#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fun s ASP 5 N 0.00 5.78 0.00 -1.34 -1.08 -1.26 -4.92 116.67 113.85 3fun s ASP 5 Ca 0.00 -1.39 0.14 0.00 -0.52 0.00 0.00 52.55 50.78 3fun s ASP 5 Cb 0.00 -2.04 0.67 0.00 -1.46 0.00 0.00 42.92 40.08 3fun s ASP 5 CO 0.00 -0.54 1.38 0.35 0.52 0.00 0.00 175.17 176.88 3fun n THR 6 N 5.00 0.73 1.11 1.71 -2.24 -1.26 -2.08 114.28 117.26 3fun n THR 6 Ca -0.11 0.18 0.12 0.00 -2.27 0.00 0.00 64.05 61.97 3fun n THR 6 Cb 0.44 -0.95 0.18 0.00 -2.10 0.00 0.00 70.33 67.89 3fun n THR 6 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3fun s SER 8 N -2.58 3.98 0.00 0.00 0.15 -0.88 -4.92 113.70 109.45 3fun s SER 8 Ca 0.20 -0.26 0.23 0.00 0.70 0.00 0.00 55.95 56.82 3fun s SER 8 Cb 0.18 -0.79 0.14 0.00 -1.71 0.00 0.00 66.02 63.84 3fun s SER 8 CO 0.59 0.32 1.16 0.18 1.20 0.00 0.00 173.24 176.69 3fun n LEU 9 N 2.08 1.28 -4.79 3.45 4.77 -1.26 -4.88 117.00 117.65 3fun n LEU 9 Ca -0.17 -0.47 -0.30 0.00 -0.03 0.00 0.00 56.01 55.04 3fun n LEU 9 Cb 0.52 -0.06 0.09 0.00 -2.33 0.00 0.00 43.42 41.64 3fun n LEU 9 CO 0.26 0.26 0.70 0.00 -1.33 0.00 0.00 177.39 177.29 3fun s ALA 10 N -2.73 2.24 0.26 -1.18 0.00 -1.26 -4.74 121.76 114.35 3fun s ALA 10 Ca 0.15 -0.08 -0.31 0.00 0.00 0.00 0.00 51.96 51.72 3fun s ALA 10 Cb 0.18 -3.15 -0.13 0.00 0.00 0.00 0.00 23.12 20.02 3fun s ALA 10 CO 0.68 -1.71 1.46 0.43 0.00 0.00 0.00 175.76 176.62 3fun n SER 11 N -3.44 3.08 -4.76 0.00 7.64 0.39 -4.94 113.62 111.60 3fun n SER 11 Ca 0.07 1.14 -0.29 0.00 1.01 0.00 0.00 58.87 60.81 3fun n SER 11 Cb 0.55 -1.48 0.14 0.00 -1.01 0.00 0.00 64.21 62.42 3fun n SER 11 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 3fun s PRO 12 N -0.44 1.02 0.63 1.43 0.04 -1.26 -4.79 135.00 131.62 3fun s PRO 12 Ca 0.67 0.39 0.41 0.00 0.04 0.00 0.00 61.00 62.50 3fun s PRO 12 Cb -0.60 -1.82 2.06 0.00 0.04 0.00 0.00 34.50 34.18 3fun s PRO 12 CO 0.49 -2.30 2.24 0.00 0.04 0.00 0.00 177.00 177.47 3fun h ALA 13 N -1.58 1.02 0.00 8.56 0.00 -1.91 -0.83 119.26 124.52 3fun h ALA 13 Ca -0.51 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.39 3fun h ALA 13 Cb 1.33 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.11 3fun h ALA 13 CO 0.60 0.01 0.00 0.66 0.00 0.00 0.00 179.25 180.52 3fun h SER 14 N 0.00 0.00 0.00 0.00 4.64 -1.96 -3.33 113.55 112.90 3fun h SER 14 Ca -0.00 0.00 -0.42 0.00 -0.47 0.00 0.00 61.79 60.90 3fun h SER 14 Cb 0.17 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.20 3fun h SER 14 CO 0.00 0.00 -2.41 0.52 -0.87 0.00 0.00 176.83 174.07 3fun n VAL 15 N -2.34 1.39 -3.48 0.95 0.31 -0.35 -4.55 118.33 110.26 3fun n VAL 15 Ca 0.03 -0.38 -0.13 0.00 -0.01 0.00 0.00 64.34 63.85 3fun n VAL 15 Cb 0.32 -1.77 -0.03 0.00 -0.91 0.00 0.00 33.84 31.45 3fun n VAL 15 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3fun s ARG 17 N -3.20 1.13 0.03 0.00 0.52 -0.23 -4.01 118.95 113.19 3fun s ARG 17 Ca -0.01 -0.19 -0.30 0.00 -0.52 0.00 0.00 55.73 54.70 3fun s ARG 17 Cb -0.00 -1.09 -0.06 0.00 0.52 0.00 0.00 34.95 34.32 3fun s ARG 17 CO -0.08 -0.09 1.32 0.99 0.02 0.00 0.00 175.30 177.46 3fun s THR 18 N 1.02 3.79 -0.17 0.02 2.01 -1.26 -0.44 115.64 120.60 3fun s THR 18 Ca -0.09 1.23 0.18 0.00 0.31 0.00 0.00 61.69 63.32 3fun s THR 18 Cb -0.14 -3.79 -0.25 0.00 0.01 0.00 0.00 72.50 68.33 3fun s THR 18 CO -0.00 0.04 0.11 0.29 -0.69 0.00 0.00 174.62 174.38 3fun n LYS 19 N 4.67 0.79 -3.63 4.92 4.76 0.68 -4.32 118.16 126.03 3fun n LYS 19 Ca 0.11 -0.03 -0.15 0.00 -2.87 0.00 0.00 58.31 55.37 3fun n LYS 19 Cb 0.44 -1.50 -0.07 0.00 -1.84 0.00 0.00 35.03 32.06 3fun n LYS 19 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 3fun s HIS 20 N -2.59 -0.56 -0.11 2.13 2.46 -1.19 -1.81 115.29 113.62 3fun s HIS 20 Ca -0.09 1.14 0.03 0.00 0.47 0.00 0.00 55.06 56.60 3fun s HIS 20 Cb 0.07 0.27 0.01 0.00 -0.13 0.00 0.00 32.58 32.79 3fun s HIS 20 CO 0.81 -0.44 -0.20 -1.17 -2.47 0.00 0.00 174.74 171.27 3fun s LEU 21 N -0.60 1.95 -0.31 8.88 2.96 -0.58 -0.74 118.68 130.25 3fun s LEU 21 Ca -0.07 -0.51 -0.07 0.00 -0.22 0.00 0.00 54.13 53.26 3fun s LEU 21 Cb -0.03 -1.27 0.02 0.00 0.50 0.00 0.00 46.19 45.41 3fun s LEU 21 CO 0.05 0.08 0.09 -2.28 -1.32 0.00 0.00 176.35 172.97 3fun s HIS 22 N 0.70 3.17 -0.22 5.38 5.65 0.01 -1.10 115.29 128.88 3fun s HIS 22 Ca -0.11 -1.08 -0.07 0.00 0.25 0.00 0.00 55.06 54.05 3fun s HIS 22 Cb -0.16 -2.26 -0.03 0.00 -1.18 0.00 0.00 32.58 28.95 3fun s HIS 22 CO 0.02 -0.61 0.05 -1.17 -0.65 0.00 0.00 174.74 172.38 3fun s LEU 23 N 1.48 3.48 -0.22 8.88 2.96 -0.12 -1.20 118.68 133.93 3fun s LEU 23 Ca 0.02 -0.14 0.02 0.00 -0.22 0.00 0.00 54.13 53.80 3fun s LEU 23 Cb -0.18 -1.91 0.04 0.00 0.50 0.00 0.00 46.19 44.64 3fun s LEU 23 CO 0.03 0.03 -0.15 -0.60 -1.32 0.00 0.00 176.35 174.34 3fun s ARG 24 N 1.20 2.61 0.17 1.98 3.52 -0.37 -0.40 118.95 127.66 3fun s ARG 24 Ca 0.04 -1.09 -0.09 0.00 -0.13 0.00 0.00 55.73 54.46 3fun s ARG 24 Cb -0.14 -2.75 -0.01 0.00 -1.56 0.00 0.00 34.95 30.48 3fun s ARG 24 CO 0.03 -0.40 0.29 0.00 -0.81 0.00 0.00 175.30 174.41 3fun s SER 26 N -2.98 1.66 -0.40 0.00 0.15 0.10 -0.60 113.70 111.62 3fun s SER 26 Ca 0.19 -0.26 -0.14 0.00 0.70 0.00 0.00 55.95 56.44 3fun s SER 26 Cb 0.03 -0.31 0.02 0.00 -1.71 0.00 0.00 66.02 64.05 3fun s SER 26 CO 0.02 0.14 0.28 -0.69 1.20 0.00 0.00 173.24 174.19 3fun s VAL 27 N -0.12 5.17 -0.51 4.45 1.01 -0.37 -1.70 120.40 128.32 3fun s VAL 27 Ca 0.01 -0.63 -0.12 0.00 0.00 0.00 0.00 61.98 61.24 3fun s VAL 27 Cb -0.08 -3.85 0.13 0.00 0.00 0.00 0.00 36.38 32.58 3fun s VAL 27 CO 0.00 -0.26 0.42 -0.62 0.00 0.00 0.00 175.10 174.65 3fun s ASP 28 N 1.67 5.94 0.44 3.32 -1.08 0.16 -4.67 116.67 122.44 3fun s ASP 28 Ca 0.05 -1.89 0.23 0.00 -0.52 0.00 0.00 52.55 50.41 3fun s ASP 28 Cb -0.19 -2.10 0.95 0.00 -1.46 0.00 0.00 42.92 40.12 3fun s ASP 28 CO 0.10 -0.76 1.85 -0.26 0.52 0.00 0.00 175.17 176.61 3fun h PHE 29 N 8.61 0.00 -0.33 -5.34 0.04 -1.96 0.50 116.94 118.45 3fun h PHE 29 Ca -0.24 0.00 -0.10 0.00 2.80 0.00 0.00 57.97 60.43 3fun h PHE 29 Cb 1.08 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.22 3fun h PHE 29 CO 0.69 0.25 -0.20 1.79 -0.60 0.00 0.00 178.31 180.24 3fun h THR 30 N 0.00 1.26 -0.01 -1.55 1.35 -1.96 -3.20 112.91 108.81 3fun h THR 30 Ca -0.00 -1.25 0.00 0.00 -0.55 0.00 0.00 66.41 64.61 3fun h THR 30 Cb 0.70 1.23 0.00 0.00 -1.73 0.00 0.00 68.15 68.35 3fun h THR 30 CO 0.03 0.41 -0.55 0.54 -0.25 0.00 0.00 175.52 175.70 3fun n ARG 31 N -4.13 1.39 -3.77 4.72 1.74 -1.11 -4.98 116.66 110.51 3fun n ARG 31 Ca 0.00 -0.57 -0.23 0.00 -0.77 0.00 0.00 57.85 56.28 3fun n ARG 31 Cb 0.40 -1.35 0.02 0.00 -1.02 0.00 0.00 32.46 30.51 3fun n ARG 31 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3fun n ARG 32 N -0.55 -4.78 -4.17 5.56 1.74 0.11 -4.66 116.66 109.91 3fun n ARG 32 Ca 0.06 0.59 -0.18 0.00 -0.77 0.00 0.00 57.85 57.55 3fun n ARG 32 Cb 0.35 -5.14 -0.12 0.00 -1.02 0.00 0.00 32.46 26.53 3fun n ARG 32 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 3fun s THR 33 N -3.65 1.10 -0.19 0.55 -4.23 -0.87 -3.37 115.64 104.97 3fun s THR 33 Ca 0.11 -1.31 -0.07 0.00 -1.18 0.00 0.00 61.69 59.24 3fun s THR 33 Cb -0.06 -1.07 -0.04 0.00 1.34 0.00 0.00 72.50 72.68 3fun s THR 33 CO 0.83 -0.24 0.05 -0.22 -0.54 0.00 0.00 174.62 174.49 3fun s LEU 34 N -1.76 3.62 0.03 4.79 0.20 -1.26 -0.67 118.68 123.63 3fun s LEU 34 Ca -0.02 -0.03 0.08 0.00 0.69 0.00 0.00 54.13 54.85 3fun s LEU 34 Cb -0.10 -1.92 -0.02 0.00 -0.43 0.00 0.00 46.19 43.72 3fun s LEU 34 CO 0.02 0.12 -0.22 -0.89 -0.29 0.00 0.00 176.35 175.09 3fun s THR 35 N 0.68 1.79 -3.69 3.68 2.01 -0.69 -0.77 115.64 118.64 3fun s THR 35 Ca 0.02 -1.20 0.00 0.00 0.31 0.00 0.00 61.69 60.82 3fun s THR 35 Cb -0.13 -1.54 0.00 0.00 0.01 0.00 0.00 72.50 70.84 3fun s THR 35 CO 0.02 0.29 0.00 0.61 -0.69 0.00 0.00 174.62 174.85 3fun n GLY 36 N 1.94 -0.52 3.05 4.40 0.00 -0.54 -0.72 105.19 112.81 3fun n GLY 36 Ca -0.17 -0.67 -0.22 0.00 0.00 0.00 0.00 46.02 44.97 3fun n GLY 36 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3fun s THR 37 N -4.00 0.97 -0.31 2.61 -4.23 0.19 -1.14 115.64 109.73 3fun s THR 37 Ca 0.00 -0.48 -0.04 0.00 -1.18 0.00 0.00 61.69 59.98 3fun s THR 37 Cb 0.00 -0.84 0.04 0.00 1.34 0.00 0.00 72.50 73.04 3fun s THR 37 CO 0.00 0.29 0.05 0.00 -0.54 0.00 0.00 174.62 174.42 3fun s ALA 38 N 0.00 2.93 -0.43 3.99 0.00 -0.43 -1.24 121.76 126.58 3fun s ALA 38 Ca -0.01 -1.71 -0.17 0.00 0.00 0.00 0.00 51.96 50.08 3fun s ALA 38 Cb -0.08 -2.09 0.03 0.00 0.00 0.00 0.00 23.12 20.99 3fun s ALA 38 CO 0.00 -1.24 0.42 0.00 0.00 0.00 0.00 175.76 174.94 3fun s ALA 39 N 1.34 3.45 -0.26 0.00 0.00 -0.34 -0.67 121.76 125.29 3fun s ALA 39 Ca -0.03 -1.66 -0.13 0.00 0.00 0.00 0.00 51.96 50.14 3fun s ALA 39 Cb -0.19 -3.05 -0.04 0.00 0.00 0.00 0.00 23.12 19.83 3fun s ALA 39 CO 0.01 -1.62 0.26 -0.51 0.00 0.00 0.00 175.76 173.90 3fun s LEU 40 N 2.02 4.06 -0.34 0.00 1.43 -0.06 -0.81 118.68 124.98 3fun s LEU 40 Ca 0.10 0.17 -0.24 0.00 -1.03 0.00 0.00 54.13 53.13 3fun s LEU 40 Cb -0.19 -2.25 0.01 0.00 0.03 0.00 0.00 46.19 43.79 3fun s LEU 40 CO 0.12 -0.07 0.82 -0.89 0.23 0.00 0.00 176.35 176.56 3fun s THR 41 N 1.63 4.72 -0.07 5.49 2.01 0.09 -0.89 115.64 128.62 3fun s THR 41 Ca 0.11 1.07 0.05 0.00 0.31 0.00 0.00 61.69 63.23 3fun s THR 41 Cb -0.15 -4.21 -0.01 0.00 0.01 0.00 0.00 72.50 68.13 3fun s THR 41 CO 0.09 -0.39 -0.23 -0.69 -0.69 0.00 0.00 174.62 172.71 3fun s VAL 42 N 3.13 2.23 -0.24 3.82 1.01 0.46 -0.23 120.40 130.57 3fun s VAL 42 Ca 0.33 -1.00 -0.07 0.00 0.00 0.00 0.00 61.98 61.24 3fun s VAL 42 Cb -0.13 -1.83 -0.03 0.00 0.00 0.00 0.00 36.38 34.39 3fun s VAL 42 CO 0.16 0.57 0.06 -1.58 0.00 0.00 0.00 175.10 174.30 3fun s GLN 43 N -0.14 3.65 0.40 2.72 0.74 0.41 -1.35 119.66 126.08 3fun s GLN 43 Ca -0.04 -0.48 -0.26 0.00 0.05 0.00 0.00 55.36 54.63 3fun s GLN 43 Cb -0.14 -3.29 -0.09 0.00 1.10 0.00 0.00 33.01 30.60 3fun s GLN 43 CO 0.04 -0.16 1.29 0.45 -0.55 0.00 0.00 175.29 176.36 3fun s SER 44 N 1.52 6.36 0.00 6.67 0.15 -0.16 -1.07 113.70 127.18 3fun s SER 44 Ca 0.06 2.64 0.08 0.00 0.70 0.00 0.00 55.95 59.43 3fun s SER 44 Cb -0.15 -2.64 0.23 0.00 -1.71 0.00 0.00 66.02 61.75 3fun s SER 44 CO 0.03 -0.81 1.17 0.00 1.20 0.00 0.00 173.24 174.83 3fun n GLN 45 N 0.18 2.75 -4.17 5.44 1.13 0.84 -0.25 117.38 123.29 3fun n GLN 45 Ca 0.03 -1.87 -0.16 0.00 -1.94 0.00 0.00 57.00 53.06 3fun n GLN 45 Cb 0.44 -1.21 -0.11 0.00 0.11 0.00 0.00 30.24 29.47 3fun n GLN 45 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 3fun s GLU 46 N -0.98 0.81 0.54 -1.09 2.02 -1.22 -4.81 118.70 113.98 3fun s GLU 46 Ca 0.17 -1.05 -0.19 0.00 0.02 0.00 0.00 54.97 53.93 3fun s GLU 46 Cb 0.09 -0.64 -0.06 0.00 0.10 0.00 0.00 34.13 33.63 3fun s GLU 46 CO 0.12 0.12 1.08 0.34 0.02 0.00 0.00 175.26 176.94 3fun s ASP 47 N -2.10 5.89 -1.51 -0.19 2.15 -1.26 -2.68 116.67 116.97 3fun s ASP 47 Ca 0.01 2.01 -0.11 0.00 0.43 0.00 0.00 52.55 54.89 3fun s ASP 47 Cb -0.06 -2.56 0.08 0.00 -0.30 0.00 0.00 42.92 40.07 3fun s ASP 47 CO 0.01 -1.10 0.89 -3.20 -0.17 0.00 0.00 175.17 171.60 3fun n ASN 48 N -1.41 -3.80 -4.67 -0.34 5.15 -0.01 -4.91 115.26 105.28 3fun n ASN 48 Ca 0.10 -0.82 -0.43 0.00 -0.60 0.00 0.00 54.58 52.83 3fun n ASN 48 Cb 0.52 -3.74 -0.02 0.00 -0.53 0.00 0.00 39.78 36.00 3fun n ASN 48 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 3fun s LEU 49 N -7.17 4.21 0.00 1.20 2.96 -0.36 -4.72 118.68 114.80 3fun s LEU 49 Ca 0.53 1.75 0.01 0.00 -0.22 0.00 0.00 54.13 56.20 3fun s LEU 49 Cb -0.27 -3.54 -0.01 0.00 0.50 0.00 0.00 46.19 42.87 3fun s LEU 49 CO 0.84 -0.72 0.10 0.54 -1.32 0.00 0.00 176.35 175.79 3fun n ARG 50 N 6.25 5.83 -3.61 1.98 1.74 -1.26 -0.98 116.66 126.61 3fun n ARG 50 Ca 0.13 -0.06 -0.11 0.00 -0.77 0.00 0.00 57.85 57.04 3fun n ARG 50 Cb 0.45 -0.60 -0.04 0.00 -1.02 0.00 0.00 32.46 31.25 3fun n ARG 50 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 3fun s SER 51 N -0.99 -0.33 0.21 0.55 1.04 -1.26 -0.88 113.70 112.03 3fun s SER 51 Ca 0.01 -0.28 -0.10 0.00 0.48 0.00 0.00 55.95 56.05 3fun s SER 51 Cb 0.01 0.54 -0.01 0.00 0.10 0.00 0.00 66.02 66.66 3fun s SER 51 CO 0.04 -0.95 0.38 -1.48 0.98 0.00 0.00 173.24 172.20 3fun s LEU 52 N -2.81 0.60 -0.02 2.42 -0.00 -0.92 -4.96 118.68 112.99 3fun s LEU 52 Ca 0.04 -0.94 0.06 0.00 -0.00 0.00 0.00 54.13 53.30 3fun s LEU 52 Cb 0.00 1.44 -0.01 0.00 -0.00 0.00 0.00 46.19 47.62 3fun s LEU 52 CO -0.09 -1.02 -0.21 -0.69 -0.00 0.00 0.00 176.35 174.34 3fun s VAL 53 N -4.01 1.67 0.22 1.48 1.01 -1.26 -0.51 120.40 119.01 3fun s VAL 53 Ca 0.22 -0.89 0.11 0.00 0.00 0.00 0.00 61.98 61.42 3fun s VAL 53 Cb 0.02 -1.39 -0.05 0.00 0.00 0.00 0.00 36.38 34.96 3fun s VAL 53 CO 0.06 0.47 -0.21 -0.76 0.00 0.00 0.00 175.10 174.66 3fun s LEU 54 N -0.41 2.55 0.33 3.92 1.43 0.22 -0.46 118.68 126.26 3fun s LEU 54 Ca 0.06 -0.89 -0.26 0.00 -1.03 0.00 0.00 54.13 52.01 3fun s LEU 54 Cb -0.09 -1.20 -0.10 0.00 0.03 0.00 0.00 46.19 44.83 3fun s LEU 54 CO -0.00 0.09 0.95 -1.81 0.23 0.00 0.00 176.35 175.81 3fun s ASP 55 N -2.98 7.31 0.07 2.29 1.01 0.67 -0.73 116.67 124.30 3fun s ASP 55 Ca 0.24 1.83 -0.12 0.00 0.71 0.00 0.00 52.55 55.22 3fun s ASP 55 Cb -0.07 -2.58 0.01 0.00 1.01 0.00 0.00 42.92 41.30 3fun s ASP 55 CO 0.12 -0.09 0.27 0.42 0.21 0.00 0.00 175.17 176.10 3fun s THR 56 N -1.64 0.10 -0.21 -1.27 -4.23 -0.97 -2.38 115.64 105.04 3fun s THR 56 Ca 0.51 -0.86 -0.04 0.00 -1.18 0.00 0.00 61.69 60.12 3fun s THR 56 Cb -0.18 -1.10 0.11 0.00 1.34 0.00 0.00 72.50 72.66 3fun s THR 56 CO 0.23 -0.47 0.36 -0.75 -0.54 0.00 0.00 174.62 173.45 3fun s LYS 57 N -3.19 0.30 -1.47 3.99 2.20 0.44 -0.62 119.74 121.40 3fun s LYS 57 Ca -0.00 0.67 -0.07 0.00 -0.36 0.00 0.00 55.97 56.21 3fun s LYS 57 Cb 0.01 -0.26 0.03 0.00 -1.51 0.00 0.00 37.83 36.10 3fun s LYS 57 CO -0.07 -0.49 0.61 -0.25 -0.36 0.00 0.00 175.35 174.79 3fun n ASP 58 N 5.37 -5.37 -4.88 1.43 8.00 -1.26 -4.23 116.55 115.60 3fun n ASP 58 Ca -0.05 -0.34 -0.35 0.00 0.71 0.00 0.00 54.79 54.76 3fun n ASP 58 Cb 0.50 -4.36 -0.05 0.00 -0.02 0.00 0.00 41.12 37.19 3fun n ASP 58 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3fun s LEU 59 N -6.68 4.32 -0.28 0.64 1.43 -1.26 -2.75 118.68 114.10 3fun s LEU 59 Ca 0.36 0.37 -0.11 0.00 -1.03 0.00 0.00 54.13 53.72 3fun s LEU 59 Cb -0.17 -2.39 -0.05 0.00 0.03 0.00 0.00 46.19 43.62 3fun s LEU 59 CO 0.44 0.32 0.18 -0.89 0.23 0.00 0.00 176.35 176.62 3fun s THR 60 N -1.21 5.19 -0.23 5.49 2.01 -0.28 -4.97 115.64 121.65 3fun s THR 60 Ca 0.23 0.12 -0.10 0.00 0.31 0.00 0.00 61.69 62.24 3fun s THR 60 Cb -0.12 -3.47 -0.05 0.00 0.01 0.00 0.00 72.50 68.86 3fun s THR 60 CO 0.13 0.25 0.15 -0.63 -0.69 0.00 0.00 174.62 173.83 3fun s ILE 61 N 1.74 5.36 -0.16 1.82 -1.09 -1.26 -1.05 121.20 126.56 3fun s ILE 61 Ca 0.07 0.18 -0.19 0.00 -2.23 0.00 0.00 60.65 58.47 3fun s ILE 61 Cb -0.16 -3.48 -0.23 0.00 -1.58 0.00 0.00 42.46 37.01 3fun s ILE 61 CO 0.10 0.38 0.39 -0.08 -1.23 0.00 0.00 174.94 174.49 3fun h GLU 62 N 7.26 0.09 -2.09 2.79 4.81 -1.23 -3.49 114.58 122.71 3fun h GLU 62 Ca -0.39 -0.16 0.17 0.00 -0.13 0.00 0.00 59.36 58.85 3fun h GLU 62 Cb 1.16 0.06 -0.14 0.00 0.63 0.00 0.00 28.75 30.46 3fun h GLU 62 CO 0.69 1.07 0.57 -1.59 -0.73 0.00 0.00 179.01 179.02 3fun s LYS 63 N -2.40 0.79 -0.09 1.92 -2.85 -1.22 -5.01 119.74 110.88 3fun s LYS 63 Ca -0.25 -0.35 0.02 0.00 -1.00 0.00 0.00 55.97 54.39 3fun s LYS 63 Cb 0.04 0.33 0.02 0.00 -2.06 0.00 0.00 37.83 36.16 3fun s LYS 63 CO 0.67 -0.35 -0.12 0.08 0.10 0.00 0.00 175.35 175.72 3fun s VAL 64 N -2.99 1.23 -0.10 1.79 1.01 -1.26 -0.91 120.40 119.17 3fun s VAL 64 Ca 0.08 -0.49 0.03 0.00 0.00 0.00 0.00 61.98 61.60 3fun s VAL 64 Cb -0.01 -1.15 -0.00 0.00 0.00 0.00 0.00 36.38 35.22 3fun s VAL 64 CO -0.05 0.39 -0.23 -0.69 0.00 0.00 0.00 175.10 174.52 3fun s VAL 65 N 0.99 2.18 -0.02 2.92 1.01 0.06 -1.08 120.40 126.46 3fun s VAL 65 Ca -0.08 -0.98 0.02 0.00 0.00 0.00 0.00 61.98 60.94 3fun s VAL 65 Cb -0.15 -1.84 0.01 0.00 0.00 0.00 0.00 36.38 34.40 3fun s VAL 65 CO -0.01 0.56 -0.06 -0.63 0.00 0.00 0.00 175.10 174.96 3fun s ILE 66 N 0.36 0.51 -1.34 2.22 1.01 -0.58 -1.06 121.20 122.32 3fun s ILE 66 Ca -0.18 -0.21 -0.05 0.00 0.00 0.00 0.00 60.65 60.21 3fun s ILE 66 Cb -0.18 -0.48 0.03 0.00 0.01 0.00 0.00 42.46 41.85 3fun s ILE 66 CO 0.08 0.17 0.38 0.59 0.00 0.00 0.00 174.94 176.16 3fun n ASN 67 N 3.35 -4.62 0.00 3.58 3.02 -1.26 -1.86 115.26 117.47 3fun n ASN 67 Ca -0.18 -0.20 0.00 0.00 -0.03 0.00 0.00 54.58 54.17 3fun n ASN 67 Cb 0.55 -3.81 0.00 0.00 -0.61 0.00 0.00 39.78 35.91 3fun n ASN 67 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3fun n GLY 68 N -1.18 0.74 3.24 7.41 0.00 -1.26 -5.02 105.19 109.13 3fun n GLY 68 Ca -0.09 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.72 3fun n GLY 68 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3fun s GLN 69 N -0.04 1.01 0.36 1.61 -1.52 -0.78 -5.10 119.66 115.20 3fun s GLN 69 Ca 0.00 -1.11 -0.27 0.00 -1.95 0.00 0.00 55.36 52.03 3fun s GLN 69 Cb 0.00 -1.14 -0.09 0.00 -0.22 0.00 0.00 33.01 31.56 3fun s GLN 69 CO 0.00 0.26 1.24 -1.21 -0.25 0.00 0.00 175.29 175.32 3fun s GLU 70 N -1.97 4.25 0.30 2.91 2.02 -1.26 -1.53 118.70 123.42 3fun s GLU 70 Ca 0.04 2.04 0.10 0.00 0.02 0.00 0.00 54.97 57.17 3fun s GLU 70 Cb -0.09 -2.93 -0.06 0.00 0.10 0.00 0.00 34.13 31.15 3fun s GLU 70 CO 0.04 -0.22 -0.13 0.14 0.02 0.00 0.00 175.26 175.11 3fun s VAL 71 N -1.24 2.19 0.30 2.63 -7.23 -0.24 -4.91 120.40 111.91 3fun s VAL 71 Ca 0.52 -2.27 -0.28 0.00 -1.81 0.00 0.00 61.98 58.14 3fun s VAL 71 Cb -0.36 -2.44 -0.09 0.00 0.56 0.00 0.00 36.38 34.05 3fun s VAL 71 CO 0.47 -0.32 1.08 -0.54 -0.31 0.00 0.00 175.10 175.47 3fun s LYS 72 N -3.59 4.55 0.15 4.82 3.01 -1.26 -4.55 119.74 122.86 3fun s LYS 72 Ca 0.30 1.72 -0.08 0.00 -1.01 0.00 0.00 55.97 56.90 3fun s LYS 72 Cb -0.00 -3.05 -0.01 0.00 -1.01 0.00 0.00 37.83 33.75 3fun s LYS 72 CO 0.14 0.16 0.24 1.52 0.51 0.00 0.00 175.35 177.92 3fun s TYR 73 N -1.27 0.45 -0.09 3.18 -0.85 -1.26 -1.02 117.35 116.47 3fun s TYR 73 Ca 0.47 -0.82 -0.07 0.00 -0.52 0.00 0.00 57.07 56.13 3fun s TYR 73 Cb -0.29 -0.12 0.03 0.00 0.38 0.00 0.00 41.96 41.96 3fun s TYR 73 CO 0.37 -0.67 0.24 0.00 -1.52 0.00 0.00 175.55 173.97 3fun s ALA 74 N -3.97 -0.57 -0.19 9.51 0.00 -0.05 -4.98 121.76 121.51 3fun s ALA 74 Ca 0.17 0.79 -0.12 0.00 0.00 0.00 0.00 51.96 52.81 3fun s ALA 74 Cb 0.04 -0.48 -0.05 0.00 0.00 0.00 0.00 23.12 22.63 3fun s ALA 74 CO -0.01 -0.14 0.20 -0.51 0.00 0.00 0.00 175.76 175.30 3fun s LEU 75 N 0.57 4.20 0.92 0.00 1.43 -1.26 -0.82 118.68 123.72 3fun s LEU 75 Ca -0.04 0.32 -0.13 0.00 -1.03 0.00 0.00 54.13 53.25 3fun s LEU 75 Cb -0.05 -2.20 0.19 0.00 0.03 0.00 0.00 46.19 44.16 3fun s LEU 75 CO -0.03 0.13 1.26 -0.83 0.23 0.00 0.00 176.35 177.10 3fun s GLY 76 N 0.52 1.79 0.53 -3.19 0.00 0.34 -4.99 107.32 102.32 3fun s GLY 76 Ca 0.11 -1.36 -0.20 0.00 0.00 0.00 0.00 44.72 43.27 3fun s GLY 76 CO 0.01 -0.62 1.18 1.85 0.00 0.00 0.00 173.10 175.52 3fun s GLU 77 N -5.74 3.35 0.28 2.90 2.12 -1.26 -4.49 118.70 115.85 3fun s GLU 77 Ca 0.73 1.76 -0.30 0.00 0.36 0.00 0.00 54.97 57.52 3fun s GLU 77 Cb -0.04 -2.11 -0.10 0.00 0.26 0.00 0.00 34.13 32.14 3fun s GLU 77 CO 0.51 -0.88 1.42 0.50 -0.54 0.00 0.00 175.26 176.27 3fun s ARG 78 N -3.11 4.27 -0.86 4.30 3.52 -1.26 -4.52 118.95 121.29 3fun s ARG 78 Ca 0.71 2.31 0.01 0.00 -0.13 0.00 0.00 55.73 58.64 3fun s ARG 78 Cb -0.28 -3.09 0.27 0.00 -1.56 0.00 0.00 34.95 30.30 3fun s ARG 78 CO 0.32 -0.38 1.07 1.04 -0.81 0.00 0.00 175.30 176.54 3fun n GLN 79 N 1.81 3.39 0.00 5.12 6.02 0.72 -4.98 117.38 129.47 3fun n GLN 79 Ca 0.05 -4.61 0.00 0.00 -0.01 0.00 0.00 57.00 52.43 3fun n GLN 79 Cb 0.40 -2.39 