0.00 175.52 176.03 3gyr h ARG 209 N 0.49 0.00 0.02 6.66 0.11 -1.86 -1.19 114.38 118.60 3gyr h ARG 209 Ca 0.57 0.00 -0.36 0.00 0.10 0.00 0.00 59.98 60.30 3gyr h ARG 209 Cb 1.06 0.00 -0.05 0.00 1.11 0.00 0.00 29.97 32.09 3gyr h ARG 209 CO -0.49 0.03 -1.98 0.91 0.10 0.00 0.00 179.97 178.54 3gyr n TRP 210 N -3.60 0.55 -0.26 4.08 8.01 -0.26 -3.85 117.44 122.12 3gyr n TRP 210 Ca -0.03 0.20 0.03 0.00 -1.31 0.00 0.00 57.50 56.40 3gyr n TRP 210 Cb 0.12 -1.06 0.17 0.00 -2.01 0.00 0.00 31.31 28.53 3gyr n TRP 210 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 177.69 175.77 3gyr h ASN 211 N -0.76 0.42 -0.11 -0.99 4.21 -1.04 0.32 115.58 117.64 3gyr h ASN 211 Ca -0.52 0.08 -0.14 0.00 1.21 0.00 0.00 56.30 56.93 3gyr h ASN 211 Cb 1.58 0.02 -0.01 0.00 -1.12 0.00 0.00 38.32 38.79 3gyr h ASN 211 CO -0.24 0.21 -0.41 0.58 -1.29 0.00 0.00 177.43 176.28 3gyr h VAL 212 N 0.56 1.30 0.00 2.81 2.07 -1.44 -2.87 116.25 118.68 3gyr h VAL 212 Ca 0.39 -1.59 -0.08 0.00 0.82 0.00 0.00 66.70 66.24 3gyr h VAL 212 Cb 0.49 1.54 -0.01 0.00 -1.52 0.00 0.00 31.29 31.78 3gyr h VAL 212 CO -0.32 0.51 -0.37 -0.03 0.02 0.00 0.00 177.57 177.38 3gyr h MET 213 N 0.52 0.00 0.00 1.57 1.85 -1.42 -2.58 114.93 114.87 3gyr h MET 213 Ca 0.04 0.00 -0.00 0.00 -0.61 0.00 0.00 59.70 59.13 3gyr h MET 213 Cb 0.94 0.00 -0.00 0.00 0.43 0.00 0.00 31.60 32.97 3gyr h MET 213 CO 0.08 0.37 -0.00 0.00 -0.40 0.00 0.00 176.91 176.96 3gyr h ALA 214 N 1.63 1.27 0.00 0.39 0.00 -0.17 -3.46 119.26 118.93 3gyr h ALA 214 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3gyr h ALA 214 Cb 0.90 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.69 3gyr h ALA 214 CO 0.05 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.71 3gyr n GLY 215 N -1.18 0.31 3.22 0.00 0.00 -0.97 -1.19 105.19 105.38 3gyr n GLY 215 Ca -0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.56 3gyr n GLY 215 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3gyr n LEU 216 N 0.00 5.79 -3.58 0.99 4.77 -1.21 -4.55 117.00 119.21 3gyr n LEU 216 Ca 0.00 -4.47 -0.16 0.00 -0.03 0.00 0.00 56.01 51.35 3gyr n LEU 216 Cb 0.00 -1.58 -0.07 0.00 -2.33 0.00 0.00 43.42 39.44 3gyr n LEU 216 CO 0.00 0.94 0.40 -0.72 -1.33 0.00 0.00 177.39 176.67 3gyr s TYR 217 N 1.41 -0.67 0.17 -1.77 -0.85 -1.26 -2.32 117.35 112.06 3gyr s TYR 217 Ca 0.43 1.38 -0.24 0.00 -0.52 0.00 0.00 57.07 58.12 3gyr s TYR 217 Cb 0.03 0.33 0.07 0.00 0.38 0.00 0.00 41.96 42.77 3gyr s TYR 217 CO 0.01 -0.50 0.97 0.20 -1.52 0.00 0.00 175.55 174.71 3gyr s GLY 218 N -0.56 -0.12 0.38 5.49 0.00 0.28 -0.78 107.32 112.01 3gyr s GLY 218 Ca -0.07 -0.03 0.07 0.00 0.00 0.00 0.00 44.72 44.70 3gyr s GLY 218 CO 0.06 0.55 -0.01 -1.08 0.00 0.00 0.00 173.10 172.61 3gyr s THR 219 N -2.97 1.98 -0.26 0.90 -1.32 -1.26 0.48 115.64 113.19 3gyr s THR 219 Ca 0.15 -2.05 -0.03 0.00 -1.21 0.00 0.00 61.69 58.54 3gyr s THR 219 Cb -0.02 -2.88 0.14 0.00 -1.51 0.00 0.00 72.50 68.24 3gyr s THR 219 CO 0.03 -0.06 0.45 -0.47 -2.21 0.00 0.00 174.62 172.36 3gyr s TYR 220 N -2.75 -1.04 -0.13 9.09 6.14 -0.87 -1.84 117.35 125.95 3gyr s TYR 220 Ca 0.34 1.19 -0.04 0.00 0.64 0.00 0.00 57.07 59.20 3gyr s TYR 220 Cb 0.08 0.22 -0.03 0.00 0.42 0.00 0.00 41.96 42.64 3gyr s TYR 220 CO 0.17 -0.73 0.01 -0.51 0.64 0.00 0.00 175.55 175.13 3gyr s LEU 221 N 2.65 3.56 -0.14 6.97 1.43 0.11 -1.00 118.68 132.26 3gyr s LEU 221 Ca 0.13 0.06 -0.04 0.00 -1.03 0.00 0.00 54.13 53.25 3gyr s LEU 221 Cb -0.15 -1.85 -0.03 0.00 0.03 0.00 0.00 46.19 44.19 3gyr s LEU 221 CO -0.17 0.27 -0.01 -0.69 0.23 0.00 0.00 176.35 175.98 3gyr s VAL 222 N -0.22 4.20 0.06 -1.59 1.01 0.23 -1.80 120.40 122.30 3gyr s VAL 222 Ca 0.06 -0.26 0.05 0.00 0.00 0.00 0.00 61.98 61.82 3gyr s VAL 222 Cb -0.12 -2.83 -0.04 0.00 0.00 0.00 0.00 36.38 33.38 3gyr s VAL 222 CO 0.02 0.52 -0.03 -0.13 0.00 0.00 0.00 175.10 175.47 3gyr s ARG 223 N 0.02 2.49 0.30 2.72 1.81 0.19 -2.27 118.95 124.22 3gyr s ARG 223 Ca 0.02 -0.82 -0.08 0.00 -1.72 0.00 0.00 55.73 53.13 3gyr s ARG 223 Cb -0.13 -2.50 0.00 0.00 -0.45 0.00 0.00 34.95 31.87 3gyr s ARG 223 CO 0.02 0.56 0.49 0.16 -0.68 0.00 0.00 175.30 175.85 3gyr s ASP 224 N -2.02 0.40 0.35 0.23 1.47 -1.26 -0.40 116.67 115.44 3gyr s ASP 224 Ca 0.22 -1.23 0.16 0.00 1.18 0.00 0.00 52.55 52.88 3gyr s ASP 224 Cb -0.11 0.64 0.62 0.00 -0.34 0.00 0.00 42.92 43.73 3gyr s ASP 224 CO 0.14 -1.26 1.72 0.44 0.68 0.00 0.00 175.17 176.89 3gyr h ASP 225 N 2.18 0.00 -0.09 2.11 3.45 -1.99 -1.67 116.42 120.40 3gyr h ASP 225 Ca -0.28 0.00 -0.03 0.00 0.43 0.00 0.00 57.03 57.14 3gyr h ASP 225 Cb 1.25 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 40.01 3gyr h ASP 225 CO 0.38 0.43 -0.08 -0.08 -1.57 0.00 0.00 179.24 178.33 3gyr h GLU 226 N 0.00 0.22 -0.52 3.56 4.81 -1.99 -2.00 114.58 118.65 3gyr h GLU 226 Ca -0.00 -0.11 -0.01 0.00 -0.13 0.00 0.00 59.36 59.10 3gyr h GLU 226 Cb 0.91 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.27 3gyr h GLU 226 CO 0.06 0.62 0.27 1.49 -0.73 0.00 0.00 179.01 180.72 3gyr h GLU 227 N -0.19 0.73 -1.00 1.92 4.81 -1.96 -2.46 114.58 116.43 3gyr h GLU 227 Ca 0.02 -0.10 0.16 0.00 -0.13 0.00 0.00 59.36 59.31 3gyr h GLU 227 Cb 0.58 -0.14 -0.10 0.00 0.63 0.00 0.00 28.75 29.72 3gyr h GLU 227 CO 0.02 0.59 0.62 -0.44 -0.73 0.00 0.00 179.01 179.07 3gyr h ASP 228 N 0.69 0.86 0.28 1.04 3.32 -1.22 -1.49 116.42 119.90 3gyr h ASP 228 Ca 0.18 0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.30 3gyr h ASP 228 Cb 0.08 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.54 3gyr h ASP 228 CO -0.03 0.38 0.00 0.00 -1.72 0.00 0.00 179.24 177.88 3gyr n ALA 229 N -2.34 2.09 0.89 3.45 0.00 -0.76 -1.34 120.51 122.50 3gyr n ALA 229 Ca 0.21 -0.10 0.13 0.00 0.00 0.00 0.00 53.44 53.68 3gyr n ALA 229 Cb 0.46 -1.32 0.45 0.00 0.00 0.00 0.00 19.45 19.04 3gyr n ALA 229 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3gyr n LEU 230 N -1.22 0.33 -3.77 0.00 4.77 -0.56 -4.95 117.00 111.60 3gyr n LEU 230 Ca 0.11 0.37 -0.26 0.00 -0.03 0.00 0.00 56.01 56.20 3gyr n LEU 230 Cb 0.14 -0.38 0.04 0.00 -2.33 0.00 0.00 43.42 40.89 3gyr n LEU 230 CO 0.14 -0.01 0.08 0.61 -1.33 0.00 0.00 177.39 176.88 3gyr n GLY 231 N 1.45 -0.43 3.78 -0.72 0.00 -0.45 -4.95 105.19 103.87 3gyr n GLY 231 Ca 0.06 0.18 -0.33 0.00 0.00 0.00 0.00 46.02 45.93 3gyr n GLY 231 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3gyr s LEU 232 N -7.05 3.36 0.31 0.99 1.43 -1.26 -4.95 118.68 111.51 3gyr s LEU 232 Ca 0.41 1.94 -0.27 0.00 -1.03 0.00 0.00 54.13 55.17 3gyr s LEU 232 Cb -0.20 -4.54 -0.13 0.00 0.03 0.00 0.00 46.19 41.34 3gyr s LEU 232 CO 0.80 -1.60 1.01 -2.65 0.23 0.00 0.00 176.35 174.14 3gyr n PRO 233 N -2.50 1.37 -3.60 1.29 -0.02 -1.26 -4.97 135.00 125.31 3gyr n PRO 233 Ca 0.10 0.48 -0.14 0.00 -2.02 0.00 0.00 63.50 61.92 3gyr n PRO 233 Cb 0.52 -1.88 -0.05 0.00 -0.02 0.00 0.00 33.50 32.07 3gyr n PRO 233 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3gyr n SER 234 N 1.12 -0.56 0.00 2.55 3.41 -1.26 -4.49 113.62 114.38 3gyr n SER 234 Ca 0.09 -2.58 0.00 0.00 -0.26 0.00 0.00 58.87 56.13 3gyr n SER 234 Cb 0.33 1.28 0.00 0.00 -0.26 0.00 0.00 64.21 65.56 3gyr n SER 234 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3gyr n GLY 235 N -0.46 3.13 0.54 5.00 0.00 -1.26 -0.68 105.19 111.46 3gyr n GLY 235 Ca 0.05 -0.30 0.32 0.00 0.00 0.00 0.00 46.02 46.09 3gyr n GLY 235 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3gyr h ASP 236 N 7.24 0.00 -0.23 1.61 3.32 -2.03 -1.37 116.42 124.96 3gyr h ASP 236 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3gyr h ASP 236 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3gyr h ASP 236 CO 0.00 0.00 0.00 0.54 -1.72 0.00 0.00 179.24 178.06 3gyr n ARG 237 N -3.55 2.36 -4.35 3.56 5.12 0.14 -4.74 116.66 115.21 3gyr n ARG 237 Ca 0.24 -2.02 -0.34 0.00 -1.93 0.00 0.00 57.85 53.80 3gyr n ARG 237 Cb 1.42 -1.49 -0.14 0.00 -1.16 0.00 0.00 32.46 31.10 3gyr n ARG 237 CO 0.00 0.00 0.00 -2.00 -1.93 0.00 0.00 177.63 173.70 3gyr s GLU 238 N -1.72 3.44 -0.12 5.56 2.12 -0.52 -0.92 118.70 126.55 3gyr s GLU 238 Ca 0.35 -0.63 -0.01 0.00 0.36 0.00 0.00 54.97 55.04 3gyr s GLU 238 Cb 0.21 -2.84 0.03 0.00 0.26 0.00 0.00 34.13 31.79 3gyr s GLU 238 CO 0.31 0.05 -0.05 0.42 -0.54 0.00 0.00 175.26 175.45 3gyr s ILE 239 N 0.80 0.89 0.29 -3.70 1.01 -0.43 -4.73 121.20 115.32 3gyr s ILE 239 Ca -0.03 -0.26 -0.29 0.00 0.00 0.00 0.00 60.65 60.07 3gyr s ILE 239 Cb -0.15 -0.98 -0.10 0.00 0.01 0.00 0.00 42.46 41.25 3gyr s ILE 239 CO 0.01 0.29 1.13 -2.84 0.00 0.00 0.00 174.94 173.53 3gyr s PRO 240 N 1.76 4.60 -0.28 2.79 0.02 -1.26 -1.39 135.00 141.23 3gyr s PRO 240 Ca 0.04 1.86 0.02 0.00 0.02 0.00 0.00 61.00 62.94 3gyr s PRO 240 Cb -0.13 -3.17 0.08 0.00 0.02 0.00 0.00 34.50 31.30 3gyr s PRO 240 CO -0.08 0.15 -0.00 -0.51 -0.33 0.00 0.00 177.00 176.24 3gyr s LEU 241 N -1.49 3.30 -0.42 -5.54 1.43 0.17 -4.84 118.68 111.28 3gyr s LEU 241 Ca 0.45 -1.59 -0.18 0.00 -1.03 0.00 0.00 54.13 51.77 3gyr s LEU 241 Cb -0.33 -1.31 0.02 0.00 0.03 0.00 0.00 46.19 44.60 3gyr s LEU 241 CO 0.43 -0.31 0.50 -0.76 0.23 0.00 0.00 176.35 176.44 3gyr s LEU 242 N 1.25 4.72 0.09 1.79 1.02 -1.26 -0.97 118.68 125.31 3gyr s LEU 242 Ca 0.02 -0.53 0.04 0.00 0.02 0.00 0.00 54.13 53.68 3gyr s LEU 242 Cb -0.19 -2.50 -0.04 0.00 0.02 0.00 0.00 46.19 43.48 3gyr s LEU 242 CO -0.10 -0.63 0.03 0.27 0.02 0.00 0.00 176.35 175.94 3gyr s ILE 243 N 2.36 4.21 -0.28 -0.59 -4.36 -0.63 -0.75 121.20 121.15 3gyr s ILE 243 Ca 0.16 -0.90 -0.17 0.00 -0.26 0.00 0.00 60.65 59.47 3gyr s ILE 243 Cb -0.16 -3.02 0.12 0.00 1.25 0.00 0.00 42.46 40.65 3gyr s ILE 243 CO 0.15 0.12 0.88 0.00 0.24 0.00 0.00 174.94 176.33 3gyr s ALA 244 N -1.34 -2.10 0.43 2.27 0.00 -0.50 0.84 121.76 121.36 3gyr s ALA 244 Ca 0.27 2.24 -0.21 0.00 0.00 0.00 0.00 51.96 54.27 3gyr s ALA 244 Cb -0.12 -1.57 -0.11 0.00 0.00 0.00 0.00 23.12 21.32 3gyr s ALA 244 CO 0.20 -0.35 0.95 0.16 0.00 0.00 0.00 175.76 176.72 3gyr s ASP 245 N 1.31 6.92 0.07 0.00 -4.77 -1.26 -0.30 116.67 118.64 3gyr s ASP 245 Ca -0.08 1.69 0.03 0.00 -3.30 0.00 0.00 52.55 50.88 3gyr s ASP 245 Cb -0.04 -2.54 -0.03 0.00 -1.09 0.00 0.00 42.92 39.22 3gyr s ASP 245 CO -0.15 -0.37 -0.08 -0.13 0.70 0.00 0.00 175.17 175.13 3gyr s ARG 246 N -3.21 0.72 0.24 2.11 1.81 0.14 -4.80 118.95 115.95 3gyr s ARG 246 Ca 0.62 -1.05 0.10 0.00 -1.72 0.00 0.00 55.73 53.68 3gyr s ARG 246 Cb -0.09 -0.34 -0.04 0.00 -0.45 0.00 0.00 34.95 34.02 3gyr s ARG 246 CO 0.14 0.04 -0.11 1.21 -0.68 0.00 0.00 175.30 175.90 3gyr s ASN 247 N -2.28 4.07 -0.01 0.23 3.84 -1.25 -1.97 114.94 117.57 3gyr s ASN 247 Ca 0.01 -0.75 0.04 0.00 0.21 0.00 0.00 52.86 52.37 3gyr s ASN 247 Cb -0.03 -0.59 -0.01 0.00 -0.55 0.00 0.00 41.25 40.07 3gyr s ASN 247 CO -0.01 0.06 -0.13 -0.76 -2.79 0.00 0.00 177.10 173.47 3gyr s LEU 248 N -3.26 1.98 0.83 3.21 1.43 -1.26 -0.43 118.68 121.19 3gyr s LEU 248 Ca 0.28 -0.23 -0.12 0.00 -1.03 0.00 0.00 54.13 53.03 3gyr s LEU 248 Cb -0.07 -0.67 0.09 0.00 0.03 0.00 0.00 46.19 45.57 3gyr s LEU 248 CO 0.16 0.14 1.10 -0.62 0.23 0.00 0.00 176.35 177.36 3gyr s ASP 249 N -0.21 4.17 0.13 2.29 -1.08 -0.25 -0.91 116.67 120.82 3gyr s ASP 249 Ca 0.03 1.30 0.05 0.00 -0.52 0.00 0.00 52.55 53.41 3gyr s ASP 249 Cb -0.06 -2.00 -0.04 0.00 -1.46 0.00 0.00 42.92 39.36 3gyr s ASP 249 CO -0.00 -2.17 -0.12 0.42 0.52 0.00 0.00 175.17 173.81 3gyr s THR 250 N -3.13 1.28 0.94 1.71 -4.23 -1.26 -2.06 115.64 108.89 3gyr s THR 250 Ca 0.62 -1.86 -0.15 0.00 -1.18 0.00 0.00 61.69 59.12 3gyr s THR 250 Cb -0.15 -1.65 0.18 0.00 1.34 0.00 0.00 72.50 72.21 3gyr s THR 250 CO 0.55 -0.55 1.27 -1.81 -0.54 0.00 0.00 174.62 173.54 3gyr s ASP 251 N -2.74 3.30 0.50 3.99 1.01 0.70 -4.86 116.67 118.56 3gyr s ASP 251 Ca 0.12 0.45 0.16 0.00 0.71 0.00 0.00 52.55 53.99 3gyr s ASP 251 Cb -0.02 -0.63 1.21 0.00 1.01 0.00 0.00 42.92 44.49 3gyr s ASP 251 CO 0.02 -2.63 2.10 -0.33 0.21 0.00 0.00 175.17 174.54 3gyr h GLU 252 N -1.57 0.11 -0.09 8.23 5.08 -2.02 1.60 114.58 125.93 3gyr h GLU 252 Ca -0.45 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 57.90 3gyr h GLU 252 Cb 1.27 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.49 3gyr h GLU 252 CO 0.45 0.07 0.00 -0.40 -1.00 0.00 0.00 179.01 178.14 3gyr n ASP 253 N -4.50 0.86 0.00 1.42 5.75 -1.26 -4.92 116.55 113.91 3gyr n ASP 253 Ca 0.01 -1.57 0.00 0.00 -0.01 0.00 0.00 54.79 53.22 3gyr n ASP 253 Cb 0.20 -0.05 0.00 0.00 -1.03 0.00 0.00 41.12 40.23 3gyr n ASP 253 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3gyr n GLY 254 N 0.96 0.79 3.77 6.12 0.00 0.55 -5.04 105.19 112.34 3gyr n GLY 254 Ca 0.15 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.81 3gyr n GLY 254 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3gyr s ARG 255 N -0.40 3.56 0.08 1.61 0.52 -1.25 -4.65 118.95 118.41 3gyr s ARG 255 Ca 0.00 1.75 -0.31 0.00 -0.52 0.00 0.00 55.73 56.65 3gyr s ARG 255 Cb 0.00 -2.25 -0.07 0.00 0.52 0.00 0.00 34.95 33.15 3gyr s ARG 255 CO 0.00 -0.71 1.34 -0.51 0.02 0.00 0.00 175.30 175.44 3gyr s LEU 256 N -3.35 4.36 0.00 2.53 1.43 -1.26 -0.22 118.68 122.17 3gyr s LEU 256 Ca 0.68 2.20 0.09 0.00 -1.03 0.00 0.00 54.13 56.07 3gyr s LEU 256 Cb -0.28 -3.58 0.12 0.00 0.03 0.00 0.00 46.19 42.49 3gyr s LEU 256 CO 0.33 -0.62 0.91 -0.46 0.23 0.00 0.00 176.35 176.74 3gyr n ASN 257 N 4.25 2.06 0.00 2.29 0.23 -0.88 -4.78 115.26 118.43 3gyr n ASN 257 Ca 0.11 -1.56 0.00 0.00 -0.53 0.00 0.00 54.58 52.60 3gyr n ASN 257 Cb 0.44 -0.05 0.00 0.00 -2.08 0.00 0.00 39.78 38.08 3gyr n ASN 257 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3gyr n GLY 258 N 0.47 1.47 3.71 4.83 0.00 -1.26 -4.66 105.19 109.76 3gyr n GLY 258 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 3gyr n GLY 258 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3gyr s ARG 259 N -0.06 4.33 0.23 1.61 0.52 -1.26 -4.54 118.95 119.78 3gyr s ARG 259 Ca 0.00 2.01 -0.31 0.00 -0.52 0.00 0.00 55.73 56.91 3gyr s ARG 259 Cb 0.00 -3.30 -0.12 0.00 0.52 0.00 0.00 34.95 32.05 3gyr s ARG 259 CO 0.00 -0.43 1.67 -0.51 0.02 0.00 0.00 175.30 176.06 3gyr s LEU 260 N 1.26 4.36 -0.20 2.53 1.43 -1.26 -1.08 118.68 125.72 3gyr s LEU 260 Ca 0.64 2.88 0.00 0.00 -1.03 0.00 0.00 54.13 56.62 3gyr s LEU 260 Cb -0.35 -3.61 0.05 0.00 0.03 0.00 0.00 46.19 42.31 3gyr s LEU 260 CO 0.30 -0.95 -0.07 -0.22 0.23 0.00 0.00 176.35 175.64 3gyr s LEU 261 N 0.65 2.12 -0.68 1.79 2.96 0.43 -1.44 118.68 124.51 3gyr s LEU 261 Ca 0.71 -0.91 -0.22 0.00 -0.22 0.00 0.00 54.13 53.49 3gyr s LEU 261 Cb -0.49 -1.09 0.07 0.00 0.50 0.00 0.00 46.19 45.18 3gyr s LEU 261 CO 0.37 -0.19 0.99 -2.28 -1.32 0.00 0.00 176.35 173.91 3gyr s HIS 262 N 1.49 2.68 -0.31 5.38 5.65 0.17 -3.79 115.29 126.56 3gyr s HIS 262 Ca -0.02 -0.58 -0.04 0.00 0.25 0.00 0.00 55.06 54.66 3gyr s HIS 262 Cb -0.17 -4.31 0.03 0.00 -1.18 0.00 0.00 32.58 26.96 3gyr s HIS 262 CO -0.07 -1.66 0.05 0.21 -0.65 0.00 0.00 174.74 172.61 3gyr s LYS 263 N 4.05 2.69 0.34 2.88 2.20 -1.26 -1.59 119.74 129.05 3gyr s LYS 263 Ca 0.23 -1.11 0.07 0.00 -0.36 0.00 0.00 55.97 54.80 3gyr s LYS 263 Cb -0.16 -3.30 -0.03 0.00 -1.51 0.00 0.00 37.83 32.84 3gyr s LYS 263 CO 0.09 -0.57 0.30 0.95 -0.36 0.00 0.00 175.35 175.76 3gyr s THR 264 N 1.37 3.43 -0.17 3.43 -4.23 -0.80 -4.50 115.64 114.18 3gyr s THR 264 Ca -0.02 -1.37 -0.01 0.00 -1.18 0.00 0.00 61.69 59.11 3gyr s THR 264 Cb -0.19 -3.16 -0.01 0.00 1.34 0.00 0.00 72.50 70.48 3gyr s THR 264 CO 0.01 -0.15 -0.11 -0.69 -0.54 0.00 0.00 174.62 173.14 3gyr s VAL 265 N -2.32 3.07 -0.01 2.29 1.01 -1.26 -2.15 120.40 121.03 3gyr s VAL 265 Ca 0.42 -0.63 -0.30 0.00 0.00 0.00 0.00 61.98 61.47 3gyr s VAL 265 Cb -0.05 -2.33 -0.05 0.00 0.00 0.00 0.00 36.38 33.94 3gyr s VAL 265 CO 0.27 0.49 1.40 -0.63 0.00 0.00 0.00 175.10 176.63 3gyr s ILE 266 N 0.84 3.75 -0.78 2.22 1.01 0.47 -1.76 121.20 126.94 3gyr s ILE 266 Ca -0.03 1.11 0.10 0.00 0.00 0.00 0.00 60.65 61.83 3gyr s ILE 266 Cb -0.15 -3.72 -0.05 0.00 0.01 0.00 0.00 42.46 38.56 3gyr s ILE 266 CO 0.01 -0.01 0.57 1.33 0.00 0.00 0.00 174.94 176.83 3gyr n VAL 267 N 4.71 0.00 -3.31 2.92 0.24 -0.04 -3.76 118.33 119.09 3gyr n VAL 267 Ca 0.13 -0.34 -0.08 0.00 -2.04 0.00 0.00 64.34 62.02 3gyr n VAL 267 Cb 0.44 1.07 -0.06 0.00 -1.47 0.00 0.00 33.84 33.82 3gyr n VAL 267 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 3gyr s GLN 268 N -1.65 0.39 0.28 7.34 0.74 -1.05 -5.01 119.66 120.71 3gyr s GLN 268 Ca 0.07 0.44 0.00 0.00 0.05 0.00 0.00 55.36 55.92 3gyr s GLN 268 Cb 0.08 -0.31 0.51 0.00 1.10 0.00 0.00 33.01 34.39 3gyr s GLN 268 CO 0.33 -0.78 1.86 0.37 -0.55 0.00 0.00 175.29 176.52 3gyr h GLN 269 N 8.16 1.03 -2.50 1.67 5.75 -1.89 -0.78 115.11 126.53 3gyr h GLN 269 Ca -0.16 -0.06 -0.30 0.00 -0.15 0.00 0.00 58.65 57.98 3gyr h GLN 269 Cb 1.14 -0.23 -0.35 0.00 1.07 0.00 0.00 27.48 29.11 3gyr h GLN 269 CO 0.27 0.68 -0.61 0.45 -2.65 0.00 0.00 178.83 176.97 3gyr s SER 270 N -5.79 1.22 -0.05 -0.69 0.15 -1.26 -3.47 113.70 103.80 3gyr s SER 270 Ca -0.12 -0.13 -0.30 0.00 0.70 0.00 0.00 55.95 56.10 3gyr s SER 270 Cb 0.21 0.45 -0.03 0.00 -1.71 0.00 0.00 66.02 64.95 3gyr s SER 270 CO 0.81 -0.32 1.15 0.21 1.20 0.00 0.00 173.24 176.29 3gyr s ASN 271 N 2.35 7.12 0.42 5.45 2.47 -0.72 -4.92 114.94 127.10 3gyr s ASN 271 Ca 0.07 1.77 0.29 0.00 0.42 0.00 0.00 52.86 55.41 3gyr s ASN 271 Cb -0.15 -2.56 1.44 0.00 -1.45 0.00 0.00 41.25 38.52 3gyr s ASN 271 CO -0.12 -0.52 1.59 -0.65 -3.72 0.00 0.00 177.10 173.68 3gyr h PRO 272 N 7.26 0.03 0.00 0.43 0.11 -1.95 -2.00 132.00 135.88 3gyr h PRO 272 Ca -0.35 -0.00 -0.26 0.00 0.11 0.00 0.00 66.00 65.50 3gyr h PRO 272 Cb 1.17 -0.01 -0.04 0.00 0.11 0.00 0.00 31.00 32.23 3gyr h PRO 272 CO 0.86 0.02 -1.62 0.39 -0.21 0.00 0.00 178.00 177.44 3gyr n GLU 273 N -4.87 0.63 -4.45 1.05 1.02 -1.26 -4.90 120.64 107.85 3gyr n GLU 273 Ca 0.39 0.28 -0.22 0.00 -0.02 0.00 0.00 57.16 57.59 3gyr n GLU 273 Cb 1.46 -1.80 -0.10 0.00 -0.02 0.00 0.00 31.44 30.98 3gyr n GLU 273 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 3gyr s THR 274 N -2.69 1.77 -0.71 2.62 -4.23 -0.75 -5.02 115.64 106.64 3gyr s THR 274 Ca -0.04 -2.15 0.18 0.00 -1.18 0.00 0.00 61.69 58.50 3gyr s THR 274 Cb 0.08 -2.49 0.17 0.00 1.34 0.00 0.00 72.50 71.61 3gyr s THR 274 CO 0.82 -0.28 1.54 0.61 -0.54 0.00 0.00 174.62 176.77 3gyr n GLY 275 N -0.63 -1.06 3.89 3.99 0.00 -1.26 -3.61 105.19 106.52 3gyr n GLY 275 Ca -0.05 0.03 -0.31 0.00 0.00 0.00 0.00 46.02 45.69 3gyr n GLY 275 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3gyr s LYS 276 N -3.18 3.68 0.70 1.61 2.47 -1.26 -4.24 119.74 119.52 3gyr s LYS 276 Ca 0.04 0.04 -0.11 0.00 -1.56 0.00 0.00 55.97 54.38 3gyr s LYS 276 Cb 0.08 -2.76 0.01 0.00 -1.46 0.00 0.00 37.83 33.70 3gyr s LYS 276 CO 0.29 0.40 1.07 -1.25 0.16 0.00 0.00 175.35 176.01 3gyr s PRO 277 N -2.79 2.90 -0.10 4.03 0.04 -1.23 -1.76 135.00 136.09 3gyr s PRO 277 Ca 0.43 0.74 0.00 0.00 0.04 0.00 0.00 61.00 62.21 3gyr s PRO 277 Cb -0.12 -2.00 0.02 0.00 0.04 0.00 0.00 34.50 32.44 3gyr s PRO 277 CO 0.24 -1.07 -0.09 0.08 0.04 0.00 0.00 177.00 176.20 3gyr s VAL 278 N -3.16 1.08 0.25 -0.36 1.01 -0.30 -4.93 120.40 113.99 3gyr s VAL 278 Ca 0.58 -0.35 0.12 0.00 0.00 0.00 0.00 61.98 62.32 3gyr s VAL 278 Cb -0.13 -1.06 -0.05 0.00 0.00 0.00 0.00 36.38 35.15 3gyr s VAL 278 CO 0.54 0.37 -0.20 -0.94 0.00 0.00 0.00 175.10 174.86 3gyr s SER 279 N 1.42 3.47 0.70 3.32 1.04 -1.26 -0.86 113.70 121.53 3gyr s SER 279 Ca -0.00 -0.99 -0.08 0.00 0.48 0.00 0.00 55.95 55.36 3gyr s SER 279 Cb -0.13 -0.28 0.05 0.00 0.10 0.00 0.00 66.02 65.76 3gyr s SER 279 CO -0.05 0.04 1.03 0.27 0.98 0.00 0.00 173.24 175.51 3gyr s ILE 280 N -2.35 2.55 1.26 -1.02 -4.36 -0.72 -4.91 121.20 111.65 3gyr s ILE 280 Ca 0.27 -0.12 -0.19 0.00 -0.26 0.00 0.00 60.65 60.35 3gyr s ILE 280 Cb -0.05 -3.11 0.31 0.00 1.25 0.00 0.00 42.46 40.85 3gyr s ILE 280 CO 0.13 -0.13 1.04 -2.84 0.24 0.00 0.00 174.94 173.38 3gyr s PRO 281 N -5.27 -1.65 0.02 0.37 0.02 -1.26 -4.43 135.00 122.80 3gyr s PRO 281 Ca 0.59 0.16 -0.29 0.00 0.02 0.00 0.00 61.00 61.49 3gyr s PRO 281 Cb -0.11 -1.53 -0.04 0.00 0.02 0.00 0.00 34.50 32.85 3gyr s PRO 281 CO 0.46 -4.04 0.92 0.12 -0.33 0.00 0.00 177.00 174.13 3gyr s PHE 282 N -2.68 3.69 -0.00 6.54 5.36 -1.26 -4.75 117.98 124.87 3gyr s PHE 282 Ca 0.69 1.65 0.01 0.00 -0.96 0.00 0.00 56.93 58.32 3gyr s PHE 282 Cb -0.14 -3.04 0.00 0.00 -0.34 0.00 0.00 43.02 39.50 3gyr s PHE 282 CO 0.58 0.08 -0.02 -0.06 -1.46 0.00 0.00 175.22 174.33 3gyr s PHE 283 N 0.66 0.24 0.15 10.12 0.08 -1.26 -4.05 117.98 123.92 3gyr s PHE 283 Ca 0.48 -0.04 0.03 0.00 0.12 0.00 0.00 56.93 57.52 3gyr s PHE 283 Cb -0.21 -0.17 -0.04 0.00 -0.57 0.00 0.00 43.02 42.02 3gyr s PHE 283 CO 0.27 -0.01 -0.05 0.20 -0.10 0.00 0.00 175.22 175.53 3gyr s GLY 284 N 0.03 1.07 0.35 4.36 0.00 -1.26 -4.78 107.32 107.09 3gyr s GLY 284 Ca 0.00 -1.51 0.19 0.00 0.00 0.00 0.00 44.72 43.40 3gyr s GLY 284 CO -0.00 -1.53 1.55 -0.56 0.00 0.00 0.00 173.10 172.55 3gyr h PRO 285 N 2.78 0.00 -5.34 2.90 0.14 -1.68 -3.42 132.00 127.38 3gyr h PRO 285 Ca -0.36 0.00 -0.62 0.00 0.14 0.00 0.00 66.00 65.16 3gyr h PRO 285 Cb 1.19 0.00 -0.13 0.00 0.14 0.00 0.00 31.00 32.20 3gyr h PRO 285 CO 0.64 0.32 -0.52 0.71 0.14 0.00 0.00 178.00 179.29 3gyr s TYR 286 N -3.13 3.37 -0.28 1.56 1.51 -0.83 -4.39 117.35 115.15 3gyr s TYR 286 Ca 0.04 0.26 -0.11 0.00 -1.01 0.00 0.00 57.07 56.25 3gyr s TYR 286 Cb 0.07 -2.09 -0.04 0.00 -0.11 0.00 0.00 41.96 39.79 3gyr s TYR 286 CO 0.71 0.30 0.18 0.99 -1.11 0.00 0.00 175.55 176.62 3gyr s THR 287 N 0.15 5.15 -0.09 -0.71 2.01 -1.26 0.29 115.64 121.18 3gyr s THR 287 Ca 0.07 0.07 -0.08 0.00 0.31 0.00 0.00 61.69 62.06 3gyr s THR 287 Cb -0.12 -3.47 -0.04 0.00 0.01 0.00 0.00 72.50 68.88 3gyr s THR 287 CO -0.00 0.23 0.20 0.42 -0.69 0.00 0.00 174.62 174.78 3gyr s THR 288 N 1.73 5.40 -0.20 -0.82 -4.23 0.59 -1.66 115.64 116.45 3gyr s THR 288 Ca 0.07 0.33 0.00 0.00 -1.18 0.00 0.00 61.69 60.91 3gyr s THR 288 Cb -0.16 -3.48 0.05 0.00 1.34 0.00 0.00 72.50 70.25 3gyr s THR 288 CO 0.10 0.59 -0.07 -0.69 -0.54 0.00 0.00 174.62 174.01 3gyr s VAL 289 N -1.06 1.47 -1.50 2.29 1.01 0.37 -1.41 120.40 121.56 3gyr s VAL 289 Ca 0.18 -0.99 -0.11 0.00 0.00 0.00 0.00 61.98 61.06 3gyr s VAL 289 Cb -0.13 -1.64 0.07 0.00 0.00 0.00 0.00 36.38 34.69 3gyr s VAL 289 CO 0.07 0.07 0.87 0.59 0.00 0.00 0.00 175.10 176.70 3gyr n ASN 290 N 4.73 -3.64 0.00 3.32 3.02 0.07 -2.09 115.26 120.66 3gyr n ASN 290 Ca -0.13 -0.83 0.00 0.00 -0.03 0.00 0.00 54.58 53.59 3gyr n ASN 290 Cb 0.46 -3.74 0.00 0.00 -0.61 0.00 0.00 39.78 35.89 3gyr n ASN 290 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3gyr n GLY 291 N -1.66 0.68 3.23 7.41 0.00 -1.26 -4.50 105.19 109.08 3gyr n GLY 291 Ca -0.04 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.68 3gyr n GLY 291 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3gyr s ARG 292 N -0.05 2.16 0.08 1.61 0.52 -0.89 -4.50 118.95 117.88 3gyr s ARG 292 Ca 0.00 -0.80 -0.31 0.00 -0.52 0.00 0.00 55.73 54.11 3gyr s ARG 292 Cb 0.00 -1.89 -0.08 0.00 0.52 0.00 0.00 34.95 33.49 3gyr s ARG 292 CO 0.00 0.37 1.66 0.42 0.02 0.00 0.00 175.30 177.76 3gyr s ILE 293 N -0.19 2.99 -1.09 1.52 1.01 -0.02 -0.48 121.20 124.94 3gyr s ILE 293 Ca -0.01 0.46 -0.21 0.00 0.00 0.00 0.00 60.65 60.89 3gyr s ILE 293 Cb -0.12 -3.29 0.01 0.00 0.01 0.00 0.00 42.46 39.07 3gyr s ILE 293 CO 0.02 0.00 0.72 0.79 0.00 0.00 0.00 174.94 176.47 3gyr n TRP 294 N 5.52 -1.82 -2.11 3.97 8.01 -0.66 -4.73 117.44 125.61 3gyr n TRP 294 Ca 0.16 0.43 -0.28 0.00 -1.31 0.00 0.00 57.50 56.49 3gyr n TRP 294 Cb 0.40 -3.15 0.05 0.00 -2.01 0.00 0.00 31.31 26.61 3gyr n TRP 294 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.69 175.43 3gyr s PRO 295 N -6.11 2.58 0.16 -0.99 0.04 -1.26 -0.41 135.00 129.00 3gyr s PRO 295 Ca 0.38 0.10 0.07 0.00 0.04 0.00 0.00 61.00 61.59 3gyr s PRO 295 Cb -0.17 -2.12 -0.04 0.00 0.04 0.00 0.00 34.50 32.22 3gyr s PRO 295 CO 0.90 -1.08 -0.02 1.52 0.04 0.00 0.00 177.00 178.36 3gyr s TYR 296 N -3.26 2.82 -0.10 0.56 -0.85 -0.84 -1.85 117.35 113.83 3gyr s TYR 296 Ca 0.58 -0.14 0.01 0.00 -0.52 0.00 0.00 57.07 57.00 3gyr s TYR 296 Cb -0.11 -1.39 0.02 0.00 0.38 0.00 0.00 41.96 40.86 3gyr s TYR 296 CO 0.48 0.50 -0.10 0.00 -1.52 0.00 0.00 175.55 174.91 3gyr s ALA 297 N -1.62 1.40 -0.18 9.51 0.00 0.19 0.81 121.76 131.88 3gyr s ALA 297 Ca 0.26 -0.57 -0.29 0.00 0.00 0.00 0.00 51.96 51.37 3gyr s ALA 297 Cb -0.10 -0.82 -0.00 0.00 0.00 0.00 0.00 23.12 22.20 3gyr s ALA 297 CO 0.18 -0.22 1.00 -0.51 0.00 0.00 0.00 175.76 176.20 3gyr s ASP 298 N 1.31 7.14 0.11 0.00 1.01 -1.26 -0.18 116.67 124.79 3gyr s ASP 298 Ca -0.02 1.41 0.05 0.00 0.71 0.00 0.00 52.55 54.70 3gyr s ASP 298 Cb -0.14 -2.54 -0.04 0.00 1.01 0.00 0.00 42.92 41.22 3gyr s ASP 298 CO -0.04 -0.55 -0.13 0.68 0.21 0.00 0.00 175.17 175.34 3gyr s VAL 299 N 2.62 1.19 0.59 -1.27 -7.23 0.45 -4.92 120.40 111.84 3gyr s VAL 299 Ca 0.45 -1.64 -0.09 0.00 -1.81 0.00 0.00 61.98 58.88 3gyr s VAL 299 Cb -0.16 -1.42 -0.03 0.00 0.56 0.00 0.00 36.38 35.32 3gyr s VAL 299 CO 0.11 -0.43 0.97 -1.81 -0.31 0.00 0.00 175.10 173.63 3gyr s ASP 300 N -2.36 6.14 -1.25 4.85 1.01 -1.26 0.13 116.67 123.93 3gyr s ASP 300 Ca 0.06 1.25 -0.14 0.00 0.71 0.00 0.00 52.55 54.43 3gyr s ASP 300 Cb -0.05 -2.34 -0.05 0.00 1.01 0.00 0.00 42.92 41.50 3gyr s ASP 300 CO 0.02 -0.85 2.28 -0.90 0.21 0.00 0.00 175.17 175.93 3gyr n ASP 301 N -2.65 4.58 -0.31 0.27 5.75 -0.83 -4.74 116.55 118.62 3gyr n ASP 301 Ca 0.05 -2.69 0.00 0.00 -0.01 0.00 0.00 54.79 52.14 3gyr n ASP 301 Cb 0.55 -1.43 0.00 0.00 -1.03 0.00 0.00 41.12 39.20 3gyr n ASP 301 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3gyr n GLY 302 N 4.07 4.60 3.70 6.12 0.00 -1.26 -3.74 105.19 118.68 3gyr n GLY 302 Ca 0.56 -1.43 -0.41 0.00 0.00 0.00 0.00 46.02 44.74 3gyr n GLY 302 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3gyr s TRP 303 N -1.69 3.52 0.16 1.61 0.52 -1.26 -0.63 118.94 121.16 3gyr s TRP 303 Ca 0.00 1.28 0.09 0.00 0.02 0.00 0.00 56.10 57.49 3gyr s TRP 303 Cb 0.00 -2.91 -0.04 0.00 -1.15 0.00 0.00 33.47 29.37 3gyr s TRP 303 CO 0.00 -0.06 -0.15 0.71 0.02 0.00 0.00 176.95 177.47 3gyr s TYR 304 N 1.37 2.54 -0.20 -1.98 1.51 -0.03 -4.84 117.35 115.73 3gyr s TYR 304 Ca 0.39 -0.26 -0.03 0.00 -1.01 0.00 0.00 57.07 56.16 3gyr s TYR 304 Cb -0.18 -1.28 -0.01 0.00 -0.11 0.00 0.00 41.96 40.38 3gyr s TYR 304 CO 0.17 0.47 -0.06 0.50 -1.11 0.00 0.00 175.55 175.51 3gyr s ARG 305 N -2.55 3.40 -0.12 -0.62 3.52 -0.10 0.38 118.95 122.85 3gyr s ARG 305 Ca 0.22 -0.63 -0.03 0.00 -0.13 0.00 0.00 55.73 55.15 3gyr s ARG 305 Cb -0.09 -2.92 -0.03 0.00 -1.56 0.00 0.00 34.95 30.35 3gyr s ARG 305 CO 0.12 -0.08 0.01 -0.51 -0.81 0.00 0.00 175.30 174.03 3gyr s LEU 306 N 1.15 3.56 -0.83 -0.88 1.43 0.16 -1.32 118.68 121.96 3gyr s LEU 306 Ca 0.02 0.07 -0.09 0.00 -1.03 0.00 0.00 54.13 53.10 3gyr s LEU 306 Cb -0.14 -1.84 0.21 0.00 0.03 0.00 0.00 46.19 44.45 3gyr s LEU 306 CO -0.01 0.29 0.74 -0.13 0.23 0.00 0.00 176.35 177.46 3gyr s ARG 307 N -0.35 3.39 -0.19 1.70 1.81 -0.49 -1.17 118.95 123.66 3gyr s ARG 307 Ca 0.07 -2.70 -0.20 0.00 -1.72 0.00 0.00 55.73 51.18 3gyr s ARG 307 Cb -0.12 -4.21 -0.03 0.00 -0.45 0.00 0.00 34.95 30.14 3gyr s ARG 307 CO 0.02 -1.25 0.59 -1.17 -0.68 0.00 0.00 175.30 172.81 3gyr s LEU 308 N -0.31 4.16 -0.02 2.53 2.96 -0.42 -0.66 118.68 126.91 3gyr s LEU 308 Ca 0.21 0.80 0.04 0.00 -0.22 0.00 0.00 54.13 54.96 3gyr s LEU 308 Cb -0.12 -2.83 -0.01 0.00 0.50 0.00 0.00 46.19 43.73 3gyr s LEU 308 CO -0.08 -0.22 -0.15 0.54 -1.32 0.00 0.00 176.35 175.12 3gyr s VAL 309 N 1.69 1.22 -0.56 1.68 0.11 -0.15 -0.43 120.40 123.96 3gyr s VAL 309 Ca 0.27 -0.64 -0.20 0.00 -2.93 0.00 0.00 61.98 58.48 3gyr s VAL 309 Cb -0.16 -1.03 0.07 0.00 -1.53 0.00 0.00 36.38 33.73 3gyr s VAL 309 CO 0.10 0.35 0.75 0.21 -3.33 0.00 0.00 175.10 173.19 3gyr s ASN 310 N -0.19 6.22 -0.12 3.54 3.84 -1.15 -1.61 114.94 125.47 3gyr s ASN 310 Ca 0.02 -0.98 0.10 0.00 0.21 0.00 0.00 52.86 52.22 3gyr s ASN 310 Cb -0.08 -2.34 0.52 0.00 -0.55 0.00 0.00 41.25 38.80 3gyr s ASN 310 CO 0.00 -1.09 1.33 0.00 -2.79 0.00 0.00 177.10 174.55 3gyr n ALA 311 N 6.67 3.20 -1.64 1.71 0.00 0.25 -0.45 120.51 130.24 3gyr n ALA 311 Ca -0.06 -1.17 -0.34 0.00 0.00 0.00 0.00 53.44 51.87 3gyr n ALA 311 Cb 