0.00 0.00 1.02 0.00 0.00 30.24 29.28 3fun n GLN 79 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 3fun n SER 80 N 1.21 0.00 0.09 1.08 2.88 -1.26 -1.31 113.62 116.31 3fun n SER 80 Ca 0.27 0.00 0.11 0.00 -1.33 0.00 0.00 58.87 57.92 3fun n SER 80 Cb 0.37 0.00 0.44 0.00 -0.75 0.00 0.00 64.21 64.27 3fun n SER 80 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3fun n TYR 81 N 14.00 0.58 0.49 0.66 4.11 -1.26 -2.05 117.16 133.69 3fun n TYR 81 Ca 0.00 0.22 0.13 0.00 -0.00 0.00 0.00 57.90 58.25 3fun n TYR 81 Cb 0.00 -0.86 0.35 0.00 -0.00 0.00 0.00 39.34 38.83 3fun n TYR 81 CO 0.00 0.00 0.00 0.87 -0.00 0.00 0.00 176.86 177.73 3fun h LYS 82 N 0.00 0.00 0.00 -3.48 1.57 -1.55 -3.50 116.57 109.61 3fun h LYS 82 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3fun h LYS 82 Cb 0.34 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.65 3fun h LYS 82 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.29 3fun n GLY 83 N 1.15 -1.08 3.24 3.86 0.00 -0.87 -4.70 105.19 106.79 3fun n GLY 83 Ca 0.05 -1.41 -0.31 0.00 0.00 0.00 0.00 46.02 44.35 3fun n GLY 83 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3fun s SER 84 N -4.00 3.04 0.34 1.61 0.01 0.20 -0.20 113.70 114.70 3fun s SER 84 Ca 0.00 -0.52 -0.26 0.00 1.31 0.00 0.00 55.95 56.47 3fun s SER 84 Cb 0.00 -1.05 -0.09 0.00 0.21 0.00 0.00 66.02 65.09 3fun s SER 84 CO 0.00 0.21 1.03 -2.16 0.41 0.00 0.00 173.24 172.73 3fun s PRO 85 N 0.03 4.44 -0.28 12.44 0.04 -1.26 -2.29 135.00 148.13 3fun s PRO 85 Ca -0.09 1.56 0.01 0.00 0.04 0.00 0.00 61.00 62.52 3fun s PRO 85 Cb -0.15 -2.84 0.06 0.00 0.04 0.00 0.00 34.50 31.60 3fun s PRO 85 CO 0.06 0.10 -0.06 1.41 0.04 0.00 0.00 177.00 178.54 3fun s MET 86 N -1.99 2.28 -0.18 4.56 1.75 0.09 -0.50 119.30 125.30 3fun s MET 86 Ca 0.51 -1.34 -0.16 0.00 -1.25 0.00 0.00 55.69 53.45 3fun s MET 86 Cb -0.25 -3.01 -0.04 0.00 2.84 0.00 0.00 34.83 34.38 3fun s MET 86 CO 0.31 -0.60 0.39 -2.00 -0.65 0.00 0.00 175.02 172.47 3fun s GLU 87 N 1.15 4.21 -0.16 4.11 2.12 0.00 -0.61 118.70 129.52 3fun s GLU 87 Ca -0.07 0.21 -0.03 0.00 0.36 0.00 0.00 54.97 55.45 3fun s GLU 87 Cb -0.20 -3.50 -0.02 0.00 0.26 0.00 0.00 34.13 30.67 3fun s GLU 87 CO -0.04 0.04 -0.06 0.42 -0.54 0.00 0.00 175.26 175.08 3fun s ILE 88 N 1.07 3.58 -0.35 -3.70 1.01 0.34 -0.87 121.20 122.28 3fun s ILE 88 Ca 0.19 -0.46 -0.22 0.00 0.00 0.00 0.00 60.65 60.16 3fun s ILE 88 Cb -0.14 -2.56 0.00 0.00 0.01 0.00 0.00 42.46 39.77 3fun s ILE 88 CO 0.07 0.49 0.70 -0.44 0.00 0.00 0.00 174.94 175.76 3fun s SER 89 N 0.51 6.49 0.24 3.58 0.01 -0.19 -2.17 113.70 122.17 3fun s SER 89 Ca -0.05 0.28 -0.30 0.00 1.31 0.00 0.00 55.95 57.20 3fun s SER 89 Cb -0.15 -2.36 -0.09 0.00 0.21 0.00 0.00 66.02 63.64 3fun s SER 89 CO 0.03 -0.63 1.07 -0.76 0.41 0.00 0.00 173.24 173.36 3fun s LEU 90 N 2.85 4.55 0.36 2.44 1.43 -0.06 -4.36 118.68 125.89 3fun s LEU 90 Ca 0.27 2.16 0.17 0.00 -1.03 0.00 0.00 54.13 55.71 3fun s LEU 90 Cb -0.14 -3.62 0.62 0.00 0.03 0.00 0.00 46.19 43.08 3fun s LEU 90 CO 0.15 -0.11 1.71 1.55 0.23 0.00 0.00 176.35 179.88 3fun h PRO 91 N 4.24 0.00 -4.00 1.29 0.13 -1.96 -3.43 132.00 128.28 3fun h PRO 91 Ca -0.46 0.00 -0.39 0.00 -0.87 0.00 0.00 66.00 64.28 3fun h PRO 91 Cb 1.21 0.00 -0.34 0.00 0.13 0.00 0.00 31.00 32.00 3fun h PRO 91 CO 0.69 0.41 -0.77 0.42 -0.23 0.00 0.00 178.00 178.52 3fun s ILE 92 N -3.60 0.47 0.33 -3.56 1.01 -1.26 -5.13 121.20 109.46 3fun s ILE 92 Ca -0.00 -0.10 -0.29 0.00 0.00 0.00 0.00 60.65 60.26 3fun s ILE 92 Cb 0.11 -0.50 -0.12 0.00 0.01 0.00 0.00 42.46 41.96 3fun s ILE 92 CO 0.70 0.20 1.53 0.00 0.00 0.00 0.00 174.94 177.37 3fun n ALA 93 N 3.97 2.34 -2.87 9.38 0.00 -1.26 -4.91 120.51 127.16 3fun n ALA 93 Ca -0.25 0.36 -0.34 0.00 0.00 0.00 0.00 53.44 53.20 3fun n ALA 93 Cb 0.51 -2.43 -0.05 0.00 0.00 0.00 0.00 19.45 17.48 3fun n ALA 93 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3fun s LEU 94 N -1.11 4.38 0.63 0.00 1.43 -0.16 -4.83 118.68 119.02 3fun s LEU 94 Ca 0.59 0.41 -0.06 0.00 -1.03 0.00 0.00 54.13 54.04 3fun s LEU 94 Cb -0.50 -2.48 0.02 0.00 0.03 0.00 0.00 46.19 43.26 3fun s LEU 94 CO 0.56 0.30 0.95 -0.94 0.23 0.00 0.00 176.35 177.44 3fun s SER 95 N -1.66 5.35 0.29 2.29 1.04 -1.26 -0.83 113.70 118.92 3fun s SER 95 Ca 0.24 0.66 -0.30 0.00 0.48 0.00 0.00 55.95 57.04 3fun s SER 95 Cb -0.13 -1.54 -0.11 0.00 0.10 0.00 0.00 66.02 64.34 3fun s SER 95 CO 0.14 -1.24 1.56 -0.75 0.98 0.00 0.00 173.24 173.94 3fun s LYS 96 N -5.09 4.14 0.00 4.02 2.20 -1.09 -1.82 119.74 122.10 3fun s LYS 96 Ca 0.56 2.54 0.00 0.00 -0.36 0.00 0.00 55.97 58.71 3fun s LYS 96 Cb -0.11 -3.03 0.00 0.00 -1.51 0.00 0.00 37.83 33.18 3fun s LYS 96 CO 0.45 -0.59 0.00 0.09 -0.36 0.00 0.00 175.35 174.94 3fun n ASN 97 N 2.05 0.00 -4.76 1.43 3.02 0.65 -4.98 115.26 112.68 3fun n ASN 97 Ca 0.07 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.22 3fun n ASN 97 Cb 0.38 -0.16 -0.03 0.00 -0.61 0.00 0.00 39.78 39.36 3fun n ASN 97 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 3fun s GLN 98 N -0.04 4.41 -0.04 3.52 0.74 -0.76 -4.69 119.66 122.80 3fun s GLN 98 Ca 0.00 2.12 0.04 0.00 0.05 0.00 0.00 55.36 57.56 3fun s GLN 98 Cb 0.00 -3.12 -0.03 0.00 1.10 0.00 0.00 33.01 30.97 3fun s GLN 98 CO 0.00 -0.14 -0.14 -1.21 -0.55 0.00 0.00 175.29 173.25 3fun s GLU 99 N -1.33 2.46 0.21 1.67 2.02 -1.26 -0.98 118.70 121.49 3fun s GLU 99 Ca 0.50 -0.72 0.01 0.00 0.02 0.00 0.00 54.97 54.78 3fun s GLU 99 Cb -0.38 -2.36 -0.05 0.00 0.10 0.00 0.00 34.13 31.44 3fun s GLU 99 CO 0.47 0.62 0.06 0.96 0.02 0.00 0.00 175.26 177.39 3fun s ILE 100 N -0.76 0.50 -0.14 -1.63 -4.36 -0.46 -4.97 121.20 109.38 3fun s ILE 100 Ca 0.12 -1.99 -0.01 0.00 -0.26 0.00 0.00 60.65 58.51 3fun s ILE 100 Cb -0.11 -2.39 -0.02 0.00 1.25 0.00 0.00 42.46 41.20 3fun s ILE 100 CO 0.01 -0.20 -0.11 -0.69 0.24 0.00 0.00 174.94 174.19 3fun s VAL 101 N -3.79 3.20 -0.22 8.37 1.01 -1.26 -0.40 120.40 127.30 3fun s VAL 101 Ca 0.32 -0.60 -0.00 0.00 0.00 0.00 0.00 61.98 61.70 3fun s VAL 101 Cb 0.07 -2.37 0.03 0.00 0.00 0.00 0.00 36.38 34.11 3fun s VAL 101 CO 0.09 0.51 -0.12 -0.63 0.00 0.00 0.00 175.10 174.95 3fun s ILE 102 N 0.47 2.48 -0.31 2.22 1.01 -0.07 -4.50 121.20 122.51 3fun s ILE 102 Ca -0.08 -1.04 -0.08 0.00 0.00 0.00 0.00 60.65 59.45 3fun s ILE 102 Cb -0.15 -2.20 0.01 0.00 0.01 0.00 0.00 42.46 40.12 3fun s ILE 102 CO 0.04 0.32 0.12 -0.70 0.00 0.00 0.00 174.94 174.71 3fun s GLU 103 N 1.29 3.10 -0.21 2.79 2.12 -0.22 -0.88 118.70 126.69 3fun s GLU 103 Ca 0.01 -0.86 -0.05 0.00 0.36 0.00 0.00 54.97 54.43 3fun s GLU 103 Cb -0.16 -3.48 -0.02 0.00 0.26 0.00 0.00 34.13 30.74 3fun s GLU 103 CO -0.08 -0.48 0.01 0.42 -0.54 0.00 0.00 175.26 174.59 3fun s ILE 104 N 1.53 3.94 -0.16 -3.70 1.01 0.16 -0.76 121.20 123.22 3fun s ILE 104 Ca 0.03 -0.31 -0.19 0.00 0.00 0.00 0.00 60.65 60.17 3fun s ILE 104 Cb -0.18 -2.80 -0.03 0.00 0.01 0.00 0.00 42.46 39.46 3fun s ILE 104 CO 0.04 0.41 0.54 -0.44 0.00 0.00 0.00 174.94 175.49 3fun s SER 105 N 1.20 6.66 0.22 3.58 0.01 -0.09 -1.31 113.70 123.97 3fun s SER 105 Ca 0.03 0.79 -0.11 0.00 1.31 0.00 0.00 55.95 57.98 3fun s SER 105 Cb -0.15 -2.31 -0.01 0.00 0.21 0.00 0.00 66.02 63.77 3fun s SER 105 CO 0.01 -0.14 0.40 0.72 0.41 0.00 0.00 173.24 174.65 3fun s PHE 106 N 1.30 0.42 -0.03 2.43 -0.71 -0.29 -0.62 117.98 120.48 3fun s PHE 106 Ca 0.27 -0.77 -0.04 0.00 -1.04 0.00 0.00 56.93 55.35 3fun s PHE 106 Cb -0.16 0.07 0.01 0.00 -1.21 0.00 0.00 43.02 41.73 3fun s PHE 106 CO 0.11 -0.89 0.10 -2.00 -1.34 0.00 0.00 175.22 171.20 3fun s GLU 107 N -4.01 0.15 0.69 1.99 2.12 -0.21 -1.47 118.70 117.96 3fun s GLU 107 Ca 0.22 0.09 -0.09 0.00 0.36 0.00 0.00 54.97 55.56 3fun s GLU 107 Cb 0.01 0.07 0.04 0.00 0.26 0.00 0.00 34.13 34.51 3fun s GLU 107 CO 0.07 -0.02 1.04 0.95 -0.54 0.00 0.00 175.26 176.75 3fun s THR 108 N -0.07 2.88 0.05 -1.70 -4.23 0.05 -1.13 115.64 111.50 3fun s THR 108 Ca -0.01 0.04 -0.10 0.00 -1.18 0.00 0.00 61.69 60.44 3fun s THR 108 Cb -0.01 -3.24 -0.06 0.00 1.34 0.00 0.00 72.50 70.53 3fun s THR 108 CO 0.00 -0.28 0.37 -0.55 -0.54 0.00 0.00 174.62 173.62 3fun s SER 109 N -4.43 6.62 0.56 3.99 0.15 -1.11 -4.55 113.70 114.93 3fun s SER 109 Ca 0.58 0.75 0.29 0.00 0.70 0.00 0.00 55.95 58.27 3fun s SER 109 Cb -0.11 -2.16 1.47 0.00 -1.71 0.00 0.00 66.02 63.51 3fun s SER 109 CO 0.47 0.21 1.93 -0.65 1.20 0.00 0.00 173.24 176.40 3fun h PRO 110 N 3.88 0.00 -0.34 5.44 0.11 -1.82 0.14 132.00 139.42 3fun h PRO 110 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3fun h PRO 110 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 3fun h PRO 110 CO 0.66 0.00 0.00 0.36 -0.21 0.00 0.00 178.00 178.81 3fun n LYS 111 N -3.99 1.76 -1.67 1.05 2.85 -1.26 -4.93 118.16 111.95 3fun n LYS 111 Ca 0.11 -1.08 -0.61 0.00 -1.05 0.00 0.00 58.31 55.68 3fun n LYS 111 Cb 0.70 -1.28 -0.08 0.00 -0.65 0.00 0.00 35.03 33.72 3fun n LYS 111 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 3fun n SER 112 N 0.36 1.44 0.08 -5.58 2.88 0.50 -4.81 113.62 108.47 3fun n SER 112 Ca 0.10 1.14 0.10 0.00 -1.33 0.00 0.00 58.87 58.87 3fun n SER 112 Cb 0.28 -1.01 0.41 0.00 -0.75 0.00 0.00 64.21 63.14 3fun n SER 112 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 3fun n SER 113 N 3.80 0.39 0.11 -3.46 3.41 -1.26 -2.13 113.62 114.48 3fun n SER 113 Ca 0.26 0.60 0.13 0.00 -0.26 0.00 0.00 58.87 59.60 3fun n SER 113 Cb 0.06 -0.68 0.32 0.00 -0.26 0.00 0.00 64.21 63.65 3fun n SER 113 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3fun h ALA 114 N 2.33 0.90 -4.14 7.33 0.00 -1.84 -3.43 119.26 120.43 3fun h ALA 114 Ca 0.00 0.00 -0.62 0.00 0.00 0.00 0.00 54.91 54.29 3fun h ALA 114 Cb 0.29 0.00 -0.26 0.00 0.00 0.00 0.00 17.79 17.82 3fun h ALA 114 CO 0.00 0.00 -0.85 -0.51 0.00 0.00 0.00 179.25 177.89 3fun s LEU 115 N -4.70 2.17 -0.16 0.00 1.43 -0.91 -0.55 118.68 115.96 3fun s LEU 115 Ca 0.09 -0.54 0.01 0.00 -1.03 0.00 0.00 54.13 52.66 3fun s LEU 115 Cb 0.12 -1.08 0.01 0.00 0.03 0.00 0.00 46.19 45.27 3fun s LEU 115 CO 0.64 0.19 -0.19 -1.58 0.23 0.00 0.00 176.35 175.63 3fun s GLN 116 N -1.20 3.05 -0.34 1.70 0.74 -0.66 -4.58 119.66 118.37 3fun s GLN 116 Ca 0.09 -0.82 -0.16 0.00 0.05 0.00 0.00 55.36 54.52 3fun s GLN 116 Cb -0.09 -2.55 -0.01 0.00 1.10 0.00 0.00 33.01 31.45 3fun s GLN 116 CO 0.02 -0.11 0.39 -1.58 -0.55 0.00 0.00 175.29 173.45 3fun s TRP 117 N 1.07 3.21 -0.14 1.67 0.52 -1.26 -2.22 118.94 121.79 3fun s TRP 117 Ca -0.01 0.04 -0.06 0.00 0.02 0.00 0.00 56.10 56.09 3fun s TRP 117 Cb -0.14 -2.70 -0.04 0.00 -1.15 0.00 0.00 33.47 29.43 3fun s TRP 117 CO -0.07 -0.43 0.07 -0.51 0.02 0.00 0.00 176.95 176.03 3fun s LEU 118 N 2.08 3.94 0.74 2.99 1.43 0.53 -5.00 118.68 125.40 3fun s LEU 118 Ca 0.13 0.21 -0.11 0.00 -1.03 0.00 0.00 54.13 53.33 3fun s LEU 118 Cb -0.16 -1.97 0.04 0.00 0.03 0.00 0.00 46.19 44.13 3fun s LEU 118 CO 0.12 0.29 1.09 0.42 0.23 0.00 0.00 176.35 178.50 3fun s THR 119 N -0.33 3.45 0.30 5.49 -4.23 -1.26 -1.76 115.64 117.30 3fun s THR 119 Ca 0.09 0.47 0.06 0.00 -1.18 0.00 0.00 61.69 61.13 3fun s THR 119 Cb -0.12 -3.30 0.29 0.00 1.34 0.00 0.00 72.50 70.72 3fun s THR 119 CO 0.02 -0.61 1.76 -0.65 -0.54 0.00 0.00 174.62 174.59 3fun h PRO 120 N -0.86 0.66 0.00 3.99 0.11 -1.88 -1.11 132.00 132.92 3fun h PRO 120 Ca -0.46 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3fun h PRO 120 Cb 1.25 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.21 3fun h PRO 120 CO 0.60 0.44 0.00 0.93 -0.21 0.00 0.00 178.00 179.76 3fun h GLU 121 N 0.68 0.00 -0.05 1.05 4.39 -1.88 -1.92 114.58 116.85 3fun h GLU 121 Ca 0.58 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.28 3fun h GLU 121 Cb 0.94 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.59 3fun h GLU 121 CO -0.41 0.00 0.00 1.04 -1.16 0.00 0.00 179.01 178.48 3fun n GLN 122 N -3.00 1.46 -3.78 2.33 6.02 -0.42 -4.90 117.38 115.08 3fun n GLN 122 Ca -0.01 -0.67 -0.25 0.00 -0.01 0.00 0.00 57.00 56.07 3fun n GLN 122 Cb 0.20 -1.44 -0.01 0.00 1.02 0.00 0.00 30.24 30.01 3fun n GLN 122 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 3fun s THR 123 N -1.95 1.95 0.10 5.09 -4.23 -0.72 -4.82 115.64 111.06 3fun s THR 123 Ca 0.38 -1.45 -0.12 0.00 -1.18 0.00 0.00 61.69 59.32 3fun s THR 123 Cb 0.19 -2.40 -0.16 0.00 1.34 0.00 0.00 72.50 71.47 3fun s THR 123 CO 0.31 0.00 1.30 0.28 -0.54 0.00 0.00 174.62 175.97 3fun h SER 124 N 0.83 0.92 1.53 3.99 0.02 -1.91 -3.34 113.55 115.60 3fun h SER 124 Ca -0.38 -0.62 -0.06 0.00 -0.84 0.00 0.00 61.79 59.89 3fun h SER 124 Cb 1.29 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 63.55 3fun h SER 124 CO 0.57 1.42 -0.48 1.23 -1.14 0.00 0.00 176.83 178.43 3fun h GLY 125 N 0.58 0.00 0.00 -3.77 0.00 -1.92 -3.48 103.07 94.48 3fun h GLY 125 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.27 3fun h GLY 125 CO 0.16 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.98 3fun n LYS 126 N -3.08 -0.38 -0.09 4.80 4.76 -1.23 -4.79 118.16 118.15 3fun n LYS 126 Ca 0.01 0.09 -0.11 0.00 -2.87 0.00 0.00 58.31 55.44 3fun n LYS 126 Cb 0.65 -3.71 -0.10 0.00 -1.84 0.00 0.00 35.03 30.04 3fun n LYS 126 CO 0.00 0.00 0.00 -1.91 -1.37 0.00 0.00 177.40 174.12 3fun n GLU 127 N -1.62 0.84 -4.37 1.97 2.13 -1.26 -4.55 120.64 113.79 3fun n GLU 127 Ca 0.00 0.07 -0.27 0.00 0.66 0.00 0.00 57.16 57.62 3fun n GLU 127 Cb 0.09 -1.37 -0.12 0.00 0.27 0.00 0.00 31.44 30.31 3fun n GLU 127 CO 0.00 0.00 0.00 -1.01 -0.41 0.00 0.00 177.13 175.71 3fun s HIS 128 N -2.37 2.14 0.93 4.31 3.76 -1.26 -4.82 115.29 117.99 3fun s HIS 128 Ca -0.19 -0.39 -0.16 0.00 -0.15 0.00 0.00 55.06 54.17 3fun s HIS 128 Cb 0.06 -1.13 0.21 0.00 1.11 0.00 0.00 32.58 32.83 3fun s HIS 128 CO 0.48 0.34 1.26 -0.35 -0.85 0.00 0.00 174.74 175.62 3fun n PRO 129 N 0.77 -1.26 -3.66 8.40 -0.04 -1.26 -4.00 135.00 133.93 3fun n PRO 129 Ca -0.17 -1.94 -0.14 0.00 -0.04 0.00 0.00 63.50 61.21 3fun n PRO 129 Cb 0.54 -1.30 -0.08 0.00 -0.04 0.00 0.00 33.50 32.62 3fun n PRO 129 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 3fun s TYR 130 N -3.74 -0.59 -0.02 0.54 6.14 -0.72 -4.49 117.35 114.47 3fun s TYR 130 Ca 0.71 1.35 0.04 0.00 0.64 0.00 0.00 57.07 59.81 3fun s TYR 130 Cb -0.02 0.23 -0.01 0.00 0.42 0.00 0.00 41.96 42.59 3fun s TYR 130 CO 0.50 -0.35 -0.14 -1.17 0.64 0.00 0.00 175.55 175.03 3fun s LEU 131 N -0.07 1.93 0.01 6.97 2.96 -0.01 -0.35 118.68 130.12 3fun s LEU 131 Ca -0.03 -0.27 -0.03 0.00 -0.22 0.00 0.00 54.13 53.58 3fun s LEU 131 Cb -0.04 -0.76 -0.01 0.00 0.50 0.00 0.00 46.19 45.89 3fun s LEU 131 CO 0.02 0.14 0.04 0.72 -1.32 0.00 0.00 176.35 175.96 3fun s PHE 132 N -0.09 0.15 0.24 5.38 -0.12 -0.94 -0.77 117.98 121.83 3fun s PHE 132 Ca 0.01 -0.33 0.06 0.00 -0.05 0.00 0.00 56.93 56.61 3fun s PHE 132 Cb -0.08 -0.12 -0.03 0.00 -0.63 0.00 0.00 43.02 42.16 3fun s PHE 132 CO 0.00 -0.22 0.29 -1.54 -0.05 0.00 0.00 175.22 173.70 3fun s SER 133 N -1.36 6.01 -0.41 1.98 1.04 -0.33 -1.66 113.70 118.97 3fun s SER 133 Ca -0.15 -0.05 0.06 0.00 0.48 0.00 0.00 55.95 56.29 3fun s SER 133 Cb -0.09 -1.68 0.17 0.00 0.10 0.00 0.00 66.02 64.52 3fun s SER 133 CO 0.00 -0.05 0.53 -1.58 0.98 0.00 0.00 173.24 173.12 3fun s GLN 134 N -3.88 0.80 0.29 4.02 -0.44 0.29 -4.77 119.66 115.97 3fun s GLN 134 Ca 0.34 -0.75 0.15 0.00 -2.50 0.00 0.00 55.36 52.59 3fun s GLN 134 Cb -0.09 -0.35 0.25 0.00 -1.64 0.00 0.00 33.01 31.19 3fun s GLN 134 CO 0.27 -1.23 1.53 0.00 0.50 0.00 0.00 175.29 176.36 3fun s GLN 136 N -3.16 4.40 -0.18 0.00 0.74 -1.25 -0.42 119.66 119.79 3fun s GLN 136 Ca 0.02 1.94 -0.20 0.00 0.05 0.00 0.00 55.36 57.16 3fun s GLN 136 Cb 0.09 -3.27 -0.18 0.00 1.10 0.00 0.00 33.01 30.76 3fun s GLN 136 CO 0.73 -0.28 0.29 0.00 -0.55 0.00 0.00 175.29 175.48 3fun h ALA 137 N 6.26 0.15 -0.86 1.58 0.00 -1.96 -3.44 119.26 120.99 3fun h ALA 137 Ca -0.43 -0.87 -0.49 0.00 0.00 0.00 0.00 54.91 53.12 3fun h ALA 137 Cb 1.21 0.48 -0.42 0.00 0.00 0.00 0.00 17.79 19.06 3fun h ALA 137 CO 0.81 0.46 -0.88 0.44 0.00 0.00 0.00 179.25 180.08 3fun n ILE 138 N -4.52 2.18 0.77 0.00 -5.35 -1.07 -4.72 119.36 106.64 3fun n ILE 138 Ca -0.21 -4.05 0.08 0.00 -0.27 0.00 0.00 62.75 58.30 3fun n ILE 138 Cb 0.53 -0.62 -0.01 0.00 -1.74 0.00 0.00 39.64 37.81 3fun n ILE 138 CO 0.00 0.00 0.00 1.41 -1.76 0.00 0.00 176.55 176.20 3fun n HIS 139 N -0.61 0.00 -0.15 4.28 8.25 0.44 -4.41 115.22 123.02 3fun n HIS 139 Ca 0.34 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.87 3fun n HIS 139 Cb 0.87 0.00 0.38 0.00 1.12 0.00 0.00 29.99 32.36 3fun n HIS 139 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3fun h ARG 141 N 0.68 0.00 -0.08 0.00 0.11 -1.77 0.14 114.38 113.45 3fun h ARG 141 Ca 0.29 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.37 3fun h ARG 141 Cb 0.26 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.34 3fun h ARG 141 CO -0.09 0.00 0.00 0.00 0.10 0.00 0.00 179.97 179.98 3fun n ALA 142 N -1.86 2.54 -0.07 0.08 0.00 0.24 -0.42 120.51 121.04 3fun n ALA 142 Ca -0.02 -0.52 -0.10 0.00 0.00 0.00 0.00 53.44 52.81 3fun n ALA 142 Cb 0.05 -1.10 -0.06 0.00 0.00 0.00 0.00 19.45 18.34 3fun n ALA 142 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 3fun n ILE 143 N 0.38 0.75 -3.58 0.00 5.41 0.37 -4.72 119.36 117.97 3fun n ILE 143 Ca 0.18 -0.27 -0.13 0.00 1.00 0.00 0.00 62.75 63.52 3fun n ILE 143 Cb 0.38 -1.08 -0.05 0.00 -0.71 0.00 0.00 39.64 38.18 3fun n ILE 143 CO 0.00 0.00 0.00 -1.48 0.00 0.00 0.00 176.55 175.07 3fun s LEU 144 N -5.92 -0.01 0.14 1.39 0.05 -0.61 -4.75 118.68 108.97 3fun s LEU 144 Ca -0.18 0.08 -0.31 0.00 0.05 0.00 0.00 54.13 53.78 3fun s LEU 144 Cb 0.05 2.09 -0.08 0.00 -2.05 0.00 0.00 46.19 46.20 3fun s LEU 144 CO 0.29 -0.75 1.33 -2.84 -0.55 0.00 0.00 176.35 173.84 3fun s PRO 145 N -2.71 4.36 0.16 1.48 0.02 -1.26 -4.08 135.00 132.97 3fun s PRO 145 Ca -0.04 2.03 -0.24 0.00 0.02 0.00 0.00 61.00 62.76 3fun s PRO 145 Cb -0.00 -3.24 0.06 0.00 0.02 0.00 0.00 34.50 31.34 3fun s PRO 145 CO -0.04 -0.34 0.85 0.00 -0.33 0.00 0.00 177.00 177.14 3fun s GLN 147 N -3.48 3.35 -1.30 0.00 -0.21 -1.26 -0.24 119.66 116.53 3fun s GLN 147 Ca 0.09 -0.71 -0.09 0.00 0.02 0.00 0.00 55.36 54.68 3fun s GLN 147 Cb -0.02 -4.65 0.15 0.00 1.00 0.00 0.00 33.01 29.49 3fun s GLN 147 CO -0.00 -2.11 1.98 -3.47 -2.12 0.00 0.00 175.29 169.56 3fun n ASP 148 N 8.86 5.51 -3.83 5.90 2.03 -1.26 -4.83 116.55 128.93 3fun n ASP 148 Ca 0.14 -3.10 -0.12 0.00 0.52 0.00 0.00 54.79 52.23 3fun n ASP 148 Cb 0.49 -1.47 -0.13 0.00 -0.72 0.00 0.00 41.12 39.30 3fun n ASP 148 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 3fun s THR 149 N 0.27 0.01 -2.00 5.18 -1.32 -1.26 -4.65 115.64 111.87 3fun s THR 149 Ca 0.42 -0.07 0.26 0.00 -1.21 0.00 0.00 61.69 61.09 3fun s THR 149 Cb 0.11 -0.20 0.75 0.00 -1.51 0.00 0.00 72.50 71.65 3fun s THR 149 CO -0.01 -0.04 1.98 -0.81 -2.21 0.00 0.00 174.62 173.53 3fun n PRO 150 N 2.86 0.94 0.00 7.08 -0.04 -1.26 -2.95 135.00 141.64 3fun n PRO 150 Ca -0.13 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.45 3fun n PRO 150 Cb 0.59 -1.44 0.63 0.00 -0.04 0.00 0.00 33.50 33.24 3fun n PRO 150 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 3fun n SER 151 N -0.94 0.00 -4.20 3.54 3.41 -1.10 -4.70 113.62 109.64 3fun n SER 151 Ca 0.20 -0.16 -0.29 0.00 -0.26 0.00 0.00 58.87 58.36 3fun n SER 151 Cb 0.09 -0.25 -0.16 0.00 -0.26 0.00 0.00 64.21 63.63 3fun n SER 151 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3fun s VAL 152 N -2.50 1.78 -0.02 -3.33 1.01 -1.15 -4.89 120.40 111.30 3fun s VAL 152 Ca 0.25 -0.90 0.07 0.00 0.00 0.00 0.00 61.98 61.40 3fun s VAL 152 Cb 0.17 -1.53 -0.02 0.00 0.00 0.00 0.00 36.38 35.00 3fun s VAL 152 CO 0.36 0.50 -0.23 -0.54 0.00 0.00 0.00 175.10 175.19 3fun s LYS 153 N 0.07 1.92 