0.45 -1.06 0.03 0.00 0.00 0.00 0.00 19.45 18.87 3gyr n ALA 311 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 3gyr s SER 312 N -0.62 5.29 0.24 0.00 0.01 -1.20 -4.82 113.70 112.61 3gyr s SER 312 Ca 0.35 2.16 -0.05 0.00 1.31 0.00 0.00 55.95 59.72 3gyr s SER 312 Cb 0.25 -2.57 0.43 0.00 0.21 0.00 0.00 66.02 64.34 3gyr s SER 312 CO 0.13 -1.51 1.72 0.78 0.41 0.00 0.00 173.24 174.77 3gyr h ASN 313 N 0.60 0.21 0.00 2.44 4.21 -1.87 -3.43 115.58 117.74 3gyr h ASN 313 Ca -0.49 0.11 0.00 0.00 1.21 0.00 0.00 56.30 57.14 3gyr h ASN 313 Cb 1.26 0.11 0.00 0.00 -1.12 0.00 0.00 38.32 38.57 3gyr h ASN 313 CO 0.55 0.07 0.00 0.00 -1.29 0.00 0.00 177.43 176.76 3gyr n ALA 314 N -2.54 0.16 -1.96 -0.83 0.00 -1.26 -0.76 120.51 113.31 3gyr n ALA 314 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.16 3gyr n ALA 314 Cb 0.41 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.83 3gyr n ALA 314 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 3gyr s ARG 315 N -0.55 4.27 -0.23 0.00 3.52 -1.26 -4.75 118.95 119.97 3gyr s ARG 315 Ca 0.00 2.25 -0.17 0.00 -0.13 0.00 0.00 55.73 57.68 3gyr s ARG 315 Cb 0.00 -3.16 -0.03 0.00 -1.56 0.00 0.00 34.95 30.20 3gyr s ARG 315 CO 0.00 -0.46 0.48 0.42 -0.81 0.00 0.00 175.30 174.93 3gyr s ILE 316 N 0.58 5.12 -0.16 4.11 1.01 -1.26 -4.09 121.20 126.50 3gyr s ILE 316 Ca 0.63 0.85 -0.22 0.00 0.00 0.00 0.00 60.65 61.91 3gyr s ILE 316 Cb -0.41 -3.80 -0.03 0.00 0.01 0.00 0.00 42.46 38.23 3gyr s ILE 316 CO 0.36 0.16 0.66 -0.31 0.00 0.00 0.00 174.94 175.82 3gyr s TYR 317 N 1.82 3.43 -0.70 3.97 2.02 -0.54 -4.91 117.35 122.43 3gyr s TYR 317 Ca 0.21 1.03 -0.11 0.00 -0.37 0.00 0.00 57.07 57.84 3gyr s TYR 317 Cb -0.15 -2.81 0.18 0.00 -0.40 0.00 0.00 41.96 38.77 3gyr s TYR 317 CO 0.09 -0.11 0.60 -0.80 -1.57 0.00 0.00 175.55 173.75 3gyr s ASN 318 N 1.08 6.16 -0.04 2.29 -0.87 -1.26 -0.00 114.94 122.29 3gyr s ASN 318 Ca 0.31 -2.54 -0.21 0.00 -1.57 0.00 0.00 52.86 48.86 3gyr s ASN 318 Cb -0.16 -2.09 -0.05 0.00 -0.02 0.00 0.00 41.25 38.93 3gyr s ASN 318 CO 0.12 -0.57 0.59 -0.76 -2.57 0.00 0.00 177.10 173.92 3gyr s LEU 319 N 0.42 4.36 0.01 0.60 1.43 0.30 -0.21 118.68 125.59 3gyr s LEU 319 Ca 0.14 1.09 0.05 0.00 -1.03 0.00 0.00 54.13 54.39 3gyr s LEU 319 Cb -0.17 -2.91 -0.02 0.00 0.03 0.00 0.00 46.19 43.13 3gyr s LEU 319 CO -0.05 0.03 -0.17 -0.69 0.23 0.00 0.00 176.35 175.70 3gyr s VAL 320 N 0.21 1.32 -0.20 -1.59 1.01 -0.50 -1.58 120.40 119.07 3gyr s VAL 320 Ca 0.31 -0.85 -0.15 0.00 0.00 0.00 0.00 61.98 61.29 3gyr s VAL 320 Cb -0.17 -1.13 -0.04 0.00 0.00 0.00 0.00 36.38 35.04 3gyr s VAL 320 CO 0.16 0.26 0.34 -0.22 0.00 0.00 0.00 175.10 175.64 3gyr s LEU 321 N -0.69 4.16 0.13 3.92 2.96 -1.26 -0.93 118.68 126.97 3gyr s LEU 321 Ca 0.06 0.44 0.08 0.00 -0.22 0.00 0.00 54.13 54.48 3gyr s LEU 321 Cb -0.07 -2.42 -0.04 0.00 0.50 0.00 0.00 46.19 44.16 3gyr s LEU 321 CO 0.00 -0.03 -0.19 0.27 -1.32 0.00 0.00 176.35 175.08 3gyr s ILE 322 N 1.17 1.75 0.02 6.68 -4.36 0.09 -1.02 121.20 125.53 3gyr s ILE 322 Ca 0.17 -1.74 -0.00 0.00 -0.26 0.00 0.00 60.65 58.82 3gyr s ILE 322 Cb -0.14 -1.70 0.00 0.00 1.25 0.00 0.00 42.46 41.87 3gyr s ILE 322 CO 0.07 -0.20 0.02 -0.90 0.24 0.00 0.00 174.94 174.17 3gyr n ASP 323 N 0.67 0.01 0.32 4.36 5.68 0.48 -0.89 116.55 127.19 3gyr n ASP 323 Ca -0.16 -1.01 0.21 0.00 -0.50 0.00 0.00 54.79 53.33 3gyr n ASP 323 Cb 0.55 -0.01 1.07 0.00 -1.14 0.00 0.00 41.12 41.59 3gyr n ASP 323 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 3gyr h GLU 324 N 0.00 0.00 -0.60 0.11 3.07 -1.89 -0.75 114.58 114.52 3gyr h GLU 324 Ca -0.01 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.85 3gyr h GLU 324 Cb 0.02 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.93 3gyr h GLU 324 CO 0.01 0.00 0.00 -0.25 -1.40 0.00 0.00 179.01 177.37 3gyr n ASP 325 N -3.11 4.53 -0.21 1.42 9.92 -1.26 -4.91 116.55 122.92 3gyr n ASP 325 Ca -0.02 -2.44 -0.03 0.00 -0.53 0.00 0.00 54.79 51.77 3gyr n ASP 325 Cb 0.13 -0.54 -0.01 0.00 -0.64 0.00 0.00 41.12 40.06 3gyr n ASP 325 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 3gyr n ASP 326 N 0.96 -4.52 -4.69 -2.24 9.92 -0.29 -4.99 116.55 110.70 3gyr n ASP 326 Ca 0.24 0.07 -0.42 0.00 -0.53 0.00 0.00 54.79 54.15 3gyr n ASP 326 Cb 0.85 -2.26 -0.03 0.00 -0.64 0.00 0.00 41.12 39.04 3gyr n ASP 326 CO 0.00 0.00 0.00 -0.60 0.13 0.00 0.00 177.20 176.73 3gyr s ARG 327 N -1.53 4.43 0.52 -1.24 3.52 -1.26 -4.72 118.95 118.68 3gyr s ARG 327 Ca 0.00 1.46 -0.22 0.00 -0.13 0.00 0.00 55.73 56.84 3gyr s ARG 327 Cb 0.00 -3.52 -0.06 0.00 -1.56 0.00 0.00 34.95 29.81 3gyr s ARG 327 CO 0.00 -0.30 1.35 -2.14 -0.81 0.00 0.00 175.30 173.41 3gyr s PRO 328 N 1.86 3.28 -0.41 5.12 0.02 -1.26 -0.39 135.00 143.22 3gyr s PRO 328 Ca 0.51 2.23 -0.07 0.00 0.02 0.00 0.00 61.00 63.68 3gyr s PRO 328 Cb -0.20 -2.33 0.09 0.00 0.02 0.00 0.00 34.50 32.07 3gyr s PRO 328 CO 0.21 -1.08 0.24 0.08 -0.33 0.00 0.00 177.00 176.12 3gyr s VAL 329 N -1.31 3.93 0.62 3.83 1.01 -0.19 -4.83 120.40 123.47 3gyr s VAL 329 Ca 0.69 -1.59 -0.10 0.00 0.00 0.00 0.00 61.98 60.98 3gyr s VAL 329 Cb -0.40 -3.48 -0.02 0.00 0.00 0.00 0.00 36.38 32.48 3gyr s VAL 329 CO 0.48 -0.55 1.01 -2.16 0.00 0.00 0.00 175.10 173.87 3gyr s PRO 330 N 1.34 3.33 -0.28 2.72 0.04 -1.26 -4.46 135.00 136.44 3gyr s PRO 330 Ca 0.04 0.54 0.00 0.00 0.04 0.00 0.00 61.00 61.62 3gyr s PRO 330 Cb -0.23 -2.12 0.00 0.00 0.04 0.00 0.00 34.50 32.19 3gyr s PRO 330 CO 0.00 -0.66 0.00 0.41 0.04 0.00 0.00 177.00 176.79 3gyr n GLY 331 N -2.75 0.59 0.00 0.56 0.00 -1.26 -4.86 105.19 97.47 3gyr n GLY 331 Ca 0.05 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 45.16 3gyr n GLY 331 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3gyr n VAL 332 N -2.92 0.00 -3.75 1.61 0.31 -1.26 -4.91 118.33 107.41 3gyr n VAL 332 Ca -0.03 0.00 -0.36 0.00 -0.01 0.00 0.00 64.34 63.94 3gyr n VAL 332 Cb 0.09 -0.39 -0.07 0.00 -0.91 0.00 0.00 33.84 32.56 3gyr n VAL 332 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 3gyr s VAL 333 N -1.62 5.41 -0.07 2.52 1.01 -1.26 -0.34 120.40 126.05 3gyr s VAL 333 Ca 0.00 0.29 -0.00 0.00 0.00 0.00 0.00 61.98 62.27 3gyr s VAL 333 Cb 0.00 -3.48 0.02 0.00 0.00 0.00 0.00 36.38 32.93 3gyr s VAL 333 CO 0.00 0.52 -0.03 -1.00 0.00 0.00 0.00 175.10 174.59 3gyr s HIS 334 N -0.31 0.82 0.04 5.22 3.76 -0.35 -1.27 115.29 123.21 3gyr s HIS 334 Ca 0.13 -0.26 -0.27 0.00 -0.15 0.00 0.00 55.06 54.51 3gyr s HIS 334 Cb -0.12 -0.80 -0.05 0.00 1.11 0.00 0.00 32.58 32.72 3gyr s HIS 334 CO 0.02 -0.29 0.84 -1.14 -0.85 0.00 0.00 174.74 173.32 3gyr s GLN 335 N 1.47 4.55 0.00 1.40 0.74 0.37 -0.71 119.66 127.48 3gyr s GLN 335 Ca -0.02 1.20 0.00 0.00 0.05 0.00 0.00 55.36 56.59 3gyr s GLN 335 Cb -0.13 -3.40 0.00 0.00 1.10 0.00 0.00 33.01 30.58 3gyr s GLN 335 CO -0.03 0.18 0.46 0.44 -0.55 0.00 0.00 175.29 175.79 3gyr n ILE 336 N 3.13 0.07 -3.53 -2.34 -5.35 0.14 -0.67 119.36 110.80 3gyr n ILE 336 Ca 0.00 -0.46 -0.11 0.00 -0.27 0.00 0.00 62.75 61.92 3gyr n ILE 336 Cb 0.50 1.10 -0.04 0.00 -1.74 0.00 0.00 39.64 39.47 3gyr n ILE 336 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 3gyr s GLY 337 N -0.07 -0.42 0.00 3.28 0.00 -1.17 -1.46 107.32 107.48 3gyr s GLY 337 Ca 0.00 1.40 0.00 0.00 0.00 0.00 0.00 44.72 46.12 3gyr s GLY 337 CO 0.00 0.67 0.00 -1.14 0.00 0.00 0.00 173.10 172.63 3gyr n SER 338 N 0.26 0.22 -0.26 1.64 3.41 0.26 -1.74 113.62 117.41 3gyr n SER 338 Ca -0.11 -0.54 0.02 0.00 -0.26 0.00 0.00 58.87 57.98 3gyr n SER 338 Cb 0.60 0.00 0.07 0.00 -0.26 0.00 0.00 64.21 64.62 3gyr n SER 338 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3gyr n ASP 339 N -1.50 -0.34 -0.64 4.04 8.00 -1.20 -1.85 116.55 123.06 3gyr n ASP 339 Ca 0.00 1.24 0.08 0.00 0.71 0.00 0.00 54.79 56.81 3gyr n ASP 339 Cb 0.00 -0.34 0.08 0.00 -0.02 0.00 0.00 41.12 40.84 3gyr n ASP 339 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3gyr n GLY 340 N -1.41 0.45 0.00 0.44 0.00 -0.73 -4.37 105.19 99.58 3gyr n GLY 340 Ca 0.10 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.68 3gyr n GLY 340 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gyr n GLY 341 N 0.85 0.40 3.76 -0.02 0.00 -0.77 -4.76 105.19 104.65 3gyr n GLY 341 Ca 0.10 -1.57 -0.41 0.00 0.00 0.00 0.00 46.02 44.14 3gyr n GLY 341 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3gyr s LEU 342 N 0.00 4.34 0.78 0.99 1.43 -1.26 -0.57 118.68 124.39 3gyr s LEU 342 Ca 0.00 2.96 -0.13 0.00 -1.03 0.00 0.00 54.13 55.93 3gyr s LEU 342 Cb 0.00 -3.65 0.07 0.00 0.03 0.00 0.00 46.19 42.64 3gyr s LEU 342 CO 0.00 -0.87 1.16 -0.76 0.23 0.00 0.00 176.35 176.11 3gyr s LEU 343 N -1.10 3.16 0.28 1.79 1.43 -0.53 -4.72 118.68 118.98 3gyr s LEU 343 Ca 0.59 2.18 -0.02 0.00 -1.03 0.00 0.00 54.13 55.84 3gyr s LEU 343 Cb -0.47 -4.57 0.39 0.00 0.03 0.00 0.00 46.19 41.58 3gyr s LEU 343 CO 0.53 -2.37 1.89 1.55 0.23 0.00 0.00 176.35 178.18 3gyr h PRO 344 N -0.80 0.99 -4.21 1.29 0.13 -1.90 -3.30 132.00 124.20 3gyr h PRO 344 Ca -0.46 -0.13 -0.23 0.00 -0.87 0.00 0.00 66.00 64.31 3gyr h PRO 344 Cb 1.27 -0.19 -0.23 0.00 0.13 0.00 0.00 31.00 31.99 3gyr h PRO 344 CO 0.48 0.76 -0.72 1.03 -0.23 0.00 0.00 178.00 179.32 3gyr s ARG 345 N -5.59 0.37 0.66 0.86 0.52 -1.26 0.11 118.95 114.63 3gyr s ARG 345 Ca -0.11 -0.55 -0.17 0.00 -0.52 0.00 0.00 55.73 54.38 3gyr s ARG 345 Cb 0.17 -0.11 0.00 0.00 0.52 0.00 0.00 34.95 35.53 3gyr s ARG 345 CO 0.80 0.01 1.21 -1.25 0.02 0.00 0.00 175.30 176.09 3gyr s PRO 346 N -1.20 2.55 -0.17 3.54 0.04 -1.26 -4.89 135.00 133.61 3gyr s PRO 346 Ca -0.10 1.78 0.00 0.00 0.04 0.00 0.00 61.00 62.72 3gyr s PRO 346 Cb -0.08 -1.88 0.03 0.00 0.04 0.00 0.00 34.50 32.61 3gyr s PRO 346 CO -0.00 -1.52 -0.10 0.08 0.04 0.00 0.00 177.00 175.49 3gyr s VAL 347 N -1.82 1.47 0.28 -0.36 1.01 0.15 -4.95 120.40 116.17 3gyr s VAL 347 Ca 0.76 -0.75 -0.29 0.00 0.00 0.00 0.00 61.98 61.69 3gyr s VAL 347 Cb -0.30 -1.50 -0.10 0.00 0.00 0.00 0.00 36.38 34.49 3gyr s VAL 347 CO 0.40 0.28 1.19 -2.16 0.00 0.00 0.00 175.10 174.80 3gyr s PRO 348 N 1.50 4.52 -0.40 2.72 0.04 -1.26 0.14 135.00 142.25 3gyr s PRO 348 Ca 0.02 1.95 0.04 0.00 0.04 0.00 0.00 61.00 63.05 3gyr s PRO 348 Cb -0.15 -3.16 0.11 0.00 0.04 0.00 0.00 34.50 31.34 3gyr s PRO 348 CO -0.09 0.02 0.13 0.08 0.04 0.00 0.00 177.00 177.18 3gyr s VAL 349 N -0.93 2.36 -1.64 -0.36 1.01 -0.40 -4.87 120.40 115.57 3gyr s VAL 349 Ca 0.48 -2.68 0.16 0.00 0.00 0.00 0.00 61.98 59.94 3gyr s VAL 349 Cb -0.35 -2.71 0.32 0.00 0.00 0.00 0.00 36.38 33.64 3gyr s VAL 349 CO 0.44 -0.67 1.23 0.47 0.00 0.00 0.00 175.10 176.56 3gyr n ASP 350 N 3.85 2.94 -3.95 3.32 8.00 -1.26 -4.18 116.55 125.27 3gyr n ASP 350 Ca 0.04 -1.87 -0.30 0.00 0.71 0.00 0.00 54.79 53.37 3gyr n ASP 350 Cb 0.38 -0.20 0.02 0.00 -0.02 0.00 0.00 41.12 41.30 3gyr n ASP 350 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3gyr n PHE 351 N 0.96 -2.17 0.00 1.24 3.01 -0.73 -4.20 117.46 115.57 3gyr n PHE 351 Ca 0.14 0.88 0.00 0.00 1.01 0.00 0.00 57.45 59.48 3gyr n PHE 351 Cb 0.47 -3.84 0.00 0.00 -0.01 0.00 0.00 39.48 36.10 3gyr n PHE 351 CO 0.00 0.00 0.00 -0.40 1.01 0.00 0.00 176.76 177.37 3gyr n ASP 352 N -2.83 0.00 -0.06 4.37 3.85 -0.97 -4.70 116.55 116.21 3gyr n ASP 352 Ca 0.01 0.00 -0.04 0.00 -0.71 0.00 0.00 54.79 54.05 3gyr n ASP 352 Cb 0.54 0.00 -0.11 0.00 -1.35 0.00 0.00 41.12 40.20 3gyr n ASP 352 CO 0.00 0.00 0.00 0.47 -1.01 0.00 0.00 177.20 176.66 3gyr n ASP 353 N 0.00 1.62 -0.03 -1.12 8.00 -1.26 -1.84 116.55 121.92 3gyr n ASP 353 Ca 0.00 0.00 0.18 0.00 0.71 0.00 0.00 54.79 55.68 3gyr n ASP 353 Cb 0.00 0.98 0.63 0.00 -0.02 0.00 0.00 41.12 42.71 3gyr n ASP 353 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 3gyr h THR 354 N 0.00 0.77 -0.75 -3.53 2.02 -2.00 -3.38 112.91 106.04 3gyr h THR 354 Ca -0.31 -0.04 -0.03 0.00 0.77 0.00 0.00 66.41 66.80 3gyr h THR 354 Cb 1.64 0.64 -0.18 0.00 -1.74 0.00 0.00 68.15 68.51 3gyr h THR 354 CO 0.02 0.02 -0.35 -0.22 0.37 0.00 0.00 175.52 175.36 3gyr s LEU 355 N -8.94 -1.13 0.28 2.58 2.96 -1.26 -4.89 118.68 108.27 3gyr s LEU 355 Ca -0.06 -0.81 0.13 0.00 -0.22 0.00 0.00 54.13 53.17 3gyr s LEU 355 Cb 0.20 1.46 0.30 0.00 0.50 0.00 0.00 46.19 48.65 3gyr s LEU 355 CO 0.74 -0.10 1.56 1.55 -1.32 0.00 0.00 176.35 178.78 3gyr h PRO 356 N 5.95 0.00 -4.91 0.98 0.13 -1.56 -1.84 132.00 130.76 3gyr h PRO 356 Ca 0.03 0.00 -0.37 0.00 -0.87 0.00 0.00 66.00 64.79 3gyr h PRO 356 Cb 1.18 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 32.06 3gyr h PRO 356 CO 0.02 0.59 -0.77 0.14 -0.23 0.00 0.00 178.00 177.76 3gyr s VAL 357 N -3.32 0.81 -0.50 1.56 -7.23 -1.26 -4.55 120.40 105.91 3gyr s VAL 357 Ca 0.01 -0.86 -0.28 0.00 -1.81 0.00 0.00 61.98 59.04 3gyr s VAL 357 Cb 0.11 -0.76 0.03 0.00 0.56 0.00 0.00 36.38 36.31 3gyr s VAL 357 CO 0.75 -0.08 1.08 -0.22 -0.31 0.00 0.00 175.10 176.31 3gyr s LEU 358 N -1.05 3.74 -0.41 1.32 2.96 -0.61 -4.85 118.68 119.78 3gyr s LEU 358 Ca -0.02 0.24 -0.18 0.00 -0.22 0.00 0.00 54.13 53.96 3gyr s LEU 358 Cb -0.07 -3.33 0.01 0.00 0.50 0.00 0.00 46.19 43.30 3gyr s LEU 358 CO 0.01 -1.24 0.48 -0.55 -1.32 0.00 0.00 176.35 173.73 3gyr s SER 359 N 2.53 6.24 -0.39 3.68 0.15 -1.26 -0.54 113.70 124.10 3gyr s SER 359 Ca 0.43 -0.46 -0.02 0.00 0.70 0.00 0.00 55.95 56.59 3gyr s SER 359 Cb -0.08 -2.25 0.10 0.00 -1.71 0.00 0.00 66.02 62.08 3gyr s SER 359 CO 0.28 -0.58 0.17 0.00 1.20 0.00 0.00 173.24 174.31 3gyr s ALA 360 N 2.31 3.10 0.68 5.45 0.00 1.00 -4.98 121.76 129.31 3gyr s ALA 360 Ca 0.15 -2.46 -0.11 0.00 0.00 0.00 0.00 51.96 49.54 3gyr s ALA 360 Cb -0.16 -2.32 -0.00 0.00 0.00 0.00 0.00 23.12 20.63 3gyr s ALA 360 CO 0.14 -1.74 1.06 0.00 0.00 0.00 0.00 175.76 175.23 3gyr s ALA 361 N 1.13 2.83 0.10 0.00 0.00 -1.26 -1.47 121.76 123.09 3gyr s ALA 361 Ca 0.07 -0.12 -0.36 0.00 0.00 0.00 0.00 51.96 51.56 3gyr s ALA 361 Cb -0.22 -3.10 -0.17 0.00 0.00 0.00 0.00 23.12 19.63 3gyr s ALA 361 CO -0.04 -1.07 1.14 -2.30 0.00 0.00 0.00 175.76 173.49 3gyr n PRO 362 N -3.00 0.75 -0.84 0.00 -0.02 -1.26 -1.59 135.00 129.04 3gyr n PRO 362 Ca 0.07 0.27 0.00 0.00 -2.02 0.00 0.00 63.50 61.82 3gyr n PRO 362 Cb 0.55 -1.77 0.00 0.00 -0.02 0.00 0.00 