0.03 2.72 1.02 -1.26 -4.15 119.74 120.10 3fun s LYS 153 Ca -0.08 -0.82 -0.00 0.00 0.02 0.00 0.00 55.97 55.09 3fun s LYS 153 Cb -0.14 -1.83 -0.03 0.00 -0.52 0.00 0.00 37.83 35.32 3fun s LYS 153 CO 0.04 0.48 -0.03 -0.48 -0.92 0.00 0.00 175.35 174.43 3fun s LEU 154 N -0.48 2.33 0.68 3.17 2.34 0.18 -4.67 118.68 122.23 3fun s LEU 154 Ca 0.07 -0.67 -0.08 0.00 0.06 0.00 0.00 54.13 53.51 3fun s LEU 154 Cb -0.09 0.11 0.04 0.00 -0.56 0.00 0.00 46.19 45.68 3fun s LEU 154 CO -0.00 -0.39 1.00 0.42 -1.06 0.00 0.00 176.35 176.32 3fun s THR 155 N -2.28 2.88 0.04 5.48 -4.23 -0.75 -0.74 115.64 116.04 3fun s THR 155 Ca -0.08 -0.05 -0.16 0.00 -1.18 0.00 0.00 61.69 60.23 3fun s THR 155 Cb -0.04 -3.22 0.03 0.00 1.34 0.00 0.00 72.50 70.61 3fun s THR 155 CO -0.04 -0.24 0.36 -0.72 -0.54 0.00 0.00 174.62 173.44 3fun s TYR 156 N -3.21 -0.19 0.14 3.99 -0.85 -0.77 -1.53 117.35 114.94 3fun s TYR 156 Ca 0.58 0.11 0.06 0.00 -0.52 0.00 0.00 57.07 57.30 3fun s TYR 156 Cb -0.11 0.16 -0.04 0.00 0.38 0.00 0.00 41.96 42.35 3fun s TYR 156 CO 0.46 -0.53 -0.15 0.95 -1.52 0.00 0.00 175.55 174.76 3fun s THR 157 N -2.47 1.45 -0.05 -3.49 -4.23 -0.26 -0.48 115.64 106.12 3fun s THR 157 Ca -0.05 -1.80 -0.17 0.00 -1.18 0.00 0.00 61.69 58.49 3fun s THR 157 Cb -0.01 -1.64 0.03 0.00 1.34 0.00 0.00 72.50 72.23 3fun s THR 157 CO -0.03 -0.41 0.39 0.00 -0.54 0.00 0.00 174.62 174.03 3fun s ALA 158 N -2.20 -0.98 -0.12 3.99 0.00 -0.71 -0.94 121.76 120.80 3fun s ALA 158 Ca 0.11 0.66 0.00 0.00 0.00 0.00 0.00 51.96 52.73 3fun s ALA 158 Cb -0.05 -0.10 0.02 0.00 0.00 0.00 0.00 23.12 23.00 3fun s ALA 158 CO 0.04 -0.26 -0.10 -1.21 0.00 0.00 0.00 175.76 174.22 3fun s GLU 159 N -0.97 1.78 -0.16 0.00 2.02 0.47 -1.06 118.70 120.77 3fun s GLU 159 Ca -0.10 -0.36 0.01 0.00 0.02 0.00 0.00 54.97 54.53 3fun s GLU 159 Cb -0.04 -1.72 0.03 0.00 0.10 0.00 0.00 34.13 32.50 3fun s GLU 159 CO 0.04 -0.22 -0.14 0.08 0.02 0.00 0.00 175.26 175.04 3fun s VAL 160 N 1.50 1.67 -0.14 2.63 1.01 0.52 -1.12 120.40 126.48 3fun s VAL 160 Ca 0.02 -0.76 -0.17 0.00 0.00 0.00 0.00 61.98 61.07 3fun s VAL 160 Cb -0.13 -1.59 -0.04 0.00 0.00 0.00 0.00 36.38 34.61 3fun s VAL 160 CO -0.07 0.42 0.45 -0.55 0.00 0.00 0.00 175.10 175.34 3fun s SER 161 N 1.43 6.61 0.05 3.32 0.15 0.23 -0.81 113.70 124.69 3fun s SER 161 Ca 0.04 0.73 -0.01 0.00 0.70 0.00 0.00 55.95 57.41 3fun s SER 161 Cb -0.14 -2.27 -0.04 0.00 -1.71 0.00 0.00 66.02 61.87 3fun s SER 161 CO -0.11 -0.01 -0.03 0.68 1.20 0.00 0.00 173.24 174.98 3fun s VAL 162 N 0.74 0.23 0.26 4.45 -7.23 -0.12 -1.24 120.40 117.49 3fun s VAL 162 Ca 0.24 -1.75 -0.30 0.00 -1.81 0.00 0.00 61.98 58.36 3fun s VAL 162 Cb -0.15 -1.43 -0.14 0.00 0.56 0.00 0.00 36.38 35.22 3fun s VAL 162 CO 0.09 -0.96 1.14 -2.65 -0.31 0.00 0.00 175.10 172.41 3fun n PRO 163 N 0.22 1.51 0.30 4.82 -0.02 -1.26 -0.82 135.00 139.74 3fun n PRO 163 Ca -0.15 0.53 0.18 0.00 -2.02 0.00 0.00 63.50 62.05 3fun n PRO 163 Cb 0.61 -2.00 0.90 0.00 -0.02 0.00 0.00 33.50 32.98 3fun n PRO 163 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 3fun h LYS 164 N 2.74 0.00 0.00 -0.52 2.10 -1.32 -0.25 116.57 119.31 3fun h LYS 164 Ca -0.42 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.23 3fun h LYS 164 Cb 1.32 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.65 3fun h LYS 164 CO 0.65 0.03 0.00 -0.85 -2.00 0.00 0.00 179.45 177.28 3fun n GLU 165 N -3.21 0.55 -3.82 0.07 0.00 -1.26 -4.85 120.64 108.12 3fun n GLU 165 Ca -0.01 0.00 -0.22 0.00 0.00 0.00 0.00 57.16 56.93 3fun n GLU 165 Cb 0.20 -1.50 -0.05 0.00 0.00 0.00 0.00 31.44 30.10 3fun n GLU 165 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 3fun s LEU 166 N -2.45 3.37 -0.04 -1.84 1.43 -0.11 -4.79 118.68 114.26 3fun s LEU 166 Ca 0.33 -0.74 0.06 0.00 -1.03 0.00 0.00 54.13 52.75 3fun s LEU 166 Cb 0.21 -1.94 -0.01 0.00 0.03 0.00 0.00 46.19 44.48 3fun s LEU 166 CO 0.44 -0.49 -0.22 -0.69 0.23 0.00 0.00 176.35 175.62 3fun s VAL 167 N -2.44 1.80 -0.11 -1.59 1.01 -0.04 -4.89 120.40 114.13 3fun s VAL 167 Ca 0.43 -0.93 -0.05 0.00 0.00 0.00 0.00 61.98 61.43 3fun s VAL 167 Cb -0.03 -1.52 -0.04 0.00 0.00 0.00 0.00 36.38 34.80 3fun s VAL 167 CO 0.26 0.51 0.07 0.00 0.00 0.00 0.00 175.10 175.93 3fun s ALA 168 N -0.18 3.57 0.06 5.51 0.00 -1.26 -1.27 121.76 128.19 3fun s ALA 168 Ca -0.01 -0.72 0.04 0.00 0.00 0.00 0.00 51.96 51.27 3fun s ALA 168 Cb -0.12 -1.75 -0.03 0.00 0.00 0.00 0.00 23.12 21.22 3fun s ALA 168 CO 0.02 0.56 -0.13 -0.51 0.00 0.00 0.00 175.76 175.70 3fun s LEU 169 N -0.81 2.27 0.31 0.00 1.43 -0.34 -5.00 118.68 116.53 3fun s LEU 169 Ca 0.13 -0.59 0.03 0.00 -1.03 0.00 0.00 54.13 52.67 3fun s LEU 169 Cb -0.12 -0.43 -0.04 0.00 0.03 0.00 0.00 46.19 45.63 3fun s LEU 169 CO 0.03 -0.10 0.15 -0.04 0.23 0.00 0.00 176.35 176.61 3fun s MET 170 N -1.68 1.60 -1.43 1.70 -1.94 -1.26 -1.09 119.30 115.20 3fun s MET 170 Ca -0.04 -1.91 -0.12 0.00 -1.71 0.00 0.00 55.69 51.91 3fun s MET 170 Cb -0.10 -0.15 -0.04 0.00 2.01 0.00 0.00 34.83 36.55 3fun s MET 170 CO 0.02 -0.43 2.51 -1.13 -0.01 0.00 0.00 175.02 175.97 3fun n SER 171 N -0.90 5.95 -3.66 3.03 3.41 -1.00 -4.69 113.62 115.77 3fun n SER 171 Ca 0.01 -2.66 -0.04 0.00 -0.26 0.00 0.00 58.87 55.91 3fun n SER 171 Cb 0.65 -1.52 -0.01 0.00 -0.26 0.00 0.00 64.21 63.06 3fun n SER 171 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3fun s ALA 172 N 2.92 -1.79 0.12 7.33 0.00 -1.16 -4.60 121.76 124.58 3fun s ALA 172 Ca 0.57 0.52 -0.30 0.00 0.00 0.00 0.00 51.96 52.75 3fun s ALA 172 Cb 0.15 0.51 -0.06 0.00 0.00 0.00 0.00 23.12 23.72 3fun s ALA 172 CO -0.06 -0.92 0.97 0.42 0.00 0.00 0.00 175.76 176.17 3fun s ILE 173 N -3.10 4.46 0.25 0.00 -1.09 -0.18 -4.84 121.20 116.71 3fun s ILE 173 Ca 0.10 2.06 -0.30 0.00 -2.23 0.00 0.00 60.65 60.28 3fun s ILE 173 Cb -0.01 -4.31 -0.10 0.00 -1.58 0.00 0.00 42.46 36.46 3fun s ILE 173 CO -0.02 0.32 1.42 -0.13 -1.23 0.00 0.00 174.94 175.31 3fun s ARG 174 N -0.06 4.28 -0.11 2.79 0.52 -1.26 -1.17 118.95 123.94 3fun s ARG 174 Ca 0.47 2.29 0.17 0.00 -0.52 0.00 0.00 55.73 58.13 3fun s ARG 174 Cb -0.24 -3.11 0.39 0.00 0.52 0.00 0.00 34.95 32.51 3fun s ARG 174 CO 0.30 -0.40 1.18 -3.47 0.02 0.00 0.00 175.30 172.94 3fun n ASP 175 N 2.20 1.37 0.00 0.23 2.03 0.46 -4.87 116.55 117.98 3fun n ASP 175 Ca 0.06 -2.98 0.00 0.00 0.52 0.00 0.00 54.79 52.39 3fun n ASP 175 Cb 0.40 -0.41 0.00 0.00 -0.72 0.00 0.00 41.12 40.39 3fun n ASP 175 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3fun n GLY 176 N -0.44 2.44 3.09 0.27 0.00 -1.25 -4.66 105.19 104.65 3fun n GLY 176 Ca 0.12 -2.03 -0.11 0.00 0.00 0.00 0.00 46.02 44.00 3fun n GLY 176 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3fun s GLU 177 N -2.42 0.42 0.09 1.61 -1.05 -1.26 -1.25 118.70 114.84 3fun s GLU 177 Ca 0.00 -0.27 -0.12 0.00 -0.15 0.00 0.00 54.97 54.43 3fun s GLU 177 Cb 0.00 0.18 0.01 0.00 -0.44 0.00 0.00 34.13 33.88 3fun s GLU 177 CO 0.00 -0.10 0.27 0.95 0.95 0.00 0.00 175.26 177.34 3fun s THR 178 N -1.08 0.11 0.63 1.83 -4.23 -0.49 -4.98 115.64 107.42 3fun s THR 178 Ca -0.12 -0.90 -0.18 0.00 -1.18 0.00 0.00 61.69 59.31 3fun s THR 178 Cb -0.06 -1.20 -0.02 0.00 1.34 0.00 0.00 72.50 72.56 3fun s THR 178 CO 0.01 -0.50 1.23 -2.84 -0.54 0.00 0.00 174.62 171.99 3fun s PRO 179 N -3.56 2.75 -0.33 3.99 0.02 -1.26 -0.01 135.00 136.60 3fun s PRO 179 Ca 0.02 1.89 -0.29 0.00 0.02 0.00 0.00 61.00 62.65 3fun s PRO 179 Cb 0.03 -1.89 0.02 0.00 0.02 0.00 0.00 34.50 32.67 3fun s PRO 179 CO -0.10 -1.40 1.06 0.34 -0.33 0.00 0.00 177.00 176.58 3fun s ASP 180 N -1.59 6.89 0.52 2.53 -1.08 -0.34 -4.60 116.67 119.00 3fun s ASP 180 Ca 0.79 0.98 0.24 0.00 -0.52 0.00 0.00 52.55 54.04 3fun s ASP 180 Cb -0.32 -2.53 1.42 0.00 -1.46 0.00 0.00 42.92 40.02 3fun s ASP 180 CO 0.36 -0.88 2.10 -0.65 0.52 0.00 0.00 175.17 176.62 3fun h PRO 181 N 8.16 0.00 0.00 4.34 0.11 -1.92 -2.07 132.00 140.63 3fun h PRO 181 Ca -0.21 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.90 3fun h PRO 181 Cb 1.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.17 3fun h PRO 181 CO 1.03 0.10 -0.06 0.39 -0.21 0.00 0.00 178.00 179.25 3fun n GLU 182 N -3.91 0.10 -3.10 1.05 1.02 -1.26 -4.70 120.64 109.85 3fun n GLU 182 Ca -0.02 0.08 0.04 0.00 -0.02 0.00 0.00 57.16 57.23 3fun n GLU 182 Cb 0.19 -1.61 -0.00 0.00 -0.02 0.00 0.00 31.44 30.00 3fun n GLU 182 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3fun s ASP 183 N -3.58 -0.98 0.19 1.62 -1.08 -0.78 -5.04 116.67 107.01 3fun s ASP 183 Ca 0.12 -0.08 0.13 0.00 -0.52 0.00 0.00 52.55 52.20 3fun s ASP 183 Cb 0.16 1.49 0.69 0.00 -1.46 0.00 0.00 42.92 43.80 3fun s ASP 183 CO 0.57 -0.16 1.39 -2.65 0.52 0.00 0.00 175.17 174.85 3fun n PRO 184 N 4.85 0.08 0.00 4.34 -0.02 -1.18 -0.96 135.00 142.12 3fun n PRO 184 Ca 0.08 0.58 0.13 0.00 -2.02 0.00 0.00 63.50 62.26 3fun n PRO 184 Cb 0.57 -1.77 0.69 0.00 -0.02 0.00 0.00 33.50 32.97 3fun n PRO 184 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3fun n SER 185 N -1.94 0.00 -4.44 2.55 3.41 -1.26 -4.86 113.62 107.08 3fun n SER 185 Ca -0.01 -0.27 -0.22 0.00 -0.26 0.00 0.00 58.87 58.12 3fun n SER 185 Cb 0.02 -0.22 -0.10 0.00 -0.26 0.00 0.00 64.21 63.66 3fun n SER 185 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3fun s ARG 186 N -2.43 1.58 0.12 4.33 0.52 -0.13 -0.95 118.95 121.98 3fun s ARG 186 Ca 0.28 -1.75 0.10 0.00 -0.52 0.00 0.00 55.73 53.84 3fun s ARG 186 Cb 0.18 -1.44 -0.04 0.00 0.52 0.00 0.00 34.95 34.17 3fun s ARG 186 CO 0.37 0.19 -0.26 0.15 0.02 0.00 0.00 175.30 175.78 3fun s LYS 187 N -3.61 1.39 -0.21 3.54 1.02 -0.00 -1.20 119.74 120.67 3fun s LYS 187 Ca 0.28 -1.29 -0.06 0.00 0.02 0.00 0.00 55.97 54.93 3fun s LYS 187 Cb -0.01 -1.82 -0.03 0.00 -0.52 0.00 0.00 37.83 35.46 3fun s LYS 187 CO 0.12 0.43 0.02 0.42 -0.92 0.00 0.00 175.35 175.42 3fun s ILE 188 N -1.05 4.05 -0.10 2.17 1.01 0.98 -0.95 121.20 127.33 3fun s ILE 188 Ca 0.12 -0.28 -0.03 0.00 0.00 0.00 0.00 60.65 60.47 3fun s ILE 188 Cb -0.10 -2.85 -0.03 0.00 0.01 0.00 0.00 42.46 39.49 3fun s ILE 188 CO 0.05 0.41 0.03 -0.31 0.00 0.00 0.00 174.94 175.12 3fun s TYR 189 N 1.11 3.25 0.16 3.97 2.02 0.01 -1.40 117.35 126.48 3fun s TYR 189 Ca 0.03 0.25 0.09 0.00 -0.37 0.00 0.00 57.07 57.06 3fun s TYR 189 Cb -0.14 -1.83 -0.04 0.00 -0.40 0.00 0.00 41.96 39.54 3fun s TYR 189 CO 0.02 0.50 -0.12 0.15 -1.57 0.00 0.00 175.55 174.53 3fun s LYS 190 N -0.85 1.98 -0.02 -0.62 1.02 -0.38 -0.36 119.74 120.51 3fun s LYS 190 Ca 0.13 -1.25 -0.10 0.00 0.02 0.00 0.00 55.97 54.77 3fun s LYS 190 Cb -0.12 -2.14 0.01 0.00 -0.52 0.00 0.00 37.83 35.07 3fun s LYS 190 CO 0.03 0.45 0.22 -0.06 -0.92 0.00 0.00 175.35 175.07 3fun s PHE 191 N -1.56 -0.10 -0.04 3.18 0.08 -0.22 -0.40 117.98 118.91 3fun s PHE 191 Ca 0.23 0.18 0.00 0.00 0.12 0.00 0.00 56.93 57.46 3fun s PHE 191 Cb -0.09 0.03 0.03 0.00 -0.57 0.00 0.00 43.02 42.42 3fun s PHE 191 CO 0.14 -0.29 -0.01 -1.50 -0.10 0.00 0.00 175.22 173.45 3fun s ILE 192 N -1.04 0.31 -0.35 0.64 2.07 -0.32 -1.74 121.20 120.77 3fun s ILE 192 Ca -0.11 0.03 0.01 0.00 -1.41 0.00 0.00 60.65 59.17 3fun s ILE 192 Cb -0.06 -0.40 0.10 0.00 0.13 0.00 0.00 42.46 42.23 3fun s ILE 192 CO 0.02 0.19 0.08 -1.58 -1.91 0.00 0.00 174.94 171.74 3fun s GLN 193 N 1.13 1.75 0.00 3.50 2.00 0.37 -1.01 119.66 127.40 3fun s GLN 193 Ca -0.08 -1.79 0.27 0.00 -2.00 0.00 0.00 55.36 51.76 3fun s GLN 193 Cb -0.14 -3.30 0.87 0.00 0.80 0.00 0.00 33.01 31.24 3fun s GLN 193 CO -0.02 -0.94 1.66 1.63 -0.50 0.00 0.00 175.29 177.13 3fun n LYS 194 N 4.39 0.14 -3.70 1.67 5.02 -1.26 -1.84 118.16 122.58 3fun n LYS 194 Ca -0.00 -0.05 -0.35 0.00 -2.02 0.00 0.00 58.31 55.88 3fun n LYS 194 Cb 0.42 -1.50 -0.08 0.00 -0.02 0.00 0.00 35.03 33.85 3fun n LYS 194 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3fun s VAL 195 N -2.90 5.39 0.20 -0.18 1.01 -1.26 -4.94 120.40 117.72 3fun s VAL 195 Ca 0.15 0.24 -0.31 0.00 0.00 0.00 0.00 61.98 62.06 3fun s VAL 195 Cb 0.18 -3.49 -0.11 0.00 0.00 0.00 0.00 36.38 32.96 3fun s VAL 195 CO 0.60 0.43 1.62 -2.84 0.00 0.00 0.00 175.10 174.91 3fun s PRO 196 N 0.40 4.18 0.10 2.72 0.02 -1.26 -4.59 135.00 136.57 3fun s PRO 196 Ca 0.09 2.46 0.04 0.00 0.02 0.00 0.00 61.00 63.61 3fun s PRO 196 Cb -0.11 -3.11 -0.04 0.00 0.02 0.00 0.00 34.50 31.26 3fun s PRO 196 CO -0.01 -0.65 -0.10 0.96 -0.33 0.00 0.00 177.00 176.87 3fun s ILE 197 N 0.99 0.97 0.62 2.83 -4.36 0.08 -4.72 121.20 117.60 3fun s ILE 197 Ca 0.70 -1.69 -0.16 0.00 -0.26 0.00 0.00 60.65 59.25 3fun s ILE 197 Cb -0.46 -1.42 -0.02 0.00 1.25 0.00 0.00 42.46 41.81 3fun s ILE 197 CO 0.34 -0.58 1.10 -2.16 0.24 0.00 0.00 174.94 173.87 3fun s PRO 198 N -2.91 3.03 0.48 0.37 0.04 -1.26 -0.64 135.00 134.12 3fun s PRO 198 Ca 0.07 1.37 0.32 0.00 0.04 0.00 0.00 61.00 62.80 3fun s PRO 198 Cb -0.02 -1.98 1.47 0.00 0.04 0.00 0.00 34.50 34.01 3fun s PRO 198 CO 0.00 -1.06 1.97 0.00 0.04 0.00 0.00 177.00 177.94 3fun n TYR 200 N -2.80 0.60 1.09 0.00 0.18 -1.26 -1.65 117.16 113.32 3fun n TYR 200 Ca 0.00 0.25 0.11 0.00 1.88 0.00 0.00 57.90 60.14 3fun n TYR 200 Cb 0.21 -0.91 0.35 0.00 -0.38 0.00 0.00 39.34 38.61 3fun n TYR 200 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 3fun n LEU 201 N -2.06 1.99 -4.69 -3.48 4.77 -0.80 -3.94 117.00 108.78 3fun n LEU 201 Ca 0.02 -0.82 -0.42 0.00 -0.03 0.00 0.00 56.01 54.75 3fun n LEU 201 Cb 0.17 -0.12 -0.03 0.00 -2.33 0.00 0.00 43.42 41.11 3fun n LEU 201 CO 0.15 0.41 0.83 -0.63 -1.33 0.00 0.00 177.39 176.83 3fun s ILE 202 N -1.77 4.63 0.02 -0.08 1.01 -0.66 -4.45 121.20 119.90 3fun s ILE 202 Ca 0.33 1.91 -0.07 0.00 0.00 0.00 0.00 60.65 62.82 3fun s ILE 202 Cb 0.19 -4.23 -0.00 0.00 0.01 0.00 0.00 42.46 38.43 3fun s ILE 202 CO 0.28 0.01 0.13 0.00 0.00 0.00 0.00 174.94 175.36 3fun s ALA 203 N 2.04 -0.25 -0.06 9.38 0.00 -1.26 -4.60 121.76 127.00 3fun s ALA 203 Ca 0.51 -0.28 -0.05 0.00 0.00 0.00 0.00 51.96 52.14 3fun s ALA 203 Cb -0.20 0.18 0.02 0.00 0.00 0.00 0.00 23.12 23.12 3fun s ALA 203 CO 0.19 -0.26 0.16 -1.17 0.00 0.00 0.00 175.76 174.68 3fun s LEU 204 N -1.71 1.24 0.01 0.00 2.96 -1.26 -2.36 118.68 117.56 3fun s LEU 204 Ca -0.11 0.32 0.03 0.00 -0.22 0.00 0.00 54.13 54.15 3fun s LEU 204 Cb -0.05 0.50 -0.01 0.00 0.50 0.00 0.00 46.19 47.13 3fun s LEU 204 CO -0.01 -0.08 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.15 3fun s VAL 205 N 0.35 0.84 -0.06 1.68 1.01 -0.25 -1.18 120.40 122.79 3fun s VAL 205 Ca -0.02 -0.64 -0.00 0.00 0.00 0.00 0.00 61.98 61.32 3fun s VAL 205 Cb -0.04 -0.74 0.03 0.00 0.00 0.00 0.00 36.38 35.63 3fun s VAL 205 CO -0.01 0.10 -0.02 -0.69 0.00 0.00 0.00 175.10 174.48 3fun s VAL 206 N -0.50 0.45 -0.03 2.92 1.01 0.05 -1.20 120.40 123.10 3fun s VAL 206 Ca 0.02 -0.00 -0.17 0.00 0.00 0.00 0.00 61.98 61.83 3fun s VAL 206 Cb -0.05 -0.54 0.05 0.00 0.00 0.00 0.00 36.38 35.84 3fun s VAL 206 CO 0.00 0.24 0.76 0.61 0.00 0.00 0.00 175.10 176.71 3fun n GLY 207 N 4.58 0.33 3.47 4.51 0.00 -0.40 -0.83 105.19 116.84 3fun n GLY 207 Ca -0.17 -0.94 -0.43 0.00 0.00 0.00 0.00 46.02 44.48 3fun n GLY 207 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fun n ALA 208 N -1.83 3.85 -2.84 4.61 0.00 -1.26 -0.86 120.51 122.17 3fun n ALA 208 Ca -0.06 -4.03 -0.35 0.00 0.00 0.00 0.00 53.44 49.01 3fun n ALA 208 Cb 0.33 -3.36 -0.06 0.00 0.00 0.00 0.00 19.45 16.36 3fun n ALA 208 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3fun s LEU 209 N 2.90 4.17 0.21 0.00 1.43 -1.26 -4.27 118.68 121.86 3fun s LEU 209 Ca 0.49 0.31 0.08 0.00 -1.03 0.00 0.00 54.13 53.97 3fun s LEU 209 Cb 0.02 -2.27 -0.05 0.00 0.03 0.00 0.00 46.19 43.92 3fun s LEU 209 CO 0.04 0.32 -0.14 -1.61 0.23 0.00 0.00 176.35 175.19 3fun s GLU 210 N -1.49 1.35 0.09 1.70 2.02 0.10 -4.87 118.70 117.60 3fun s GLU 210 Ca 0.21 -1.61 0.04 0.00 0.02 0.00 0.00 54.97 53.64 3fun s GLU 210 Cb -0.12 -1.14 -0.03 0.00 0.10 0.00 0.00 34.13 32.93 3fun s GLU 210 CO 0.11 0.18 -0.12 -1.54 0.02 0.00 0.00 175.26 173.92 3fun s SER 211 N -3.33 1.54 -0.01 -0.19 1.04 -1.26 -1.80 113.70 109.69 3fun s SER 211 Ca 0.23 -0.73 0.00 0.00 0.48 0.00 0.00 55.95 55.93 3fun s SER 211 Cb -0.01 -0.02 0.02 0.00 0.10 0.00 0.00 66.02 66.11 3fun s SER 211 CO 0.07 -0.18 0.01 -0.60 0.98 0.00 0.00 173.24 173.52 3fun s ARG 212 N -2.34 0.04 0.16 4.02 3.52 -0.42 -4.98 118.95 118.94 3fun s ARG 212 Ca 0.02 0.09 -0.30 0.00 -0.13 0.00 0.00 55.73 55.42 3fun s ARG 212 Cb -0.06 -0.20 -0.07 0.00 -1.56 0.00 0.00 34.95 33.05 3fun s ARG 212 CO 0.01 -0.10 1.14 -1.14 -0.81 0.00 0.00 175.30 174.41 3fun s GLN 213 N 0.66 4.54 0.00 5.12 0.74 -1.26 -0.71 119.66 128.75 3fun s GLN 213 Ca -0.06 1.76 0.00 0.00 0.05 0.00 0.00 55.36 57.12 3fun s GLN 213 Cb -0.08 -3.28 0.00 0.00 1.10 0.00 0.00 33.01 30.75 3fun s GLN 213 CO -0.02 -0.02 0.25 0.44 -0.55 0.00 0.00 175.29 175.39 3fun n ILE 214 N 2.65 0.00 -3.85 -2.34 -5.35 -0.14 -4.92 119.36 105.42 3fun n ILE 214 Ca 0.04 -0.39 -0.04 0.00 -0.27 0.00 0.00 62.75 62.10 3fun n ILE 214 Cb 0.46 1.14 0.01 0.00 -1.74 0.00 0.00 39.64 39.51 3fun n ILE 214 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 3fun s GLY 215 N -0.28 0.07 0.56 3.28 0.00 -1.10 -4.83 107.32 105.01 3fun s GLY 215 Ca 0.00 -0.28 0.32 0.00 0.00 0.00 0.00 44.72 44.76 3fun s GLY 215 CO 0.00 1.68 2.11 -0.56 0.00 0.00 0.00 173.10 176.33 3fun h PRO 216 N 2.00 0.00 0.00 2.90 0.13 -2.00 -2.99 132.00 132.04 3fun h PRO 216 Ca -0.27 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.75 3fun h PRO 216 Cb 1.22 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 32.12 3fun h PRO 216 CO 0.34 0.07 -0.81 2.89 -0.23 0.00 0.00 178.00 180.26 3fun n ARG 217 N -3.39 0.50 -3.68 0.86 1.85 -1.26 -5.06 116.66 106.47 3fun n ARG 217 Ca -0.01 -2.32 -0.16 0.00 -1.00 0.00 0.00 57.85 54.35 3fun n ARG 217 Cb 0.22 -0.55 -0.15 0.00 -1.05 0.00 0.00 32.46 30.93 3fun n ARG 217 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 3fun s THR 218 N -1.02 -0.22 -0.03 8.89 2.01 -1.13 -0.53 115.64 123.60 3fun s THR 218 Ca 0.33 0.33 -0.00 0.00 0.31 0.00 0.00 61.69 62.65 3fun s THR 218 Cb 0.35 -0.28 -0.04 0.00 0.01 0.00 0.00 72.50 72.55 3fun s THR 218 CO -0.12 0.14 0.03 -0.76 -0.69 0.00 0.00 174.62 173.22 3fun s LEU 219 N 2.08 3.69 -0.11 4.42 1.43 -1.26 -0.96 118.68 127.96 3fun s LEU 219 Ca 0.01 0.10 -0.11 0.00 -1.03 0.00 0.00 54.13 53.11 3fun s LEU 219 Cb -0.12 -2.04 -0.05 0.00 0.03 0.00 0.00 46.19 44.02 3fun s LEU 219 CO -0.06 0.31 0.23 0.54 0.23 0.00 0.00 176.35 177.61 3fun s VAL 220 N -1.06 5.35 -0.03 -1.59 0.11 0.12 -1.21 120.40 122.08 3fun s VAL 220 Ca 0.18 0.42 0.07 0.00 -2.93 0.00 0.00 61.98 59.72 3fun s VAL 220 Cb -0.12 -3.53 -0.02 0.00 -1.53 0.00 0.00 36.38 31.19 3fun s VAL 220 CO 0.09 0.54 -0.25 0.26 -3.33 0.00 0.00 175.10 172.41 3fun s TRP 221 N -0.55 2.38 0.16 1.54 0.52 0.11 -1.31 118.94 121.80 3fun s TRP 221 Ca 0.16 -0.49 -0.23 0.00 0.02 0.00 0.00 56.10 55.56 3fun s TRP 221 Cb -0.13 -1.53 0.08 0.00 -1.15 0.00 0.00 33.47 30.73 3fun s TRP 221 CO 0.05 -0.07 1.05 -1.54 0.02 0.00 0.00 176.95 176.47 3fun s SER 222 N -0.51 -0.03 0.73 2.95 1.04 -0.74 -0.87 113.70 116.27 3fun s SER 222 Ca 0.07 -0.58 -0.14 0.00 0.48 0.00 0.00 55.95 55.78 3fun s SER 222 Cb -0.11 0.46 0.04 0.00 0.10 0.00 0.00 66.02 66.51 3fun s SER 222 CO 0.00 -0.90 1.15 -1.61 0.98 0.00 0.00 173.24 172.86 3fun s GLU 223 N -2.35 2.28 0.41 4.02 2.02 -1.26 -0.72 118.70 123.10 3fun s GLU 223 Ca 0.20 1.55 0.11 0.00 0.02 0.00 0.00 54.97 56.85 3fun s GLU 223 Cb -0.02 -1.87 0.94 0.00 0.10 0.00 0.00 34.13 33.28 3fun s GLU 223 CO 0.04 -1.68 1.98 1.57 0.02 0.00 0.00 175.26 177.18 3fun h LYS 224 N -0.41 0.50 -0.06 1.61 2.10 -1.92 -0.70 116.57 117.69 3fun h LYS 224 Ca -0.46 -0.03 0.02 0.00 -2.00 0.00 0.00 60.65 58.17 3fun h LYS 224 Cb 1.27 -0.11 -0.00 0.00 -0.90 0.00 