33.50 32.26 3gyr n PRO 362 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3gyr n ALA 363 N 1.70 0.00 -1.73 3.55 0.00 0.40 -4.95 120.51 119.49 3gyr n ALA 363 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.29 3gyr n ALA 363 Cb 0.18 -0.23 -0.00 0.00 0.00 0.00 0.00 19.45 19.40 3gyr n ALA 363 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3gyr s GLU 364 N -0.23 3.52 -0.05 0.00 2.02 -0.62 -4.85 118.70 118.49 3gyr s GLU 364 Ca 0.00 1.12 0.05 0.00 0.02 0.00 0.00 54.97 56.16 3gyr s GLU 364 Cb 0.00 -2.07 -0.01 0.00 0.10 0.00 0.00 34.13 32.16 3gyr s GLU 364 CO 0.00 -0.64 -0.20 1.03 0.02 0.00 0.00 175.26 175.47 3gyr s ARG 365 N -4.10 2.04 -0.16 1.61 0.52 -1.26 -2.95 118.95 114.66 3gyr s ARG 365 Ca 0.62 -0.72 -0.00 0.00 -0.52 0.00 0.00 55.73 55.11 3gyr s ARG 365 Cb -0.14 -1.77 0.03 0.00 0.52 0.00 0.00 34.95 33.60 3gyr s ARG 365 CO 0.36 0.31 -0.08 -0.06 0.02 0.00 0.00 175.30 175.84 3gyr s PHE 366 N -0.07 1.82 -0.47 -0.53 0.08 0.43 -3.30 117.98 115.93 3gyr s PHE 366 Ca -0.03 -1.09 -0.18 0.00 0.12 0.00 0.00 56.93 55.75 3gyr s PHE 366 Cb -0.12 -1.38 0.05 0.00 -0.57 0.00 0.00 43.02 40.99 3gyr s PHE 366 CO 0.02 -0.62 0.53 0.34 -0.10 0.00 0.00 175.22 175.40 3gyr s ASP 367 N 1.60 6.21 -0.05 1.36 2.15 -0.71 -1.30 116.67 125.92 3gyr s ASP 367 Ca 0.02 -0.85 0.03 0.00 0.43 0.00 0.00 52.55 52.18 3gyr s ASP 367 Cb -0.14 -2.26 -0.03 0.00 -0.30 0.00 0.00 42.92 40.19 3gyr s ASP 367 CO -0.08 -0.75 -0.14 -0.76 -0.17 0.00 0.00 175.17 173.27 3gyr s LEU 368 N 2.34 2.77 -0.14 -1.34 1.43 -0.31 0.24 118.68 123.67 3gyr s LEU 368 Ca 0.13 -0.18 -0.04 0.00 -1.03 0.00 0.00 54.13 53.01 3gyr s LEU 368 Cb -0.19 -1.57 -0.03 0.00 0.03 0.00 0.00 46.19 44.43 3gyr s LEU 368 CO 0.12 0.34 0.01 -0.76 0.23 0.00 0.00 176.35 176.29 3gyr s LEU 369 N -0.72 3.54 -0.17 1.79 1.43 0.11 0.40 118.68 125.05 3gyr s LEU 369 Ca 0.11 0.04 0.01 0.00 -1.03 0.00 0.00 54.13 53.26 3gyr s LEU 369 Cb -0.11 -1.85 0.02 0.00 0.03 0.00 0.00 46.19 44.28 3gyr s LEU 369 CO 0.01 0.25 -0.20 -0.69 0.23 0.00 0.00 176.35 175.95 3gyr s VAL 370 N -0.13 2.09 -0.78 -1.59 1.01 0.16 -1.21 120.40 119.96 3gyr s VAL 370 Ca 0.05 -0.94 -0.18 0.00 0.00 0.00 0.00 61.98 60.91 3gyr s VAL 370 Cb -0.13 -1.87 0.15 0.00 0.00 0.00 0.00 36.38 34.53 3gyr s VAL 370 CO 0.02 0.54 0.88 -0.62 0.00 0.00 0.00 175.10 175.92 3gyr s ASP 371 N 1.18 6.51 0.00 3.32 2.15 0.53 -0.85 116.67 129.51 3gyr s ASP 371 Ca 0.02 -2.00 0.14 0.00 0.43 0.00 0.00 52.55 51.15 3gyr s ASP 371 Cb -0.14 -2.31 0.49 0.00 -0.30 0.00 0.00 42.92 40.66 3gyr s ASP 371 CO -0.10 -0.95 1.37 0.49 -0.17 0.00 0.00 175.17 175.80 3gyr n PHE 372 N 5.79 0.34 -0.27 -5.34 3.72 0.20 -4.55 117.46 117.33 3gyr n PHE 372 Ca 0.09 -0.17 0.09 0.00 -0.05 0.00 0.00 57.45 57.41 3gyr n PHE 372 Cb 0.46 0.00 0.22 0.00 -0.94 0.00 0.00 39.48 39.23 3gyr n PHE 372 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3gyr h ARG 373 N 1.94 0.23 -0.10 -1.08 3.08 -1.67 0.30 114.38 117.07 3gyr h ARG 373 Ca 0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.04 3gyr h ARG 373 Cb 0.44 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.43 3gyr h ARG 373 CO 0.00 0.15 0.00 0.00 -1.07 0.00 0.00 179.97 179.05 3gyr n ALA 374 N -2.70 2.54 -1.03 0.04 0.00 -1.26 -4.44 120.51 113.66 3gyr n ALA 374 Ca 0.17 -0.32 0.09 0.00 0.00 0.00 0.00 53.44 53.38 3gyr n ALA 374 Cb 0.55 -1.15 0.23 0.00 0.00 0.00 0.00 19.45 19.08 3gyr n ALA 374 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3gyr n LEU 375 N -0.17 3.47 -4.61 0.00 4.77 0.10 -5.04 117.00 115.52 3gyr n LEU 375 Ca 0.13 -3.05 -0.45 0.00 -0.03 0.00 0.00 56.01 52.60 3gyr n LEU 375 Cb 0.19 -0.52 -0.02 0.00 -2.33 0.00 0.00 43.42 40.74 3gyr n LEU 375 CO 0.10 0.69 0.69 0.61 -1.33 0.00 0.00 177.39 178.15 3gyr n GLY 376 N -0.78 0.02 2.56 -0.72 0.00 -1.26 -1.43 105.19 103.59 3gyr n GLY 376 Ca 0.20 0.39 -0.05 0.00 0.00 0.00 0.00 46.02 46.55 3gyr n GLY 376 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gyr n GLY 377 N 1.45 0.67 3.80 -0.02 0.00 0.20 -4.74 105.19 106.56 3gyr n GLY 377 Ca 0.10 -0.14 -0.23 0.00 0.00 0.00 0.00 46.02 45.75 3gyr n GLY 377 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3gyr s ARG 378 N -2.05 2.87 -0.13 1.61 1.81 -0.51 -4.95 118.95 117.60 3gyr s ARG 378 Ca 0.00 -1.04 0.01 0.00 -1.72 0.00 0.00 55.73 52.98 3gyr s ARG 378 Cb 0.00 -2.55 0.02 0.00 -0.45 0.00 0.00 34.95 31.97 3gyr s ARG 378 CO 0.00 0.42 -0.17 1.03 -0.68 0.00 0.00 175.30 175.90 3gyr s ARG 379 N -3.66 2.51 0.07 3.54 0.52 -1.26 -1.12 118.95 119.56 3gyr s ARG 379 Ca 0.32 -0.66 0.08 0.00 -0.52 0.00 0.00 55.73 54.95 3gyr s ARG 379 Cb -0.08 -2.15 -0.03 0.00 0.52 0.00 0.00 34.95 33.21 3gyr s ARG 379 CO 0.24 -0.11 -0.22 -0.51 0.02 0.00 0.00 175.30 174.72 3gyr s LEU 380 N 1.10 2.23 -0.06 2.53 1.43 -0.54 -3.60 118.68 121.77 3gyr s LEU 380 Ca -0.03 -0.61 0.06 0.00 -1.03 0.00 0.00 54.13 52.52 3gyr s LEU 380 Cb -0.14 -1.01 -0.01 0.00 0.03 0.00 0.00 46.19 45.06 3gyr s LEU 380 CO -0.05 0.14 -0.24 -0.13 0.23 0.00 0.00 176.35 176.30 3gyr s ARG 381 N -1.51 2.51 -0.02 1.70 0.52 -0.06 0.43 118.95 122.52 3gyr s ARG 381 Ca 0.08 -0.86 -0.30 0.00 -0.52 0.00 0.00 55.73 54.13 3gyr s ARG 381 Cb -0.09 -2.10 -0.03 0.00 0.52 0.00 0.00 34.95 33.25 3gyr s ARG 381 CO 0.03 0.34 0.99 -1.17 0.02 0.00 0.00 175.30 175.51 3gyr s LEU 382 N -0.07 4.34 0.14 2.53 2.96 0.08 -0.73 118.68 127.94 3gyr s LEU 382 Ca -0.06 1.64 0.05 0.00 -0.22 0.00 0.00 54.13 55.54 3gyr s LEU 382 Cb -0.14 -3.57 -0.04 0.00 0.50 0.00 0.00 46.19 42.94 3gyr s LEU 382 CO 0.04 -0.30 -0.10 0.68 -1.32 0.00 0.00 176.35 175.34 3gyr s VAL 383 N 1.23 1.16 -0.31 1.68 -7.23 -0.11 -1.49 120.40 115.34 3gyr s VAL 383 Ca 0.51 -2.01 -0.16 0.00 -1.81 0.00 0.00 61.98 58.52 3gyr s VAL 383 Cb -0.21 -1.79 -0.02 0.00 0.56 0.00 0.00 36.38 34.92 3gyr s VAL 383 CO 0.26 -0.71 0.41 -0.62 -0.31 0.00 0.00 175.10 174.12 3gyr s ASP 384 N -3.06 6.25 -0.18 4.85 2.15 0.19 -1.40 116.67 125.46 3gyr s ASP 384 Ca 0.15 0.09 -0.28 0.00 0.43 0.00 0.00 52.55 52.95 3gyr s ASP 384 Cb 0.02 -2.22 -0.00 0.00 -0.30 0.00 0.00 42.92 40.41 3gyr s ASP 384 CO 0.01 -0.29 0.95 -0.75 -0.17 0.00 0.00 175.17 174.92 3gyr s LYS 385 N 2.13 4.31 0.53 4.34 2.20 0.71 -4.54 119.74 129.42 3gyr s LYS 385 Ca 0.15 1.23 -0.17 0.00 -0.36 0.00 0.00 55.97 56.82 3gyr s LYS 385 Cb -0.16 -3.59 -0.07 0.00 -1.51 0.00 0.00 37.83 32.50 3gyr s LYS 385 CO 0.11 -0.44 1.01 0.20 -0.36 0.00 0.00 175.35 175.87 3gyr s GLY 386 N 1.17 2.16 0.54 5.54 0.00 -1.26 -4.68 107.32 110.78 3gyr s GLY 386 Ca 0.43 0.31 0.26 0.00 0.00 0.00 0.00 44.72 45.72 3gyr s GLY 386 CO 0.11 0.61 2.14 -0.56 0.00 0.00 0.00 173.10 175.40 3gyr h PRO 387 N 0.90 0.00 -0.32 2.90 0.13 -1.91 -3.17 132.00 130.53 3gyr h PRO 387 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3gyr h PRO 387 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 3gyr h PRO 387 CO 0.60 0.08 0.00 0.41 -0.23 0.00 0.00 178.00 178.85 3gyr n GLY 388 N -1.03 1.31 3.56 1.56 0.00 -1.26 -4.97 105.19 104.36 3gyr n GLY 388 Ca -0.02 -0.65 -0.14 0.00 0.00 0.00 0.00 46.02 45.20 3gyr n GLY 388 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gyr s ALA 389 N -1.59 -1.85 0.60 4.61 0.00 -1.20 -5.05 121.76 117.29 3gyr s ALA 389 Ca 0.37 1.50 -0.18 0.00 0.00 0.00 0.00 51.96 53.64 3gyr s ALA 389 Cb 0.21 -0.43 -0.06 0.00 0.00 0.00 0.00 23.12 22.84 3gyr s ALA 389 CO 0.30 -0.34 0.75 -2.30 0.00 0.00 0.00 175.76 174.17 3gyr n PRO 390 N 1.01 0.67 -1.61 0.00 -0.02 -1.26 -4.35 135.00 129.45 3gyr n PRO 390 Ca -0.15 0.27 -0.51 0.00 -2.02 0.00 0.00 63.50 61.09 3gyr n PRO 390 Cb 0.57 -1.95 -0.06 0.00 -0.02 0.00 0.00 33.50 32.04 3gyr n PRO 390 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3gyr n ALA 391 N -1.79 -0.57 0.00 3.55 0.00 -1.26 -1.61 120.51 118.82 3gyr n ALA 391 Ca 0.13 0.50 0.00 0.00 0.00 0.00 0.00 53.44 54.07 3gyr n ALA 391 Cb 0.48 -2.13 0.00 0.00 0.00 0.00 0.00 19.45 17.80 3gyr n ALA 391 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gyr n GLY 392 N 2.71 3.44 3.73 0.00 0.00 -1.26 -4.89 105.19 108.92 3gyr n GLY 392 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 3gyr n GLY 392 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3gyr s THR 393 N -2.97 5.28 0.30 2.61 2.01 -0.63 -4.84 115.64 117.40 3gyr s THR 393 Ca 0.00 0.62 -0.28 0.00 0.31 0.00 0.00 61.69 62.35 3gyr s THR 393 Cb 0.00 -3.67 -0.14 0.00 0.01 0.00 0.00 72.50 68.71 3gyr s THR 393 CO 0.00 0.38 1.01 -2.65 -0.69 0.00 0.00 174.62 172.67 3gyr n PRO 394 N 3.55 1.36 -3.15 4.92 -0.02 -1.26 -4.76 135.00 135.65 3gyr n PRO 394 Ca -0.11 0.48 -0.20 0.00 -2.02 0.00 0.00 63.50 61.65 3gyr n PRO 394 Cb 0.52 -1.86 -0.04 0.00 -0.02 0.00 0.00 33.50 32.09 3gyr n PRO 394 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 3gyr n ASP 395 N 1.16 0.16 -0.17 2.55 2.03 0.39 -4.88 116.55 117.78 3gyr n ASP 395 Ca 0.09 -2.90 0.09 0.00 0.52 0.00 0.00 54.79 52.59 3gyr n ASP 395 Cb 0.33 -0.38 0.40 0.00 -0.72 0.00 0.00 41.12 40.74 3gyr n ASP 395 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 3gyr h PRO 396 N 3.54 0.63 -0.72 -0.67 0.13 -1.83 -0.11 132.00 132.97 3gyr h PRO 396 Ca 0.06 -0.04 -0.04 0.00 -0.87 0.00 0.00 66.00 65.12 3gyr h PRO 396 Cb 0.94 -0.14 -0.03 0.00 0.13 0.00 0.00 31.00 31.89 3gyr h PRO 396 CO 0.45 0.42 0.30 -0.07 -0.23 0.00 0.00 178.00 178.87 3gyr h LEU 397 N 0.65 0.98 0.00 1.56 3.38 -1.92 -1.93 115.31 118.03 3gyr h LEU 397 Ca 0.33 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 58.16 3gyr h LEU 397 Cb 0.42 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.91 3gyr h LEU 397 CO -0.11 0.86 0.00 0.61 0.09 0.00 0.00 178.44 179.89 3gyr n GLY 398 N -0.96 -0.97 2.03 0.83 0.00 -0.18 -4.86 105.19 101.08 3gyr n GLY 398 Ca 0.07 -0.01 -0.00 0.00 0.00 0.00 0.00 46.02 46.07 3gyr n GLY 398 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gyr n GLY 399 N 0.50 0.48 2.57 -0.02 0.00 -0.72 -4.57 105.19 103.42 3gyr n GLY 399 Ca 0.01 -0.06 -0.27 0.00 0.00 0.00 0.00 46.02 45.70 3gyr n GLY 399 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3gyr n VAL 400 N -2.97 1.63 -0.34 1.61 0.31 -0.45 -4.91 118.33 113.21 3gyr n VAL 400 Ca -0.00 -4.89 0.01 0.00 -0.01 0.00 0.00 64.34 59.45 3gyr n VAL 400 Cb 0.02 -2.09 0.15 0.00 -0.91 0.00 0.00 33.84 31.00 3gyr n VAL 400 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 3gyr h ARG 401 N 4.68 1.08 -4.18 5.55 2.43 -1.82 0.11 114.38 122.23 3gyr h ARG 401 Ca 0.18 -0.06 -0.63 0.00 -0.81 0.00 0.00 59.98 58.65 3gyr h ARG 401 Cb 0.73 -0.24 -0.40 0.00 -0.42 0.00 0.00 29.97 29.63 3gyr h ARG 401 CO 0.73 0.71 -0.73 0.71 -1.51 0.00 0.00 179.97 179.89 3gyr s TYR 402 N -6.07 3.03 0.37 2.20 1.51 -1.26 -4.39 117.35 112.74 3gyr s TYR 402 Ca -0.13 -2.62 0.15 0.00 -1.01 0.00 0.00 57.07 53.47 3gyr s TYR 402 Cb 0.19 -2.51 1.04 0.00 -0.11 0.00 0.00 41.96 40.56 3gyr s TYR 402 CO 0.80 -0.91 1.74 -1.35 -1.11 0.00 0.00 175.55 174.73 3gyr h PRO 403 N 7.63 0.43 -6.90 -1.71 0.11 -1.80 -3.45 132.00 126.31 3gyr h PRO 403 Ca -0.07 -0.03 -0.52 0.00 0.11 0.00 0.00 66.00 65.49 3gyr h PRO 403 Cb 1.00 -0.10 0.07 0.00 0.11 0.00 0.00 31.00 32.08 3gyr h PRO 403 CO 0.52 0.29 0.62 -1.83 -0.21 0.00 0.00 178.00 177.38 3gyr s GLU 404 N -5.60 4.24 0.01 1.05 1.03 -1.26 0.54 118.70 118.71 3gyr s GLU 404 Ca -0.09 2.16 -0.04 0.00 0.03 0.00 0.00 54.97 57.03 3gyr s GLU 404 Cb 0.26 -2.96 -0.02 0.00 -0.80 0.00 0.00 34.13 30.62 3gyr s GLU 404 CO 0.80 -0.27 -0.07 0.28 -1.33 0.00 0.00 175.26 174.67 3gyr n VAL 405 N 0.58 0.96 -3.63 1.83 0.31 -0.55 -4.62 118.33 113.21 3gyr n VAL 405 Ca 0.01 0.20 -0.07 0.00 -0.01 0.00 0.00 64.34 64.48 3gyr n VAL 405 Cb 0.43 -1.69 -0.02 0.00 -0.91 0.00 0.00 33.84 31.65 3gyr n VAL 405 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3gyr s MET 406 N -2.16 1.20 -0.03 5.55 0.23 -1.15 -3.98 119.30 118.97 3gyr s MET 406 Ca -0.07 -0.57 0.07 0.00 -1.03 0.00 0.00 55.69 54.09 3gyr s MET 406 Cb 0.02 0.47 -0.02 0.00 -1.53 0.00 0.00 34.83 33.77 3gyr s MET 406 CO 0.10 -0.54 -0.24 -2.00 -2.03 0.00 0.00 175.02 170.30 3gyr s GLU 407 N -3.44 2.22 -0.19 3.16 2.12 -0.77 -0.74 118.70 121.07 3gyr s GLU 407 Ca 0.08 -0.90 -0.06 0.00 0.36 0.00 0.00 54.97 54.45 3gyr s GLU 407 Cb -0.02 -2.10 -0.03 0.00 0.26 0.00 0.00 34.13 32.24 3gyr s GLU 407 CO -0.03 0.54 0.02 -0.06 -0.54 0.00 0.00 175.26 175.19 3gyr s PHE 408 N -0.56 3.12 -0.33 5.30 0.40 0.17 -0.64 117.98 125.44 3gyr s PHE 408 Ca 0.08 -0.19 -0.07 0.00 -0.60 0.00 0.00 56.93 56.15 3gyr s PHE 408 Cb -0.11 -2.07 0.03 0.00 0.51 0.00 0.00 43.02 41.39 3gyr s PHE 408 CO -0.00 -0.04 0.11 1.03 0.70 0.00 0.00 175.22 177.02 3gyr s ARG 409 N 0.65 2.79 -0.31 0.44 0.52 0.75 -1.46 118.95 122.32 3gyr s ARG 409 Ca 0.01 -1.07 -0.20 0.00 -0.52 0.00 0.00 55.73 53.96 3gyr s ARG 409 Cb -0.14 -3.47 -0.01 0.00 0.52 0.00 0.00 34.95 31.85 3gyr s ARG 409 CO 0.02 -0.60 0.60 0.08 0.02 0.00 0.00 175.30 175.42 3gyr s VAL 410 N 1.45 4.95 -0.11 3.52 1.01 -0.27 -0.41 120.40 130.55 3gyr s VAL 410 Ca 0.00 0.75 -0.21 0.00 0.00 0.00 0.00 61.98 62.52 3gyr s VAL 410 Cb -0.19 -3.99 -0.04 0.00 0.00 0.00 0.00 36.38 32.17 3gyr s VAL 410 CO 0.03 -0.15 0.60 -0.60 0.00 0.00 0.00 175.10 174.98 3gyr s ARG 411 N 2.56 4.36 0.03 2.72 3.52 0.12 0.61 118.95 132.87 3gyr s ARG 411 Ca 0.24 0.66 -0.30 0.00 -0.13 0.00 0.00 55.73 56.19 3gyr s ARG 411 Cb -0.15 -3.46 -0.06 0.00 -1.56 0.00 0.00 34.95 29.71 3gyr s ARG 411 CO 0.12 0.05 1.44 -2.00 -0.81 0.00 0.00 175.30 174.10 3gyr s GLU 412 N 0.90 4.28 0.48 5.12 2.12 -1.26 -1.97 118.70 128.37 3gyr s GLU 412 Ca 0.31 2.04 0.05 0.00 0.36 0.00 0.00 54.97 57.73 3gyr s GLU 412 Cb -0.16 -3.52 -0.02 0.00 0.26 0.00 0.00 34.13 30.69 3gyr s GLU 412 CO 0.14 -0.57 0.16 0.99 -0.54 0.00 0.00 175.26 175.43 3gyr s THR 413 N 2.21 1.73 -0.39 -1.70 2.01 -1.26 -4.96 115.64 113.28 3gyr s THR 413 Ca 0.65 -1.77 0.23 0.00 0.31 0.00 0.00 61.69 61.11 3gyr s THR 413 Cb -0.34 -2.51 -0.03 0.00 0.01 0.00 0.00 72.50 69.63 3gyr s THR 413 CO 0.28 0.00 1.07 0.00 -0.69 0.00 0.00 174.62 175.28 3gyr n GLU 415 N -2.38 0.20 -3.85 0.00 1.02 -1.26 -4.99 120.64 109.38 3gyr n GLU 415 Ca 0.01 0.14 -0.36 0.00 -0.02 0.00 0.00 57.16 56.93 3gyr n GLU 415 Cb 0.50 -2.38 -0.13 0.00 -0.02 