0.00 32.23 32.48 3fun h LYS 224 CO 0.51 0.33 0.07 0.93 -2.00 0.00 0.00 179.45 179.28 3fun h GLU 225 N 0.51 0.00 -0.01 0.07 3.07 -1.95 -2.65 114.58 113.61 3fun h GLU 225 Ca 0.28 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.14 3fun h GLU 225 Cb 0.44 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.35 3fun h GLU 225 CO -0.09 0.00 -0.21 1.04 -1.40 0.00 0.00 179.01 178.36 3fun n GLN 226 N -3.85 1.59 0.11 2.33 3.00 -0.28 -4.74 117.38 115.53 3fun n GLN 226 Ca -0.01 -0.95 -0.13 0.00 -0.01 0.00 0.00 57.00 55.90 3fun n GLN 226 Cb 0.16 -1.24 -0.06 0.00 0.00 0.00 0.00 30.24 29.10 3fun n GLN 226 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.06 177.34 3fun h VAL 227 N 2.01 0.70 -0.37 5.09 2.07 -1.32 -1.10 116.25 123.33 3fun h VAL 227 Ca 0.00 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 3fun h VAL 227 Cb 0.53 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 30.98 3fun h VAL 227 CO 0.00 0.00 0.20 -0.08 0.02 0.00 0.00 177.57 177.71 3fun h GLU 228 N -0.29 0.52 -0.53 1.57 4.81 -1.85 -0.44 114.58 118.36 3fun h GLU 228 Ca 0.01 -0.06 -0.08 0.00 -0.13 0.00 0.00 59.36 59.09 3fun h GLU 228 Cb 0.28 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.54 3fun h GLU 228 CO -0.04 0.43 -0.01 -0.22 -0.73 0.00 0.00 179.01 178.44 3fun h LYS 229 N 0.47 0.90 -0.65 1.92 3.64 -1.85 -2.59 116.57 118.40 3fun h LYS 229 Ca 0.13 -0.26 -0.07 0.00 -1.27 0.00 0.00 60.65 59.18 3fun h LYS 229 Cb 0.06 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 31.76 3fun h LYS 229 CO -0.02 0.90 0.14 0.77 -2.27 0.00 0.00 179.45 178.97 3fun h SER 230 N 0.83 1.01 -0.89 4.20 0.02 -0.88 -0.10 113.55 117.75 3fun h SER 230 Ca 0.15 -0.25 -0.02 0.00 -0.84 0.00 0.00 61.79 60.84 3fun h SER 230 Cb 0.51 -0.27 -0.04 0.00 0.14 0.00 0.00 62.40 62.74 3fun h SER 230 CO 0.03 1.00 0.49 0.00 -1.14 0.00 0.00 176.83 177.21 3fun h ALA 231 N 1.05 1.20 -0.16 3.77 0.00 -0.81 -1.80 119.26 122.51 3fun h ALA 231 Ca 0.20 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 3fun h ALA 231 Cb 0.40 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 3fun h ALA 231 CO 0.01 0.65 -0.15 -0.92 0.00 0.00 0.00 179.25 178.84 3fun h TYR 232 N 1.24 0.46 -0.79 0.00 3.20 -1.32 -3.05 116.97 116.71 3fun h TYR 232 Ca 0.31 -0.14 0.03 0.00 3.14 0.00 0.00 58.73 62.07 3fun h TYR 232 Cb 0.01 -0.10 -0.04 0.00 1.54 0.00 0.00 36.73 38.14 3fun h TYR 232 CO 0.01 0.76 0.52 1.49 -1.64 0.00 0.00 178.16 179.30 3fun h GLU 233 N 0.02 0.98 -0.45 1.82 4.57 -0.63 -2.56 114.58 118.32 3fun h GLU 233 Ca 0.03 -0.06 -0.09 0.00 -1.18 0.00 0.00 59.36 58.05 3fun h GLU 233 Cb 0.68 -0.22 -0.05 0.00 -0.16 0.00 0.00 28.75 29.00 3fun h GLU 233 CO 0.04 0.65 0.07 1.19 -1.18 0.00 0.00 179.01 179.77 3fun n PHE 234 N -4.44 1.56 0.32 0.92 3.72 -0.71 -4.52 117.46 114.31 3fun n PHE 234 Ca 0.10 -1.07 0.21 0.00 -0.05 0.00 0.00 57.45 56.64 3fun n PHE 234 Cb 0.09 -0.48 1.11 0.00 -0.94 0.00 0.00 39.48 39.26 3fun n PHE 234 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3fun h SER 235 N 2.20 0.00 0.00 4.37 4.64 -1.33 -1.89 113.55 121.54 3fun h SER 235 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 3fun h SER 235 Cb 1.81 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.90 3fun h SER 235 CO 0.44 0.01 0.00 -0.62 -0.87 0.00 0.00 176.83 175.78 3fun n GLU 236 N -3.18 0.99 -0.07 4.77 1.02 -1.26 -4.33 120.64 118.57 3fun n GLU 236 Ca -0.02 0.00 -0.07 0.00 -0.02 0.00 0.00 57.16 57.04 3fun n GLU 236 Cb 0.11 -1.39 -0.00 0.00 -0.02 0.00 0.00 31.44 30.13 3fun n GLU 236 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 3fun h THR 237 N 0.00 0.82 -0.79 2.62 2.02 -1.71 -1.07 112.91 114.80 3fun h THR 237 Ca 0.00 -0.04 -0.03 0.00 0.77 0.00 0.00 66.41 67.11 3fun h THR 237 Cb 0.00 0.70 -0.04 0.00 -1.74 0.00 0.00 68.15 67.08 3fun h THR 237 CO 0.00 0.02 0.36 -0.08 0.37 0.00 0.00 175.52 176.19 3fun h GLU 238 N 0.10 1.15 -0.96 6.66 4.57 -1.85 -0.08 114.58 124.18 3fun h GLU 238 Ca 0.13 -0.18 0.06 0.00 -1.18 0.00 0.00 59.36 58.19 3fun h GLU 238 Cb 0.17 -0.20 -0.06 0.00 -0.16 0.00 0.00 28.75 28.49 3fun h GLU 238 CO -0.21 0.91 0.62 0.77 -1.18 0.00 0.00 179.01 179.92 3fun h SER 239 N 1.13 1.00 -0.20 1.04 0.02 -1.68 -0.25 113.55 114.60 3fun h SER 239 Ca 0.27 0.01 -0.15 0.00 -0.84 0.00 0.00 61.79 61.07 3fun h SER 239 Cb 0.15 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.48 3fun h SER 239 CO -0.03 0.65 -0.42 0.24 -1.14 0.00 0.00 176.83 176.13 3fun h MET 240 N 1.14 0.75 -0.69 3.45 2.86 -0.59 -2.47 114.93 119.37 3fun h MET 240 Ca 0.41 -0.40 -0.03 0.00 -2.06 0.00 0.00 59.70 57.62 3fun h MET 240 Cb 0.13 0.02 -0.03 0.00 0.06 0.00 0.00 31.60 31.78 3fun h MET 240 CO -0.16 1.03 0.31 -0.07 1.06 0.00 0.00 176.91 179.07 3fun h LEU 241 N 0.61 0.93 -0.84 1.22 3.38 -0.30 -0.37 115.31 119.94 3fun h LEU 241 Ca 0.04 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 57.83 3fun h LEU 241 Cb 0.98 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 41.45 3fun h LEU 241 CO 0.09 0.82 0.40 0.11 0.09 0.00 0.00 178.44 179.95 3fun h LYS 242 N 0.97 1.22 -0.28 1.13 1.57 -0.91 -0.37 116.57 119.90 3fun h LYS 242 Ca 0.23 -0.18 -0.06 0.00 -1.87 0.00 0.00 60.65 58.77 3fun h LYS 242 Cb 0.16 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.25 3fun h LYS 242 CO -0.02 0.94 -0.04 0.82 -0.57 0.00 0.00 179.45 180.57 3fun h ILE 243 N 1.20 1.27 -0.95 1.86 2.04 -1.22 -2.24 117.51 119.49 3fun h ILE 243 Ca 0.29 -1.03 0.02 0.00 1.00 0.00 0.00 64.86 65.13 3fun h ILE 243 Cb 0.13 1.39 -0.05 0.00 -0.74 0.00 0.00 36.82 37.55 3fun h ILE 243 CO -0.03 0.33 0.62 0.00 0.00 0.00 0.00 178.15 179.07 3fun h ALA 244 N 0.79 1.35 -0.58 1.87 0.00 -0.76 -1.41 119.26 120.53 3fun h ALA 244 Ca 0.07 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 3fun h ALA 244 Cb 0.50 -0.37 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 3fun h ALA 244 CO 0.02 0.59 0.15 0.93 0.00 0.00 0.00 179.25 180.94 3fun h GLU 245 N 1.25 0.89 -0.85 0.00 5.08 -0.91 0.27 114.58 120.31 3fun h GLU 245 Ca 0.36 -0.19 -0.01 0.00 -1.00 0.00 0.00 59.36 58.52 3fun h GLU 245 Cb -0.10 -0.13 -0.04 0.00 0.50 0.00 0.00 28.75 28.98 3fun h GLU 245 CO -0.09 0.80 0.49 0.22 -1.00 0.00 0.00 179.01 179.43 3fun h ASP 246 N 0.86 1.04 0.60 1.42 3.58 -0.67 -0.34 116.42 122.92 3fun h ASP 246 Ca 0.19 -0.08 -0.28 0.00 0.42 0.00 0.00 57.03 57.27 3fun h ASP 246 Cb 0.30 -0.26 -0.01 0.00 1.72 0.00 0.00 39.33 41.08 3fun h ASP 246 CO -0.00 0.82 -1.34 -0.07 -2.88 0.00 0.00 179.24 175.77 3fun h LEU 247 N 1.17 0.34 0.00 2.28 3.38 -0.76 -3.39 115.31 118.34 3fun h LEU 247 Ca 0.30 -0.41 0.00 0.00 0.09 0.00 0.00 57.88 57.86 3fun h LEU 247 Cb -0.00 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.63 3fun h LEU 247 CO -0.05 1.33 -1.29 0.61 0.09 0.00 0.00 178.44 179.13 3fun n GLY 248 N 1.56 -0.44 0.00 0.83 0.00 0.89 -4.18 105.19 103.84 3fun n GLY 248 Ca -0.11 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.61 3fun n GLY 248 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fun n GLY 249 N 1.66 -2.12 3.71 -0.02 0.00 -0.14 -4.80 105.19 103.48 3fun n GLY 249 Ca -0.01 -2.14 -0.41 0.00 0.00 0.00 0.00 46.02 43.47 3fun n GLY 249 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3fun n PRO 250 N -0.09 1.98 -2.67 1.61 -0.02 -1.26 -4.42 135.00 130.13 3fun n PRO 250 Ca 0.00 0.71 -0.43 0.00 -2.02 0.00 0.00 63.50 61.76 3fun n PRO 250 Cb 0.00 -2.43 -0.02 0.00 -0.02 0.00 0.00 33.50 31.03 3fun n PRO 250 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 3fun s TYR 251 N -1.20 3.29 -2.89 6.00 5.04 -1.26 -4.95 117.35 121.39 3fun s TYR 251 Ca 0.61 1.38 0.24 0.00 -2.44 0.00 0.00 57.07 56.86 3fun s TYR 251 Cb -0.50 -3.36 0.29 0.00 0.35 0.00 0.00 41.96 38.74 3fun s TYR 251 CO 0.58 -0.55 1.32 1.33 -1.34 0.00 0.00 175.55 176.89 3fun n VAL 252 N 5.45 0.07 0.73 3.14 0.24 -1.26 -4.53 118.33 122.16 3fun n VAL 252 Ca 0.12 -0.51 0.12 0.00 -2.04 0.00 0.00 64.34 62.02 3fun n VAL 252 Cb 0.46 1.35 0.15 0.00 -1.47 0.00 0.00 33.84 34.33 3fun n VAL 252 CO 0.00 0.00 0.00 0.79 -2.14 0.00 0.00 176.83 175.48 3fun n TRP 253 N 1.28 0.20 0.00 6.34 7.02 -1.26 -5.00 117.44 126.01 3fun n TRP 253 Ca 0.15 -0.10 0.00 0.00 -1.02 0.00 0.00 57.50 56.53 3fun n TRP 253 Cb 0.58 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.47 3fun n TRP 253 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3fun n GLY 254 N 1.42 1.88 3.95 6.99 0.00 -1.26 -4.73 105.19 113.44 3fun n GLY 254 Ca 0.16 -0.19 -0.23 0.00 0.00 0.00 0.00 46.02 45.76 3fun n GLY 254 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3fun s GLN 255 N 0.00 3.47 -0.47 1.61 -2.07 -1.26 -4.99 119.66 115.95 3fun s GLN 255 Ca 0.00 -0.55 0.03 0.00 -1.82 0.00 0.00 55.36 53.02 3fun s GLN 255 Cb 0.00 -2.82 0.14 0.00 -1.09 0.00 0.00 33.01 29.24 3fun s GLN 255 CO 0.00 0.34 0.27 -0.47 -1.32 0.00 0.00 175.29 174.11 3fun s TYR 256 N -2.05 2.18 0.35 9.60 5.04 0.31 -4.29 117.35 128.50 3fun s TYR 256 Ca 0.37 -2.57 0.01 0.00 -2.44 0.00 0.00 57.07 52.43 3fun s TYR 256 Cb -0.10 -1.99 -0.03 0.00 0.35 0.00 0.00 41.96 40.20 3fun s TYR 256 CO 0.31 -0.76 0.55 -0.51 -1.34 0.00 0.00 175.55 173.81 3fun s ASP 257 N 0.12 6.24 -0.03 4.32 1.11 -0.74 -4.05 116.67 123.64 3fun s ASP 257 Ca 0.19 0.41 0.06 0.00 0.18 0.00 0.00 52.55 53.39 3fun s ASP 257 Cb -0.21 -1.96 -0.01 0.00 1.07 0.00 0.00 42.92 41.81 3fun s ASP 257 CO -0.02 -0.33 -0.21 -0.76 1.18 0.00 0.00 175.17 175.02 3fun s LEU 258 N -4.33 2.01 -0.15 1.23 1.43 -0.35 -1.20 118.68 117.32 3fun s LEU 258 Ca 0.41 -0.39 0.02 0.00 -1.03 0.00 0.00 54.13 53.13 3fun s LEU 258 Cb -0.10 -1.10 0.01 0.00 0.03 0.00 0.00 46.19 45.03 3fun s LEU 258 CO 0.36 0.23 -0.21 -0.22 0.23 0.00 0.00 176.35 176.74 3fun s LEU 259 N -0.31 2.13 -0.40 1.79 2.96 0.52 0.09 118.68 125.45 3fun s LEU 259 Ca 0.03 -0.61 -0.16 0.00 -0.22 0.00 0.00 54.13 53.17 3fun s LEU 259 Cb -0.10 -1.46 0.01 0.00 0.50 0.00 0.00 46.19 45.15 3fun s LEU 259 CO 0.01 0.07 0.39 -0.69 -1.32 0.00 0.00 176.35 174.80 3fun s VAL 260 N 0.90 5.14 0.89 1.68 1.01 -0.04 -0.57 120.40 129.41 3fun s VAL 260 Ca -0.05 -0.33 -0.13 0.00 0.00 0.00 0.00 61.98 61.46 3fun s VAL 260 Cb -0.15 -3.97 0.15 0.00 0.00 0.00 0.00 36.38 32.41 3fun s VAL 260 CO -0.04 -0.32 1.24 -0.76 0.00 0.00 0.00 175.10 175.22 3fun s LEU 261 N 2.01 2.67 0.98 3.92 1.02 -0.52 -4.59 118.68 124.17 3fun s LEU 261 Ca 0.10 0.40 -0.12 0.00 0.02 0.00 0.00 54.13 54.53 3fun s LEU 261 Cb -0.17 -2.64 0.18 0.00 0.02 0.00 0.00 46.19 43.58 3fun s LEU 261 CO 0.12 -2.36 1.11 -2.84 0.02 0.00 0.00 176.35 172.40 3fun s PRO 262 N -5.72 0.56 0.42 1.29 0.02 -1.26 -4.04 135.00 126.27 3fun s PRO 262 Ca 0.69 0.43 0.29 0.00 0.02 0.00 0.00 61.00 62.43 3fun s PRO 262 Cb -0.07 -1.76 1.32 0.00 0.02 0.00 0.00 34.50 34.02 3fun s PRO 262 CO 0.51 -2.62 1.88 -1.35 -0.33 0.00 0.00 177.00 175.09 3fun h PRO 263 N -1.81 0.00 -0.00 5.54 0.11 -1.88 -2.24 132.00 131.72 3fun h PRO 263 Ca -0.54 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.57 3fun h PRO 263 Cb 1.33 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.44 3fun h PRO 263 CO 0.59 0.00 -0.00 -1.13 -0.21 0.00 0.00 178.00 177.25 3fun n SER 264 N -2.63 0.01 -4.65 -2.05 3.41 -1.26 -0.63 113.62 105.82 3fun n SER 264 Ca 0.00 -0.89 -0.48 0.00 -0.26 0.00 0.00 58.87 57.24 3fun n SER 264 Cb 0.21 -0.04 -0.05 0.00 -0.26 0.00 0.00 64.21 64.07 3fun n SER 264 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 3fun n PHE 265 N -1.03 2.08 1.22 7.33 7.35 -0.84 -4.61 117.46 128.96 3fun n PHE 265 Ca 0.23 0.34 0.14 0.00 -0.76 0.00 0.00 57.45 57.40 3fun n PHE 265 Cb 0.13 -2.50 0.66 0.00 0.35 0.00 0.00 39.48 38.11 3fun n PHE 265 CO 0.00 0.00 0.00 -0.35 -0.76 0.00 0.00 176.76 175.65 3fun n PRO 266 N 3.73 0.25 -4.33 -7.13 -0.04 -1.26 -3.42 135.00 122.80 3fun n PRO 266 Ca 0.19 -0.02 -0.17 0.00 -0.04 0.00 0.00 63.50 63.45 3fun n PRO 266 Cb 0.26 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.11 3fun n PRO 266 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 3fun s TYR 267 N -2.77 1.56 0.15 0.54 2.02 -1.26 -0.30 117.35 117.29 3fun s TYR 267 Ca 0.22 -1.12 -0.13 0.00 -0.37 0.00 0.00 57.07 55.67 3fun s TYR 267 Cb 0.20 -0.93 0.03 0.00 -0.40 0.00 0.00 41.96 40.86 3fun s TYR 267 CO 0.50 -0.26 1.65 0.78 -1.57 0.00 0.00 175.55 176.65 3fun h GLY 268 N 2.39 0.89 -3.19 0.71 0.00 -1.94 -3.34 103.07 98.59 3fun h GLY 268 Ca -0.38 -0.58 0.01 0.00 0.00 0.00 0.00 47.33 46.38 3fun h GLY 268 CO 0.62 0.54 0.29 -0.32 0.00 0.00 0.00 176.54 177.67 3fun s GLY 269 N -3.27 -0.57 -0.04 4.60 0.00 -1.26 -1.58 107.32 105.20 3fun s GLY 269 Ca -0.13 0.71 0.00 0.00 0.00 0.00 0.00 44.72 45.31 3fun s GLY 269 CO 0.80 0.28 -0.01 -0.29 0.00 0.00 0.00 173.10 173.88 3fun s MET 270 N -3.36 0.51 -0.01 2.90 1.75 0.36 -4.99 119.30 116.46 3fun s MET 270 Ca 0.01 0.02 -0.03 0.00 -1.25 0.00 0.00 55.69 54.44 3fun s MET 270 Cb -0.01 -0.65 -0.13 0.00 2.84 0.00 0.00 34.83 36.87 3fun s MET 270 CO -0.10 -0.13 2.83 -0.85 -0.65 0.00 0.00 175.02 176.12 3fun n GLU 271 N 4.22 1.53 -1.78 4.11 0.00 -1.26 -1.26 120.64 126.20 3fun n GLU 271 Ca -0.24 -0.55 -0.42 0.00 0.00 0.00 0.00 57.16 55.95 3fun n GLU 271 Cb 0.50 -1.53 -0.03 0.00 0.00 0.00 0.00 31.44 30.39 3fun n GLU 271 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.13 176.33 3fun s ASN 272 N 1.96 6.42 0.32 -1.84 0.02 -1.26 -4.86 114.94 115.71 3fun s ASN 272 Ca 0.35 2.83 -0.29 0.00 -1.02 0.00 0.00 52.86 54.73 3fun s ASN 272 Cb 0.17 -2.60 -0.11 0.00 0.02 0.00 0.00 41.25 38.73 3fun s ASN 272 CO -0.00 -0.93 1.46 -2.16 0.02 0.00 0.00 177.10 175.49 3fun s PRO 273 N 0.89 4.20 0.00 -0.60 0.04 -1.26 -1.66 135.00 136.61 3fun s PRO 273 Ca 0.72 2.44 0.00 0.00 0.04 0.00 0.00 61.00 64.20 3fun s PRO 273 Cb -0.48 -3.03 0.00 0.00 0.04 0.00 0.00 34.50 31.03 3fun s PRO 273 CO 0.34 -0.46 0.00 0.00 0.04 0.00 0.00 177.00 176.92 3fun s LEU 275 N 0.00 -0.53 0.30 0.00 2.96 -0.67 -1.80 118.68 118.95 3fun s LEU 275 Ca 0.00 -1.72 -0.29 0.00 -0.22 0.00 0.00 54.13 51.90 3fun s LEU 275 Cb 0.00 1.08 -0.11 0.00 0.50 0.00 0.00 46.19 47.67 3fun s LEU 275 CO 0.00 -0.16 1.48 -0.89 -1.32 0.00 0.00 176.35 175.46 3fun s THR 276 N 1.12 2.36 -0.16 3.68 2.01 -0.34 -4.01 115.64 120.28 3fun s THR 276 Ca 0.23 0.32 -0.10 0.00 0.31 0.00 0.00 61.69 62.45 3fun s THR 276 Cb -0.05 -3.20 -0.05 0.00 0.01 0.00 0.00 72.50 69.21 3fun s THR 276 CO -0.07 0.06 0.18 -0.36 -0.69 0.00 0.00 174.62 173.74 3fun s PHE 277 N -0.39 3.49 0.10 4.92 0.40 -0.39 -0.36 117.98 125.75 3fun s PHE 277 Ca 0.58 0.47 0.03 0.00 -0.60 0.00 0.00 56.93 57.41 3fun s PHE 277 Cb -0.44 -2.14 -0.04 0.00 0.51 0.00 0.00 43.02 40.91 3fun s PHE 277 CO 0.50 0.43 -0.09 0.14 0.70 0.00 0.00 175.22 176.89 3fun s VAL 278 N -0.09 0.89 0.40 -0.44 -7.23 0.27 -0.49 120.40 113.72 3fun s VAL 278 Ca 0.12 -1.65 -0.25 0.00 -1.81 0.00 0.00 61.98 58.39 3fun s VAL 278 Cb -0.12 -1.37 -0.08 0.00 0.56 0.00 0.00 36.38 35.37 3fun s VAL 278 CO 0.02 -0.59 1.19 0.28 -0.31 0.00 0.00 175.10 175.69 3fun s THR 279 N -2.55 3.05 -1.16 5.32 -1.32 -0.62 -1.43 115.64 116.94 3fun s THR 279 Ca 0.06 0.89 0.21 0.00 -1.21 0.00 0.00 61.69 61.63 3fun s THR 279 Cb -0.02 -3.50 0.24 0.00 -1.51 0.00 0.00 72.50 67.71 3fun s THR 279 CO -0.01 0.09 1.66 -0.81 -2.21 0.00 0.00 174.62 173.34 3fun n PRO 280 N 0.07 0.11 0.00 7.08 -0.04 -1.26 -2.14 135.00 138.82 3fun n PRO 280 Ca 0.04 0.13 0.04 0.00 -0.04 0.00 0.00 63.50 63.67 3fun n PRO 280 Cb 0.46 -1.50 0.18 0.00 -0.04 0.00 0.00 33.50 32.60 3fun n PRO 280 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 3fun n THR 281 N -1.42 1.13 0.81 0.52 -2.24 -1.26 -1.61 114.28 110.20 3fun n THR 281 Ca 0.07 0.28 0.13 0.00 -2.27 0.00 0.00 64.05 62.25 3fun n THR 281 Cb 0.21 -1.15 0.52 0.00 -2.10 0.00 0.00 70.33 67.81 3fun n THR 281 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3fun n LEU 282 N -1.38 0.21 -3.72 3.22 4.77 -0.91 -4.49 117.00 114.70 3fun n LEU 282 Ca 0.03 0.53 -0.42 0.00 -0.03 0.00 0.00 56.01 56.12 3fun n LEU 282 Cb 0.07 -0.47 -0.00 0.00 -2.33 0.00 0.00 43.42 40.70 3fun n LEU 282 CO 0.06 -0.11 2.70 0.18 -1.33 0.00 0.00 177.39 178.90 3fun n LEU 283 N -1.70 6.89 0.15 2.23 4.77 -0.63 -4.64 117.00 124.06 3fun n LEU 283 Ca 0.06 -4.13 0.13 0.00 -0.03 0.00 0.00 56.01 52.03 3fun n LEU 283 Cb 0.32 -1.65 0.34 0.00 -2.33 0.00 0.00 43.42 40.11 3fun n LEU 283 CO 0.25 1.12 0.86 0.00 -1.33 0.00 0.00 177.39 178.30 3fun h ALA 284 N 5.99 1.00 0.00 -1.18 0.00 -1.87 -3.47 119.26 119.73 3fun h ALA 284 Ca 0.58 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.49 3fun h ALA 284 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.42 3fun h ALA 284 CO 1.89 0.00 0.00 0.41 0.00 0.00 0.00 179.25 181.55 3fun n GLY 285 N 1.11 1.01 0.03 0.00 0.00 -1.26 -4.78 105.19 101.30 3fun n GLY 285 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 3fun n GLY 285 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3fun n ASP 286 N 0.00 0.86 -0.19 1.61 5.68 -1.26 -5.00 116.55 118.26 3fun n ASP 286 Ca 0.00 -1.52 -0.02 0.00 -0.50 0.00 0.00 54.79 52.74 3fun n ASP 286 Cb 0.00 -0.03 -0.01 0.00 -1.14 0.00 0.00 41.12 39.94 3fun n ASP 286 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 3fun n LYS 287 N -0.25 -1.26 0.13 0.11 5.02 -1.26 -4.88 118.16 115.77 3fun n LYS 287 Ca 0.01 0.45 0.12 0.00 -2.02 0.00 0.00 58.31 56.87 3fun n LYS 287 Cb 0.42 -4.46 0.48 0.00 -0.02 0.00 0.00 35.03 31.45 3fun n LYS 287 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 3fun n SER 288 N -0.59 0.73 -1.72 4.39 3.41 -1.26 -2.47 113.62 116.10 3fun n SER 288 Ca -0.02 0.65 0.03 0.00 -0.26 0.00 0.00 58.87 59.26 3fun n SER 288 Cb 0.35 -0.82 0.34 0.00 -0.26 0.00 0.00 64.21 63.83 3fun n SER 288 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3fun n LEU 289 N -2.27 5.48 0.03 1.04 4.77 -1.26 -4.61 117.00 120.18 3fun n LEU 289 Ca 0.03 -3.08 0.09 0.00 -0.03 0.00 0.00 56.01 53.01 3fun n LEU 289 Cb 0.28 -0.68 0.38 0.00 -2.33 0.00 0.00 43.42 41.07 3fun n LEU 289 CO 0.22 0.72 0.78 -1.54 -1.33 0.00 0.00 177.39 176.25 3fun n SER 290 N 0.08 0.19 0.27 -1.43 3.41 -1.03 -2.17 113.62 112.94 3fun n SER 290 Ca 0.31 0.54 0.10 0.00 -0.26 0.00 0.00 58.87 59.57 3fun n SER 290 Cb 1.21 -0.58 0.73 0.00 -0.26 0.00 0.00 64.21 65.30 3fun n SER 290 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3fun h ASN 291 N 0.00 0.00 -0.83 4.04 -1.07 -1.86 -0.92 115.58 114.93 3fun h ASN 291 Ca 0.00 0.00 -0.03 0.00 0.07 0.00 0.00 56.30 56.34 3fun h ASN 291 Cb 0.31 0.00 -0.04 0.00 -2.07 0.00 0.00 38.32 36.52 3fun h ASN 291 CO 0.00 0.02 0.40 0.58 0.07 0.00 0.00 177.43 178.50 3fun h VAL 292 N 0.00 1.26 -0.47 6.14 2.07 -1.83 -0.12 116.25 123.29 3fun h VAL 292 Ca -0.00 -0.72 -0.13 0.00 0.82 0.00 0.00 66.70 66.67 3fun h VAL 292 Cb 0.04 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 29.99 3fun h VAL 292 CO 0.00 0.31 -0.22 0.40 0.02 0.00 0.00 177.57 178.09 3fun h ILE 293 N 1.19 1.27 -1.00 4.57 1.08 -1.40 -1.02 117.51 122.19 3fun h ILE 293 Ca 0.29 -1.38 0.06 0.00 -0.39 0.00 0.00 64.86 63.44 3fun h ILE 293 Cb 0.12 1.14 -0.07 0.00 -3.07 0.00 0.00 36.82 34.94 3fun h ILE 293 CO -0.04 0.47 0.65 0.00 -0.69 0.00 0.00 178.15 178.55 3fun h ALA 294 N 0.92 1.39 0.20 1.87 0.00 -0.78 0.11 119.26 122.96 3fun h ALA 294 Ca 0.11 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 3fun h ALA 294 Cb 0.79 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.27 3fun h ALA 294 CO 0.07 0.45 -0.10 1.25 0.00 0.00 0.00 179.25 180.92 3fun h HIS 295 N 1.18 -0.25 -0.76 0.00 -0.00 -0.70 -1.15 115.15 113.47 3fun h HIS 295 Ca 0.43 -0.01 -0.05 0.00 -0.00 0.00 0.00 60.37 60.74 3fun h HIS 295 Cb 0.15 0.08 -0.03 0.00 -0.00 0.00 0.00 27.41 27.61 3fun h HIS 295 CO -0.00 -0.08 0.26 0.93 -0.00 0.00 0.00 177.93 179.04 3fun h GLU 296 N -0.38 1.16 -0.44 5.26 4.39 -0.80 -2.13 