0.00 0.00 31.44 29.41 3gyr n GLU 415 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 3gyr s GLU 416 N -3.98 2.63 -0.50 3.49 2.56 -1.26 -5.06 118.70 116.58 3gyr s GLU 416 Ca 0.73 -1.15 -0.14 0.00 0.00 0.00 0.00 54.97 54.41 3gyr s GLU 416 Cb -0.30 -3.26 0.11 0.00 2.00 0.00 0.00 34.13 32.68 3gyr s GLU 416 CO 0.52 -0.58 0.42 0.34 -0.56 0.00 0.00 175.26 175.40 3gyr s ASP 417 N 1.34 6.04 -0.08 -1.70 -1.08 -1.26 -4.93 116.67 115.00 3gyr s ASP 417 Ca -0.02 -1.64 0.15 0.00 -0.52 0.00 0.00 52.55 50.52 3gyr s ASP 417 Cb -0.19 -2.15 0.57 0.00 -1.46 0.00 0.00 42.92 39.69 3gyr s ASP 417 CO 0.00 -0.73 1.45 -1.54 0.52 0.00 0.00 175.17 174.86 3gyr n SER 418 N 5.15 3.81 -4.53 -0.34 3.41 -1.26 -4.97 113.62 114.89 3gyr n SER 418 Ca -0.12 -2.32 -0.40 0.00 -0.26 0.00 0.00 58.87 55.77 3gyr n SER 418 Cb 0.42 -0.50 0.02 0.00 -0.26 0.00 0.00 64.21 63.89 3gyr n SER 418 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 3gyr n PHE 419 N 0.89 0.13 -4.22 7.33 7.35 -1.26 -4.98 117.46 122.69 3gyr n PHE 419 Ca 0.20 0.51 -0.23 0.00 -0.76 0.00 0.00 57.45 57.18 3gyr n PHE 419 Cb 0.71 -2.07 -0.17 0.00 0.35 0.00 0.00 39.48 38.30 3gyr n PHE 419 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3gyr s ALA 420 N -1.50 0.98 -0.30 3.13 0.00 -1.26 -5.13 121.76 117.69 3gyr s ALA 420 Ca 0.67 -0.27 -0.08 0.00 0.00 0.00 0.00 51.96 52.28 3gyr s ALA 420 Cb -0.51 -0.59 -0.00 0.00 0.00 0.00 0.00 23.12 22.02 3gyr s ALA 420 CO 0.55 -0.08 0.11 -1.17 0.00 0.00 0.00 175.76 175.17 3gyr s LEU 421 N 1.07 3.94 0.51 0.00 2.96 -1.26 -5.06 118.68 120.84 3gyr s LEU 421 Ca -0.08 -0.60 -0.11 0.00 -0.22 0.00 0.00 54.13 53.12 3gyr s LEU 421 Cb -0.14 -1.94 -0.06 0.00 0.50 0.00 0.00 46.19 44.55 3gyr s LEU 421 CO -0.01 -0.19 0.91 -2.16 -1.32 0.00 0.00 176.35 173.59 3gyr s PRO 422 N 1.56 3.73 0.36 0.98 0.04 -1.26 -4.96 135.00 135.45 3gyr s PRO 422 Ca 0.04 0.64 0.09 0.00 0.04 0.00 0.00 61.00 61.81 3gyr s PRO 422 Cb -0.17 -2.23 0.67 0.00 0.04 0.00 0.00 34.50 32.81 3gyr s PRO 422 CO 0.04 -0.29 1.83 0.93 0.04 0.00 0.00 177.00 179.56 3gyr h GLU 423 N 0.52 0.18 -5.15 4.56 4.39 -1.99 -3.37 114.58 113.73 3gyr h GLU 423 Ca -0.46 -0.06 -0.65 0.00 0.34 0.00 0.00 59.36 58.53 3gyr h GLU 423 Cb 1.19 -0.02 -0.24 0.00 -0.10 0.00 0.00 28.75 29.58 3gyr h GLU 423 CO 0.62 0.45 -0.69 0.08 -1.16 0.00 0.00 179.01 178.31 3gyr s VAL 424 N -4.43 3.69 -0.21 3.13 1.01 -1.26 -4.26 120.40 118.06 3gyr s VAL 424 Ca -0.05 -0.41 -0.15 0.00 0.00 0.00 0.00 61.98 61.38 3gyr s VAL 424 Cb 0.15 -2.65 -0.19 0.00 0.00 0.00 0.00 36.38 33.69 3gyr s VAL 424 CO 0.74 0.45 0.08 -0.11 0.00 0.00 0.00 175.10 176.26 3gyr n LEU 425 N 4.15 2.13 -4.29 3.92 7.94 0.12 -4.93 117.00 126.04 3gyr n LEU 425 Ca -0.18 0.32 -0.34 0.00 -1.11 0.00 0.00 56.01 54.70 3gyr n LEU 425 Cb 0.52 -0.96 -0.14 0.00 0.53 0.00 0.00 43.42 43.36 3gyr n LEU 425 CO 0.31 0.51 -0.42 -0.55 -1.11 0.00 0.00 177.39 176.13 3gyr s SER 426 N -7.02 4.05 0.18 1.96 0.15 -1.07 -4.97 113.70 106.97 3gyr s SER 426 Ca -0.30 -0.42 -0.04 0.00 0.70 0.00 0.00 55.95 55.89 3gyr s SER 426 Cb 0.08 -1.67 0.08 0.00 -1.71 0.00 0.00 66.02 62.81 3gyr s SER 426 CO 0.60 0.03 1.49 1.23 1.20 0.00 0.00 173.24 177.79 3gyr h GLY 427 N 7.75 0.66 2.00 9.45 0.00 -1.91 -3.29 103.07 117.73 3gyr h GLY 427 Ca -0.39 -0.77 0.00 0.00 0.00 0.00 0.00 47.33 46.18 3gyr h GLY 427 CO 0.60 0.69 0.00 1.48 0.00 0.00 0.00 176.54 179.31 3gyr h SER 428 N 0.47 0.00 -3.04 0.19 4.64 -2.00 -3.46 113.55 110.36 3gyr h SER 428 Ca 0.01 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.81 3gyr h SER 428 Cb 1.10 0.00 0.05 0.00 -0.31 0.00 0.00 62.40 63.24 3gyr h SER 428 CO 0.11 0.00 0.85 0.12 -0.87 0.00 0.00 176.83 177.04 3gyr s PHE 429 N -3.28 3.00 -0.13 4.77 5.36 -1.24 -5.01 117.98 121.46 3gyr s PHE 429 Ca 0.07 0.74 0.00 0.00 -0.96 0.00 0.00 56.93 56.78 3gyr s PHE 429 Cb 0.09 -3.93 0.02 0.00 -0.34 0.00 0.00 43.02 38.86 3gyr s PHE 429 CO 0.59 -3.28 -0.12 1.03 -1.46 0.00 0.00 175.22 171.97 3gyr s ARG 430 N 0.51 2.04 0.37 10.12 1.81 -1.26 -5.07 118.95 127.46 3gyr s ARG 430 Ca 0.66 -0.47 -0.28 0.00 -1.72 0.00 0.00 55.73 53.93 3gyr s ARG 430 Cb -0.44 -1.88 -0.11 0.00 -0.45 0.00 0.00 34.95 32.07 3gyr s ARG 430 CO 0.37 -0.20 1.50 0.50 -0.68 0.00 0.00 175.30 176.80 3gyr s ARG 431 N 1.40 4.10 -0.24 3.54 6.06 -1.26 -4.95 118.95 127.61 3gyr s ARG 431 Ca 0.02 2.58 -0.29 0.00 -2.50 0.00 0.00 55.73 55.54 3gyr s ARG 431 Cb -0.13 -2.97 -0.01 0.00 0.06 0.00 0.00 34.95 31.89 3gyr s ARG 431 CO -0.07 -0.55 1.39 -1.64 -2.50 0.00 0.00 175.30 171.92 3gyr s MET 432 N -1.91 3.95 -0.00 5.12 -1.94 -1.26 -5.01 119.30 118.26 3gyr s MET 432 Ca 0.54 1.47 -0.30 0.00 -1.71 0.00 0.00 55.69 55.69 3gyr s MET 432 Cb -0.47 -3.90 -0.03 0.00 2.01 0.00 0.00 34.83 32.43 3gyr s MET 432 CO 0.62 -1.08 1.05 0.45 -0.01 0.00 0.00 175.02 176.05 3gyr s SER 433 N 3.04 7.26 0.55 3.03 0.15 -1.26 -4.91 113.70 121.56 3gyr s SER 433 Ca 0.61 1.74 0.36 0.00 0.70 0.00 0.00 55.95 59.36 3gyr s SER 433 Cb -0.20 -2.57 1.97 0.00 -1.71 0.00 0.00 66.02 63.51 3gyr s SER 433 CO 0.23 -0.36 2.11 -0.74 1.20 0.00 0.00 173.24 175.68 3gyr h HIS 434 N 6.89 0.00 0.00 3.44 2.76 -2.03 -1.80 115.15 124.41 3gyr h HIS 434 Ca -0.39 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.78 3gyr h HIS 434 Cb 1.20 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.16 3gyr h HIS 434 CO 0.69 0.00 0.00 -0.25 -1.30 0.00 0.00 177.93 177.07 3gyr n ASP 435 N -2.78 0.75 -4.67 3.26 8.00 -1.26 -4.67 116.55 115.17 3gyr n ASP 435 Ca -0.02 0.64 -0.42 0.00 0.71 0.00 0.00 54.79 55.70 3gyr n ASP 435 Cb 0.07 -0.82 -0.03 0.00 -0.02 0.00 0.00 41.12 40.32 3gyr n ASP 435 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3gyr s ILE 436 N -3.26 3.07 0.23 0.53 1.01 -0.68 -4.94 121.20 117.16 3gyr s ILE 436 Ca 0.06 0.34 -0.32 0.00 0.00 0.00 0.00 60.65 60.73 3gyr s ILE 436 Cb 0.10 -3.22 -0.14 0.00 0.01 0.00 0.00 42.46 39.22 3gyr s ILE 436 CO 0.47 -0.02 1.39 -2.65 0.00 0.00 0.00 174.94 174.13 3gyr n PRO 437 N 6.49 1.94 -3.58 2.79 -0.02 -1.26 -4.99 135.00 136.37 3gyr n PRO 437 Ca 0.18 0.69 -0.14 0.00 -2.02 0.00 0.00 63.50 62.21 3gyr n PRO 437 Cb 0.41 -2.34 -0.05 0.00 -0.02 0.00 0.00 33.50 31.50 3gyr n PRO 437 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 3gyr s HIS 438 N -0.02 -0.41 0.76 6.00 -3.43 -1.26 -4.44 115.29 112.48 3gyr s HIS 438 Ca 0.69 0.46 -0.04 0.00 -0.80 0.00 0.00 55.06 55.37 3gyr s HIS 438 Cb -0.68 0.33 0.13 0.00 -1.43 0.00 0.00 32.58 30.94 3gyr s HIS 438 CO 0.49 -0.63 1.05 0.20 -2.00 0.00 0.00 174.74 173.85 3gyr s GLY 439 N -1.95 1.76 -0.04 -1.38 0.00 -0.67 -4.89 107.32 100.16 3gyr s GLY 439 Ca -0.05 -1.55 0.00 0.00 0.00 0.00 0.00 44.72 43.12 3gyr s GLY 439 CO -0.02 -0.97 -0.01 0.30 0.00 0.00 0.00 173.10 172.41 3gyr s HIS 440 N -3.28 0.44 0.06 1.90 3.76 -1.26 -1.13 115.29 115.79 3gyr s HIS 440 Ca 0.67 -0.06 0.09 0.00 -0.15 0.00 0.00 55.06 55.61 3gyr s HIS 440 Cb -0.06 -0.50 -0.03 0.00 1.11 0.00 0.00 32.58 33.11 3gyr s HIS 440 CO 0.46 -0.16 -0.25 1.03 -0.85 0.00 0.00 174.74 174.97 3gyr s ARG 441 N 1.05 1.79 -0.20 1.40 1.81 -0.41 -4.99 118.95 119.40 3gyr s ARG 441 Ca -0.09 -1.12 -0.00 0.00 -1.72 0.00 0.00 55.73 52.79 3gyr s ARG 441 Cb -0.14 -2.01 0.02 0.00 -0.45 0.00 0.00 34.95 32.37 3gyr s ARG 441 CO -0.01 0.51 -0.15 -1.17 -0.68 0.00 0.00 175.30 173.80 3gyr s LEU 442 N -1.40 2.46 -0.27 2.53 2.96 -1.26 -1.02 118.68 122.68 3gyr s LEU 442 Ca 0.13 -0.65 -0.00 0.00 -0.22 0.00 0.00 54.13 53.38 3gyr s LEU 442 Cb -0.10 -1.56 0.04 0.00 0.50 0.00 0.00 46.19 45.08 3gyr s LEU 442 CO 0.03 -0.03 -0.06 -0.63 -1.32 0.00 0.00 176.35 174.35 3gyr s ILE 443 N 1.33 2.69 -0.02 6.68 1.09 0.11 -2.38 121.20 130.71 3gyr s ILE 443 Ca 0.04 -1.34 -0.19 0.00 -1.10 0.00 0.00 60.65 58.07 3gyr s ILE 443 Cb -0.14 -2.49 -0.05 0.00 -1.06 0.00 0.00 42.46 38.71 3gyr s ILE 443 CO -0.10 0.02 0.53 -0.69 -0.10 0.00 0.00 174.94 174.61 3gyr s VAL 444 N 1.23 4.97 -0.21 2.92 1.01 0.76 0.13 120.40 131.22 3gyr s VAL 444 Ca -0.04 1.10 -0.06 0.00 0.00 0.00 0.00 61.98 62.98 3gyr s VAL 444 Cb -0.19 -3.86 -0.03 0.00 0.00 0.00 0.00 36.38 32.31 3gyr s VAL 444 CO -0.04 0.45 0.02 -0.76 0.00 0.00 0.00 175.10 174.77 3gyr s LEU 445 N -0.30 3.36 0.14 3.92 1.43 0.77 -0.04 118.68 127.96 3gyr s LEU 445 Ca 0.28 -0.17 -0.03 0.00 -1.03 0.00 0.00 54.13 53.18 3gyr s LEU 445 Cb -0.17 -1.86 -0.05 0.00 0.03 0.00 0.00 46.19 44.14 3gyr s LEU 445 CO 0.15 0.05 0.34 0.42 0.23 0.00 0.00 176.35 177.55 3gyr s THR 446 N 1.07 5.23 0.75 5.49 -4.23 -0.86 -0.93 115.64 122.15 3gyr s THR 446 Ca 0.03 -0.17 -0.13 0.00 -1.18 0.00 0.00 61.69 60.24 3gyr s THR 446 Cb -0.14 -3.66 0.05 0.00 1.34 0.00 0.00 72.50 70.09 3gyr s THR 446 CO 0.02 0.00 1.14 -2.16 -0.54 0.00 0.00 174.62 173.08 3gyr s PRO 447 N -2.81 2.20 0.23 3.99 0.04 -1.26 -3.60 135.00 133.79 3gyr s PRO 447 Ca 0.39 1.45 -0.07 0.00 0.04 0.00 0.00 61.00 62.81 3gyr s PRO 447 Cb -0.12 -1.87 0.20 0.00 0.04 0.00 0.00 34.50 32.75 3gyr s PRO 447 CO 0.27 -1.72 1.87 -1.35 0.04 0.00 0.00 177.00 176.10 3gyr h PRO 448 N -0.66 1.21 -0.65 0.56 0.11 -1.85 -2.84 132.00 127.89 3gyr h PRO 448 Ca -0.46 -0.12 0.00 0.00 0.11 0.00 0.00 66.00 65.53 3gyr h PRO 448 Cb 1.26 -0.25 0.00 0.00 0.11 0.00 0.00 31.00 32.12 3gyr h PRO 448 CO 0.50 0.86 0.00 0.41 -0.21 0.00 0.00 178.00 179.57 3gyr n GLY 449 N -1.19 0.70 3.77 -0.55 0.00 -1.26 -2.61 105.19 104.04 3gyr n GLY 449 Ca 0.09 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.71 3gyr n GLY 449 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3gyr s THR 450 N -1.30 2.76 0.13 2.61 2.01 -1.07 -4.70 115.64 116.07 3gyr s THR 450 Ca 0.00 0.74 -0.34 0.00 0.31 0.00 0.00 61.69 62.40 3gyr s THR 450 Cb 0.00 -3.46 -0.14 0.00 0.01 0.00 0.00 72.50 68.91 3gyr s THR 450 CO 0.00 0.16 1.56 1.17 -0.69 0.00 0.00 174.62 176.82 3gyr n LYS 451 N 0.64 2.00 -0.86 4.92 4.81 0.11 -1.76 118.16 128.03 3gyr n LYS 451 Ca 0.01 0.72 0.00 0.00 -0.87 0.00 0.00 58.31 58.17 3gyr n LYS 451 Cb 0.43 -2.48 0.00 0.00 0.02 0.00 0.00 35.03 33.00 3gyr n LYS 451 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3gyr n GLY 452 N 3.36 0.81 0.22 3.14 0.00 -1.26 -4.85 105.19 106.60 3gyr n GLY 452 Ca 0.18 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.32 3gyr n GLY 452 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3gyr n SER 453 N 0.00 1.00 -1.33 1.61 3.41 -0.72 -4.93 113.62 112.66 3gyr n SER 453 Ca 0.00 -0.83 -0.14 0.00 -0.26 0.00 0.00 58.87 57.64 3gyr n SER 453 Cb 0.00 0.19 -0.04 0.00 -0.26 0.00 0.00 64.21 64.10 3gyr n SER 453 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3gyr n GLY 454 N 1.37 0.81 1.77 5.00 0.00 -1.26 -2.43 105.19 110.45 3gyr n GLY 454 Ca 0.11 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.81 3gyr n GLY 454 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gyr n GLY 455 N -1.13 0.57 3.69 -0.02 0.00 -1.23 -4.88 105.19 102.19 3gyr n GLY 455 Ca -0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.52 3gyr n GLY 455 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3gyr s HIS 456 N -2.05 3.14 0.61 1.61 3.76 -1.02 -4.54 115.29 116.80 3gyr s HIS 456 Ca 0.00 0.16 -0.19 0.00 -0.15 0.00 0.00 55.06 54.88 3gyr s HIS 456 Cb 0.00 -1.75 -0.03 0.00 1.11 0.00 0.00 32.58 31.92 3gyr s HIS 456 CO 0.00 0.47 1.27 -1.25 -0.85 0.00 0.00 174.74 174.38 3gyr s PRO 457 N -1.14 2.80 0.14 8.40 0.04 -1.26 -4.56 135.00 139.42 3gyr s PRO 457 Ca 0.16 2.01 0.03 0.00 0.04 0.00 0.00 61.00 63.24 3gyr s PRO 457 Cb -0.11 -1.95 -0.04 0.00 0.04 0.00 0.00 34.50 32.44 3gyr s PRO 457 CO 0.05 -1.39 -0.07 -1.21 0.04 0.00 0.00 177.00 174.42 3gyr s GLU 458 N -3.27 1.02 -0.19 4.56 2.02 -1.24 -4.74 118.70 116.86 3gyr s GLU 458 Ca 0.79 -1.44 -0.18 0.00 0.02 0.00 0.00 54.97 54.16 3gyr s GLU 458 Cb -0.36 -0.47 -0.03 0.00 0.10 0.00 0.00 34.13 33.37 3gyr s GLU 458 CO 0.39 0.02 0.49 0.42 0.02 0.00 0.00 175.26 176.59 3gyr s ILE 459 N -3.45 5.13 -0.21 -1.63 1.01 -1.26 -2.03 121.20 118.76 3gyr s ILE 459 Ca 0.17 0.90 -0.04 0.00 0.00 0.00 0.00 60.65 61.68 3gyr s ILE 459 Cb 0.04 -3.82 -0.01 0.00 0.01 0.00 0.00 42.46 38.68 3gyr s ILE 459 CO -0.00 0.20 -0.04 0.26 0.00 0.00 0.00 174.94 175.37 3gyr s TRP 460 N 1.50 2.97 0.05 3.97 0.52 0.94 -4.05 118.94 124.84 3gyr s TRP 460 Ca 0.23 -0.78 -0.25 0.00 0.02 0.00 0.00 56.10 55.32 3gyr s TRP 460 Cb -0.15 -2.08 -0.06 0.00 -1.15 0.00 0.00 33.47 30.03 3gyr s TRP 460 CO 0.09 -0.44 0.78 -1.21 0.02 0.00 0.00 176.95 176.19 3gyr s GLU 461 N 1.26 4.51 -0.05 4.98 2.02 -0.66 -0.17 118.70 130.60 3gyr s GLU 461 Ca 0.03 1.09 0.07 0.00 0.02 0.00 0.00 54.97 56.17 3gyr s GLU 461 Cb -0.14 -3.36 -0.01 0.00 0.10 0.00 0.00 34.13 30.71 3gyr s GLU 461 CO -0.01 0.28 -0.25 -1.64 0.02 0.00 0.00 175.26 173.67 3gyr s MET 462 N -0.07 2.42 -0.10 1.61 -1.94 -1.00 0.14 119.30 120.35 3gyr s MET 462 Ca 0.39 -0.90 -0.01 0.00 -1.71 0.00 0.00 55.69 53.46 3gyr s MET 462 Cb -0.21 -2.14 -0.03 0.00 2.01 0.00 0.00 34.83 34.47 3gyr s MET 462 CO 0.23 0.45 -0.06 0.00 -0.01 0.00 0.00 175.02 175.63 3gyr s ALA 463 N -0.33 2.97 0.01 3.03 0.00 0.25 -4.44 121.76 123.25 3gyr s ALA 463 Ca 0.02 -0.86 -0.30 0.00 0.00 0.00 0.00 51.96 50.81 3gyr s ALA 463 Cb -0.12 -1.34 -0.07 0.00 0.00 0.00 0.00 23.12 21.58 3gyr s ALA 463 CO 0.02 0.44 1.68 -2.00 0.00 0.00 0.00 175.76 175.90 3gyr s GLU 464 N -0.36 4.19 -0.01 0.00 2.12 -1.26 -0.09 118.70 123.29 3gyr s GLU 464 Ca 0.05 2.29 -0.30 0.00 0.36 0.00 0.00 54.97 57.37 3gyr s GLU 464 Cb -0.12 -3.84 -0.04 0.00 0.26 0.00 0.00 34.13 30.38 3gyr s GLU 464 CO 0.02 -0.80 1.20 0.08 -0.54 0.00 0.00 175.26 175.22 3gyr s VAL 465 N 3.47 4.16 -0.40 3.70 1.01 -0.08 -4.88 120.40 127.39 3gyr s VAL 465 Ca 0.75 1.52 0.10 0.00 0.00 0.00 0.00 61.98 64.35 3gyr s VAL 465 Cb -0.37 -3.98 0.43 0.00 0.00 0.00 0.00 36.38 32.47 3gyr s VAL 465 CO 0.32 0.05 1.05 -0.62 0.00 0.00 0.00 175.10 175.90 3gyr n GLU 466 N 4.69 2.60 0.00 2.72 1.02 -1.26 -4.72 120.64 125.69 3gyr n GLU 466 Ca 0.10 -4.05 0.00 0.00 -0.02 0.00 0.00 57.16 53.19 3gyr n GLU 466 Cb 0.46 -1.88 0.00 0.00 -0.02 0.00 0.00 31.44 30.00 3gyr n GLU 466 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 3gyr n GLN 472 N -0.33 0.00 0.00 3.49 1.13 -1.26 -5.21 117.38 115.20 3gyr n GLN 472 Ca 0.28 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.34 3gyr n GLN 472 Cb 0.72 0.00 0.00 0.00 0.11 0.00 0.00 30.24 31.07 3gyr n GLN 472 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 3gyr n VAL 473 N 0.00 0.00 -2.89 5.09 0.31 -1.26 -4.79 118.33 114.79 3gyr n VAL 473 Ca 0.00 0.00 -0.32 0.00 -0.01 0.00 0.00 64.34 64.01 3gyr n VAL 473 Cb 0.00 0.00 -0.06 0.00 -0.91 0.00 0.00 33.84 32.87 3gyr n VAL 473 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 3gyr s PRO 474 N -1.55 4.03 0.01 5.55 0.04 -1.26 -5.18 135.00 136.64 3gyr s PRO 474 Ca 0.00 0.81 -0.23 0.00 0.04 0.00 0.00 61.00 61.62 3gyr s PRO 474 Cb 0.00 -2.31 0.05 0.00 0.04 0.00 0.00 34.50 32.28 3gyr s PRO 474 CO 0.00 0.01 0.53 0.00 0.04 0.00 0.00 177.00 177.57 3gyr s ALA 475 N -2.20 -1.35 0.26 8.56 0.00 -1.26 -5.10 121.76 120.67 3gyr s ALA 475 Ca 0.57 0.75 -0.31 0.00 0.00 0.00 0.00 51.96 52.97 3gyr s ALA 475 Cb -0.10 0.22 -0.12 0.00 0.00 0.00 0.00 23.12 23.12 3gyr s ALA 475 CO 0.20 -0.42 1.56 -1.91 0.00 0.00 0.00 175.76 175.19 3gyr n GLU 476 N 0.71 2.51 -0.70 0.00 2.13 -1.25 -2.07 120.64 121.96 3gyr n GLU 476 Ca -0.19 0.90 0.00 0.00 0.66 0.00 0.00 57.16 58.52 3gyr n GLU 476 Cb 0.59 -2.65 0.00 0.00 0.27 0.00 0.00 31.44 29.64 3gyr n GLU 476 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3gyr n GLY 477 N 2.45 1.25 3.48 8.31 0.00 0.38 -4.93 105.19 116.14 3gyr n GLY 477 Ca 0.11 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.78 3gyr n GLY 477 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gyr s VAL 478 N -3.56 4.16 -0.06 1.61 1.01 -0.88 0.69 120.40 123.37 3gyr s VAL 478 Ca 0.00 -0.24 0.02 0.00 0.00 0.00 0.00 61.98 61.76 3gyr s VAL 478 Cb 0.00 -2.89 0.01 0.00 0.00 0.00 0.00 36.38 33.50 3gyr s VAL 478 CO 0.00 0.42 -0.12 -0.63 0.00 0.00 0.00 175.10 174.76 3gyr s ILE 479 N 1.01 1.14 -0.01 2.22 1.01 -0.32 -1.40 121.20 124.85 3gyr s ILE 479 Ca 0.02 -0.48 -0.01 0.00 0.00 0.00 0.00 60.65 60.18 3gyr s ILE 479 Cb -0.14 -1.04 -0.04 0.00 0.01 0.00 0.00 42.46 41.25 3gyr s ILE 479 CO 0.02 0.35 0.11 -1.10 0.00 0.00 0.00 174.94 174.33 3gyr s GLN 480 N 0.65 3.17 -0.04 2.79 -0.21 -1.26 -1.48 119.66 123.28 3gyr s GLN 480 Ca -0.14 -0.44 0.02 0.00 0.02 0.00 0.00 55.36 54.81 3gyr s GLN 480 Cb -0.16 -2.93 0.02 0.00 1.00 0.00 0.00 33.01 30.94 3gyr s GLN 480 CO 0.04 0.66 -0.07 0.08 -2.12 0.00 0.00 175.29 173.87 3gyr s VAL 481 N -1.23 0.71 -0.24 1.09 1.01 -0.04 0.33 120.40 122.04 3gyr s VAL 481 Ca 0.24 -0.26 -0.06 0.00 0.00 0.00 0.00 61.98 61.90 3gyr s VAL 481 Cb -0.12 -0.69 -0.02 0.00 0.00 0.00 0.00 36.38 35.55 3gyr s VAL 481 CO 0.15 0.25 0.04 -0.89 0.00 0.00 0.00 175.10 174.66 3gyr s THR 482 N 0.66 4.10 0.00 3.92 2.01 0.16 -0.75 115.64 125.74 3gyr s THR 482 Ca -0.10 -0.25 0.00 0.00 0.31 0.00 0.00 61.69 61.65 3gyr s THR 482 Cb -0.13 -2.90 0.00 0.00 0.01 0.00 0.00 72.50 69.48 3gyr s THR 482 CO 0.01 0.37 0.00 0.61 -0.69 0.00 0.00 174.62 174.92 3gyr n GLY 483 N 4.82 0.37 0.28 4.40 0.00 -0.83 -1.14 105.19 113.10 3gyr n GLY 483 Ca -0.17 -1.86 0.01 0.00 0.00 0.00 0.00 46.02 44.00 3gyr n GLY 483 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gyr h ALA 484 N -1.08 1.49 -0.00 4.61 0.00 -1.91 -2.55 119.26 119.82 3gyr h ALA 484 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 3gyr h ALA 484 Cb 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.63 3gyr h ALA 484 CO 0.00 0.38 0.00 -0.40 0.00 0.00 0.00 179.25 179.23 3gyr n ASP 485 N -4.35 0.03 0.00 0.00 5.68 -1.26 -4.88 116.55 111.78 3gyr n ASP 485 Ca 0.02 -1.43 0.00 0.00 -0.50 0.00 0.00 54.79 52.88 3gyr n ASP 485 Cb 0.18 -0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.16 3gyr n ASP 485 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3gyr n GLY 486 N 0.79 1.17 3.74 6.12 0.00 -0.96 -5.03 105.19 111.01 3gyr n GLY 486 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 3gyr n GLY 486 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3gyr s ARG 487 N -0.05 4.66 -0.24 1.61 3.52 -1.26 -4.82 118.95 122.37 3gyr s ARG 487 Ca 0.00 1.35 -0.11 0.00 -0.13 0.00 0.00 55.73 56.84 3gyr s ARG 487 Cb 0.00 -3.36 -0.05 0.00 -1.56 0.00 0.00 34.95 29.99 3gyr s ARG 487 CO 0.00 0.28 0.21 0.99 -0.81 0.00 0.00 175.30 175.97 3gyr s THR 488 N -0.20 5.32 0.23 4.11 2.01 -1.26 -1.96 115.64 123.89 3gyr s THR 488 Ca 0.44 0.27 0.10 0.00 0.31 0.00 0.00 61.69 62.81 3gyr s THR 488 Cb -0.23 -3.54 -0.04 0.00 0.01 0.00 0.00 72.50 68.69 3gyr s THR 488 CO 0.28 0.31 -0.10 -0.54 -0.69 0.00 0.00 174.62 173.89 3gyr s LYS 489 N 1.22 2.02 -0.11 4.92 1.02 0.07 -4.95 119.74 123.93 3gyr s LYS 489 Ca 0.09 -1.45 0.03 0.00 0.02 0.00 0.00 55.97 54.66 3gyr s LYS 489 Cb -0.14 -2.05 0.01 0.00 -0.52 0.00 0.00 37.83 35.12 3gyr s LYS 489 CO 0.06 0.38 -0.22 0.99 -0.92 0.00 0.00 175.35 175.65 3gyr s THR 490 N -2.10 1.96 0.16 2.17 2.01 -1.26 -0.86 115.64 117.72 3gyr s THR 490 Ca 0.28 -0.94 0.10 0.00 0.31 0.00 0.00 61.69 61.44 3gyr s THR 490 Cb -0.07 -1.72 -0.04 0.00 0.01 0.00 0.00 72.50 70.68 3gyr s THR 490 CO 0.16 0.53 -0.22 -0.31 -0.69 0.00 0.00 174.62 174.09 3gyr s TYR 491 N 0.60 2.10 -0.07 4.92 1.51 -0.55 -0.90 117.35 124.97 3gyr s TYR 491 Ca -0.13 -0.40 0.05 0.00 -1.01 0.00 0.00 57.07 55.58 3gyr s TYR 491 Cb -0.17 -1.07 -0.01 0.00 -0.11 0.00 0.00 41.96 40.61 3gyr s TYR 491 CO 0.03 0.39 -0.23 0.50 -1.11 0.00 0.00 175.55 175.13 3gyr s ARG 492 N -2.51 2.53 0.19 -0.62 3.52 0.87 -1.17 118.95 121.76 3gyr s ARG 492 Ca 0.16 -0.83 -0.32 0.00 -0.13 0.00 0.00 55.73 54.61 3gyr s ARG 492 Cb -0.08 -2.07 -0.11 0.00 -1.56 0.00 0.00 34.95 31.13 3gyr s ARG 492 CO 0.08 0.29 1.67 0.50 -0.81 0.00 0.00 175.30 177.03 3gyr s ARG 493 N 0.04 4.16 -0.00 5.12 3.52 0.22 -0.58 118.95 131.42 3gyr s ARG 493 Ca -0.08 2.52 0.04 0.00 -0.13 0.00 0.00 55.73 58.08 3gyr s ARG 493 Cb -0.15 -3.13 -0.05 0.00 -1.56 0.00 0.00 34.95 30.07 3gyr s ARG 493 CO 0.05 -0.71 0.17 0.25 -0.81 0.00 0.00 175.30 174.25 3gyr n THR 494 N 4.02 0.00 -3.57 4.11 -2.24 0.12 -4.91 114.28 111.81 3gyr n THR 494 Ca 0.15 -0.36 -0.14 0.00 -2.27 0.00 0.00 64.05 61.43 3gyr n THR 494 Cb 0.36 0.93 -0.06 0.00 -2.10 0.00 0.00 70.33 69.46 3gyr n THR 494 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3gyr s ALA 495 N -1.51 -1.83 0.00 6.98 0.00 -1.23 -4.87 121.76 119.30 3gyr s ALA 495 Ca 0.01 1.61 0.00 0.00 0.00 0.00 0.00 51.96 53.58 3gyr s ALA 495 Cb 0.03 -0.60 0.00 0.00 0.00 0.00 0.00 23.12 22.55 3gyr s ALA 495 CO 0.18 -0.33 0.03 2.89 0.00 0.00 0.00 175.76 178.52 3gyr n ARG 496 N 1.45 2.38 -3.79 0.00 1.85 -1.26 -1.65 116.66 115.64 3gyr n ARG 496 Ca -0.15 -0.03 -0.09 0.00 -1.00 0.00 0.00 57.85 56.58 3gyr n ARG 496 Cb 0.57 -0.27 -0.04 0.00 -1.05 0.00 0.00 32.46 31.67 3gyr n ARG 496 CO 0.00 0.00 0.00 -0.08 -0.01 0.00 0.00 177.63 177.54 3gyr s THR 497 N -0.35 0.03 0.19 8.89 -1.32 -1.26 -4.17 115.64 117.65 3gyr s THR 497 Ca 0.00 -0.91 -0.18 0.00 -1.21 0.00 0.00 61.69 59.39 3gyr s THR 497 Cb 0.00 -1.67 0.14 0.00 -1.51 0.00 0.00 72.50 69.46 3gyr s THR 497 CO 0.00 -0.13 1.61 0.15 -2.21 0.00 0.00 174.62 174.04 3gyr h PHE 498 N 2.24 -0.62 -0.32 9.09 3.04 -1.15 -2.50 116.94 126.72 3gyr h PHE 498 Ca -0.29 0.06 0.00 0.00 3.98 0.00 0.00 57.97 61.72 3gyr h PHE 498 Cb 1.26 0.35 0.00 0.00 2.56 0.00 0.00 35.95 40.12 3gyr h PHE 498 CO 0.36 -0.32 0.00 0.09 -2.02 0.00 0.00 178.31 176.42 3gyr n ASN 499 N -5.42 1.78 -4.65 0.41 5.03 -1.26 -4.58 115.26 106.57 3gyr n ASN 499 Ca 0.04 -1.96 -0.32 0.00 0.87 0.00 0.00 54.58 53.21 3gyr n ASN 499 Cb 0.33 -0.21 0.14 0.00 -1.02 0.00 0.00 39.78 39.02 3gyr n ASN 499 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 3gyr n ASP 500 N 0.46 0.41 -4.31 6.41 8.00 -0.94 -4.94 116.55 121.64 3gyr n ASP 500 Ca 0.12 0.49 -0.39 0.00 0.71 0.00 0.00 54.79 55.72 3gyr n ASP 500 Cb 0.29 -1.46 0.01 0.00 -0.02 0.00 0.00 41.12 39.94 3gyr n ASP 500 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3gyr n GLY 501 N 0.53 -2.75 3.77 0.44 0.00 -1.26 -4.86 105.19 101.05 3gyr n GLY 501 Ca 0.12 -0.16 -0.40 0.00 0.00 0.00 0.00 46.02 45.58 3gyr n GLY 501 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3gyr s LEU 502 N 3.93 4.22 -0.15 0.99 2.96 -1.26 -4.93 118.68 124.44 3gyr s LEU 502 Ca 0.60 2.93 -0.08 0.00 -0.22 0.00 0.00 54.13 57.35 3gyr s LEU 502 Cb -0.50 -3.82 -0.06 0.00 0.50 0.00 0.00 46.19 42.31 3gyr s LEU 502 CO 0.63 -0.99 -0.21 0.61 -1.32 0.00 0.00 176.35 175.07 3gyr n GLY 503 N 0.56 -0.27 3.52 7.98 0.00 -1.26 -4.98 105.19 110.74 3gyr n GLY 503 Ca 0.03 -0.10 -0.42 0.00 0.00 0.00 0.00 46.02 45.54 3gyr n GLY 503 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3gyr s PHE 504 N -2.32 3.19 -0.13 1.61 0.08 -1.26 -5.03 117.98 114.11 3gyr s PHE 504 Ca -0.22 -0.12 0.00 0.00 0.12 0.00 0.00 56.93 56.72 3gyr s PHE 504 Cb 0.08 -2.80 -0.01 0.00 -0.57 0.00 0.00 43.02 39.71 3gyr s PHE 504 CO 0.28 -0.55 -0.14 0.99 -0.10 0.00 0.00 175.22 175.69 3gyr s THR 505 N 2.13 2.96 -0.03 0.64 2.01 -1.26 -0.54 115.64 121.55 3gyr s THR 505 Ca 0.13 -0.69 0.02 0.00 0.31 0.00 0.00 61.69 61.46 3gyr s THR 505 Cb -0.16 -2.24 0.01 0.00 0.01 0.00 0.00 72.50 70.11 3gyr s THR 505 CO 0.13 0.53 -0.10 -0.63 -0.69 0.00 0.00 174.62 173.86 3gyr s ILE 506 N 0.35 0.86 -0.05 1.82 1.01 0.13 -4.95 121.20 120.37 3gyr s ILE 506 Ca -0.12 -0.38 -0.30 0.00 0.00 0.00 0.00 60.65 59.85 3gyr s ILE 506 Cb -0.16 -0.77 -0.03 0.00 0.01 0.00 0.00 42.46 41.51 3gyr s ILE 506 CO 0.06 0.27 1.18 -0.83 0.00 0.00 0.00 174.94 175.62 3gyr s GLY 507 N 0.30 2.15 0.25 6.18 0.00 -1.26 -1.51 107.32 113.42 3gyr s GLY 507 Ca -0.05 0.61 -0.31 0.00 0.00 0.00 0.00 44.72 44.97 3gyr s GLY 507 CO 0.01 2.17 1.33 -2.21 0.00 0.00 0.00 173.10 174.41 3gyr n GLU 508 N 5.11 1.89 -0.06 2.90 0.00 0.59 -1.87 120.64 129.19 3gyr n GLU 508 Ca 0.11 0.67 0.00 0.00 0.00 0.00 0.00 57.16 57.94 3gyr n GLU 508 Cb 0.46 -2.28 0.00 0.00 0.00 0.00 0.00 31.44 29.63 3gyr n GLU 508 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3gyr n GLY 509 N 1.89 1.25 3.93 8.31 0.00 0.27 -4.50 105.19 116.34 3gyr n GLY 509 Ca 0.11 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.87 3gyr n GLY 509 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3gyr s THR 510 N -2.51 2.20 0.04 2.61 -4.23 -0.78 -4.78 115.64 108.19 3gyr s THR 510 Ca 0.00 -0.23 0.07 0.00 -1.18 0.00 0.00 61.69 60.35 3gyr s THR 510 Cb 0.00 -2.97 -0.03 0.00 1.34 0.00 0.00 72.50 70.84 3gyr s THR 510 CO 0.00 0.00 -0.19 -1.00 -0.54 0.00 0.00 174.62 172.89 3gyr s HIS 511 N -3.34 2.54 0.01 3.99 3.76 -1.26 -1.21 115.29 119.78 3gyr s HIS 511 Ca 0.62 -0.27 0.02 0.00 -0.15 0.00 0.00 55.06 55.28 3gyr s HIS 511 Cb -0.10 -1.46 -0.01 0.00 1.11 0.00 0.00 32.58 32.12 3gyr s HIS 511 CO 0.46 0.23 -0.06 -1.21 -0.85 0.00 0.00 174.74 173.31 3gyr s GLU 512 N -1.37 0.47 -0.17 1.40 2.02 -0.59 -1.66 118.70 118.79 3gyr s GLU 512 Ca 0.14 -0.36 -0.11 0.00 0.02 0.00 0.00 54.97 54.65 3gyr s GLU 512 Cb -0.10 -0.39 -0.05 0.00 0.10 0.00 0.00 34.13 33.68 3gyr s GLU 512 CO 0.05 0.10 0.21 -1.14 0.02 0.00 0.00 175.26 174.49 3gyr s GLN 513 N -0.55 4.13 -0.08 1.61 0.74 -0.28 -1.60 119.66 123.63 3gyr s GLN 513 Ca -0.01 -0.06 0.00 0.00 0.05 0.00 0.00 55.36 55.35 3gyr s GLN 513 Cb -0.04 -3.39 -0.03 0.00 1.10 0.00 0.00 33.01 30.65 3gyr s GLN 513 CO -0.00 0.34 -0.07 -1.58 -0.55 0.00 0.00 175.29 173.43 3gyr s TRP 514 N 0.21 2.95 -0.17 1.67 0.52 0.09 -1.29 118.94 122.92 3gyr s TRP 514 Ca 0.13 -0.01 -0.03 0.00 0.02 0.00 0.00 56.10 56.21 3gyr s TRP 514 Cb -0.12 -1.73 -0.02 0.00 -1.15 0.00 0.00 33.47 30.45 3gyr s TRP 514 CO 0.02 0.30 -0.07 0.99 0.02 0.00 0.00 176.95 178.21 3gyr s THR 515 N -0.71 3.48 -0.34 2.01 2.01 -0.19 -0.95 115.64 120.95 3gyr s THR 515 Ca 0.11 -0.49 -0.13 0.00 0.31 0.00 0.00 61.69 61.49 3gyr s THR 515 Cb -0.11 -2.52 -0.01 0.00 0.01 0.00 0.00 72.50 69.86 3gyr s THR 515 CO 0.02 0.48 0.23 -0.36 -0.69 0.00 0.00 174.62 174.30 3gyr s PHE 516 N 0.67 3.22 -0.39 4.92 0.40 0.10 0.08 117.98 126.99 3gyr s PHE 516 Ca -0.04 -0.27 -0.02 0.00 -0.60 0.00 0.00 56.93 55.99 3gyr s PHE 516 Cb -0.15 -2.47 0.10 0.00 0.51 0.00 0.00 43.02 41.02 3gyr s PHE 516 CO 0.02 -0.38 0.17 -1.17 0.70 0.00 0.00 175.22 174.57 3gyr s LEU 517 N 1.71 5.08 -0.38 -0.37 2.96 0.12 -0.14 118.68 127.66 3gyr s LEU 517 Ca 0.06 -1.95 -0.22 0.00 -0.22 0.00 0.00 54.13 51.80 3gyr s LEU 517 Cb -0.17 -1.81 0.01 0.00 0.50 0.00 0.00 46.19 44.72 3gyr s LEU 517 CO 0.10 -0.50 0.73 0.21 -1.32 0.00 0.00 176.35 175.57 3gyr s ASN 518 N 1.71 6.48 0.00 3.68 3.84 0.07 -0.16 114.94 130.56 3gyr s ASN 518 Ca 0.07 0.19 0.27 0.00 0.21 0.00 0.00 52.86 53.60 3gyr s ASN 518 Cb -0.22 -2.37 0.90 0.00 -0.55 0.00 0.00 41.25 39.01 3gyr s ASN 518 CO -0.04 -0.72 1.66 0.18 -2.79 0.00 0.00 177.10 175.39 3gyr n LEU 519 N 6.34 0.74 -4.90 3.21 4.77 -0.11 -0.87 117.00 126.19 3gyr n LEU 519 Ca 0.01 -0.11 -0.22 0.00 -0.03 0.00 0.00 56.01 55.66 3gyr n LEU 519 Cb 0.48 -0.17 -0.02 0.00 -2.33 0.00 0.00 43.42 41.38 3gyr n LEU 519 CO 0.53 0.14 0.04 -0.94 -1.33 0.00 0.00 177.39 175.83 3gyr s SER 520 N -2.57 4.95 0.00 -1.43 1.04 -1.26 -4.74 113.70 109.69 3gyr s SER 520 Ca 0.24 -0.88 0.28 0.00 0.48 0.00 0.00 55.95 56.07 3gyr s SER 520 Cb 0.19 -0.25 1.48 0.00 0.10 0.00 0.00 66.02 67.54 3gyr s SER 520 CO 0.53 -0.82 1.98 -0.81 0.98 0.00 0.00 173.24 175.09 3gyr n PRO 521 N -1.66 1.22 -3.07 4.02 -0.04 -1.26 -2.84 135.00 131.38 3gyr n PRO 521 Ca 0.03 -0.33 -0.40 0.00 -0.04 0.00 0.00 63.50 62.77 3gyr n PRO 521 Cb 0.62 -1.46 -0.05 0.00 -0.04 0.00 0.00 33.50 32.58 3gyr n PRO 521 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3gyr s ILE 522 N -1.98 5.00 -0.18 0.52 1.01 -1.26 -4.46 121.20 119.85 3gyr s ILE 522 Ca 0.41 1.32 -0.29 0.00 0.00 0.00 0.00 60.65 62.09 3gyr s ILE 522 Cb 0.20 -4.00 -0.00 0.00 0.01 0.00 0.00 42.46 38.67 3gyr s ILE 522 CO 0.33 0.13 1.12 -0.22 0.00 0.00 0.00 174.94 176.30 3gyr s LEU 523 N 1.70 4.16 -0.20 2.97 0.20 -1.26 -4.39 118.68 121.86 3gyr s LEU 523 Ca 0.32 1.53 -0.03 0.00 0.69 0.00 0.00 54.13 56.65 3gyr s LEU 523 Cb -0.16 -3.54 -0.01 0.00 -0.43 0.00 0.00 46.19 42.05 3gyr s LEU 523 CO 0.12 -0.67 -0.07 -1.00 -0.29 0.00 0.00 176.35 174.44 3gyr s HIS 524 N 3.10 2.93 -0.51 5.38 3.76 -0.92 -4.95 