114.58 121.63 3fun h GLU 296 Ca -0.03 -0.24 0.04 0.00 0.34 0.00 0.00 59.36 59.47 3fun h GLU 296 Cb 0.29 -0.18 -0.04 0.00 -0.10 0.00 0.00 28.75 28.73 3fun h GLU 296 CO 0.05 0.97 0.22 0.82 -1.16 0.00 0.00 179.01 179.91 3fun h ILE 297 N 1.12 0.97 -0.21 3.13 2.04 -0.73 -2.51 117.51 121.31 3fun h ILE 297 Ca 0.25 -0.15 0.01 0.00 1.00 0.00 0.00 64.86 65.96 3fun h ILE 297 Cb 0.28 0.48 -0.01 0.00 -0.74 0.00 0.00 36.82 36.83 3fun h ILE 297 CO -0.01 0.08 0.14 0.28 0.00 0.00 0.00 178.15 178.64 3fun h SER 298 N 0.44 0.23 0.08 1.72 0.02 -0.58 -0.59 113.55 114.88 3fun h SER 298 Ca 0.19 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.14 3fun h SER 298 Cb 0.10 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 62.58 3fun h SER 298 CO -0.14 0.16 0.00 0.45 -1.14 0.00 0.00 176.83 176.17 3fun h HIS 299 N 0.27 0.00 0.00 3.45 3.86 -0.96 -1.46 115.15 120.30 3fun h HIS 299 Ca 0.08 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.29 3fun h HIS 299 Cb 0.00 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.47 3fun h HIS 299 CO -0.00 0.00 0.00 0.43 0.86 0.00 0.00 177.93 179.22 3fun n SER 300 N -2.62 0.50 0.01 2.45 7.64 -0.23 -0.97 113.62 120.41 3fun n SER 300 Ca -0.02 0.68 -0.03 0.00 1.01 0.00 0.00 58.87 60.51 3fun n SER 300 Cb 0.07 -0.76 -0.01 0.00 -1.01 0.00 0.00 64.21 62.50 3fun n SER 300 CO 0.00 0.00 0.00 0.79 -3.01 0.00 0.00 175.04 172.82 3fun n TRP 301 N -2.11 0.00 -3.08 1.43 8.01 -0.60 -4.11 117.44 116.99 3fun n TRP 301 Ca 0.00 0.00 -0.45 0.00 -1.31 0.00 0.00 57.50 55.75 3fun n TRP 301 Cb 0.11 -0.13 -0.04 0.00 -2.01 0.00 0.00 31.31 29.25 3fun n TRP 301 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.69 177.63 3fun s THR 302 N -2.20 4.81 0.00 -0.99 -4.23 -0.89 -1.90 115.64 110.23 3fun s THR 302 Ca -0.07 -1.10 0.00 0.00 -1.18 0.00 0.00 61.69 59.34 3fun s THR 302 Cb 0.01 -4.55 0.00 0.00 1.34 0.00 0.00 72.50 69.30 3fun s THR 302 CO 0.10 -1.21 0.00 0.61 -0.54 0.00 0.00 174.62 173.59 3fun n GLY 303 N 5.21 3.19 0.08 3.99 0.00 0.13 -4.25 105.19 113.54 3fun n GLY 303 Ca -0.03 -0.70 -0.07 0.00 0.00 0.00 0.00 46.02 45.22 3fun n GLY 303 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3fun n ASN 304 N 0.00 0.87 -0.10 1.61 3.02 -0.14 -3.95 115.26 116.57 3fun n ASN 304 Ca 0.00 0.41 -0.14 0.00 -0.03 0.00 0.00 54.58 54.82 3fun n ASN 304 Cb 0.00 -0.02 -0.05 0.00 -0.61 0.00 0.00 39.78 39.10 3fun n ASN 304 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3fun n LEU 305 N -3.02 1.89 -4.63 3.41 4.77 -1.00 -4.85 117.00 113.58 3fun n LEU 305 Ca -0.16 0.44 -0.38 0.00 -0.03 0.00 0.00 56.01 55.88 3fun n LEU 305 Cb 1.02 -0.83 -0.09 0.00 -2.33 0.00 0.00 43.42 41.19 3fun n LEU 305 CO 0.45 -0.08 0.03 -0.69 -1.33 0.00 0.00 177.39 175.76 3fun s VAL 306 N -2.55 5.21 0.01 4.08 1.01 -0.80 -0.50 120.40 126.87 3fun s VAL 306 Ca -0.27 0.53 0.08 0.00 0.00 0.00 0.00 61.98 62.31 3fun s VAL 306 Cb 0.06 -3.67 -0.02 0.00 0.00 0.00 0.00 36.38 32.75 3fun s VAL 306 CO 0.40 0.21 -0.23 -0.89 0.00 0.00 0.00 175.10 174.60 3fun s THR 307 N 1.72 1.81 0.27 3.92 2.01 -0.64 0.17 115.64 124.91 3fun s THR 307 Ca 0.14 -1.12 -0.31 0.00 0.31 0.00 0.00 61.69 60.72 3fun s THR 307 Cb -0.15 -1.54 -0.12 0.00 0.01 0.00 0.00 72.50 70.71 3fun s THR 307 CO 0.09 0.38 1.64 -0.46 -0.69 0.00 0.00 174.62 175.57 3fun n ASN 308 N 2.16 3.93 0.01 3.53 2.04 -1.26 -0.42 115.26 125.26 3fun n ASN 308 Ca -0.16 1.13 -0.08 0.00 -0.44 0.00 0.00 54.58 55.02 3fun n ASN 308 Cb 0.52 -1.59 0.08 0.00 -2.53 0.00 0.00 39.78 36.26 3fun n ASN 308 CO 0.00 0.00 0.00 0.50 -0.44 0.00 0.00 177.26 177.32 3fun h LYS 309 N 5.31 0.52 -4.48 -3.83 3.64 -1.03 -3.40 116.57 113.28 3fun h LYS 309 Ca -0.46 -0.31 -0.22 0.00 -1.27 0.00 0.00 60.65 58.39 3fun h LYS 309 Cb 1.22 0.03 -0.15 0.00 -0.41 0.00 0.00 32.23 32.92 3fun h LYS 309 CO 0.84 0.91 -0.58 0.95 -2.27 0.00 0.00 179.45 179.29 3fun s THR 310 N -4.03 0.02 -0.32 1.00 -4.23 -1.26 -2.69 115.64 104.13 3fun s THR 310 Ca -0.07 -1.93 0.27 0.00 -1.18 0.00 0.00 61.69 58.78 3fun s THR 310 Cb 0.12 -2.39 0.30 0.00 1.34 0.00 0.00 72.50 71.86 3fun s THR 310 CO 0.83 -0.08 1.80 -0.50 -0.54 0.00 0.00 174.62 176.12 3fun h TRP 311 N 2.63 0.00 -0.11 3.99 4.06 -1.99 -1.98 115.95 122.56 3fun h TRP 311 Ca -0.35 0.00 0.03 0.00 2.06 0.00 0.00 58.89 60.63 3fun h TRP 311 Cb 1.24 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.40 3fun h TRP 311 CO 0.37 0.00 0.11 -0.44 -3.56 0.00 0.00 178.44 174.92 3fun h ASP 312 N 0.00 0.00 -0.45 -3.49 3.32 -1.97 -2.37 116.42 111.47 3fun h ASP 312 Ca 0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 3fun h ASP 312 Cb 0.44 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.97 3fun h ASP 312 CO 0.00 0.00 0.02 1.41 -1.72 0.00 0.00 179.24 178.95 3fun n HIS 313 N -3.93 1.59 -0.25 4.55 8.25 -0.74 -2.76 115.22 121.93 3fun n HIS 313 Ca -0.00 -0.86 0.25 0.00 -0.26 0.00 0.00 57.72 56.84 3fun n HIS 313 Cb 0.22 -0.44 0.61 0.00 1.12 0.00 0.00 29.99 31.49 3fun n HIS 313 CO 0.00 0.00 0.00 0.35 0.64 0.00 0.00 176.34 177.33 3fun h PHE 314 N 2.84 0.33 -0.13 4.41 3.57 -1.53 -0.45 116.94 125.97 3fun h PHE 314 Ca 0.03 0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.58 3fun h PHE 314 Cb 1.77 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 40.41 3fun h PHE 314 CO 0.85 0.06 0.14 0.11 -2.23 0.00 0.00 178.31 177.24 3fun h TRP 315 N 0.22 0.00 -0.49 0.41 5.08 -1.83 -1.18 115.95 118.16 3fun h TRP 315 Ca 0.49 0.00 -0.01 0.00 1.08 0.00 0.00 58.89 60.45 3fun h TRP 315 Cb 1.54 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 27.68 3fun h TRP 315 CO -0.00 0.00 0.26 -0.07 -1.28 0.00 0.00 178.44 177.35 3fun h LEU 316 N 0.00 0.62 0.03 0.11 3.38 -1.42 0.34 115.31 118.36 3fun h LEU 316 Ca 0.06 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.94 3fun h LEU 316 Cb 0.34 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 3fun h LEU 316 CO -0.00 0.54 -0.03 0.78 0.09 0.00 0.00 178.44 179.82 3fun h ASN 317 N 0.65 -0.07 0.16 -0.43 4.21 -1.39 -3.24 115.58 115.47 3fun h ASN 317 Ca 0.17 0.01 -0.36 0.00 1.21 0.00 0.00 56.30 57.33 3fun h ASN 317 Cb 0.06 0.03 -0.00 0.00 -1.12 0.00 0.00 38.32 37.28 3fun h ASN 317 CO -0.03 -0.04 -1.85 -0.33 -1.29 0.00 0.00 177.43 173.89 3fun h GLU 318 N -0.06 0.34 -0.44 0.81 4.39 -1.10 -2.81 114.58 115.71 3fun h GLU 318 Ca 0.00 -0.58 0.02 0.00 0.34 0.00 0.00 59.36 59.14 3fun h GLU 318 Cb 0.06 0.22 -0.03 0.00 -0.10 0.00 0.00 28.75 28.90 3fun h GLU 318 CO -0.01 1.28 0.27 0.78 -1.16 0.00 0.00 179.01 180.17 3fun h GLY 319 N 0.82 0.62 1.55 -3.84 0.00 -0.40 0.11 103.07 101.94 3fun h GLY 319 Ca -0.38 -0.21 -0.14 0.00 0.00 0.00 0.00 47.33 46.61 3fun h GLY 319 CO 0.14 0.19 -0.45 0.45 0.00 0.00 0.00 176.54 176.86 3fun h HIS 320 N 0.55 0.58 -0.35 5.60 3.86 -1.68 -1.10 115.15 122.60 3fun h HIS 320 Ca 0.17 -0.18 -0.06 0.00 -1.16 0.00 0.00 60.37 59.14 3fun h HIS 320 Cb -0.01 -0.12 -0.01 0.00 1.06 0.00 0.00 27.41 28.33 3fun h HIS 320 CO -0.06 0.85 -0.03 1.15 0.86 0.00 0.00 177.93 180.70 3fun h THR 321 N 0.39 1.27 -0.65 2.45 2.02 -1.18 -0.54 112.91 116.67 3fun h THR 321 Ca 0.03 -1.04 -0.04 0.00 0.77 0.00 0.00 66.41 66.13 3fun h THR 321 Cb 0.94 1.24 -0.03 0.00 -1.74 0.00 0.00 68.15 68.56 3fun h THR 321 CO 0.08 0.34 0.24 0.58 0.37 0.00 0.00 175.52 177.14 3fun h VAL 322 N 0.45 1.23 -0.40 3.16 2.07 -0.70 0.16 116.25 122.22 3fun h VAL 322 Ca 0.10 -0.74 0.01 0.00 0.82 0.00 0.00 66.70 66.89 3fun h VAL 322 Cb 0.51 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 30.72 3fun h VAL 322 CO 0.02 0.29 0.25 0.22 0.02 0.00 0.00 177.57 178.37 3fun h TYR 323 N 0.94 0.46 -0.31 1.57 3.20 -0.94 -0.27 116.97 121.62 3fun h TYR 323 Ca 0.22 0.01 -0.08 0.00 3.14 0.00 0.00 58.73 62.02 3fun h TYR 323 Cb 0.20 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.31 3fun h TYR 323 CO 0.02 0.28 -0.13 -0.07 -1.64 0.00 0.00 178.16 176.62 3fun h LEU 324 N 0.50 0.65 -0.53 2.82 3.38 -0.74 -2.36 115.31 119.03 3fun h LEU 324 Ca 0.16 -0.39 0.10 0.00 0.09 0.00 0.00 57.88 57.84 3fun h LEU 324 Cb -0.01 -0.18 -0.11 0.00 0.09 0.00 0.00 40.66 40.45 3fun h LEU 324 CO -0.06 0.90 -0.25 -0.08 0.09 0.00 0.00 178.44 179.04 3fun h GLU 325 N 0.40 -0.12 0.00 1.13 4.81 -0.48 -0.23 114.58 120.09 3fun h GLU 325 Ca 0.07 0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.24 3fun h GLU 325 Cb 0.64 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.04 3fun h GLU 325 CO 0.04 -0.08 -0.32 0.00 -0.73 0.00 0.00 179.01 177.92 3fun h ARG 326 N -0.12 0.00 -0.28 1.92 3.08 -0.92 -0.97 114.38 117.09 3fun h ARG 326 Ca 0.24 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 60.16 3fun h ARG 326 Cb 0.50 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.54 3fun h ARG 326 CO -0.61 0.32 -0.37 0.45 -1.07 0.00 0.00 179.97 178.69 3fun h HIS 327 N 0.00 0.76 -0.23 3.04 3.86 -0.78 -0.36 115.15 121.43 3fun h HIS 327 Ca -0.00 -0.21 -0.01 0.00 -1.16 0.00 0.00 60.37 58.99 3fun h HIS 327 Cb 0.81 -0.17 -0.01 0.00 1.06 0.00 0.00 27.41 29.10 3fun h HIS 327 CO 0.00 0.92 0.12 0.82 0.86 0.00 0.00 177.93 180.66 3fun h ILE 328 N 0.54 1.12 -0.84 2.45 2.04 -0.35 0.47 117.51 122.95 3fun h ILE 328 Ca 0.05 -0.34 -0.01 0.00 1.00 0.00 0.00 64.86 65.56 3fun h ILE 328 Cb 0.88 0.92 -0.04 0.00 -0.74 0.00 0.00 36.82 37.85 3fun h ILE 328 CO 0.08 0.12 0.48 0.00 0.00 0.00 0.00 178.15 178.83 3fun h GLY 330 N 1.18 0.66 1.23 0.00 0.00 -0.78 0.07 103.07 105.42 3fun h GLY 330 Ca 0.30 -0.63 -0.10 0.00 0.00 0.00 0.00 47.33 46.91 3fun h GLY 330 CO -0.05 0.57 -0.07 -0.09 0.00 0.00 0.00 176.54 176.90 3fun h ARG 331 N 0.51 0.92 0.02 4.80 9.65 -0.37 0.21 114.38 130.11 3fun h ARG 331 Ca 0.05 -0.30 -0.27 0.00 -1.10 0.00 0.00 59.98 58.36 3fun h ARG 331 Cb 0.85 -0.08 0.02 0.00 -1.39 0.00 0.00 29.97 29.38 3fun h ARG 331 CO 0.07 0.95 -1.08 -0.07 2.80 0.00 0.00 179.97 182.65 3fun h LEU 332 N 0.83 0.89 -0.58 3.80 3.38 -1.13 -3.40 115.31 119.11 3fun h LEU 332 Ca 0.14 -0.73 0.00 0.00 0.09 0.00 0.00 57.88 57.38 3fun h LEU 332 Cb 0.59 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.06 3fun h LEU 332 CO 0.04 1.54 0.00 0.49 0.09 0.00 0.00 178.44 180.59 3fun n PHE 333 N -3.84 0.00 0.00 1.13 3.72 -0.01 -5.11 117.46 113.35 3fun n PHE 333 Ca -0.11 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.29 3fun n PHE 333 Cb 0.90 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.44 3fun n PHE 333 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3fun n GLY 334 N 0.19 2.62 0.29 1.37 0.00 0.72 -4.57 105.19 105.81 3fun n GLY 334 Ca 0.00 -1.90 -0.04 0.00 0.00 0.00 0.00 46.02 44.08 3fun n GLY 334 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3fun h GLU 335 N 0.00 0.78 -0.70 1.61 4.57 -1.92 -1.54 114.58 117.38 3fun h GLU 335 Ca 0.00 -0.19 0.04 0.00 -1.18 0.00 0.00 59.36 58.03 3fun h GLU 335 Cb 0.00 -0.10 -0.04 0.00 -0.16 0.00 0.00 28.75 28.45 3fun h GLU 335 CO 0.00 0.76 0.46 0.87 -1.18 0.00 0.00 179.01 179.92 3fun h LYS 336 N 0.74 0.78 -0.41 1.92 1.57 -1.93 -0.94 116.57 118.29 3fun h LYS 336 Ca 0.15 -0.05 -0.14 0.00 -1.87 0.00 0.00 60.65 58.74 3fun h LYS 336 Cb 0.40 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 3fun h LYS 336 CO 0.01 0.52 -0.29 0.35 -0.57 0.00 0.00 179.45 179.47 3fun h PHE 337 N 0.81 1.09 -0.46 -1.35 3.57 -1.55 -0.08 116.94 118.97 3fun h PHE 337 Ca 0.28 -0.30 0.05 0.00 3.53 0.00 0.00 57.97 61.54 3fun h PHE 337 Cb 0.11 -0.24 -0.05 0.00 2.79 0.00 0.00 35.95 38.57 3fun h PHE 337 CO -0.00 1.11 0.20 -0.09 -2.23 0.00 0.00 178.31 177.30 3fun h ARG 338 N 0.75 0.39 -0.79 1.11 2.43 -0.66 -0.80 114.38 116.81 3fun h ARG 338 Ca 0.08 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.19 3fun h ARG 338 Cb 0.87 -0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 30.30 3fun h ARG 338 CO 0.08 0.26 0.35 0.45 -1.51 0.00 0.00 179.97 179.59 3fun h HIS 339 N 0.40 1.17 -0.41 2.20 3.86 -1.00 0.55 115.15 121.91 3fun h HIS 339 Ca 0.21 -0.07 0.04 0.00 -1.16 0.00 0.00 60.37 59.39 3fun h HIS 339 Cb 0.16 -0.36 -0.04 0.00 1.06 0.00 0.00 27.41 28.23 3fun h HIS 339 CO -0.13 0.87 0.17 0.35 0.86 0.00 0.00 177.93 180.06 3fun h PHE 340 N 1.13 0.32 -0.25 2.45 3.57 -0.31 0.12 116.94 123.97 3fun h PHE 340 Ca 0.27 0.02 -0.16 0.00 3.53 0.00 0.00 57.97 61.63 3fun h PHE 340 Cb 0.17 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 38.82 3fun h PHE 340 CO 0.02 0.14 -0.49 -0.91 -2.23 0.00 0.00 178.31 174.84 3fun h ASN 341 N 0.36 0.73 -0.58 0.41 -0.26 -0.87 -1.05 115.58 114.33 3fun h ASN 341 Ca 0.18 -0.37 0.03 0.00 -0.56 0.00 0.00 56.30 55.58 3fun h ASN 341 Cb 0.13 -0.21 -0.04 0.00 -1.06 0.00 0.00 38.32 37.15 3fun h ASN 341 CO -0.16 1.10 0.35 0.00 -1.06 0.00 0.00 177.43 177.66 3fun h ALA 342 N 0.92 0.75 -0.29 -0.83 0.00 -0.50 -0.80 119.26 118.52 3fun h ALA 342 Ca 0.03 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.78 3fun h ALA 342 Cb 1.04 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 3fun h ALA 342 CO 0.10 0.08 -0.40 1.25 0.00 0.00 0.00 179.25 180.27 3fun h LEU 343 N 0.69 0.74 -1.11 0.00 5.85 -0.52 -2.16 115.31 118.80 3fun h LEU 343 Ca 0.23 -0.34 0.01 0.00 0.84 0.00 0.00 57.88 58.63 3fun h LEU 343 Cb 0.03 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 40.80 3fun h LEU 343 CO -0.10 1.05 0.60 1.23 -0.34 0.00 0.00 178.44 180.88 3fun h GLY 344 N 0.96 1.28 1.21 3.75 0.00 -0.90 -1.93 103.07 107.45 3fun h GLY 344 Ca 0.05 -0.47 -0.06 0.00 0.00 0.00 0.00 47.33 46.85 3fun h GLY 344 CO 0.09 0.45 0.16 -1.33 0.00 0.00 0.00 176.54 175.90 3fun h GLY 345 N 1.21 1.06 0.97 4.60 0.00 -0.60 -0.76 103.07 109.55 3fun h GLY 345 Ca 0.34 -0.63 0.02 0.00 0.00 0.00 0.00 47.33 47.05 3fun h GLY 345 CO -0.08 0.59 0.57 -0.25 0.00 0.00 0.00 176.54 177.37 3fun h TRP 346 N 0.94 1.07 -0.67 5.60 2.91 -0.90 -0.40 115.95 124.51 3fun h TRP 346 Ca 0.20 0.03 0.07 0.00 1.13 0.00 0.00 58.89 60.32 3fun h TRP 346 Cb 0.33 -0.36 -0.06 0.00 -0.51 0.00 0.00 29.16 28.56 3fun h TRP 346 CO 0.02 0.66 0.35 0.78 -1.03 0.00 0.00 178.44 179.22 3fun h GLY 347 N 1.14 0.98 1.50 2.65 0.00 -0.53 0.50 103.07 109.31 3fun h GLY 347 Ca 0.32 -0.23 -0.08 0.00 0.00 0.00 0.00 47.33 47.34 3fun h GLY 347 CO -0.08 0.11 -0.11 0.83 0.00 0.00 0.00 176.54 177.29 3fun h GLU 348 N 0.63 0.60 -0.53 4.80 4.39 -0.49 -1.72 114.58 122.25 3fun h GLU 348 Ca 0.31 -0.18 -0.06 0.00 0.34 0.00 0.00 59.36 59.77 3fun h GLU 348 Cb 0.25 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.82 3fun h GLU 348 CO -0.21 0.70 0.11 1.25 -1.16 0.00 0.00 179.01 179.69 3fun h LEU 349 N 0.55 0.83 -0.58 1.33 5.85 -0.44 -1.23 115.31 121.61 3fun h LEU 349 Ca 0.10 -0.25 0.06 0.00 0.84 0.00 0.00 57.88 58.63 3fun h LEU 349 Cb 0.52 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 41.27 3fun h LEU 349 CO 0.03 0.86 0.29 1.56 -0.34 0.00 0.00 178.44 180.84 3fun h GLN 350 N 0.76 0.52 -0.33 1.25 4.20 -0.43 -1.26 115.11 119.83 3fun h GLN 350 Ca 0.16 -0.03 0.01 0.00 0.06 0.00 0.00 58.65 58.85 3fun h GLN 350 Cb 0.37 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.01 3fun h GLN 350 CO 0.01 0.35 0.21 -0.91 -0.67 0.00 0.00 178.83 177.81 3fun h ASN 351 N 0.54 0.36 -0.66 1.46 2.35 -0.96 -1.23 115.58 117.43 3fun h ASN 351 Ca 0.27 -0.01 -0.05 0.00 -0.55 0.00 0.00 56.30 55.96 3fun h ASN 351 Cb 0.21 -0.09 -0.03 0.00 0.05 0.00 0.00 38.32 38.46 3fun h ASN 351 CO -0.20 0.26 0.20 0.28 -1.65 0.00 0.00 177.43 176.33 3fun h SER 352 N 0.43 0.97 -0.52 5.81 0.02 -0.79 -0.47 113.55 119.01 3fun h SER 352 Ca 0.12 -0.21 -0.10 0.00 -0.84 0.00 0.00 61.79 60.76 3fun h SER 352 Cb -0.04 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.23 3fun h SER 352 CO -0.03 0.93 -0.06 0.58 -1.14 0.00 0.00 176.83 177.10 3fun h VAL 353 N 0.97 1.27 -0.58 2.27 2.07 -1.07 -1.01 116.25 120.16 3fun h VAL 353 Ca 0.21 -1.19 -0.10 0.00 0.82 0.00 0.00 66.70 66.45 3fun h VAL 353 Cb 0.30 0.98 -0.02 0.00 -1.52 0.00 0.00 31.29 31.04 3fun h VAL 353 CO -0.01 0.42 -0.01 0.50 0.02 0.00 0.00 177.57 178.49 3fun h LYS 354 N 0.82 1.03 0.28 1.57 3.64 -0.95 0.27 116.57 123.23 3fun h LYS 354 Ca 0.14 -0.33 -0.01 0.00 -1.27 0.00 0.00 60.65 59.18 3fun h LYS 354 Cb 0.61 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.33 3fun h LYS 354 CO 0.04 1.03 -0.20 1.15 -2.27 0.00 0.00 179.45 179.19 3fun h THR 355 N 0.93 0.58 -0.02 1.00 2.02 -0.81 -3.21 112.91 113.39 3fun h THR 355 Ca 0.16 0.00 -0.20 0.00 0.77 0.00 0.00 66.41 67.14 3fun h THR 355 Cb 0.56 0.58 -0.00 0.00 -1.74 0.00 0.00 68.15 67.55 3fun h THR 355 CO 0.03 0.00 -0.85 -0.26 0.37 0.00 0.00 175.52 174.81 3fun h PHE 356 N -0.48 0.51 0.00 3.16 0.04 -1.14 -3.50 116.94 115.53 3fun h PHE 356 Ca -0.02 -0.26 0.00 0.00 2.80 0.00 0.00 57.97 60.49 3fun h PHE 356 Cb 0.41 -0.06 0.00 0.00 2.20 0.00 0.00 35.95 38.50 3fun h PHE 356 CO -0.11 1.05 0.00 0.41 -0.60 0.00 0.00 178.31 179.06 3fun n GLY 357 N 0.79 2.65 0.02 -1.45 0.00 0.94 -4.63 105.19 103.51 3fun n GLY 357 Ca -0.05 -1.56 0.06 0.00 0.00 0.00 0.00 46.02 44.47 3fun n GLY 357 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 3fun n GLU 358 N 1.24 0.02 -0.12 1.61 0.28 -1.23 -1.43 120.64 121.00 3fun n GLU 358 Ca 0.00 0.33 0.05 0.00 -0.16 0.00 0.00 57.16 57.38 3fun n GLU 358 Cb 0.00 -1.54 0.12 0.00 1.43 0.00 0.00 31.44 31.44 3fun n GLU 358 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 3fun n THR 359 N -1.58 0.76 -2.32 3.84 -2.24 -1.26 -2.34 114.28 109.13 3fun n THR 359 Ca 0.02 -0.88 -0.41 0.00 -2.27 0.00 0.00 64.05 60.51 3fun n THR 359 Cb 0.13 0.67 -0.03 0.00 -2.10 0.00 0.00 70.33 69.00 3fun n THR 359 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 3fun s HIS 360 N -0.96 3.37 0.62 4.78 2.46 -0.52 -4.87 115.29 120.16 3fun s HIS 360 Ca 0.19 1.41 0.35 0.00 0.47 0.00 0.00 55.06 57.48 3fun s HIS 360 Cb 0.10 -3.48 2.02 0.00 -0.13 0.00 0.00 32.58 31.09 3fun s HIS 360 CO 0.14 -1.35 2.27 -1.35 -2.47 0.00 0.00 174.74 171.99 3fun h PRO 361 N 4.91 0.00 -0.04 2.88 0.11 -1.95 -1.40 132.00 136.51 3fun h PRO 361 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3fun h PRO 361 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3fun h PRO 361 CO 0.73 0.00 0.00 1.19 -0.21 0.00 0.00 178.00 179.71 3fun n PHE 362 N -3.55 0.05 0.71 0.65 3.72 -1.26 -2.73 117.46 115.05 3fun n PHE 362 Ca -0.02 -0.02 0.10 0.00 -0.05 0.00 0.00 57.45 57.45 3fun n PHE 362 Cb 0.11 0.00 0.10 0.00 -0.94 0.00 0.00 39.48 38.75 3fun n PHE 362 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 3fun n THR 363 N -0.54 0.09 -1.86 4.37 -2.24 -0.53 -4.87 114.28 108.71 3fun n THR 363 Ca 0.13 -0.54 -0.33 0.00 -2.27 0.00 0.00 64.05 61.04 3fun n THR 363 Cb 0.11 1.32 0.03 0.00 -2.10 0.00 0.00 70.33 69.70 3fun n THR 363 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3fun s LYS 364 N -1.56 3.03 -0.00 -0.78 1.02 -1.11 -3.82 119.74 116.52 3fun s LYS 364 Ca 0.24 1.25 -0.19 0.00 0.02 0.00 0.00 55.97 57.29 3fun s LYS 364 Cb 0.17 -1.99 -0.29 0.00 -0.52 0.00 0.00 37.83 35.20 3fun s LYS 364 CO 0.25 -1.05 1.01 1.25 -0.92 0.00 0.00 175.35 175.89 3fun h LEU 365 N 0.11 0.61 -8.87 3.17 5.85 -1.75 -3.42 115.31 111.01 3fun h LEU 365 Ca -0.46 -0.86 -0.63 0.00 0.84 0.00 0.00 57.88 56.76 3fun h LEU 365 Cb 1.23 -0.19 -0.19 0.00 0.37 0.00 0.00 40.66 41.88 3fun h LEU 365 CO 0.56 1.41 -0.57 -0.69 -0.34 0.00 0.00 178.44 178.80 3fun s VAL 366 N -2.82 4.74 0.40 1.05 1.01 -0.51 -4.51 120.40 119.76 3fun s VAL 366 Ca -0.12 -0.03 0.08 0.00 0.00 0.00 0.00 61.98 61.90 3fun s VAL 366 Cb 0.03 -3.20 -0.04 0.00 0.00 0.00 0.00 36.38 33.17 3fun s VAL 366 CO 0.86 0.36 0.22 0.68 0.00 0.00 0.00 175.10 177.22 3fun s VAL 367 N 1.19 2.54 -0.30 2.92 -7.23 -1.11 -4.81 120.40 113.60 3fun s VAL 367 Ca 0.05 -1.62 0.03 0.00 -1.81 0.00 0.00 61.98 58.64 3fun s VAL 367 Cb -0.14 -2.99 0.08 0.00 0.56 0.00 0.00 36.38 33.89 3fun s VAL 367 CO 0.04 -0.04 -0.02 -0.62 -0.31 0.00 0.00 175.10 174.15 3fun s ASP 368 N -3.94 4.54 -0.10 4.85 -1.08 -1.26 -4.59 116.67 115.09 3fun s ASP 368 Ca 0.42 -1.77 0.09 0.00 -0.52 0.00 0.00 52.55 50.77 3fun s ASP 368 Cb 0.01 -1.53 0.45 0.00 -1.46 0.00 0.00 42.92 40.38 3fun s ASP 368 CO 0.24 -0.30 1.24 0.18 0.52 0.00 0.00 175.17 177.05 3fun n LEU 369 N 4.38 3.36 -4.68 -1.34 4.77 -1.26 -4.84 117.00 117.39 3fun n LEU 369 Ca -0.04 -1.70 -0.47 0.00 -0.03 0.00 0.00 56.01 53.76 3fun n LEU 369 Cb 0.42 -0.53 -0.04 0.00 -2.33 0.00 0.00 43.42 40.94 3fun n LEU 369 CO 0.21 0.49 1.44 0.41 -1.33 0.00 0.00 177.39 178.61 3fun n THR 370 N 0.45 0.47 -1.72 -5.08 -1.04 -1.26 -1.48 114.28 104.62 3fun n THR 370 Ca 0.15 -0.08 -0.19 0.00 -2.04 0.00 0.00 64.05 61.89 3fun n THR 370 Cb 0.69 -1.83 -0.06 0.00 -1.82 0.00 0.00 70.33 67.30 3fun n THR 370 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 3fun n ASP 371 N 6.02 -4.99 -4.39 8.00 8.00 -1.26 -4.98 116.55 122.95 3fun n ASP 371 Ca 0.21 0.37 -0.33 0.00 0.71 0.00 0.00 54.79 55.75 3fun n ASP 371 Cb 0.30 -4.39 -0.14 0.00 -0.02 0.00 0.00 41.12 36.87 3fun n ASP 371 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3fun s ILE 372 N -2.65 3.27 -0.04 0.53 -1.09 -0.55 -5.09 121.20 115.59 3fun s ILE 372 Ca 0.00 -0.58 -0.30 0.00 -2.23 0.00 0.00 60.65 57.55 3fun s ILE 372 Cb 0.00 -2.40 -0.07 0.00 -1.58 0.00 0.00 42.46 38.41 3fun s ILE 372 CO 0.00 0.51 1.84 -0.62 -1.23 0.00 0.00 174.94 175.43 3fun s ASP 373 N 0.49 6.46 0.40 3.58 -1.08 -1.26 -4.88 116.67 120.37 3fun s ASP 373 Ca -0.07 2.37 0.16 0.00 -0.52 0.00 0.00 52.55 54.49 3fun s ASP 373 Cb -0.15 -2.53 1.04 0.00 -1.46 0.00 0.00 42.92 39.81 3fun s ASP 373 CO 0.04 -1.08 1.82 -0.65 0.52 0.00 0.00 175.17 175.82 3fun h PRO 374 N 10.50 0.45 0.00 4.34 0.11 -1.98 0.20 132.00 145.61 3fun h PRO 374 Ca -0.44 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.63 3fun h PRO 374 Cb 1.21 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.21 3fun h PRO 374 CO 0.95 0.30 -0.10 -0.44 -0.21 0.00 0.00 178.00 178.50 3fun h ASP 375 N 0.46 0.00 1.04 -2.05 3.32 -1.98 -2.43 116.42 114.78 3fun h ASP 375 Ca 0.52 0.00 -0.20 0.00 0.02 0.00 0.00 57.03 57.37 3fun h ASP 375 Cb 1.22 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.74 3fun h ASP 375 CO -0.23 0.10 -0.98 0.58 -1.72 0.00 0.00 179.24 176.99 3fun h VAL 376 N 0.00 1.52 0.00 -1.35 2.07 -1.34 -3.27 116.25 113.88 3fun h VAL 376 Ca -0.00 -3.18 -0.03 0.00 0.82 0.00 0.00 66.70 64.31 3fun h VAL 376 Cb 0.48 2.75 -0.00 0.00 -1.52 0.00 0.00 31.29 33.00 3fun h VAL 376 CO 0.01 0.86 -0.14 0.00 0.02 0.00 0.00 177.57 178.33 3fun h ALA 377 N 1.08 0.92 -2.59 1.67 0.00 -1.32 -3.47 119.26 115.56 3fun h ALA 377 Ca -0.03 -0.13 -0.55 0.00 0.00 0.00 0.00 54.91 54.21 3fun h ALA 377 Cb 1.73 -0.02 0.08 0.00 0.00 0.00 0.00 17.79 19.57 3fun h ALA 377 CO 0.12 0.17 0.84 0.98 0.00 0.00 0.00 179.25 181.36 3fun n TYR 378 N -3.15 2.61 -3.77 0.00 9.36 -1.03 -4.96 117.16 116.22 3fun n TYR 378 Ca 0.03 0.25 -0.02 0.00 3.32 0.00 0.00 57.90 61.48 3fun n TYR 378 Cb 0.56 -2.58 0.01 0.00 -0.63 0.00 0.00 39.34 36.71 3fun n TYR 378 CO 0.00 0.00 0.00 -1.13 0.22 0.00 0.00 176.86 175.95 3fun n SER 379 N 2.73 -1.20 0.01 2.98 3.41 -1.26 -5.01 113.62 115.28 3fun n SER 379 Ca 0.12 -1.61 0.07 0.00 -0.26 0.00 0.00 58.87 57.19 3fun n SER 379 Cb 0.34 1.94 0.31 0.00 -0.26 0.00 0.00 64.21 66.54 3fun n SER 379 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3fun n SER 380 N -1.06 0.04 0.08 4.04 7.64 -1.26 -4.09 113.62 119.01 3fun n SER 380 Ca -0.01 0.51 -0.12 0.00 1.01 0.00 0.00 58.87 60.26 3fun n SER 380 Cb 0.41 -0.52 -0.06 0.00 -1.01 0.00 0.00 64.21 63.03 3fun n SER 380 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 3fun h VAL 381 N 0.00 0.76 -0.13 0.44 2.07 -1.94 0.61 116.25 118.06 3fun h VAL 381 Ca 0.00 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.50 3fun h VAL 381 Cb 0.25 0.76 -0.01 0.00 -1.52 0.00 0.00 31.29 30.77 3fun h VAL 381 CO 0.00 0.00 -0.02 1.55 0.02 0.00 0.00 177.57 179.12 3fun h PRO 382 N -0.21 0.19 0.37 1.57 0.13 -1.90 0.24 132.00 132.38 3fun h PRO 382 Ca 0.01 -0.03 -0.02 0.00 -0.87 0.00 0.00 66.00 65.10 3fun h PRO 382 Cb 0.22 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 31.32 3fun h PRO 382 CO -0.05 0.23 -0.18 1.88 -0.23 0.00 0.00 178.00 179.66 3fun h TYR 383 N 0.19 -0.46 0.04 1.56 -1.99 -1.67 -2.54 116.97 112.11 3fun h TYR 383 Ca 0.05 -0.01 -0.32 0.00 2.00 0.00 0.00 58.73 60.44 3fun h TYR 383 Cb 0.17 0.15 -0.04 0.00 2.00 0.00 0.00 36.73 39.01 3fun h TYR 383 CO 0.00 -0.14 -1.88 0.39 -0.00 0.00 0.00 178.16 176.53 3fun n GLU 384 N -5.19 0.68 -0.03 4.88 -0.58 0.15 -1.32 120.64 119.23 3fun n GLU 384 Ca -0.10 0.26 -0.09 0.00 -0.42 0.00 0.00 57.16 56.81 3fun n GLU 384 Cb 0.27 -1.74 0.06 0.00 -0.57 0.00 0.00 31.44 29.47 3fun n GLU 384 CO 0.00 0.00 0.00 -0.22 -0.48 0.00 0.00 177.13 176.43 3fun h LYS 385 N 0.02 0.65 -0.11 3.49 3.64 -0.71 -0.78 116.57 122.78 3fun h LYS 385 Ca -0.36 -0.35 -0.00 0.00 -1.27 0.00 0.00 60.65 58.67 3fun h LYS 385 Cb 2.03 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 33.87 3fun h LYS 385 CO 0.07 0.96 0.07 0.78 -2.27 0.00 0.00 179.45 179.06 3fun h GLY 386 N 0.99 0.15 0.99 5.01 0.00 -1.50 -1.91 103.07 106.80 3fun h GLY 386 Ca 0.04 -0.06 0.01 0.00 0.00 0.00 0.00 47.33 47.31 3fun h GLY 386 CO 0.09 0.06 0.35 -2.75 0.00 0.00 0.00 176.54 174.30 3fun h PHE 387 N 0.11 0.67 -0.99 5.60 3.57 -1.16 -2.33 116.94 122.43 3fun h PHE 387 Ca 0.04 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.58 3fun h PHE 387 Cb 0.02 -0.23 -0.05 0.00 2.79 0.00 0.00 35.95 38.48 3fun h PHE 387 CO -0.06 0.42 0.65 0.00 -2.23 0.00 0.00 178.31 177.09 3fun h ALA 388 N 1.20 1.28 -0.38 2.41 0.00 -0.97 0.46 119.26 123.26 3fun h ALA 388 Ca 0.20 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3fun h ALA 388 Cb -0.07 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.33 3fun h ALA 388 CO -0.05 0.58 0.25 1.25 0.00 0.00 0.00 179.25 181.28 3fun h LEU 389 N 1.28 0.44 -0.80 0.00 5.85 -1.03 0.86 115.31 121.91 3fun h LEU 389 Ca 0.38 -0.02 -0.09 0.00 0.84 0.00 0.00 57.88 59.00 3fun h LEU 389 Cb -0.06 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 40.84 3fun h LEU 389 CO -0.11 0.32 -0.06 -0.07 -0.34 0.00 0.00 178.44 178.19 3fun h LEU 390 N 0.51 0.82 -0.37 2.25 3.38 -0.79 -0.58 115.31 120.54 3fun h LEU 390 Ca 0.14 -0.23 -0.12 0.00 0.09 0.00 0.00 57.88 57.76 3fun h LEU 390 Cb -0.05 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.47 3fun h LEU 390 CO -0.03 0.92 -0.22 0.15 0.09 0.00 0.00 178.44 179.35 3fun h PHE 391 N 0.77 0.93 -0.44 1.13 3.57 -0.75 0.15 116.94 122.31 3fun h PHE 391 Ca 0.14 -0.24 0.04 0.00 3.53 0.00 0.00 57.97 61.43 3fun h PHE 391 Cb 0.55 -0.21 -0.04 0.00 2.79 0.00 0.00 35.95 39.04 3fun h PHE 391 CO 0.03 1.00 0.20 -0.92 -2.23 0.00 0.00 178.31 176.40 3fun h TYR 392 N 0.59 0.37 -0.61 0.41 3.20 -0.70 -1.60 116.97 118.63 3fun h TYR 392 Ca 0.08 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.91 3fun h TYR 392 Cb 0.78 -0.10 -0.03 0.00 1.54 0.00 0.00 36.73 38.92 3fun h TYR 392 CO 0.06 0.18 0.17 -0.07 -1.64 0.00 0.00 178.16 176.86 3fun h LEU 393 N 0.41 0.91 -0.52 2.82 3.38 -0.82 -0.35 115.31 121.14 3fun h LEU 393 Ca 0.19 -0.22 0.10 0.00 0.09 0.00 0.00 57.88 58.04 3fun h LEU 393 Cb 0.13 -0.24 -0.08 0.00 0.09 0.00 0.00 40.66 40.56 3fun h LEU 393 CO -0.15 0.89 0.05 -0.08 0.09 0.00 0.00 178.44 179.24 3fun h GLU 394 N 0.89 0.17 -0.44 1.13 4.81 -0.41 0.34 114.58 121.06 3fun h GLU 394 Ca 0.20 -0.01 -0.12 0.00 -0.13 0.00 0.00 59.36 59.30 3fun h GLU 394 Cb 0.32 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.65 3fun h GLU 394 CO -0.00 0.11 -0.19 1.96 -0.73 0.00 0.00 179.01 180.16 3fun h GLN 395 N 0.17 0.91 -0.73 1.92 4.20 -0.74 0.59 115.11 121.43 3fun h GLN 395 Ca 0.27 -0.39 -0.03 0.00 0.06 0.00 0.00 58.65 58.56 3fun h GLN 395 Cb 0.39 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.10 3fun h GLN 395 CO -0.39 1.04 0.33 1.25 -0.67 0.00 0.00 178.83 180.39 3fun h LEU 396 N 0.74 0.95 -1.52 1.46 5.85 -0.69 -3.30 115.31 118.81 3fun h LEU 396 Ca 0.10 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.71 3fun h LEU 396 Cb 0.75 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 41.54 3fun h LEU 396 CO 0.06 0.82 0.00 0.18 -0.34 0.00 0.00 178.44 179.16 3fun n LEU 397 N -4.32 2.33 0.00 2.25 4.77 0.07 -4.93 117.00 117.18 3fun n LEU 397 Ca 0.07 -0.85 0.00 0.00 -0.03 0.00 0.00 56.01 55.20 3fun n LEU 397 Cb 0.15 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 3fun n LEU 397 CO 0.39 0.42 0.00 0.61 -1.33 0.00 0.00 177.39 177.48 3fun n GLY 398 N 1.28 1.11 0.00 -0.72 0.00 -1.11 -4.88 105.19 100.86 3fun n GLY 398 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 3fun n GLY 398 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fun n GLY 399 N -0.23 -0.29 0.29 -0.02 0.00 0.18 -4.69 105.19 100.44 3fun n GLY 399 Ca 0.00 -2.28 -0.07 0.00 0.00 0.00 0.00 46.02 43.67 3fun n GLY 399 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3fun h PRO 400 N 6.98 0.92 -0.47 1.61 0.13 -1.99 -0.84 132.00 138.34 3fun h PRO 400 Ca 0.00 -0.29 -0.01 0.00 -0.87 0.00 0.00 66.00 64.84 3fun h PRO 400 Cb 0.00 -0.09 -0.02 0.00 0.13 0.00 0.00 31.00 31.02 3fun h PRO 400 CO 0.00 0.93 0.26 0.93 -0.23 0.00 0.00 178.00 179.90 3fun h GLU 401 N 0.85 0.65 -0.06 0.86 5.08 -1.97 0.12 114.58 120.10 3fun h GLU 401 Ca 0.15 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.44 3fun h GLU 401 Cb 0.54 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.66 3fun h GLU 401 CO 0.03 0.51 0.03 0.82 -1.00 0.00 0.00 179.01 179.40 3fun h ILE 402 N 0.62 1.12 -0.19 3.13 2.04 -1.80 -2.53 117.51 119.91 3fun h ILE 402 Ca 0.17 -0.35 -0.09 0.00 1.00 0.00 0.00 64.86 65.59 3fun h ILE 402 Cb 0.04 1.23 -0.01 0.00 -0.74 0.00 0.00 36.82 37.34 3fun h ILE 402 CO -0.03 0.10 -0.28 0.15 0.00 0.00 0.00 178.15 178.09 3fun h PHE 403 N -0.03 0.42 -0.01 1.37 3.57 -0.97 -1.60 116.94 119.69 3fun h PHE 403 Ca 0.02 -0.09 -0.04 0.00 3.53 0.00 0.00 57.97 61.39 3fun h PHE 403 Cb 0.13 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.76 3fun h PHE 403 CO -0.03 0.62 -0.19 -0.07 -2.23 0.00 0.00 178.31 176.41 3fun h LEU 404 N 0.33 0.01 -0.69 0.59 3.38 -0.67 -0.93 115.31 117.34 3fun h LEU 404 Ca 0.05 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 3fun h LEU 404 Cb 0.66 -0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.38 3fun h LEU 404 CO 0.05 0.21 0.32 1.23 0.09 0.00 0.00 178.44 180.33 3fun h GLY 405 N 0.60 1.07 0.93 0.83 0.00 -0.85 -1.61 103.07 104.04 3fun h GLY 405 Ca 0.00 -0.55 0.00 0.00 0.00 0.00 0.00 47.33 46.79 3fun h GLY 405 CO 0.03 0.52 -0.03 -2.75 0.00 0.00 0.00 176.54 174.30 3fun h PHE 406 N 0.96 -0.08 -0.44 5.60 3.57 -1.13 -2.24 116.94 123.19 3fun h PHE 406 Ca 0.23 0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.82 3fun h PHE 406 Cb 0.14 0.03 -0.08 0.00 2.79 0.00 0.00 35.95 38.84 3fun h PHE 406 CO 0.01 -0.05 -0.05 1.25 -2.23 0.00 0.00 178.31 177.24 3fun h LEU 407 N -0.06 -0.28 -0.65 0.59 5.85 -0.94 0.24 115.31 120.06 3fun h LEU 407 Ca 0.01 0.12 -0.07 0.00 0.84 0.00 0.00 57.88 58.78 3fun h LEU 407 Cb 0.07 0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.30 3fun h LEU 407 CO -0.03 -0.10 0.15 0.50 -0.34 0.00 0.00 178.44 178.62 3fun h LYS 408 N 0.06 1.05 -0.13 1.25 3.64 -1.25 -1.23 116.57 119.96 3fun h LYS 408 Ca 0.22 -0.26 -0.11 0.00 -1.27 0.00 0.00 60.65 59.22 3fun h LYS 408 Cb 0.32 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.00 3fun h LYS 408 CO -0.40 0.95 -0.41 0.00 -2.27 0.00 0.00 179.45 177.32 3fun h ALA 409 N 1.06 1.07 -0.20 5.00 0.00 -0.75 -1.34 119.26 124.11 3fun h ALA 409 Ca 0.20 -0.42 -0.03 0.00 0.00 0.00 0.00 54.91 54.67 3fun h ALA 409 Cb 0.38 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 3fun h ALA 409 CO 0.00 0.60 0.01 -0.92 0.00 0.00 0.00 179.25 178.94 3fun h TYR 410 N 0.24 0.37 -0.64 0.00 3.20 -0.28 -0.64 116.97 119.21 3fun h TYR 410 Ca 0.02 -0.06 0.02 0.00 3.14 0.00 0.00 58.73 61.85 3fun h TYR 410 Cb 0.83 -0.10 -0.04 0.00 1.54 0.00 0.00 36.73 38.97 3fun h TYR 410 CO 0.02 0.52 0.42 0.28 -1.64 0.00 0.00 178.16 177.75 3fun h VAL 411 N 0.11 1.13 -0.22 1.81 2.07 -1.00 -1.98 116.25 118.17 3fun h VAL 411 Ca 0.06 -0.29 -0.00 0.00 0.82 0.00 0.00 66.70 67.29 3fun h VAL 411 Cb 0.37 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 30.35 3fun h VAL 411 CO 0.01 0.15 0.12 -0.08 0.02 0.00 0.00 177.57 177.79 3fun h GLU 412 N 0.83 0.31 -0.60 1.57 4.22 -1.10 -1.04 114.58 118.78 3fun h GLU 412 Ca 0.25 -0.04 0.02 0.00 0.08 0.00 0.00 59.36 59.66 3fun h GLU 412 Cb -0.05 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.11 3fun h GLU 412 CO -0.07 0.29 0.38 -0.22 -2.18 0.00 0.00 179.01 177.21 3fun h LYS 413 N 0.25 0.75 -0.35 1.92 1.63 -0.84 -3.17 116.57 116.75 3fun h LYS 413 Ca 0.08 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.83 3fun h LYS 413 Cb 0.07 -0.17 0.00 0.00 -0.60 0.00 0.00 32.23 31.53 3fun h LYS 413 CO -0.01 0.49 0.00 1.19 -3.45 0.00 0.00 179.45 177.67 3fun n PHE 414 N -4.70 0.75 -1.67 1.91 3.72 -0.77 -5.00 117.46 111.70 3fun n PHE 414 Ca 0.05 -0.64 -0.45 0.00 -0.05 0.00 0.00 57.45 56.36 3fun n PHE 414 Cb 0.05 -0.15 -0.02 0.00 -0.94 0.00 0.00 39.48 38.41 3fun n PHE 414 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 3fun n SER 415 N 0.24 2.67 -0.37 4.37 7.64 -0.41 -1.51 113.62 126.25 3fun n SER 415 Ca 0.17 1.15 -0.05 0.00 1.01 0.00 0.00 58.87 61.15 3fun n SER 415 Cb 0.64 -1.42 -0.02 0.00 -1.01 0.00 0.00 64.21 62.40 3fun n SER 415 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 3fun n TYR 416 N 1.69 0.00 -4.56 1.43 4.02 0.34 -4.95 117.16 115.13 3fun n TYR 416 Ca 0.11 0.00 -0.26 0.00 -0.01 0.00 0.00 57.90 57.74 3fun n TYR 416 Cb 0.32 -1.44 -0.11 0.00 -0.02 0.00 0.00 39.34 38.09 3fun n TYR 416 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 176.86 176.00 3fun s LYS 417 N -1.87 1.85 -0.08 -0.72 1.02 -0.57 -5.00 119.74 114.37 3fun s LYS 417 Ca 0.00 -2.01 0.04 0.00 0.02 0.00 0.00 55.97 54.02 3fun s LYS 417 Cb 0.00 -1.50 -0.00 0.00 -0.52 0.00 0.00 37.83 35.80 3fun s LYS 417 CO 0.00 -0.02 -0.23 -1.12 -0.92 0.00 0.00 175.35 173.07 3fun s SER 418 N -3.63 2.89 0.12 2.83 0.01 -1.26 -1.62 113.70 113.04 3fun s SER 418 Ca 0.34 -0.51 0.00 0.00 1.31 0.00 0.00 55.95 57.10 3fun s SER 418 Cb 0.08 -1.13 -0.04 0.00 0.21 0.00 0.00 66.02 65.14 3fun s SER 418 CO 0.17 0.17 0.01 0.27 0.41 0.00 0.00 173.24 174.27 3fun s ILE 419 N 0.20 0.36 0.48 1.44 -4.36 0.44 -4.66 121.20 115.10 3fun s ILE 419 Ca -0.13 -1.92 0.07 0.00 -0.26 0.00 0.00 60.65 58.42 3fun s ILE 419 Cb -0.16 -1.93 0.01 0.00 1.25 0.00 0.00 42.46 41.63 3fun s ILE 419 CO 0.06 -0.61 0.42 0.42 0.24 0.00 0.00 174.94 175.47 3fun s THR 420 N -3.86 2.23 0.28 8.37 -4.23 -1.26 -0.46 115.64 116.71 3fun s THR 420 Ca 0.20 -1.38 -0.03 0.00 -1.18 0.00 0.00 61.69 59.30 3fun s THR 420 Cb 0.07 -2.61 0.22 0.00 1.34 0.00 0.00 72.50 71.51 3fun s THR 420 CO -0.00 0.00 1.91 0.74 -0.54 0.00 0.00 174.62 176.72 3fun h THR 421 N 0.87 1.22 -0.40 3.99 2.02 -1.97 -1.89 112.91 116.74 3fun h THR 421 Ca -0.39 -0.56 -0.09 0.00 0.77 0.00 0.00 66.41 66.15 3fun h THR 421 Cb 1.28 0.22 -0.02 0.00 -1.74 0.00 0.00 68.15 67.89 3fun h THR 421 CO 0.56 0.25 -0.10 0.44 0.37 0.00 0.00 175.52 177.04 3fun h ASP 422 N 1.04 0.69 -0.37 4.18 3.45 -1.99 -0.23 116.42 123.19 3fun h ASP 422 Ca 0.26 -0.20 0.03 0.00 0.43 0.00 0.00 57.03 57.56 3fun h ASP 422 Cb 0.03 -0.19 -0.03 0.00 -0.56 0.00 0.00 39.33 38.58 3fun h ASP 422 CO -0.04 0.83 0.17 0.44 -1.57 0.00 0.00 179.24 179.07 3fun h ASP 423 N 0.65 0.24 -0.56 6.45 3.32 -1.76 -0.30 116.42 124.46 3fun h ASP 423 Ca 0.11 0.02 0.01 0.00 0.02 0.00 0.00 57.03 57.19 3fun h ASP 423 Cb 0.55 -0.02 -0.03 0.00 0.22 0.00 0.00 39.33 40.05 3fun h ASP 423 CO 0.03 0.18 0.37 -0.25 -1.72 0.00 0.00 179.24 177.85 3fun h TRP 424 N 0.36 0.69 -0.35 4.55 7.01 -0.94 -1.93 115.95 125.34 3fun h TRP 424 Ca 0.16 0.02 -0.15 0.00 2.11 0.00 0.00 58.89 61.03 3fun h TRP 424 Cb 0.08 -0.23 -0.01 0.00 -2.10 0.00 0.00 29.16 26.90 3fun h TRP 424 CO -0.11 0.43 -0.38 -0.22 -2.79 0.00 0.00 178.44 175.37 3fun h LYS 425 N 0.75 0.83 -0.33 2.65 3.64 -0.83 0.26 116.57 123.53 3fun h LYS 425 Ca 0.21 -0.42 0.01 0.00 -1.27 0.00 0.00 60.65 59.17 3fun h LYS 425 Cb -0.08 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.73 3fun h LYS 425 CO -0.05 1.06 0.20 -0.44 -2.27 0.00 0.00 179.45 177.95 3fun h ASP 426 N 0.68 0.34 -0.56 4.20 3.45 -0.99 -0.87 116.42 122.66 3fun h ASP 426 Ca 0.06 -0.00 -0.09 0.00 0.43 0.00 0.00 57.03 57.43 3fun h ASP 426 Cb 0.94 -0.08 -0.02 0.00 -0.56 0.00 0.00 39.33 39.62 3fun h ASP 426 CO 0.09 0.25 0.01 0.15 -1.57 0.00 0.00 179.24 178.16 3fun h PHE 427 N 0.42 1.08 -0.53 4.55 3.57 -0.96 -1.26 116.94 123.80 3fun h PHE 427 Ca 0.12 -0.18 0.10 0.00 3.53 0.00 0.00 57.97 61.54 3fun h PHE 427 Cb -0.03 -0.28 -0.08 0.00 2.79 0.00 0.00 35.95 38.35 3fun h PHE 427 CO -0.06 0.97 0.06 1.25 -2.23 0.00 0.00 178.31 178.29 3fun h LEU 428 N 0.88 -0.10 -1.10 0.59 5.85 -0.66 0.18 115.31 120.95 3fun h LEU 428 Ca 0.16 0.11 -0.06 0.00 0.84 0.00 0.00 57.88 58.93 3fun h LEU 428 Cb 0.53 0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.72 3fun h LEU 428 CO 0.03 -0.03 -0.02 1.88 -0.34 0.00 0.00 178.44 179.96 3fun h TYR 429 N 0.18 0.64 -0.11 1.25 -1.99 -0.92 -1.06 116.97 114.97 3fun h TYR 429 Ca 0.27 -0.08 -0.05 0.00 2.00 0.00 0.00 58.73 60.87 3fun h TYR 429 Cb 0.40 -0.18 -0.00 0.00 2.00 0.00 0.00 36.73 38.95 3fun h TYR 429 CO -0.28 0.63 -0.14 1.03 -0.00 0.00 0.00 178.16 179.41 3fun h SER 430 N 0.58 0.32 -0.42 3.88 0.87 -0.46 -2.39 113.55 115.93 3fun h SER 430 Ca 0.12 -0.51 -0.02 0.00 -1.23 0.00 0.00 61.79 60.16 3fun h SER 430 Cb 0.40 -0.09 -0.02 0.00 -0.44 0.00 0.00 62.40 62.25 3fun h SER 430 CO 0.02 0.76 0.20 0.22 -0.53 0.00 0.00 176.83 177.50 3fun h TYR 431 N -0.12 0.61 -0.99 2.24 3.20 -0.59 -3.08 116.97 118.25 3fun h TYR 431 Ca 0.01 -0.03 -0.64 0.00 3.14 0.00 0.00 58.73 61.21 3fun h TYR 431 Cb 0.68 -0.19 -0.30 0.00 1.54 0.00 0.00 36.73 38.47 3fun h TYR 431 CO 0.09 0.50 0.78 1.19 -1.64 0.00 0.00 178.16 179.08 3fun n PHE 432 N -4.68 3.17 0.26 -3.82 3.72 -0.41 -4.70 117.46 111.01 3fun n PHE 432 Ca 0.00 -2.78 0.09 0.00 -0.05 0.00 0.00 57.45 54.72 3fun n PHE 432 Cb 0.11 -1.32 0.68 0.00 -0.94 0.00 0.00 39.48 38.01 3fun n PHE 432 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 3fun h LYS 433 N 1.80 0.00 0.00 -1.08 -0.00 -1.33 0.16 116.57 116.12 3fun h LYS 433 Ca 0.61 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 61.26 3fun h LYS 433 Cb 1.23 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.46 3fun h LYS 433 CO 1.47 0.04 0.00 -0.25 -0.00 0.00 0.00 179.45 180.71 3fun n ASP 434 N -4.32 0.00 -0.58 7.07 10.43 -1.26 -2.97 116.55 124.92 3fun n ASP 434 Ca -0.03 -0.52 0.06 0.00 2.57 0.00 0.00 54.79 56.87 3fun n ASP 434 Cb 0.12 -0.15 0.16 0.00 1.84 0.00 0.00 41.12 43.09 3fun n ASP 434 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 3fun n LYS 435 N -1.15 1.26 0.14 -1.24 5.02 0.55 -4.81 118.16 117.93 3fun n LYS 435 Ca 0.18 -2.88 0.06 0.00 -2.02 0.00 0.00 58.31 53.65 3fun n LYS 435 Cb 0.17 -1.35 0.54 0.00 -0.02 0.00 0.00 35.03 34.38 3fun n LYS 435 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3fun h VAL 436 N 1.77 1.05 -0.73 -0.18 2.07 -1.40 -1.17 116.25 117.67 3fun h VAL 436 Ca -0.03 -0.11 -0.00 0.00 0.82 0.00 0.00 66.70 67.39 3fun h VAL 436 Cb 1.13 0.79 -0.04 0.00 -1.52 0.00 0.00 31.29 31.65 3fun h VAL 436 CO 0.01 0.05 0.46 -2.24 0.02 0.00 0.00 177.57 175.87 3fun h ASP 437 N 0.25 0.86 -0.28 0.57 2.03 -1.87 0.42 116.42 118.40 3fun h ASP 437 Ca 0.07 -0.05 -0.04 0.00 -0.73 0.00 0.00 57.03 56.28 3fun h ASP 437 Cb -0.02 -0.22 -0.01 