115.29 124.07 3gyr s HIS 524 Ca 0.49 -0.90 -0.25 0.00 -0.15 0.00 0.00 55.06 54.25 3gyr s HIS 524 Cb -0.18 -2.04 0.03 0.00 1.11 0.00 0.00 32.58 31.50 3gyr s HIS 524 CO 0.11 -0.48 0.95 -1.25 -0.85 0.00 0.00 174.74 173.22 3gyr s PRO 525 N 1.22 3.43 -0.03 8.40 0.04 -1.26 -0.88 135.00 145.92 3gyr s PRO 525 Ca 0.02 -0.04 -0.17 0.00 0.04 0.00 0.00 61.00 60.85 3gyr s PRO 525 Cb -0.14 -3.99 -0.05 0.00 0.04 0.00 0.00 34.50 30.35 3gyr s PRO 525 CO -0.02 -1.38 0.47 -1.64 0.04 0.00 0.00 177.00 174.46 3gyr s MET 526 N 3.93 4.13 -0.05 4.56 -1.94 0.39 -0.45 119.30 129.87 3gyr s MET 526 Ca 0.34 0.49 0.03 0.00 -1.71 0.00 0.00 55.69 54.84 3gyr s MET 526 Cb -0.11 -3.30 0.01 0.00 2.01 0.00 0.00 34.83 33.43 3gyr s MET 526 CO 0.23 0.48 -0.12 -1.58 -0.01 0.00 0.00 175.02 174.02 3gyr s HIS 527 N -0.46 1.38 -0.17 -0.03 5.04 0.59 -1.02 115.29 120.63 3gyr s HIS 527 Ca 0.26 -0.46 -0.02 0.00 -1.54 0.00 0.00 55.06 53.30 3gyr s HIS 527 Cb -0.17 -1.00 -0.02 0.00 0.04 0.00 0.00 32.58 31.44 3gyr s HIS 527 CO 0.13 -0.22 -0.08 0.42 -2.34 0.00 0.00 174.74 172.66 3gyr s ILE 528 N 0.46 3.38 1.23 0.89 1.01 -1.10 -0.97 121.20 126.11 3gyr s ILE 528 Ca -0.10 -0.52 -0.19 0.00 0.00 0.00 0.00 60.65 59.83 3gyr s ILE 528 Cb -0.14 -2.48 0.30 0.00 0.01 0.00 0.00 42.46 40.15 3gyr s ILE 528 CO 0.03 0.48 1.07 -1.00 0.00 0.00 0.00 174.94 175.52 3gyr s HIS 529 N 0.75 0.43 0.00 3.97 3.76 -0.63 -4.43 115.29 119.14 3gyr s HIS 529 Ca -0.03 0.58 0.00 0.00 -0.15 0.00 0.00 55.06 55.46 3gyr s HIS 529 Cb -0.15 -3.31 0.00 0.00 1.11 0.00 0.00 32.58 30.24 3gyr s HIS 529 CO 0.02 -4.03 0.00 -0.11 -0.85 0.00 0.00 174.74 169.76 3gyr n LEU 530 N -4.91 0.00 -4.94 0.89 7.94 -1.26 -4.91 117.00 109.82 3gyr n LEU 530 Ca 0.12 0.00 -0.24 0.00 -1.11 0.00 0.00 56.01 54.77 3gyr n LEU 530 Cb 0.59 0.00 -0.00 0.00 0.53 0.00 0.00 43.42 44.54 3gyr n LEU 530 CO 0.46 0.00 0.27 0.00 -1.11 0.00 0.00 177.39 177.01 3gyr s ALA 531 N 0.00 3.64 -0.04 1.96 0.00 -1.26 -4.36 121.76 121.70 3gyr s ALA 531 Ca 0.00 -0.87 -0.14 0.00 0.00 0.00 0.00 51.96 50.95 3gyr s ALA 531 Cb 0.00 -2.23 -0.05 0.00 0.00 0.00 0.00 23.12 20.84 3gyr s ALA 531 CO 0.00 -0.22 0.37 -0.51 0.00 0.00 0.00 175.76 175.40 3gyr s ASP 532 N -4.11 6.71 0.28 0.00 1.01 -1.26 -4.79 116.67 114.50 3gyr s ASP 532 Ca 0.44 0.84 0.08 0.00 0.71 0.00 0.00 52.55 54.62 3gyr s ASP 532 Cb -0.10 -2.23 -0.06 0.00 1.01 0.00 0.00 42.92 41.55 3gyr s ASP 532 CO 0.39 0.27 -0.09 -0.36 0.21 0.00 0.00 175.17 175.59 3gyr s PHE 533 N -0.71 2.03 0.01 4.23 0.40 -0.42 -3.78 117.98 119.74 3gyr s PHE 533 Ca 0.22 -0.61 0.07 0.00 -0.60 0.00 0.00 56.93 56.00 3gyr s PHE 533 Cb -0.16 -1.10 -0.02 0.00 0.51 0.00 0.00 43.02 42.25 3gyr s PHE 533 CO 0.11 0.38 -0.20 -0.65 0.70 0.00 0.00 175.22 175.56 3gyr s GLN 534 N -3.68 1.47 -0.02 0.44 -0.21 -0.20 -0.53 119.66 116.94 3gyr s GLN 534 Ca 0.29 -0.81 -0.30 0.00 0.02 0.00 0.00 55.36 54.56 3gyr s GLN 534 Cb 0.02 -1.50 -0.04 0.00 1.00 0.00 0.00 33.01 32.49 3gyr s GLN 534 CO 0.12 0.40 1.25 0.08 -2.12 0.00 0.00 175.29 175.01 3gyr s VAL 535 N -0.63 4.09 -0.16 1.09 1.01 -1.26 -1.23 120.40 123.30 3gyr s VAL 535 Ca 0.07 1.45 0.04 0.00 0.00 0.00 0.00 61.98 63.54 3gyr s VAL 535 Cb -0.08 -3.93 -0.23 0.00 0.00 0.00 0.00 36.38 32.15 3gyr s VAL 535 CO 0.00 0.02 0.18 0.18 0.00 0.00 0.00 175.10 175.48 3gyr n LEU 536 N 5.00 1.96 -3.57 3.92 4.77 0.99 -4.94 117.00 125.13 3gyr n LEU 536 Ca 0.11 0.10 -0.07 0.00 -0.03 0.00 0.00 56.01 56.12 3gyr n LEU 536 Cb 0.46 -0.54 -0.03 0.00 -2.33 0.00 0.00 43.42 40.98 3gyr n LEU 536 CO 0.56 0.74 0.87 -0.83 -1.33 0.00 0.00 177.39 177.39 3gyr s GLY 537 N -5.78 -0.30 0.07 -0.72 0.00 -1.15 -4.99 107.32 94.45 3gyr s GLY 537 Ca -0.21 1.64 0.05 0.00 0.00 0.00 0.00 44.72 46.20 3gyr s GLY 537 CO 0.74 0.65 -0.14 0.50 0.00 0.00 0.00 173.10 174.85 3gyr s ARG 538 N -2.18 0.80 -0.10 2.90 0.52 -1.26 -0.52 118.95 119.11 3gyr s ARG 538 Ca 0.05 -0.94 -0.07 0.00 -0.52 0.00 0.00 55.73 54.26 3gyr s ARG 538 Cb -0.01 -0.79 0.04 0.00 0.52 0.00 0.00 34.95 34.71 3gyr s ARG 538 CO -0.05 0.17 0.25 -0.51 0.02 0.00 0.00 175.30 175.18 3gyr s ASP 539 N -1.72 -0.26 0.46 0.23 1.11 -0.58 -4.38 116.67 111.52 3gyr s ASP 539 Ca -0.03 0.51 -0.21 0.00 0.18 0.00 0.00 52.55 53.01 3gyr s ASP 539 Cb -0.10 0.46 -0.10 0.00 1.07 0.00 0.00 42.92 44.25 3gyr s ASP 539 CO 0.02 -0.13 0.99 0.00 1.18 0.00 0.00 175.17 177.23 3gyr s ALA 540 N 0.72 2.97 0.03 5.23 0.00 -1.25 -0.09 121.76 129.36 3gyr s ALA 540 Ca -0.05 0.49 0.02 0.00 0.00 0.00 0.00 51.96 52.42 3gyr s ALA 540 Cb -0.06 -3.19 -0.02 0.00 0.00 0.00 0.00 23.12 19.85 3gyr s ALA 540 CO -0.04 -0.07 -0.08 0.71 0.00 0.00 0.00 175.76 176.28 3gyr s TYR 541 N -2.10 0.67 -0.32 0.00 2.02 -1.02 -1.28 117.35 115.32 3gyr s TYR 541 Ca 0.64 -0.34 -0.18 0.00 -0.37 0.00 0.00 57.07 56.82 3gyr s TYR 541 Cb -0.12 -0.41 -0.01 0.00 -0.40 0.00 0.00 41.96 41.02 3gyr s TYR 541 CO 0.16 -0.04 0.52 0.34 -1.57 0.00 0.00 175.55 174.96 3gyr s ASP 542 N -1.02 6.36 -0.01 2.29 2.15 0.12 -4.69 116.67 121.87 3gyr s ASP 542 Ca -0.04 0.16 0.13 0.00 0.43 0.00 0.00 52.55 53.22 3gyr s ASP 542 Cb -0.07 -2.27 0.38 0.00 -0.30 0.00 0.00 42.92 40.66 3gyr s ASP 542 CO 0.00 -0.42 1.32 0.00 -0.17 0.00 0.00 175.17 175.90 3gyr n ALA 543 N 5.70 2.28 0.31 3.66 0.00 -1.26 -1.28 120.51 129.92 3gyr n ALA 543 Ca -0.04 -1.25 0.20 0.00 0.00 0.00 0.00 53.44 52.34 3gyr n ALA 543 Cb 0.49 -0.54 0.98 0.00 0.00 0.00 0.00 19.45 20.38 3gyr n ALA 543 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3gyr h SER 544 N 2.39 0.00 0.57 0.00 4.64 -1.91 -0.35 113.55 118.89 3gyr h SER 544 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3gyr h SER 544 Cb 0.83 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.92 3gyr h SER 544 CO 0.02 0.02 0.00 1.23 -0.87 0.00 0.00 176.83 177.23 3gyr h GLY 545 N 0.76 0.00 -5.02 -0.77 0.00 -1.81 -3.42 103.07 92.81 3gyr h GLY 545 Ca -0.00 0.00 -0.57 0.00 0.00 0.00 0.00 47.33 46.76 3gyr h GLY 545 CO 0.00 0.00 0.78 -0.12 0.00 0.00 0.00 176.54 177.20 3gyr s PHE 546 N -3.80 3.25 -0.36 5.60 2.19 -0.14 -0.18 117.98 124.53 3gyr s PHE 546 Ca -0.01 1.37 -0.11 0.00 0.33 0.00 0.00 56.93 58.50 3gyr s PHE 546 Cb 0.10 -3.32 0.01 0.00 -1.31 0.00 0.00 43.02 38.50 3gyr s PHE 546 CO 0.46 -0.77 0.21 0.34 1.83 0.00 0.00 175.22 177.29 3gyr s ASP 547 N 1.38 5.79 0.26 6.13 -1.08 0.12 -4.95 116.67 124.32 3gyr s ASP 547 Ca 0.48 -0.75 -0.03 0.00 -0.52 0.00 0.00 52.55 51.73 3gyr s ASP 547 Cb -0.18 -2.06 0.42 0.00 -1.46 0.00 0.00 42.92 39.65 3gyr s ASP 547 CO 0.11 -0.32 1.84 -0.07 0.52 0.00 0.00 175.17 177.25 3gyr h LEU 548 N 8.45 0.85 -0.43 -1.34 4.07 -1.91 0.41 115.31 125.41 3gyr h LEU 548 Ca -0.29 0.03 -0.07 0.00 0.08 0.00 0.00 57.88 57.63 3gyr h LEU 548 Cb 1.13 -0.14 -0.01 0.00 1.08 0.00 0.00 40.66 42.72 3gyr h LEU 548 CO 0.66 0.50 -0.35 0.00 -1.08 0.00 0.00 178.44 178.18 3gyr h ALA 549 N 1.46 0.84 0.08 1.53 0.00 -1.94 0.40 119.26 121.64 3gyr h ALA 549 Ca 0.42 -0.31 -0.28 0.00 0.00 0.00 0.00 54.91 54.74 3gyr h ALA 549 Cb 0.31 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 3gyr h ALA 549 CO -0.22 0.43 -1.44 1.25 0.00 0.00 0.00 179.25 179.28 3gyr h LEU 550 N 0.00 0.26 -0.98 0.00 5.85 -1.83 -3.43 115.31 115.18 3gyr h LEU 550 Ca -0.00 -0.35 -0.21 0.00 0.84 0.00 0.00 57.88 58.16 3gyr h LEU 550 Cb 1.10 -0.08 0.08 0.00 0.37 0.00 0.00 40.66 42.12 3gyr h LEU 550 CO 0.04 1.29 -0.36 0.61 -0.34 0.00 0.00 178.44 179.68 3gyr n GLY 551 N 1.58 0.15 3.81 3.75 0.00 0.08 -3.96 105.19 110.60 3gyr n GLY 551 Ca -0.13 -0.18 -0.05 0.00 0.00 0.00 0.00 46.02 45.66 3gyr n GLY 551 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3gyr s GLY 552 N -3.21 -0.09 0.13 -0.02 0.00 -1.16 0.14 107.32 103.13 3gyr s GLY 552 Ca 0.29 -0.18 -0.28 0.00 0.00 0.00 0.00 44.72 44.55 3gyr s GLY 552 CO 0.39 0.09 0.88 -0.51 0.00 0.00 0.00 173.10 173.95 3gyr s THR 553 N -3.38 4.43 -0.11 0.90 -4.23 -0.49 0.14 115.64 112.90 3gyr s THR 553 Ca 0.13 1.92 0.17 0.00 -1.18 0.00 0.00 61.69 62.72 3gyr s THR 553 Cb -0.04 -4.25 -0.20 0.00 1.34 0.00 0.00 72.50 69.35 3gyr s THR 553 CO 0.05 0.40 0.58 0.54 -0.54 0.00 0.00 174.62 175.65 3gyr n ARG 554 N 2.31 0.64 -3.99 3.99 1.74 0.74 -4.54 116.66 117.54 3gyr n ARG 554 Ca -0.01 0.15 -0.11 0.00 -0.77 0.00 0.00 57.85 57.11 3gyr n ARG 554 Cb 0.49 -1.71 -0.12 0.00 -1.02 0.00 0.00 32.46 30.10 3gyr n ARG 554 CO 0.00 0.00 0.00 -0.08 -1.52 0.00 0.00 177.63 176.03 3gyr s THR 555 N -2.81 0.21 0.55 0.55 -1.32 -1.21 -4.95 115.64 106.66 3gyr s THR 555 Ca -0.05 -0.78 -0.21 0.00 -1.21 0.00 0.00 61.69 59.44 3gyr s THR 555 Cb 0.08 -0.31 -0.06 0.00 -1.51 0.00 0.00 72.50 70.71 3gyr s THR 555 CO 0.83 -0.37 1.08 -2.65 -2.21 0.00 0.00 174.62 171.30 3gyr n PRO 556 N 1.85 1.20 -2.01 7.08 -0.02 -1.26 -4.29 135.00 137.56 3gyr n PRO 556 Ca -0.21 0.45 -0.42 0.00 -2.02 0.00 0.00 63.50 61.29 3gyr n PRO 556 Cb 0.56 -2.25 -0.03 0.00 -0.02 0.00 0.00 33.50 31.76 3gyr n PRO 556 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3gyr s VAL 557 N -1.40 3.22 -0.13 -1.45 1.01 0.15 -4.62 120.40 117.17 3gyr s VAL 557 Ca 0.72 0.65 0.01 0.00 0.00 0.00 0.00 61.98 63.36 3gyr s VAL 557 Cb -0.45 -3.42 -0.00 0.00 0.00 0.00 0.00 36.38 32.51 3gyr s VAL 557 CO 0.50 -0.00 -0.18 -0.60 0.00 0.00 0.00 175.10 174.82 3gyr s ARG 558 N 2.59 3.19 0.17 2.72 3.52 -0.41 -0.66 118.95 130.07 3gyr s ARG 558 Ca 0.71 -0.78 -0.32 0.00 -0.13 0.00 0.00 55.73 55.21 3gyr s ARG 558 Cb -0.37 -2.52 -0.12 0.00 -1.56 0.00 0.00 34.95 30.38 3gyr s ARG 558 CO 0.31 0.10 1.76 -0.11 -0.81 0.00 0.00 175.30 176.55 3gyr n LEU 559 N 3.80 3.96 -4.34 -0.88 0.00 -0.29 0.14 117.00 119.38 3gyr n LEU 559 Ca -0.19 1.03 -0.46 0.00 0.00 0.00 0.00 56.01 56.40 3gyr n LEU 559 Cb 0.52 -1.55 -0.04 0.00 0.00 0.00 0.00 43.42 42.35 3gyr n LEU 559 CO 0.29 0.15 0.31 -0.62 0.00 0.00 0.00 177.39 177.52 3gyr s ASP 560 N 1.75 6.30 0.00 1.96 2.15 -0.40 -4.86 116.67 123.57 3gyr s ASP 560 Ca 0.78 -1.83 0.15 0.00 0.43 0.00 0.00 52.55 52.08 3gyr s ASP 560 Cb -0.51 -2.25 0.87 0.00 -0.30 0.00 0.00 42.92 40.73 3gyr s ASP 560 CO 0.35 -0.91 1.34 -0.81 -0.17 0.00 0.00 175.17 174.97 3gyr n PRO 561 N 5.46 0.41 0.00 4.34 -0.04 -1.26 -2.09 135.00 141.82 3gyr n PRO 561 Ca -0.06 0.04 0.12 0.00 -0.04 0.00 0.00 63.50 63.55 3gyr n PRO 561 Cb 0.42 -1.50 0.18 0.00 -0.04 0.00 0.00 33.50 32.56 3gyr n PRO 561 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3gyr n ASP 562 N -1.07 1.04 -3.95 3.54 8.00 -1.26 -4.43 116.55 118.42 3gyr n ASP 562 Ca 0.10 -0.83 -0.31 0.00 0.71 0.00 0.00 54.79 54.46 3gyr n ASP 562 Cb 0.07 0.40 -0.09 0.00 -0.02 0.00 0.00 41.12 41.47 3gyr n ASP 562 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 3gyr n THR 563 N -0.96 2.28 -1.86 -3.53 -1.04 -0.89 -5.09 114.28 103.20 3gyr n THR 563 Ca 0.08 -5.01 -0.38 0.00 -2.04 0.00 0.00 64.05 56.70 3gyr n THR 563 Cb 0.36 -2.25 0.03 0.00 -1.82 0.00 0.00 70.33 66.65 3gyr n THR 563 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 3gyr s PRO 564 N -1.54 3.27 -0.30 -2.82 0.02 -1.26 -3.91 135.00 128.46 3gyr s PRO 564 Ca 0.27 2.17 0.02 0.00 0.02 0.00 0.00 61.00 63.48 3gyr s PRO 564 Cb -0.04 -2.30 0.08 0.00 0.02 0.00 0.00 34.50 32.26 3gyr s PRO 564 CO -0.14 -1.07 0.02 0.08 -0.33 0.00 0.00 177.00 175.56 3gyr s VAL 565 N -1.33 1.73 0.56 3.83 1.01 -1.26 -4.92 120.40 120.01 3gyr s VAL 565 Ca 0.70 -1.74 -0.18 0.00 0.00 0.00 0.00 61.98 60.75 3gyr s VAL 565 Cb -0.39 -2.16 -0.05 0.00 0.00 0.00 0.00 36.38 33.78 3gyr s VAL 565 CO 0.46 -0.42 1.07 -2.16 0.00 0.00 0.00 175.10 174.05 3gyr s PRO 566 N 1.23 3.42 0.31 2.72 0.04 -1.26 -4.41 135.00 137.04 3gyr s PRO 566 Ca 0.04 1.37 -0.28 0.00 0.04 0.00 0.00 61.00 62.17 3gyr s PRO 566 Cb -0.19 -2.04 -0.09 0.00 0.04 0.00 0.00 34.50 32.22 3gyr s PRO 566 CO -0.11 -0.75 1.12 -0.51 0.04 0.00 0.00 177.00 176.79 3gyr s LEU 567 N -4.06 4.47 0.24 -3.56 1.43 -1.26 -4.98 118.68 110.97 3gyr s LEU 567 Ca 0.67 2.30 -0.30 0.00 -1.03 0.00 0.00 54.13 55.77 3gyr s LEU 567 Cb -0.18 -3.72 -0.14 0.00 0.03 0.00 0.00 46.19 42.18 3gyr s LEU 567 CO 0.30 -0.26 1.15 0.00 0.23 0.00 0.00 176.35 177.77 3gyr n ALA 568 N 0.94 -0.07 0.26 4.21 0.00 -1.26 -4.88 120.51 119.70 3gyr n ALA 568 Ca 0.00 0.42 0.12 0.00 0.00 0.00 0.00 53.44 53.98 3gyr n ALA 568 Cb 0.45 -2.08 0.70 0.00 0.00 0.00 0.00 19.45 18.51 3gyr n ALA 568 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3gyr h PRO 569 N 2.91 0.00 -0.60 0.00 0.11 -1.94 -2.40 132.00 130.08 3gyr h PRO 569 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 3gyr h PRO 569 Cb 1.33 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.44 3gyr h PRO 569 CO 0.67 0.13 0.00 0.27 -0.21 0.00 0.00 178.00 178.86 3gyr n ASN 570 N -3.62 3.46 -1.41 -2.05 6.94 -1.26 -4.23 115.26 113.08 3gyr n ASN 570 Ca -0.02 -2.17 -0.03 0.00 -0.02 0.00 0.00 54.58 52.35 3gyr n ASN 570 Cb 0.26 -0.45 0.24 0.00 -2.36 0.00 0.00 39.78 37.47 3gyr n ASN 570 CO 0.00 0.00 0.00 -1.84 -1.03 0.00 0.00 177.26 174.39 3gyr n GLU 571 N 1.03 2.67 -0.36 -3.83 0.28 -0.90 -4.58 120.64 114.95 3gyr n GLU 571 Ca 0.20 -3.05 0.12 0.00 -0.16 0.00 0.00 57.16 54.27 3gyr n GLU 571 Cb 0.60 -1.97 0.32 0.00 1.43 0.00 0.00 31.44 31.82 3gyr n GLU 571 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 3gyr n LEU 572 N -0.71 3.89 0.00 -1.84 4.77 -1.26 -4.22 117.00 117.63 3gyr n LEU 572 Ca 0.35 -1.93 0.00 0.00 -0.03 0.00 0.00 56.01 54.40 3gyr n LEU 572 Cb 1.16 -0.47 0.00 0.00 -2.33 0.00 0.00 43.42 41.77 3gyr n LEU 572 CO 0.29 0.97 0.00 0.61 -1.33 0.00 0.00 177.39 177.92 3gyr n GLY 573 N 1.66 3.42 3.66 -0.72 0.00 -1.26 -4.80 105.19 107.15 3gyr n GLY 573 Ca 0.24 -1.76 -0.41 0.00 0.00 0.00 0.00 46.02 44.09 3gyr n GLY 573 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3gyr s HIS 574 N 3.65 3.39 0.12 1.61 3.76 -1.26 -4.51 115.29 122.05 3gyr s HIS 574 Ca 0.00 1.20 0.07 0.00 -0.15 0.00 0.00 55.06 56.18 3gyr s HIS 574 Cb 0.00 -3.00 -0.04 0.00 1.11 0.00 0.00 32.58 30.65 3gyr s HIS 574 CO 0.00 -0.27 -0.16 0.15 -0.85 0.00 0.00 174.74 173.61 3gyr s LYS 575 N 2.27 1.06 0.00 1.40 -0.14 0.31 -1.77 119.74 122.87 3gyr s LYS 575 Ca 0.37 -1.21 0.00 0.00 -1.36 0.00 0.00 55.97 53.77 3gyr s LYS 575 Cb -0.16 -1.07 0.00 0.00 -1.68 0.00 0.00 37.83 