0.00 -0.83 0.00 0.00 39.33 38.25 3fun h ASP 437 CO -0.01 0.65 0.04 0.58 -1.03 0.00 0.00 179.24 179.47 3fun h VAL 438 N 0.99 1.24 -0.68 4.15 2.07 -1.63 -3.05 116.25 119.34 3fun h VAL 438 Ca 0.26 -0.82 0.02 0.00 0.82 0.00 0.00 66.70 66.98 3fun h VAL 438 Cb -0.06 1.23 -0.04 0.00 -1.52 0.00 0.00 31.29 30.90 3fun h VAL 438 CO -0.05 0.27 0.45 -0.07 0.02 0.00 0.00 177.57 178.18 3fun h LEU 439 N 0.29 0.75 -0.67 2.57 3.38 -0.97 -1.62 115.31 119.04 3fun h LEU 439 Ca 0.09 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.04 3fun h LEU 439 Cb 0.36 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.93 3fun h LEU 439 CO 0.01 0.53 0.00 0.59 0.09 0.00 0.00 178.44 179.66 3fun n ASN 440 N -4.44 0.73 0.19 -0.43 5.03 0.11 -2.19 115.26 114.26 3fun n ASN 440 Ca 0.08 0.67 0.14 0.00 0.87 0.00 0.00 54.58 56.33 3fun n ASN 440 Cb 0.07 -0.83 0.54 0.00 -1.02 0.00 0.00 39.78 38.54 3fun n ASN 440 CO 0.00 0.00 0.00 1.56 -1.83 0.00 0.00 177.26 176.99 3fun h GLN 441 N 0.00 0.00 -6.76 3.52 4.20 -1.19 -3.45 115.11 111.44 3fun h GLN 441 Ca 0.00 0.00 -0.51 0.00 0.06 0.00 0.00 58.65 58.20 3fun h GLN 441 Cb 0.41 0.00 0.02 0.00 0.30 0.00 0.00 27.48 28.21 3fun h GLN 441 CO 0.00 0.00 0.51 0.08 -0.67 0.00 0.00 178.83 178.75 3fun s VAL 442 N -3.43 3.48 -1.23 -0.54 1.01 -0.93 -4.95 120.40 113.82 3fun s VAL 442 Ca 0.04 1.39 -0.16 0.00 0.00 0.00 0.00 61.98 63.25 3fun s VAL 442 Cb 0.09 -3.89 0.13 0.00 0.00 0.00 0.00 36.38 32.71 3fun s VAL 442 CO 0.49 0.29 1.55 -0.62 0.00 0.00 0.00 175.10 176.81 3fun s ASP 443 N -0.48 6.95 0.22 3.32 -1.08 -1.26 -4.82 116.67 119.52 3fun s ASP 443 Ca 0.48 -2.70 -0.09 0.00 -0.52 0.00 0.00 52.55 49.71 3fun s ASP 443 Cb -0.33 -2.48 0.18 0.00 -1.46 0.00 0.00 42.92 38.83 3fun s ASP 443 CO 0.40 -0.95 1.89 -0.50 0.52 0.00 0.00 175.17 176.53 3fun h TRP 444 N 7.45 1.02 -0.95 -5.34 4.06 -1.93 -0.83 115.95 119.43 3fun h TRP 444 Ca 0.36 0.02 0.00 0.00 2.06 0.00 0.00 58.89 61.34 3fun h TRP 444 Cb 0.88 -0.34 -0.05 0.00 -1.00 0.00 0.00 29.16 28.65 3fun h TRP 444 CO 1.24 0.64 0.61 -0.97 -3.56 0.00 0.00 178.44 176.40 3fun h ASN 445 N 1.09 1.11 0.05 -3.49 -1.24 -1.99 -0.49 115.58 110.63 3fun h ASN 445 Ca 0.29 -0.04 -0.00 0.00 0.71 0.00 0.00 56.30 57.26 3fun h ASN 445 Cb -0.12 -0.28 0.00 0.00 0.73 0.00 0.00 38.32 38.65 3fun h ASN 445 CO -0.06 0.82 -0.02 0.00 -1.29 0.00 0.00 177.43 176.88 3fun h ALA 446 N 1.37 -0.06 -0.36 1.57 0.00 -1.82 -1.31 119.26 118.65 3fun h ALA 446 Ca 0.35 -0.24 0.04 0.00 0.00 0.00 0.00 54.91 55.05 3fun h ALA 446 Cb -0.12 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 3fun h ALA 446 CO -0.07 -0.28 0.13 -1.49 0.00 0.00 0.00 179.25 177.53 3fun h TRP 447 N -0.57 0.23 0.09 0.00 4.06 -0.98 -2.41 115.95 116.37 3fun h TRP 447 Ca -0.01 0.02 -0.30 0.00 2.06 0.00 0.00 58.89 60.66 3fun h TRP 447 Cb 0.51 -0.05 -0.02 0.00 -1.00 0.00 0.00 29.16 28.60 3fun h TRP 447 CO 0.09 0.10 -1.54 -0.07 -3.56 0.00 0.00 178.44 173.46 3fun h LEU 448 N 0.28 0.30 -0.08 -4.49 3.38 -1.18 -3.39 115.31 110.13 3fun h LEU 448 Ca 0.16 -0.45 0.00 0.00 0.09 0.00 0.00 57.88 57.68 3fun h LEU 448 Cb 0.13 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.78 3fun h LEU 448 CO -0.16 1.38 0.00 -1.22 0.09 0.00 0.00 178.44 178.52 3fun n TYR 449 N -3.39 0.00 -3.78 1.13 4.01 -0.51 -1.42 117.16 113.19 3fun n TYR 449 Ca -0.16 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.24 3fun n TYR 449 Cb 1.04 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 40.01 3fun n TYR 449 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 3fun s SER 450 N -0.84 6.47 0.93 7.72 0.01 -0.91 -4.89 113.70 122.19 3fun s SER 450 Ca 0.00 0.52 -0.12 0.00 1.31 0.00 0.00 55.95 57.65 3fun s SER 450 Cb 0.00 -2.07 0.15 0.00 0.21 0.00 0.00 66.02 64.31 3fun s SER 450 CO 0.00 0.24 1.12 -2.16 0.41 0.00 0.00 173.24 172.86 3fun s PRO 451 N -1.84 0.98 0.38 12.44 0.04 -1.26 -4.38 135.00 141.35 3fun s PRO 451 Ca 0.28 0.36 0.00 0.00 0.04 0.00 0.00 61.00 61.69 3fun s PRO 451 Cb -0.13 -1.81 0.00 0.00 0.04 0.00 0.00 34.50 32.60 3fun s PRO 451 CO 0.17 -2.32 0.00 0.41 0.04 0.00 0.00 177.00 175.30 3fun n GLY 452 N -1.90 -2.16 3.75 0.56 0.00 -0.99 -4.88 105.19 99.58 3fun n GLY 452 Ca 0.06 -1.78 -0.36 0.00 0.00 0.00 0.00 46.02 43.94 3fun n GLY 452 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3fun s LEU 453 N 0.00 3.65 0.93 0.99 1.43 -1.26 -4.89 118.68 119.53 3fun s LEU 453 Ca 0.00 2.41 -0.11 0.00 -1.03 0.00 0.00 54.13 55.40 3fun s LEU 453 Cb 0.00 -4.60 0.10 0.00 0.03 0.00 0.00 46.19 41.72 3fun s LEU 453 CO 0.00 -1.64 0.83 -2.65 0.23 0.00 0.00 176.35 173.12 3fun n PRO 454 N -1.64 -0.40 0.20 1.29 -0.02 -1.26 -4.90 135.00 128.27 3fun n PRO 454 Ca 0.14 -0.06 0.14 0.00 -2.02 0.00 0.00 63.50 61.70 3fun n PRO 454 Cb 0.49 -2.16 0.56 0.00 -0.02 0.00 0.00 33.50 32.38 3fun n PRO 454 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 3fun h PRO 455 N -1.77 0.00 -3.97 0.52 0.13 -1.94 -3.42 132.00 121.55 3fun h PRO 455 Ca -0.43 0.00 -0.34 0.00 -0.87 0.00 0.00 66.00 64.36 3fun h PRO 455 Cb 1.28 0.00 -0.32 0.00 0.13 0.00 0.00 31.00 32.09 3fun h PRO 455 CO 0.38 0.00 -0.75 0.42 -0.23 0.00 0.00 178.00 177.82 3fun s ILE 456 N -3.46 0.31 -0.19 -3.56 -1.09 -1.26 -5.14 121.20 106.81 3fun s ILE 456 Ca 0.03 -0.06 -0.11 0.00 -2.23 0.00 0.00 60.65 58.28 3fun s ILE 456 Cb 0.09 -0.33 -0.05 0.00 -1.58 0.00 0.00 42.46 40.59 3fun s ILE 456 CO 0.48 0.14 0.19 -0.75 -1.23 0.00 0.00 174.94 173.77 3fun s LYS 457 N 0.54 4.21 1.11 2.79 2.20 -1.26 -5.04 119.74 124.29 3fun s LYS 457 Ca -0.06 -0.11 -0.12 0.00 -0.36 0.00 0.00 55.97 55.32 3fun s LYS 457 Cb -0.09 -3.43 0.25 0.00 -1.51 0.00 0.00 37.83 33.06 3fun s LYS 457 CO -0.01 0.27 1.05 -2.14 -0.36 0.00 0.00 175.35 174.17 3fun s PRO 458 N 0.42 -0.50 -0.06 4.03 0.02 -1.26 -5.00 135.00 132.65 3fun s PRO 458 Ca 0.11 1.02 -0.25 0.00 0.02 0.00 0.00 61.00 61.90 3fun s PRO 458 Cb -0.12 -1.59 -0.03 0.00 0.02 0.00 0.00 34.50 32.78 3fun s PRO 458 CO 0.00 -3.50 0.78 -0.80 -0.33 0.00 0.00 177.00 173.15 3fun s ASN 459 N -2.53 7.08 -0.09 2.53 0.01 -1.26 -5.07 114.94 115.61 3fun s ASN 459 Ca 0.68 1.30 0.03 0.00 -0.71 0.00 0.00 52.86 54.17 3fun s ASN 459 Cb -0.25 -2.45 0.01 0.00 0.41 0.00 0.00 41.25 38.96 3fun s ASN 459 CO 0.63 -0.18 -0.19 -0.31 -1.51 0.00 0.00 177.10 175.54 3fun s TYR 460 N 0.98 2.13 0.33 2.20 1.51 -1.26 -5.10 117.35 118.14 3fun s TYR 460 Ca 0.41 -0.85 -0.29 0.00 -1.01 0.00 0.00 57.07 55.33 3fun s TYR 460 Cb -0.18 -1.46 -0.11 0.00 -0.11 0.00 0.00 41.96 40.09 3fun s TYR 460 CO 0.20 -0.37 1.54 -3.47 -1.11 0.00 0.00 175.55 172.34 3fun n ASP 461 N 3.65 3.76 -0.48 2.29 2.03 -1.26 -4.92 116.55 121.62 3fun n ASP 461 Ca -0.21 1.18 0.05 0.00 0.52 0.00 0.00 54.79 56.34 3fun n ASP 461 Cb 0.52 -1.60 0.07 0.00 -0.72 0.00 0.00 41.12 39.40 3fun n ASP 461 CO 0.00 0.00 0.00 0.23 -1.92 0.00 0.00 177.20 175.51 3fun n MET 462 N 1.41 1.08 -0.17 -0.67 2.81 -1.26 -4.51 117.12 115.81 3fun n MET 462 Ca 0.06 -1.36 -0.05 0.00 -1.81 0.00 0.00 57.70 54.53 3fun n MET 462 Cb 0.37 -1.22 0.02 0.00 -0.71 0.00 0.00 33.22 31.68 3fun n MET 462 CO 0.00 0.00 0.00 1.15 1.51 0.00 0.00 175.97 178.63 3fun h THR 463 N 2.10 0.27 0.00 2.03 2.02 -1.92 -0.23 112.91 117.19 3fun h THR 463 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 3fun h THR 463 Cb 0.52 0.27 0.00 0.00 -1.74 0.00 0.00 68.15 67.20 3fun h THR 463 CO 0.00 0.00 0.00 -0.07 0.37 0.00 0.00 175.52 175.82 3fun h LEU 464 N -0.14 0.00 0.00 2.58 3.38 -1.86 -3.29 115.31 115.97 3fun h LEU 464 Ca 0.23 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.97 3fun h LEU 464 Cb 0.51 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.22 3fun h LEU 464 CO -0.60 0.00 -1.29 0.74 0.09 0.00 0.00 178.44 177.37 3fun h THR 465 N 0.00 1.14 -0.62 0.22 2.02 -1.50 -3.39 112.91 110.78 3fun h THR 465 Ca 0.00 -2.85 0.12 0.00 0.77 0.00 0.00 66.41 64.45 3fun h THR 465 Cb 0.88 2.54 -0.09 0.00 -1.74 0.00 0.00 68.15 69.74 3fun h THR 465 CO 0.00 0.65 0.12 0.78 0.37 0.00 0.00 175.52 177.44 3fun h ASN 466 N 0.00 -0.02 0.21 4.18 -0.26 -1.17 -0.53 115.58 117.99 3fun h ASN 466 Ca -0.14 0.12 -0.08 0.00 -0.56 0.00 0.00 56.30 55.64 3fun h ASN 466 Cb 1.81 0.17 -0.01 0.00 -1.06 0.00 0.00 38.32 39.23 3fun h ASN 466 CO 0.09 -0.01 -0.30 0.00 -1.06 0.00 0.00 177.43 176.15 3fun h ALA 467 N 1.51 1.34 -0.19 -0.83 0.00 -1.80 -0.24 119.26 119.05 3fun h ALA 467 Ca 0.33 -0.32 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 3fun h ALA 467 Cb 0.51 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 3fun h ALA 467 CO -0.43 0.46 -0.06 0.00 0.00 0.00 0.00 179.25 179.22 3fun h ILE 469 N 0.08 1.17 -0.63 0.00 2.04 -1.08 -1.42 117.51 117.66 3fun h ILE 469 Ca 0.04 -0.51 0.03 0.00 1.00 0.00 0.00 64.86 65.43 3fun h ILE 469 Cb 0.52 0.97 -0.04 0.00 -0.74 0.00 0.00 36.82 37.53 3fun h ILE 469 CO 0.02 0.18 0.38 0.00 0.00 0.00 0.00 178.15 178.73 3fun h ALA 470 N 0.97 0.82 -0.48 1.87 0.00 -1.05 0.61 119.26 122.01 3fun h ALA 470 Ca 0.10 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.86 3fun h ALA 470 Cb 0.16 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3fun h ALA 470 CO -0.01 0.13 -0.22 1.25 0.00 0.00 0.00 179.25 180.40 3fun h LEU 471 N 0.75 1.02 -0.52 0.00 5.85 -1.25 -1.16 115.31 120.00 3fun h LEU 471 Ca 0.25 -0.40 -0.00 0.00 0.84 0.00 0.00 57.88 58.57 3fun h LEU 471 Cb 0.03 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 40.75 3fun h LEU 471 CO -0.11 1.19 0.31 -1.28 -0.34 0.00 0.00 178.44 178.21 3fun h SER 472 N 0.85 0.63 -0.52 1.25 0.87 -0.83 -2.23 113.55 113.57 3fun h SER 472 Ca 0.11 -0.07 -0.06 0.00 -1.23 0.00 0.00 61.79 60.54 3fun h SER 472 Cb 0.80 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 62.57 3fun h SER 472 CO 0.07 0.51 0.10 1.56 -0.53 0.00 0.00 176.83 178.53 3fun h GLN 473 N 0.70 0.91 -0.68 2.24 1.08 -0.76 -1.11 115.11 117.49 3fun h GLN 473 Ca 0.19 -0.22 0.08 0.00 -1.45 0.00 0.00 58.65 57.25 3fun h GLN 473 Cb 0.00 -0.12 -0.06 0.00 -0.05 0.00 0.00 27.48 27.25 3fun h GLN 473 CO -0.03 0.84 0.34 0.00 -0.95 0.00 0.00 178.83 179.03 3fun h ARG 474 N 0.86 0.59 -0.27 1.46 3.08 -0.70 -1.21 114.38 118.19 3fun h ARG 474 Ca 0.18 -0.04 -0.08 0.00 0.07 0.00 0.00 59.98 60.12 3fun h ARG 474 Cb 0.38 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.29 3fun h ARG 474 CO 0.01 0.39 -0.13 -1.49 -1.07 0.00 0.00 179.97 177.67 3fun h TRP 475 N 0.61 0.65 -0.53 3.04 4.06 -0.84 -1.62 115.95 121.32 3fun h TRP 475 Ca 0.32 -0.16 -0.07 0.00 2.06 0.00 0.00 58.89 61.04 3fun h TRP 475 Cb 0.30 -0.15 -0.02 0.00 -1.00 0.00 0.00 29.16 28.28 3fun h TRP 475 CO -0.10 0.82 0.03 0.82 -3.56 0.00 0.00 178.44 176.44 3fun h ILE 476 N 0.30 1.25 0.00 1.49 2.04 -0.97 -2.76 117.51 118.86 3fun h ILE 476 Ca 0.06 -1.00 0.00 0.00 1.00 0.00 0.00 64.86 64.92 3fun h ILE 476 Cb 0.65 0.81 0.00 0.00 -0.74 0.00 0.00 36.82 37.54 3fun h ILE 476 CO 0.04 0.36 -0.49 0.35 0.00 0.00 0.00 178.15 178.41 3fun n THR 477 N -4.22 0.01 -1.89 -0.27 -2.24 -0.48 -4.91 114.28 100.28 3fun n THR 477 Ca 0.03 -0.01 -0.41 0.00 -2.27 0.00 0.00 64.05 61.39 3fun n THR 477 Cb 0.30 0.22 -0.01 0.00 -2.10 0.00 0.00 70.33 68.73 3fun n THR 477 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3fun s ALA 478 N -3.01 3.58 0.53 6.98 0.00 -0.61 -5.05 121.76 124.19 3fun s ALA 478 Ca 0.11 1.48 0.08 0.00 0.00 0.00 0.00 51.96 53.64 3fun s ALA 478 Cb 0.17 -3.58 0.06 0.00 0.00 0.00 0.00 23.12 19.77 3fun s ALA 478 CO 0.70 -0.93 0.65 0.15 0.00 0.00 0.00 175.76 176.33 3fun s LYS 479 N -1.74 2.39 0.27 0.00 3.01 -1.26 -4.98 119.74 117.42 3fun s LYS 479 Ca 0.53 -1.65 -0.01 0.00 -1.01 0.00 0.00 55.97 53.83 3fun s LYS 479 Cb -0.45 -2.53 0.50 0.00 -1.01 0.00 0.00 37.83 34.34 3fun s LYS 479 CO 0.58 -0.68 1.81 1.49 0.51 0.00 0.00 175.35 179.06 3fun h GLU 480 N 0.42 0.81 0.00 1.68 4.81 -2.01 0.08 114.58 120.38 3fun h GLU 480 Ca -0.33 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.85 3fun h GLU 480 Cb 1.29 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 30.48 3fun h GLU 480 CO 0.46 0.54 0.00 -0.40 -0.73 0.00 0.00 179.01 178.88 3fun n ASP 481 N -4.72 0.00 0.02 1.04 5.75 -1.26 -2.24 116.55 115.14 3fun n ASP 481 Ca 0.17 0.13 0.11 0.00 -0.01 0.00 0.00 54.79 55.19 3fun n ASP 481 Cb 0.35 -0.32 0.02 0.00 -1.03 0.00 0.00 41.12 40.14 3fun n ASP 481 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 3fun n ASP 482 N -1.32 0.65 0.03 -1.12 8.00 0.01 -4.41 116.55 118.38 3fun n ASP 482 Ca 0.07 -0.36 0.02 0.00 0.71 0.00 0.00 54.79 55.23 3fun n ASP 482 Cb 0.14 0.80 0.38 0.00 -0.02 0.00 0.00 41.12 42.41 3fun n ASP 482 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 3fun h LEU 483 N 0.00 0.42 -2.31 0.64 3.38 -1.42 -1.90 115.31 114.13 3fun h LEU 483 Ca 0.00 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.92 3fun h LEU 483 Cb 0.66 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.30 3fun h LEU 483 CO 0.00 0.42 -0.02 -1.13 0.09 0.00 0.00 178.44 177.81 3fun h ASN 484 N 0.46 0.00 1.13 -0.43 -1.24 -1.78 -2.47 115.58 111.25 3fun h ASN 484 Ca 0.11 0.00 -0.03 0.00 0.71 0.00 0.00 56.30 57.09 3fun h ASN 484 Cb 0.17 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.21 3fun h ASN 484 CO -0.01 0.02 -0.15 0.77 -1.29 0.00 0.00 177.43 176.78 3fun h SER 485 N 0.00 0.00 -4.03 1.15 4.64 -1.64 -3.44 113.55 110.23 3fun h SER 485 Ca -0.00 0.00 -0.48 0.00 -0.47 0.00 0.00 61.79 60.84 3fun h SER 485 Cb 0.04 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.15 3fun h SER 485 CO 0.00 0.15 0.40 -0.36 -0.87 0.00 0.00 176.83 176.14 3fun s PHE 486 N -3.56 3.10 0.06 4.77 0.08 -0.93 -5.04 117.98 116.46 3fun s PHE 486 Ca 0.02 1.60 -0.26 0.00 0.12 0.00 0.00 56.93 58.41 3fun s PHE 486 Cb 0.09 -3.09 0.07 0.00 -0.57 0.00 0.00 43.02 39.51 3fun s PHE 486 CO 0.62 -0.76 0.62 1.21 -0.10 0.00 0.00 175.22 176.81 3fun s ASN 487 N -1.81 -0.59 0.59 1.36 3.84 -1.26 -4.98 114.94 112.09 3fun s ASN 487 Ca 0.64 0.31 0.29 0.00 0.21 0.00 0.00 52.86 54.30 3fun s ASN 487 Cb -0.19 0.56 1.49 0.00 -0.55 0.00 0.00 41.25 42.57 3fun s ASN 487 CO 0.23 -0.79 1.91 0.00 -2.79 0.00 0.00 177.10 175.66 3fun h ALA 488 N 2.50 2.12 0.00 1.71 0.00 -1.96 0.06 119.26 123.70 3fun h ALA 488 Ca -0.31 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.59 3fun h ALA 488 Cb 1.23 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.05 3fun h ALA 488 CO 0.39 -0.67 0.00 1.79 0.00 0.00 0.00 179.25 180.76 3fun h THR 489 N 0.00 0.00 -0.18 0.00 1.35 -1.96 -2.31 112.91 109.82 3fun h THR 489 Ca 0.20 -0.22 0.05 0.00 -0.55 0.00 0.00 66.41 65.89 3fun h THR 489 Cb 1.10 1.07 -0.01 0.00 -1.73 0.00 0.00 68.15 68.59 3fun h THR 489 CO -0.00 0.00 0.17 0.44 -0.25 0.00 0.00 175.52 175.88 3fun h ASP 490 N 0.00 0.00 -0.02 5.36 3.32 -1.39 -2.34 116.42 121.35 3fun h ASP 490 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3fun h ASP 490 Cb 0.25 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.80 3fun h ASP 490 CO 0.00 0.00 -0.14 0.18 -1.72 0.00 0.00 179.24 177.56 3fun n LEU 491 N -3.98 2.60 0.24 1.55 4.77 -0.87 -4.64 117.00 116.68 3fun n LEU 491 Ca 0.01 -0.93 0.09 0.00 -0.03 0.00 0.00 56.01 55.16 3fun n LEU 491 Cb 0.30 0.00 0.61 0.00 -2.33 0.00 0.00 43.42 42.00 3fun n LEU 491 CO 0.29 0.45 0.92 0.50 -1.33 0.00 0.00 177.39 178.22 3fun h LYS 492 N 3.80 0.00 -0.47 3.23 3.11 -1.54 -1.49 116.57 123.20 3fun h LYS 492 Ca 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.84 3fun h LYS 492 Cb 0.88 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.11 3fun h LYS 492 CO 0.00 0.17 0.00 -0.25 -2.81 0.00 0.00 179.45 176.56 3fun n ASP 493 N -3.87 4.63 -4.66 4.20 8.00 -1.26 -4.95 116.55 118.64 3fun n ASP 493 Ca -0.02 -2.75 -0.35 0.00 0.71 0.00 0.00 54.79 52.39 3fun n ASP 493 Cb 0.27 -0.57 -0.09 0.00 -0.02 0.00 0.00 41.12 40.70 3fun n ASP 493 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3fun s LEU 494 N -2.38 3.83 0.89 0.64 1.43 -0.56 -5.10 118.68 117.43 3fun s LEU 494 Ca 0.47 0.12 -0.12 0.00 -1.03 0.00 0.00 54.13 53.57 3fun s LEU 494 Cb 0.34 -1.95 0.13 0.00 0.03 0.00 0.00 46.19 44.74 3fun s LEU 494 CO 0.16 0.22 1.14 -0.94 0.23 0.00 0.00 176.35 177.16 3fun s SER 495 N 0.07 3.69 0.33 2.29 1.04 -1.26 -4.79 113.70 115.08 3fun s SER 495 Ca 0.05 0.97 0.05 0.00 0.48 0.00 0.00 55.95 57.51 3fun s SER 495 Cb -0.12 -1.56 0.70 0.00 0.10 0.00 0.00 66.02 65.14 3fun s SER 495 CO 0.01 -2.44 1.87 0.77 0.98 0.00 0.00 173.24 174.43 3fun h SER 496 N -1.42 0.77 -0.82 7.02 4.64 -1.99 0.90 113.55 122.66 3fun h SER 496 Ca -0.50 0.04 -0.02 0.00 -0.47 0.00 0.00 61.79 60.84 3fun h SER 496 Cb 1.33 -0.12 -0.04 0.00 -0.31 0.00 0.00 62.40 63.26 3fun h SER 496 CO 0.62 0.41 0.42 0.45 -0.87 0.00 0.00 176.83 177.87 3fun h HIS 497 N 0.83 1.16 -0.09 4.77 3.86 -1.95 -0.53 115.15 123.20 3fun h HIS 497 Ca 0.45 -0.04 -0.19 0.00 -1.16 0.00 0.00 60.37 59.43 3fun h HIS 497 Cb 0.57 -0.36 -0.00 0.00 1.06 0.00 0.00 27.41 28.67 3fun h HIS 497 CO -0.00 0.82 -0.74 1.96 0.86 0.00 0.00 177.93 180.83 3fun h GLN 498 N 1.15 0.46 -0.40 2.45 4.20 -1.51 -1.68 115.11 119.79 3fun h GLN 498 Ca 0.29 -0.38 0.01 0.00 0.06 0.00 0.00 58.65 58.63 3fun h GLN 498 Cb 0.08 0.08 -0.02 0.00 0.30 0.00 0.00 27.48 27.91 3fun h GLN 498 CO -0.04 1.01 0.25 -0.07 -0.67 0.00 0.00 178.83 179.31 3fun h LEU 499 N 0.31 0.42 -0.77 1.46 3.38 -0.49 0.39 115.31 120.00 3fun h LEU 499 Ca -0.03 -0.00 0.03 0.00 0.09 0.00 0.00 57.88 57.97 3fun h LEU 499 Cb 1.32 -0.09 -0.05 0.00 0.09 0.00 0.00 40.66 41.93 3fun h LEU 499 CO 0.13 0.30 0.49 -1.13 0.09 0.00 0.00 178.44 178.32 3fun h ASN 500 N 0.50 0.80 -0.03 -0.43 -1.24 -0.98 -1.87 115.58 112.33 3fun h ASN 500 Ca 0.15 -0.00 -0.13 0.00 0.71 0.00 0.00 56.30 57.03 3fun h ASN 500 Cb -0.02 -0.17 -0.01 0.00 0.73 0.00 0.00 38.32 38.84 3fun h ASN 500 CO -0.05 0.55 -0.42 -0.08 -1.29 0.00 0.00 177.43 176.14 3fun h GLU 501 N 0.95 0.55 -0.76 6.67 4.57 -0.92 0.82 114.58 126.46 3fun h GLU 501 Ca 0.31 -0.29 0.03 0.00 -1.18 0.00 0.00 59.36 58.23 3fun h GLU 501 Cb 0.03 0.01 -0.04 0.00 -0.16 0.00 0.00 28.75 28.58 3fun h GLU 501 CO -0.12 0.87 0.49 0.35 -1.18 0.00 0.00 179.01 179.42 3fun h PHE 502 N 0.46 0.92 -0.45 0.92 3.57 -0.55 0.59 116.94 122.39 3fun h PHE 502 Ca 0.04 0.02 -0.13 0.00 3.53 0.00 0.00 57.97 61.43 3fun h PHE 502 Cb 0.92 -0.31 -0.01 0.00 2.79 0.00 0.00 35.95 39.34 3fun h PHE 502 CO 0.04 0.54 -0.23 -0.07 -2.23 0.00 0.00 178.31 176.35 3fun h LEU 503 N 0.97 0.98 -0.70 0.59 3.38 -0.97 -1.50 115.31 118.06 3fun h LEU 503 Ca 0.30 -0.41 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 3fun h LEU 503 Cb -0.02 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.43 3fun h LEU 503 CO -0.10 1.17 0.34 0.00 0.09 0.00 0.00 178.44 179.94 3fun h ALA 504 N 0.84 0.90 -0.58 1.53 0.00 -0.33 0.20 119.26 121.83 3fun h ALA 504 Ca 0.10 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 3fun h ALA 504 Cb 0.81 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 3fun h ALA 504 CO 0.07 0.46 0.35 1.96 0.00 0.00 0.00 179.25 182.09 3fun h GLN 505 N 0.97 0.79 -0.24 0.00 1.08 -0.79 -2.24 115.11 114.68 3fun h GLN 505 Ca 0.24 -0.07 -0.20 0.00 -1.45 0.00 0.00 58.65 57.17 3fun h GLN 505 Cb 0.12 -0.16 0.00 0.00 -0.05 0.00 0.00 27.48 27.39 3fun h GLN 505 CO -0.03 0.57 -0.63 1.15 -0.95 0.00 0.00 178.83 178.94 3fun h THR 506 N 0.78 1.27 -0.09 -0.54 2.02 -0.82 -2.86 112.91 112.68 3fun h THR 506 Ca 0.21 -1.82 -0.00 0.00 0.77 0.00 0.00 66.41 65.57 3fun h THR 506 Cb -0.02 1.75 -0.00 0.00 -1.74 0.00 0.00 68.15 68.14 3fun h THR 506 CO -0.04 0.59 0.04 0.25 0.37 0.00 0.00 175.52 176.73 3fun h LEU 507 N 0.63 0.10 -2.76 2.58 5.85 -0.46 -0.33 115.31 120.93 3fun h LEU 507 Ca -0.01 -0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.71 3fun h LEU 507 Cb 1.25 -0.03 -0.00 0.00 0.37 0.00 0.00 40.66 42.25 3fun h LEU 507 