34.92 3gyr s LYS 575 CO 0.11 0.22 0.07 -0.40 -0.76 0.00 0.00 175.35 174.59 3gyr n ASP 576 N 0.71 0.14 -3.86 2.83 5.68 -1.26 -1.31 116.55 119.49 3gyr n ASP 576 Ca -0.17 -0.94 -0.23 0.00 -0.50 0.00 0.00 54.79 52.94 3gyr n ASP 576 Cb 0.56 0.01 -0.17 0.00 -1.14 0.00 0.00 41.12 40.38 3gyr n ASP 576 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 3gyr s VAL 577 N -0.01 0.67 -0.07 2.12 1.01 -1.26 -2.70 120.40 120.16 3gyr s VAL 577 Ca 0.00 -0.11 0.03 0.00 0.00 0.00 0.00 61.98 61.91 3gyr s VAL 577 Cb 0.00 -0.73 0.00 0.00 0.00 0.00 0.00 36.38 35.65 3gyr s VAL 577 CO 0.00 0.29 -0.18 -0.36 0.00 0.00 0.00 175.10 174.85 3gyr s PHE 578 N 1.52 1.91 -0.13 5.22 0.08 -0.18 -4.90 117.98 121.49 3gyr s PHE 578 Ca -0.01 -0.69 -0.29 0.00 0.12 0.00 0.00 56.93 56.05 3gyr s PHE 578 Cb -0.13 -1.31 -0.03 0.00 -0.57 0.00 0.00 43.02 40.97 3gyr s PHE 578 CO -0.04 -0.29 1.47 -0.65 -0.10 0.00 0.00 175.22 175.61 3gyr s GLN 579 N 0.38 4.14 -0.77 0.44 -0.21 -1.26 -0.46 119.66 121.92 3gyr s GLN 579 Ca -0.13 1.86 -0.04 0.00 0.02 0.00 0.00 55.36 57.07 3gyr s GLN 579 Cb -0.15 -3.90 0.20 0.00 1.00 0.00 0.00 33.01 30.15 3gyr s GLN 579 CO 0.05 -0.86 0.63 0.08 -2.12 0.00 0.00 175.29 173.07 3gyr s VAL 580 N 3.99 4.32 1.04 1.09 1.01 -0.05 -4.96 120.40 126.84 3gyr s VAL 580 Ca 0.65 -3.23 -0.14 0.00 0.00 0.00 0.00 61.98 59.26 3gyr s VAL 580 Cb -0.27 -3.73 0.21 0.00 0.00 0.00 0.00 36.38 32.60 3gyr s VAL 580 CO 0.23 -0.99 1.10 -2.16 0.00 0.00 0.00 175.10 173.29 3gyr s PRO 581 N -0.53 0.08 0.11 2.72 0.04 -1.26 -2.16 135.00 134.00 3gyr s PRO 581 Ca 0.21 0.34 -0.08 0.00 0.04 0.00 0.00 61.00 61.51 3gyr s PRO 581 Cb -0.14 -1.71 -0.01 0.00 0.04 0.00 0.00 34.50 32.68 3gyr s PRO 581 CO -0.07 -2.93 0.21 0.20 0.04 0.00 0.00 177.00 174.45 3gyr s GLY 582 N -3.62 0.26 -0.29 0.56 0.00 -1.25 -3.85 107.32 99.13 3gyr s GLY 582 Ca 0.67 -0.75 -0.25 0.00 0.00 0.00 0.00 44.72 44.38 3gyr s GLY 582 CO 0.57 -0.85 0.86 2.56 0.00 0.00 0.00 173.10 176.24 3gyr s PRO 583 N -3.90 4.03 0.06 2.90 0.04 -1.13 -4.26 135.00 132.74 3gyr s PRO 583 Ca 0.10 0.78 -0.25 0.00 0.04 0.00 0.00 61.00 61.66 3gyr s PRO 583 Cb 0.05 -3.71 0.06 0.00 0.04 0.00 0.00 34.50 30.94 3gyr s PRO 583 CO -0.07 -0.69 0.60 -1.14 0.04 0.00 0.00 177.00 175.74 3gyr s GLN 584 N 3.08 1.14 -0.05 4.56 0.74 -0.05 -2.45 119.66 126.64 3gyr s GLN 584 Ca 0.36 -0.16 0.04 0.00 0.05 0.00 0.00 55.36 55.65 3gyr s GLN 584 Cb -0.14 0.53 -0.02 0.00 1.10 0.00 0.00 33.01 34.47 3gyr s GLN 584 CO 0.12 -0.43 -0.16 0.20 -0.55 0.00 0.00 175.29 174.47 3gyr s GLY 585 N -2.01 1.49 -0.07 2.59 0.00 0.87 -0.75 107.32 109.43 3gyr s GLY 585 Ca -0.05 -1.00 0.04 0.00 0.00 0.00 0.00 44.72 43.71 3gyr s GLY 585 CO -0.02 -0.77 -0.19 -2.27 0.00 0.00 0.00 173.10 169.85 3gyr s LEU 586 N -0.67 1.90 -0.22 0.66 2.96 0.80 -1.53 118.68 122.58 3gyr s LEU 586 Ca 0.10 -0.43 -0.05 0.00 -0.22 0.00 0.00 54.13 53.54 3gyr s LEU 586 Cb -0.11 -1.12 -0.02 0.00 0.50 0.00 0.00 46.19 45.44 3gyr s LEU 586 CO 0.00 0.12 -0.02 -0.13 -1.32 0.00 0.00 176.35 175.01 3gyr s ARG 587 N 0.36 3.47 0.13 1.98 0.52 0.33 -0.72 118.95 125.02 3gyr s ARG 587 Ca -0.13 -0.58 0.09 0.00 -0.52 0.00 0.00 55.73 54.59 3gyr s ARG 587 Cb -0.16 -3.07 -0.04 0.00 0.52 0.00 0.00 34.95 32.20 3gyr s ARG 587 CO 0.06 -0.15 -0.23 0.14 0.02 0.00 0.00 175.30 175.14 3gyr s VAL 588 N 1.40 1.95 -0.00 3.52 -7.23 -0.12 -0.01 120.40 119.91 3gyr s VAL 588 Ca 0.05 -1.72 0.03 0.00 -1.81 0.00 0.00 61.98 58.53 3gyr s VAL 588 Cb -0.14 -1.79 -0.01 0.00 0.56 0.00 0.00 36.38 35.00 3gyr s VAL 588 CO -0.01 -0.07 -0.11 -0.32 -0.31 0.00 0.00 175.10 174.29 3gyr s MET 589 N -2.17 0.83 0.06 4.82 1.75 -0.37 -0.73 119.30 123.49 3gyr s MET 589 Ca 0.12 -0.43 -0.18 0.00 -1.25 0.00 0.00 55.69 53.95 3gyr s MET 589 Cb -0.09 -0.80 0.04 0.00 2.84 0.00 0.00 34.83 36.82 3gyr s MET 589 CO 0.06 0.21 0.41 0.20 -0.65 0.00 0.00 175.02 175.26 3gyr s GLY 590 N -0.40 -0.28 -0.20 2.11 0.00 -0.63 -1.03 107.32 106.90 3gyr s GLY 590 Ca 0.03 0.23 -0.05 0.00 0.00 0.00 0.00 44.72 44.93 3gyr s GLY 590 CO -0.00 -0.03 0.01 1.25 0.00 0.00 0.00 173.10 174.33 3gyr s LYS 591 N -2.81 3.67 -0.78 2.90 2.20 -1.25 -1.55 119.74 122.12 3gyr s LYS 591 Ca -0.03 -0.50 -0.16 0.00 -0.36 0.00 0.00 55.97 54.93 3gyr s LYS 591 Cb -0.00 -3.10 0.18 0.00 -1.51 0.00 0.00 37.83 33.40 3gyr s LYS 591 CO -0.05 0.06 0.80 -0.06 -0.36 0.00 0.00 175.35 175.73 3gyr s PHE 592 N 0.90 3.49 -0.01 4.03 0.08 -0.35 -4.44 117.98 121.67 3gyr s PHE 592 Ca 0.01 -1.67 0.01 0.00 0.12 0.00 0.00 56.93 55.40 3gyr s PHE 592 Cb -0.14 -3.93 0.01 0.00 -0.57 0.00 0.00 43.02 38.39 3gyr s PHE 592 CO 0.02 -1.13 -0.02 0.34 -0.10 0.00 0.00 175.22 174.34 3gyr s ASP 593 N 2.79 0.37 0.00 1.36 2.15 -1.26 0.95 116.67 123.03 3gyr s ASP 593 Ca 0.18 -0.04 0.00 0.00 0.43 0.00 0.00 52.55 53.12 3gyr s ASP 593 Cb -0.13 -0.11 0.00 0.00 -0.30 0.00 0.00 42.92 42.37 3gyr s ASP 593 CO -0.06 -0.02 0.00 0.61 -0.17 0.00 0.00 175.17 175.53 3gyr n GLY 594 N 3.48 0.53 3.58 2.66 0.00 -1.26 -4.95 105.19 109.23 3gyr n GLY 594 Ca -0.19 -0.41 -0.05 0.00 0.00 0.00 0.00 46.02 45.38 3gyr n GLY 594 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gyr s ALA 595 N -2.00 -2.02 0.35 4.61 0.00 -1.26 -4.76 121.76 116.68 3gyr s ALA 595 Ca 0.00 1.33 0.06 0.00 0.00 0.00 0.00 51.96 53.36 3gyr s ALA 595 Cb 0.00 0.08 -0.07 0.00 0.00 0.00 0.00 23.12 23.13 3gyr s ALA 595 CO 0.00 -0.67 -0.01 0.71 0.00 0.00 0.00 175.76 175.79 3gyr s TYR 596 N -2.61 2.22 0.00 0.00 2.02 -1.26 -4.86 117.35 112.85 3gyr s TYR 596 Ca 0.09 -0.73 0.00 0.00 -0.37 0.00 0.00 57.07 56.06 3gyr s TYR 596 Cb -0.00 -1.43 0.00 0.00 -0.40 0.00 0.00 41.96 40.13 3gyr s TYR 596 CO -0.05 0.31 0.00 0.41 -1.57 0.00 0.00 175.55 174.65 3gyr n GLY 597 N -0.77 0.28 3.40 0.71 0.00 0.12 -0.96 105.19 107.97 3gyr n GLY 597 Ca -0.04 -2.16 -0.34 0.00 0.00 0.00 0.00 46.02 43.48 3gyr n GLY 597 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3gyr s ARG 598 N 0.00 3.49 0.31 1.61 3.52 -1.26 -0.51 118.95 126.10 3gyr s ARG 598 Ca 0.00 -0.61 0.03 0.00 -0.13 0.00 0.00 55.73 55.02 3gyr s ARG 598 Cb 0.00 -2.84 -0.01 0.00 -1.56 0.00 0.00 34.95 30.54 3gyr s ARG 598 CO 0.00 0.11 0.10 1.19 -0.81 0.00 0.00 175.30 175.90 3gyr n PHE 599 N 3.87 0.13 -4.39 5.12 3.72 0.18 -4.59 117.46 121.50 3gyr n PHE 599 Ca -0.18 -1.95 -0.23 0.00 -0.05 0.00 0.00 57.45 55.04 3gyr n PHE 599 Cb 0.52 -0.01 -0.11 0.00 -0.94 0.00 0.00 39.48 38.94 3gyr n PHE 599 CO 0.00 0.00 0.00 -1.64 -0.05 0.00 0.00 176.76 175.07 3gyr s MET 600 N -3.17 1.45 0.05 -1.08 -1.94 -1.26 -1.62 119.30 111.73 3gyr s MET 600 Ca 0.15 -1.56 0.01 0.00 -1.71 0.00 0.00 55.69 52.58 3gyr s MET 600 Cb 0.01 -1.56 -0.03 0.00 2.01 0.00 0.00 34.83 35.26 3gyr s MET 600 CO 0.10 0.31 -0.05 1.52 -0.01 0.00 0.00 175.02 176.89 3gyr s TYR 601 N -2.18 0.57 0.01 -0.03 -0.85 0.09 -1.61 117.35 113.35 3gyr s TYR 601 Ca 0.22 -0.69 -0.29 0.00 -0.52 0.00 0.00 57.07 55.78 3gyr s TYR 601 Cb -0.06 -0.36 0.11 0.00 0.38 0.00 0.00 41.96 42.03 3gyr s TYR 601 CO 0.10 -0.18 1.17 -3.38 -1.52 0.00 0.00 175.55 171.73 3gyr s HIS 602 N -2.29 -0.09 0.25 -3.49 -3.43 -0.14 -0.73 115.29 105.37 3gyr s HIS 602 Ca -0.05 -0.06 -0.30 0.00 -0.80 0.00 0.00 55.06 53.86 3gyr s HIS 602 Cb -0.04 0.57 -0.09 0.00 -1.43 0.00 0.00 32.58 31.59 3gyr s HIS 602 CO -0.03 -0.43 1.07 0.00 -2.00 0.00 0.00 174.74 173.35 3gyr n HIS 604 N 1.49 1.75 -2.96 0.00 -0.00 0.41 -4.31 115.22 111.60 3gyr n HIS 604 Ca -0.01 -0.78 -0.43 0.00 0.46 0.00 0.00 57.72 56.96 3gyr n HIS 604 Cb 0.45 -0.50 -0.05 0.00 -0.12 0.00 0.00 29.99 29.77 3gyr n HIS 604 CO 0.00 0.00 0.00 -0.51 0.46 0.00 0.00 176.34 176.29 3gyr s LEU 605 N -2.17 4.37 0.35 0.27 1.43 -1.26 -4.71 118.68 116.96 3gyr s LEU 605 Ca 0.41 -0.44 0.09 0.00 -1.03 0.00 0.00 54.13 53.16 3gyr s LEU 605 Cb 0.32 -2.75 0.82 0.00 0.03 0.00 0.00 46.19 44.61 3gyr s LEU 605 CO 0.11 -1.06 1.86 -0.07 0.23 0.00 0.00 176.35 177.42 3gyr h LEU 606 N 10.42 0.66 -1.09 1.79 3.38 -1.24 0.67 115.31 129.91 3gyr h LEU 606 Ca -0.26 0.04 0.02 0.00 0.09 0.00 0.00 57.88 57.77 3gyr h LEU 606 Cb 1.08 -0.08 -0.05 0.00 0.09 0.00 0.00 40.66 41.70 3gyr h LEU 606 CO 1.02 0.32 0.62 -0.33 0.09 0.00 0.00 178.44 180.16 3gyr h GLU 607 N 0.69 1.19 0.05 1.13 3.07 -1.93 0.05 114.58 118.83 3gyr h GLU 607 Ca 0.46 -0.07 -0.23 0.00 -0.50 0.00 0.00 59.36 59.02 3gyr h GLU 607 Cb 0.75 -0.27 -0.00 0.00 -0.84 0.00 0.00 28.75 28.39 3gyr h GLU 607 CO -0.22 0.79 -1.03 0.45 -1.40 0.00 0.00 179.01 177.60 3gyr h HIS 608 N 1.22 0.47 -0.96 4.33 3.86 -0.08 -2.92 115.15 121.08 3gyr h HIS 608 Ca 0.35 -0.29 0.02 0.00 -1.16 0.00 0.00 60.37 59.30 3gyr h HIS 608 Cb -0.08 -0.04 -0.05 0.00 1.06 0.00 0.00 27.41 28.30 3gyr h HIS 608 CO -0.00 1.15 0.63 1.49 0.86 0.00 0.00 177.93 182.06 3gyr h GLU 609 N 0.14 1.22 0.00 2.45 4.81 -0.81 -1.44 114.58 120.95 3gyr h GLU 609 Ca -0.09 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.07 3gyr h GLU 609 Cb 1.70 -0.28 0.00 0.00 0.63 0.00 0.00 28.75 30.81 3gyr h GLU 609 CO 0.17 0.81 0.00 -0.44 -0.73 0.00 0.00 179.01 178.82 3gyr h ASP 610 N 1.26 0.00 -1.42 1.04 3.32 -0.87 -3.19 116.42 116.55 3gyr h ASP 610 Ca 0.37 0.00 -0.65 0.00 0.02 0.00 0.00 57.03 56.76 3gyr h ASP 610 Cb -0.08 0.00 -0.35 0.00 0.22 0.00 0.00 39.33 39.12 3gyr h ASP 610 CO -0.10 0.00 0.08 0.23 -1.72 0.00 0.00 179.24 177.73 3gyr n MET 611 N -2.57 3.13 0.00 3.56 2.81 -0.60 -4.58 117.12 118.87 3gyr n MET 611 Ca 0.03 -3.93 0.00 0.00 -1.81 0.00 0.00 57.70 51.99 3gyr n MET 611 Cb 0.38 -2.27 0.00 0.00 -0.71 0.00 0.00 33.22 30.62 3gyr n MET 611 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3gyr n GLY 612 N -0.62 1.87 2.56 3.03 0.00 -1.18 -4.92 105.19 105.94 3gyr n GLY 612 Ca 0.49 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.28 3gyr n GLY 612 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 3gyr n MET 613 N -2.00 2.16 -3.69 1.61 0.00 -0.88 -2.13 117.12 112.20 3gyr n MET 613 Ca 0.00 -1.46 -0.14 0.00 -0.00 0.00 0.00 57.70 56.09 3gyr n MET 613 Cb 0.00 -2.44 -0.08 0.00 0.00 0.00 0.00 33.22 30.70 3gyr n MET 613 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 175.97 177.38 3gyr s MET 614 N 3.22 0.70 0.00 2.12 0.00 -1.26 -2.32 119.30 121.75 3gyr s MET 614 Ca 0.42 0.33 -0.02 0.00 0.00 0.00 0.00 55.69 56.42 3gyr s MET 614 Cb 0.11 0.33 -0.01 0.00 0.00 0.00 0.00 34.83 35.26 3gyr s MET 614 CO -0.03 -0.15 0.04 1.03 0.00 0.00 0.00 175.02 175.90 3gyr s ARG 615 N -0.50 0.28 0.56 4.11 1.81 0.09 -2.57 118.95 122.73 3gyr s ARG 615 Ca -0.06 -0.34 -0.09 0.00 -1.72 0.00 0.00 55.73 53.52 3gyr s ARG 615 Cb -0.03 0.11 -0.04 0.00 -0.45 0.00 0.00 34.95 34.54 3gyr s ARG 615 CO 0.04 -0.05 0.92 -1.25 -0.68 0.00 0.00 175.30 174.28 3gyr s PRO 616 N -0.97 3.58 0.07 3.54 0.04 -1.26 -0.73 135.00 139.27 3gyr s PRO 616 Ca -0.11 0.52 -0.11 0.00 0.04 0.00 0.00 61.00 61.34 3gyr s PRO 616 Cb -0.06 -2.21 0.01 0.00 0.04 0.00 0.00 34.50 32.28 3gyr s PRO 616 CO -0.00 -0.41 0.25 -0.59 0.04 0.00 0.00 177.00 176.29 3gyr s PHE 617 N -2.99 0.01 -0.10 0.56 -0.71 -0.64 -4.50 117.98 109.62 3gyr s PHE 617 Ca 0.52 -0.30 0.03 0.00 -1.04 0.00 0.00 56.93 56.14 3gyr s PHE 617 Cb -0.11 0.03 0.01 0.00 -1.21 0.00 0.00 43.02 41.74 3gyr s PHE 617 CO 0.50 -0.52 -0.18 0.08 -1.34 0.00 0.00 175.22 173.75 3gyr s VAL 618 N -3.18 1.67 -0.20 -2.49 1.01 0.30 -0.64 120.40 116.87 3gyr s VAL 618 Ca -0.00 -0.78 -0.02 0.00 0.00 0.00 0.00 61.98 61.18 3gyr s VAL 618 Cb 0.02 -1.48 -0.00 0.00 0.00 0.00 0.00 36.38 34.91 3gyr s VAL 618 CO -0.07 0.47 -0.09 -0.69 0.00 0.00 0.00 175.10 174.72 3gyr s VAL 619 N 0.63 3.04 0.12 2.92 1.01 0.33 0.23 120.40 128.68 3gyr s VAL 619 Ca -0.14 -0.62 0.04 0.00 0.00 0.00 0.00 61.98 61.26 3gyr s VAL 619 Cb -0.16 -2.35 -0.04 0.00 0.00 0.00 0.00 36.38 33.83 3gyr s VAL 619 CO 0.04 0.47 -0.09 0.00 0.00 0.00 0.00 175.10 175.51 3gyr s MET 620 N 1.24 0.94 0.29 2.72 0.23 -0.57 0.13 119.30 124.27 3gyr s MET 620 Ca 0.03 -1.32 -0.30 0.00 -1.03 0.00 0.00 55.69 53.07 3gyr s MET 620 Cb -0.14 -0.50 -0.13 0.00 -1.53 0.00 0.00 34.83 32.53 3gyr s MET 620 CO -0.04 0.06 1.35 -2.30 -2.03 0.00 0.00 175.02 172.06 3gyr n PRO 621 N 0.10 2.07 -0.29 3.16 -0.02 -1.26 -0.30 135.00 138.45 3gyr n PRO 621 Ca -0.13 0.73 0.21 0.00 -2.02 0.00 0.00 63.50 62.29 3gyr n PRO 621 Cb 0.60 -2.35 0.50 0.00 -0.02 0.00 0.00 33.50 32.23 3gyr n PRO 621 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 3gyr h PRO 622 N 3.45 0.41 -0.15 0.52 0.11 -1.91 0.40 132.00 134.83 3gyr h PRO 622 Ca -0.45 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.60 3gyr h PRO 622 Cb 1.28 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 3gyr h PRO 622 CO 0.70 0.27 -0.08 0.93 -0.21 0.00 0.00 178.00 179.61 3gyr h GLU 623 N 0.42 0.22 0.00 1.05 3.07 -1.97 -2.47 114.58 114.90 3gyr h GLU 623 Ca 0.54 -0.04 -0.04 0.00 -0.50 0.00 0.00 59.36 59.32 3gyr h GLU 623 Cb 1.33 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 29.20 3gyr h GLU 623 CO -0.24 0.32 -0.45 0.00 -1.40 0.00 0.00 179.01 177.24 3gyr h ALA 624 N 1.71 0.79 -0.10 3.43 0.00 -1.28 -3.13 119.26 120.68 3gyr h ALA 624 Ca 0.05 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 3gyr h ALA 624 Cb 0.28 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 3gyr h ALA 624 CO 0.01 0.22 -0.08 1.25 0.00 0.00 0.00 179.25 180.66 3gyr h LEU 625 N 0.00 0.13 -2.20 0.00 5.85 -0.98 -0.55 115.31 117.56 3gyr h LEU 625 Ca -0.01 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.69 3gyr h LEU 625 Cb 1.14 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.14 3gyr h LEU 625 CO 0.02 0.23 0.18 0.11 -0.34 0.00 0.00 178.44 178.64 3gyr h LYS 626 N 0.14 0.00 -0.41 1.25 1.79 -1.52 -0.27 116.57 117.56 3gyr h LYS 626 Ca 0.03 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.50 3gyr h LYS 626 Cb 0.23 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.88 3gyr h LYS 626 CO 0.01 0.00 0.00 1.19 -1.08 0.00 0.00 179.45 179.57 3gyr n PHE 627 N -2.82 0.90 -0.47 -1.35 3.72 -0.22 -5.18 117.46 112.05 3gyr n PHE 627 Ca -0.02 -0.65 0.00 0.00 -0.05 0.00 0.00 57.45 56.73 3gyr n PHE 627 Cb 0.23 -0.18 0.00 0.00 -0.94 0.00 0.00 39.48 38.60 3gyr n PHE 627 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24