CO 0.14 0.09 -0.00 1.56 -0.34 0.00 0.00 178.44 179.89 3fun h GLN 508 N 0.12 0.00 -0.36 1.25 4.20 -1.16 -1.68 115.11 117.48 3fun h GLN 508 Ca 0.03 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.74 3fun h GLN 508 Cb 0.02 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.80 3fun h GLN 508 CO -0.00 0.00 0.00 0.54 -0.67 0.00 0.00 178.83 178.70 3fun n ARG 509 N -3.17 2.75 -2.18 1.46 3.00 -0.15 -5.04 116.66 113.33 3fun n ARG 509 Ca -0.03 -2.06 -0.34 0.00 -0.01 0.00 0.00 57.85 55.41 3fun n ARG 509 Cb 0.10 -1.29 0.01 0.00 0.00 0.00 0.00 32.46 31.28 3fun n ARG 509 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 3fun s ALA 510 N -1.00 2.68 0.54 7.54 0.00 -0.63 -4.41 121.76 126.47 3fun s ALA 510 Ca 0.25 0.69 -0.18 0.00 0.00 0.00 0.00 51.96 52.72 3fun s ALA 510 Cb 0.13 -3.32 -0.06 0.00 0.00 0.00 0.00 23.12 19.87 3fun s ALA 510 CO 0.17 -0.80 1.04 -1.25 0.00 0.00 0.00 175.76 174.92 3fun s PRO 511 N -3.52 3.60 0.30 0.00 0.04 -1.26 -5.06 135.00 129.10 3fun s PRO 511 Ca 0.70 1.24 0.06 0.00 0.04 0.00 0.00 61.00 63.04 3fun s PRO 511 Cb -0.21 -2.07 -0.02 0.00 0.04 0.00 0.00 34.50 32.24 3fun s PRO 511 CO 0.30 -0.58 0.39 -0.51 0.04 0.00 0.00 177.00 176.64 3fun s LEU 512 N -4.02 3.99 0.48 -3.56 1.02 -1.26 -5.01 118.68 110.32 3fun s LEU 512 Ca 0.64 -0.17 -0.24 0.00 0.02 0.00 0.00 54.13 54.38 3fun s LEU 512 Cb -0.15 -2.67 -0.08 0.00 0.02 0.00 0.00 46.19 43.31 3fun s LEU 512 CO 0.29 -0.30 1.30 -2.65 0.02 0.00 0.00 176.35 175.01 3fun n PRO 513 N -1.51 1.82 -0.25 1.29 -0.02 -1.26 -4.73 135.00 130.35 3fun n PRO 513 Ca -0.03 0.66 0.05 0.00 -2.02 0.00 0.00 63.50 62.16 3fun n PRO 513 Cb 0.58 -2.46 0.29 0.00 -0.02 0.00 0.00 33.50 31.89 3fun n PRO 513 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3fun h LEU 514 N 1.78 0.79 -1.46 2.45 5.85 -1.97 -1.19 115.31 121.56 3fun h LEU 514 Ca -0.49 0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.20 3fun h LEU 514 Cb 1.30 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 42.15 3fun h LEU 514 CO 0.58 0.51 -0.04 1.23 -0.34 0.00 0.00 178.44 180.38 3fun h GLY 515 N 0.90 0.32 0.83 3.75 0.00 -1.94 -0.60 103.07 106.34 3fun h GLY 515 Ca 0.36 -0.18 -0.04 0.00 0.00 0.00 0.00 47.33 47.47 3fun h GLY 515 CO -0.13 0.17 -0.02 0.45 0.00 0.00 0.00 176.54 177.00 3fun h HIS 516 N 0.29 0.47 -0.70 5.60 3.86 -1.58 -1.68 115.15 121.42 3fun h HIS 516 Ca 0.07 -0.09 -0.07 0.00 -1.16 0.00 0.00 60.37 59.12 3fun h HIS 516 Cb 0.26 -0.12 -0.03 0.00 1.06 0.00 0.00 27.41 28.59 3fun h HIS 516 CO 0.01 0.62 0.16 0.82 0.86 0.00 0.00 177.93 180.39 3fun h ILE 517 N 0.18 1.26 -0.86 2.45 1.08 -1.08 0.12 117.51 120.66 3fun h ILE 517 Ca 0.06 -0.99 -0.01 0.00 -0.39 0.00 0.00 64.86 63.54 3fun h ILE 517 Cb 0.45 0.56 -0.04 0.00 -3.07 0.00 0.00 36.82 34.72 3fun h ILE 517 CO 0.02 0.38 0.50 0.11 -0.69 0.00 0.00 178.15 178.47 3fun h LYS 518 N 1.06 1.19 -0.70 2.37 1.57 -1.09 -2.13 116.57 118.83 3fun h LYS 518 Ca 0.22 -0.12 -0.07 0.00 -1.87 0.00 0.00 60.65 58.81 3fun h LYS 518 Cb 0.39 -0.24 -0.03 0.00 0.08 0.00 0.00 32.23 32.43 3fun h LYS 518 CO 0.00 0.85 0.16 -0.09 -0.57 0.00 0.00 179.45 179.80 3fun h ARG 519 N 1.19 1.12 -0.65 3.15 9.65 -0.66 -1.23 114.38 126.95 3fun h ARG 519 Ca 0.31 -0.28 0.07 0.00 -1.10 0.00 0.00 59.98 58.98 3fun h ARG 519 Cb -0.02 -0.14 -0.06 0.00 -1.39 0.00 0.00 29.97 28.36 3fun h ARG 519 CO -0.05 1.00 0.33 0.52 2.80 0.00 0.00 179.97 184.57 3fun h MET 520 N 1.06 0.58 -0.58 0.20 2.86 -0.47 -0.08 114.93 118.49 3fun h MET 520 Ca 0.22 -0.04 -0.09 0.00 -2.06 0.00 0.00 59.70 57.73 3fun h MET 520 Cb 0.39 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.89 3fun h MET 520 CO 0.00 0.39 0.01 0.37 1.06 0.00 0.00 176.91 178.74 3fun h GLN 521 N 0.60 1.01 -0.54 1.72 5.75 -1.06 0.71 115.11 123.31 3fun h GLN 521 Ca 0.30 -0.31 0.01 0.00 -0.15 0.00 0.00 58.65 58.51 3fun h GLN 521 Cb 0.26 -0.10 -0.03 0.00 1.07 0.00 0.00 27.48 28.68 3fun h GLN 521 CO -0.22 0.99 0.35 1.49 -2.65 0.00 0.00 178.83 178.79 3fun h GLU 522 N 0.93 0.69 0.00 1.69 4.81 0.10 -0.73 114.58 122.07 3fun h GLU 522 Ca 0.17 -0.04 -0.27 0.00 -0.13 0.00 0.00 59.36 59.09 3fun h GLU 522 Cb 0.53 -0.16 -0.05 0.00 0.63 0.00 0.00 28.75 29.70 3fun h GLU 522 CO 0.03 0.46 -2.05 1.33 -0.73 0.00 0.00 179.01 178.04 3fun n VAL 523 N -4.72 1.18 0.12 0.32 0.24 -0.20 -4.53 118.33 110.73 3fun n VAL 523 Ca 0.03 -0.77 0.07 0.00 -2.04 0.00 0.00 64.34 61.64 3fun n VAL 523 Cb 0.03 -0.53 -0.11 0.00 -1.47 0.00 0.00 33.84 31.76 3fun n VAL 523 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 3fun n TYR 524 N -2.75 0.00 -3.87 6.34 4.01 0.23 -3.39 117.16 117.74 3fun n TYR 524 Ca -0.22 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.27 3fun n TYR 524 Cb 1.00 -0.27 0.00 0.00 -0.31 0.00 0.00 39.34 39.76 3fun n TYR 524 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 3fun n ASN 525 N -1.89 -1.22 0.30 7.72 4.05 -0.28 -4.86 115.26 119.07 3fun n ASN 525 Ca -0.02 -0.91 0.17 0.00 0.45 0.00 0.00 54.58 54.27 3fun n ASN 525 Cb 0.35 -3.50 0.92 0.00 1.23 0.00 0.00 39.78 38.78 3fun n ASN 525 CO 0.00 0.00 0.00 -0.26 -3.05 0.00 0.00 177.26 173.95 3fun h PHE 526 N -1.85 0.00 -0.05 1.20 0.04 -1.80 -1.89 116.94 112.58 3fun h PHE 526 Ca -0.62 0.00 0.01 0.00 2.80 0.00 0.00 57.97 60.17 3fun h PHE 526 Cb 1.37 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.52 3fun h PHE 526 CO 0.50 0.04 0.08 -0.91 -0.60 0.00 0.00 178.31 177.41 3fun h ASN 527 N 0.00 0.00 0.52 2.17 2.35 -1.90 -1.48 115.58 117.24 3fun h ASN 527 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3fun h ASN 527 Cb 0.19 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.56 3fun h ASN 527 CO 0.01 0.00 -0.21 0.00 -1.65 0.00 0.00 177.43 175.57 3fun n ALA 528 N -2.25 2.93 -2.69 -0.83 0.00 -0.71 -4.85 120.51 112.11 3fun n ALA 528 Ca -0.02 -0.27 -0.41 0.00 0.00 0.00 0.00 53.44 52.74 3fun n ALA 528 Cb 0.16 -1.28 -0.04 0.00 0.00 0.00 0.00 19.45 18.30 3fun n ALA 528 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3fun s ILE 529 N -2.73 4.91 -0.78 0.00 1.01 -0.56 -4.93 121.20 118.12 3fun s ILE 529 Ca 0.20 1.69 0.22 0.00 0.00 0.00 0.00 60.65 62.76 3fun s ILE 529 Cb 0.19 -4.16 -0.23 0.00 0.01 0.00 0.00 42.46 38.27 3fun s ILE 529 CO 0.55 0.10 0.86 0.59 0.00 0.00 0.00 174.94 177.04 3fun n ASN 530 N 4.66 0.75 -4.70 3.58 3.02 -1.26 -4.59 115.26 116.71 3fun n ASN 530 Ca 0.04 -0.70 -0.58 0.00 -0.03 0.00 0.00 54.58 53.31 3fun n ASN 530 Cb 0.50 1.14 -0.08 0.00 -0.61 0.00 0.00 39.78 40.73 3fun n ASN 530 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3fun n ASN 531 N -1.69 2.26 -0.09 6.41 2.85 -1.26 -4.83 115.26 118.90 3fun n ASN 531 Ca 0.02 1.06 -0.04 0.00 -0.11 0.00 0.00 54.58 55.51 3fun n ASN 531 Cb 0.39 -1.12 0.16 0.00 1.24 0.00 0.00 39.78 40.45 3fun n ASN 531 CO 0.00 0.00 0.00 0.77 -2.11 0.00 0.00 177.26 175.92 3fun h SER 532 N 7.24 0.74 -0.18 1.20 4.64 -1.91 -0.26 113.55 125.01 3fun h SER 532 Ca -0.45 -0.19 -0.02 0.00 -0.47 0.00 0.00 61.79 60.66 3fun h SER 532 Cb 1.32 -0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 63.21 3fun h SER 532 CO 0.97 0.83 0.04 -0.33 -0.87 0.00 0.00 176.83 177.47 3fun h GLU 533 N 0.71 0.29 -0.11 4.77 4.39 -1.88 -0.64 114.58 122.11 3fun h GLU 533 Ca 0.13 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 59.75 3fun h GLU 533 Cb 0.49 -0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 29.10 3fun h GLU 533 CO 0.02 0.43 0.04 0.82 -1.16 0.00 0.00 179.01 179.16 3fun h ILE 534 N 0.10 1.17 -0.76 3.13 2.04 -1.89 -2.55 117.51 118.75 3fun h ILE 534 Ca 0.06 -0.50 0.01 0.00 1.00 0.00 0.00 64.86 65.42 3fun h ILE 534 Cb 0.28 1.31 -0.04 0.00 -0.74 0.00 0.00 36.82 37.63 3fun h ILE 534 CO 0.00 0.15 0.49 -0.09 0.00 0.00 0.00 178.15 178.70 3fun h ARG 535 N -0.01 1.01 -0.11 2.37 2.43 -1.02 -0.32 114.38 118.73 3fun h ARG 535 Ca 0.03 -0.07 0.04 0.00 -0.81 0.00 0.00 59.98 59.18 3fun h ARG 535 Cb 0.20 -0.22 -0.06 0.00 -0.42 0.00 0.00 29.97 29.47 3fun h ARG 535 CO -0.00 0.68 -0.28 0.35 -1.51 0.00 0.00 179.97 179.21 3fun h PHE 536 N 1.03 -0.75 -0.45 2.20 3.57 -1.03 0.11 116.94 121.62 3fun h PHE 536 Ca 0.28 0.03 -0.11 0.00 3.53 0.00 0.00 57.97 61.70 3fun h PHE 536 Cb -0.10 0.35 -0.02 0.00 2.79 0.00 0.00 35.95 38.97 3fun h PHE 536 CO -0.02 -0.36 -0.16 0.00 -2.23 0.00 0.00 178.31 175.54 3fun h ARG 537 N -0.36 0.87 -0.33 1.11 3.08 -1.04 -0.96 114.38 116.75 3fun h ARG 537 Ca 0.09 -0.33 -0.02 0.00 0.07 0.00 0.00 59.98 59.79 3fun h ARG 537 Cb 0.50 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.48 3fun h ARG 537 CO -0.31 0.97 0.13 2.35 -1.07 0.00 0.00 179.97 182.04 3fun h TRP 538 N 0.77 0.50 -0.46 3.04 -0.00 -0.78 -0.90 115.95 118.13 3fun h TRP 538 Ca 0.11 -0.04 -0.11 0.00 -0.00 0.00 0.00 58.89 58.85 3fun h TRP 538 Cb 0.69 -0.15 -0.02 0.00 -0.00 0.00 0.00 29.16 29.69 3fun h TRP 538 CO 0.04 0.48 -0.17 -0.07 -0.00 0.00 0.00 178.44 178.72 3fun h LEU 539 N 0.39 0.89 -0.56 0.65 3.38 -0.55 -0.23 115.31 119.27 3fun h LEU 539 Ca 0.11 -0.31 0.02 0.00 0.09 0.00 0.00 57.88 57.80 3fun h LEU 539 Cb 0.19 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.66 3fun h LEU 539 CO -0.01 1.05 0.34 0.03 0.09 0.00 0.00 178.44 179.94 3fun h ARG 540 N 0.78 0.65 -0.62 1.13 3.08 -1.02 -0.32 114.38 118.07 3fun h ARG 540 Ca 0.12 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.12 3fun h ARG 540 Cb 0.70 -0.15 -0.03 0.00 0.08 0.00 0.00 29.97 30.57 3fun h ARG 540 CO 0.05 0.43 0.37 1.25 -1.07 0.00 0.00 179.97 181.00 3fun h LEU 541 N 0.67 0.75 -0.26 3.04 5.85 -0.70 0.66 115.31 125.32 3fun h LEU 541 Ca 0.22 -0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.87 3fun h LEU 541 Cb 0.02 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 40.85 3fun h LEU 541 CO -0.10 0.59 0.13 0.00 -0.34 0.00 0.00 178.44 178.73 3fun h ILE 543 N 0.29 1.30 0.00 0.00 1.08 -0.86 -1.06 117.51 118.26 3fun h ILE 543 Ca 0.09 -1.10 -0.00 0.00 -0.39 0.00 0.00 64.86 63.45 3fun h ILE 543 Cb 0.10 1.63 -0.00 0.00 -3.07 0.00 0.00 36.82 35.48 3fun h ILE 543 CO -0.01 0.33 -0.01 1.56 -0.69 0.00 0.00 178.15 179.33 3fun h GLN 544 N 0.08 0.00 -0.44 2.37 4.20 -0.87 -0.10 115.11 120.35 3fun h GLN 544 Ca 0.04 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.75 3fun h GLN 544 Cb 0.54 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.32 3fun h GLN 544 CO 0.02 0.01 0.00 0.43 -0.67 0.00 0.00 178.83 178.63 3fun n SER 545 N -4.36 2.35 -1.35 1.46 7.64 -0.53 -4.47 113.62 114.36 3fun n SER 545 Ca -0.03 -2.02 -0.10 0.00 1.01 0.00 0.00 58.87 57.74 3fun n SER 545 Cb 0.10 -0.30 0.01 0.00 -1.01 0.00 0.00 64.21 63.01 3fun n SER 545 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 3fun n LYS 546 N 0.75 -1.75 -2.94 1.43 4.76 -0.05 -4.34 118.16 116.03 3fun n LYS 546 Ca 0.14 0.42 -0.43 0.00 -2.87 0.00 0.00 58.31 55.57 3fun n LYS 546 Cb 0.38 -4.29 -0.05 0.00 -1.84 0.00 0.00 35.03 29.23 3fun n LYS 546 CO 0.00 0.00 0.00 -0.46 -1.37 0.00 0.00 177.40 175.57 3fun s TRP 547 N -2.71 2.92 0.43 2.13 -0.00 -0.46 -4.92 118.94 116.33 3fun s TRP 547 Ca 0.09 -0.00 0.11 0.00 -0.00 0.00 0.00 56.10 56.30 3fun s TRP 547 Cb -0.04 -3.82 0.94 0.00 -0.00 0.00 0.00 33.47 30.55 3fun s TRP 547 CO 0.12 -1.14 2.01 0.93 -0.00 0.00 0.00 176.95 178.86 3fun h GLU 548 N 9.12 0.21 -0.04 5.86 5.08 -1.94 -1.48 114.58 131.39 3fun h GLU 548 Ca -0.26 -0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.08 3fun h GLU 548 Cb 1.08 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 30.29 3fun h GLU 548 CO 1.01 0.26 0.04 -0.44 -1.00 0.00 0.00 179.01 178.89 3fun h ASP 549 N 0.21 0.00 0.77 1.42 3.45 -1.97 -0.88 116.42 119.42 3fun h ASP 549 Ca 0.05 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.51 3fun h ASP 549 Cb 0.20 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.97 3fun h ASP 549 CO 0.01 0.00 -0.23 0.00 -1.57 0.00 0.00 179.24 177.45 3fun n ALA 550 N -2.33 2.88 0.13 3.45 0.00 -0.56 -4.16 120.51 119.92 3fun n ALA 550 Ca -0.02 -0.21 -0.13 0.00 0.00 0.00 0.00 53.44 53.08 3fun n ALA 550 Cb 0.13 -1.31 -0.06 0.00 0.00 0.00 0.00 19.45 18.21 3fun n ALA 550 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 3fun h ILE 551 N 0.00 0.55 -0.13 0.00 2.04 -1.26 -0.38 117.51 118.33 3fun h ILE 551 Ca 0.00 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.80 3fun h ILE 551 Cb 0.50 0.55 -0.01 0.00 -0.74 0.00 0.00 36.82 37.12 3fun h ILE 551 CO 0.00 0.00 -0.20 1.55 0.00 0.00 0.00 178.15 179.50 3fun h PRO 552 N -0.41 0.22 -0.47 2.37 0.13 -1.77 -0.74 132.00 131.33 3fun h PRO 552 Ca 0.01 -0.06 -0.06 0.00 -0.87 0.00 0.00 66.00 65.02 3fun h PRO 552 Cb 0.41 -0.02 -0.02 0.00 0.13 0.00 0.00 31.00 31.50 3fun h PRO 552 CO -0.08 0.43 0.05 -0.07 -0.23 0.00 0.00 178.00 178.10 3fun h LEU 553 N 0.21 0.76 -0.41 1.56 3.38 -1.65 -1.51 115.31 117.65 3fun h LEU 553 Ca 0.04 -0.28 -0.18 0.00 0.09 0.00 0.00 57.88 57.56 3fun h LEU 553 Cb 0.49 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.03 3fun h LEU 553 CO 0.03 0.85 -0.57 0.00 0.09 0.00 0.00 178.44 178.84 3fun h ALA 554 N 0.94 0.59 -0.78 1.53 0.00 -0.60 -1.65 119.26 119.29 3fun h ALA 554 Ca 0.14 -0.52 -0.04 0.00 0.00 0.00 0.00 54.91 54.49 3fun h ALA 554 Cb 0.43 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.11 3fun h ALA 554 CO 0.01 0.69 0.34 -0.07 0.00 0.00 0.00 179.25 180.23 3fun h LEU 555 N 0.51 1.05 0.02 0.00 3.38 -1.09 -0.74 115.31 118.44 3fun h LEU 555 Ca 0.00 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 57.82 3fun h LEU 555 Cb 1.15 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.63 3fun h LEU 555 CO 0.12 0.92 -0.01 0.50 0.09 0.00 0.00 178.44 180.06 3fun h LYS 556 N 1.12 -0.02 -0.64 1.13 3.64 -1.08 -2.34 116.57 118.38 3fun h LYS 556 Ca 0.26 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.62 3fun h LYS 556 Cb 0.17 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.96 3fun h LYS 556 CO -0.03 0.16 0.32 1.98 -2.27 0.00 0.00 179.45 179.61 3fun h MET 557 N -0.20 0.90 0.00 1.90 4.05 -1.17 0.15 114.93 120.56 3fun h MET 557 Ca -0.00 -0.11 -0.06 0.00 -0.28 0.00 0.00 59.70 59.24 3fun h MET 557 Cb 0.19 -0.17 -0.01 0.00 -0.80 0.00 0.00 31.60 30.81 3fun h MET 557 CO 0.00 0.69 -0.30 0.00 0.23 0.00 0.00 176.91 177.54 3fun h ALA 558 N 1.44 1.37 0.00 0.39 0.00 -0.79 -3.24 119.26 118.43 3fun h ALA 558 Ca 0.22 -0.27 -0.25 0.00 0.00 0.00 0.00 54.91 54.62 3fun h ALA 558 Cb 0.08 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.78 3fun h ALA 558 CO -0.03 0.38 -2.00 0.25 0.00 0.00 0.00 179.25 177.85 3fun n THR 559 N -3.99 0.92 0.83 0.00 -2.24 -0.91 -4.51 114.28 104.38 3fun n THR 559 Ca -0.02 -0.61 0.13 0.00 -2.27 0.00 0.00 64.05 61.29 3fun n THR 559 Cb 0.36 -0.52 0.53 0.00 -2.10 0.00 0.00 70.33 68.60 3fun n THR 559 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3fun n GLU 560 N -2.50 0.09 -4.19 -0.78 1.02 0.49 -4.74 120.64 110.02 3fun n GLU 560 Ca -0.22 0.10 -0.12 0.00 -0.02 0.00 0.00 57.16 56.90 3fun n GLU 560 Cb 0.93 -1.61 -0.10 0.00 -0.02 0.00 0.00 31.44 30.64 3fun n GLU 560 CO 0.00 0.00 0.00 1.14 1.18 0.00 0.00 177.13 179.45 3fun s GLN 561 N -3.04 1.18 -0.02 3.49 1.03 -1.22 -4.83 119.66 116.23 3fun s GLN 561 Ca 0.12 -1.60 0.04 0.00 0.04 0.00 0.00 55.36 53.96 3fun s GLN 561 Cb 0.16 0.27 0.05 0.00 0.03 0.00 0.00 33.01 33.52 3fun s GLN 561 CO 0.53 -0.38 0.94 0.41 -2.54 0.00 0.00 175.29 174.25 3fun n GLY 562 N -0.25 0.81 3.68 2.60 0.00 0.20 -4.71 105.19 107.52 3fun n GLY 562 Ca 0.01 -0.21 -0.42 0.00 0.00 0.00 0.00 46.02 45.40 3fun n GLY 562 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3fun s ARG 563 N -0.59 4.21 0.47 1.61 3.52 -1.22 -4.31 118.95 122.64 3fun s ARG 563 Ca 0.06 2.24 0.15 0.00 -0.13 0.00 0.00 55.73 58.05 3fun s ARG 563 Cb 0.05 -3.71 1.08 0.00 -1.56 0.00 0.00 34.95 30.81 3fun s ARG 563 CO 0.01 -0.74 2.04 0.52 -0.81 0.00 0.00 175.30 176.32 3fun h MET 564 N 8.62 0.02 -0.86 5.12 2.86 -0.92 0.10 114.93 129.86 3fun h MET 564 Ca -0.41 -0.00 0.17 0.00 -2.06 0.00 0.00 59.70 57.40 3fun h MET 564 Cb 1.19 -0.00 -0.06 0.00 0.06 0.00 0.00 31.60 32.79 3fun h MET 564 CO 0.93 0.13 0.57 -0.22 1.06 0.00 0.00 176.91 179.38 3fun h LYS 565 N 0.02 0.47 0.00 1.72 3.64 -1.89 -1.47 116.57 119.05 3fun h LYS 565 Ca 0.00 -0.03 -0.45 0.00 -1.27 0.00 0.00 60.65 58.91 3fun h LYS 565 Cb 0.21 -0.10 -0.07 0.00 -0.41 0.00 0.00 32.23 31.85 3fun h LYS 565 CO 0.01 0.31 -2.54 1.19 -2.27 0.00 0.00 179.45 176.16 3fun n PHE 566 N -4.52 0.00 -0.26 1.91 3.72 -0.44 -4.45 117.46 113.42 3fun n PHE 566 Ca 0.18 0.00 -0.06 0.00 -0.05 0.00 0.00 57.45 57.52 3fun n PHE 566 Cb 0.60 -1.00 0.05 0.00 -0.94 0.00 0.00 39.48 38.19 3fun n PHE 566 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 176.76 177.86 3fun h THR 567 N -0.76 1.23 0.08 4.37 2.02 -0.99 -1.97 112.91 116.88 3fun h THR 567 Ca -0.68 -0.64 -0.00 0.00 0.77 0.00 0.00 66.41 65.86 3fun h THR 567 Cb 1.68 0.35 0.00 0.00 -1.74 0.00 0.00 68.15 68.44 3fun h THR 567 CO -0.35 0.27 -0.04 0.03 0.37 0.00 0.00 175.52 175.80 3fun h ARG 568 N 0.99 -0.10 0.00 6.66 3.08 -1.50 -1.72 114.38 121.79 3fun h ARG 568 Ca 0.24 0.01 -0.13 0.00 0.07 0.00 0.00 59.98 60.18 3fun h ARG 568 Cb 0.11 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.16 3fun h ARG 568 CO -0.03 0.15 -0.60 -1.35 -1.07 0.00 0.00 179.97 177.07 3fun h PRO 569 N -0.35 0.00 -0.13 0.04 0.11 -1.74 -0.78 132.00 129.16 3fun h PRO 569 Ca -0.01 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.09 3fun h PRO 569 Cb 0.30 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.40 3fun h PRO 569 CO 0.02 0.60 0.06 -0.07 -0.21 0.00 0.00 178.00 178.39 3fun h LEU 570 N 0.00 0.18 -0.70 2.35 3.38 -1.31 0.13 115.31 119.34 3fun h LEU 570 Ca -0.01 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.81 3fun h LEU 570 Cb 1.11 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.78 3fun h LEU 570 CO 0.08 0.28 0.44 -0.26 0.09 0.00 0.00 178.44 179.07 3fun h PHE 571 N 0.07 0.91 -0.36 1.13 0.04 -1.12 -0.61 116.94 117.00 3fun h PHE 571 Ca 0.04 0.01 0.02 0.00 2.80 0.00 0.00 57.97 60.84 3fun h PHE 571 Cb 0.16 -0.30 -0.02 0.00 2.20 0.00 0.00 35.95 37.98 3fun h PHE 571 CO -0.02 0.60 0.20 0.87 -0.60 0.00 0.00 178.31 179.36 3fun h LYS 572 N 0.96 0.40 -0.66 1.51 1.57 -0.93 0.41 116.57 119.84 3fun h LYS 572 Ca 0.25 -0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 58.96 3fun h LYS 572 Cb -0.07 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.13 3fun h LYS 572 CO -0.05 0.27 0.20 -0.44 -0.57 0.00 0.00 179.45 178.85 3fun h ASP 573 N 0.41 0.96 -0.24 0.86 5.19 -0.51 -1.49 116.42 121.60 3fun h ASP 573 Ca 0.14 -0.21 -0.09 0.00 -0.62 0.00 0.00 57.03 56.25 3fun h ASP 573 Cb 0.01 -0.25 -0.02 0.00 0.18 0.00 0.00 39.33 39.25 3fun h ASP 573 CO -0.07 0.92 -0.15 -0.07 -3.12 0.00 0.00 179.24 176.75 3fun h LEU 574 N 0.96 0.65 -1.10 1.55 3.38 -0.87 -2.29 115.31 117.58 3fun h LEU 574 Ca 0.21 -0.20 -0.09 0.00 0.09 0.00 0.00 57.88 57.89 3fun h LEU 574 Cb 0.31 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 3fun h LEU 574 CO -0.01 0.82 -0.38 0.00 0.09 0.00 0.00 178.44 178.96 3fun h ALA 575 N 1.24 1.25 0.00 1.53 0.00 -0.55 -2.90 119.26 119.83 3fun h ALA 575 Ca 0.10 -0.37 -0.03 0.00 0.00 0.00 0.00 54.91 54.61 3fun h ALA 575 Cb 0.59 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 3fun h ALA 575 CO 0.04 0.53 -0.15 0.00 0.00 0.00 0.00 179.25 179.67 3fun h ALA 576 N 1.51 0.92 -2.16 0.00 0.00 -0.81 -3.41 119.26 115.30 3fun h ALA 576 Ca 0.01 -0.13 -0.60 0.00 0.00 0.00 0.00 54.91 54.19 3fun h ALA 576 Cb 0.73 -0.02 -0.10 0.00 0.00 0.00 0.00 17.79 18.40 3fun h ALA 576 CO 0.05 0.18 0.48 0.12 0.00 0.00 0.00 179.25 180.08 3fun s PHE 577 N -3.23 3.16 0.45 0.00 5.36 -0.91 -4.94 117.98 117.88 3fun s PHE 577 Ca 0.05 0.80 0.15 0.00 -0.96 0.00 0.00 56.93 56.97 3fun s PHE 577 Cb 0.06 -3.38 1.08 0.00 -0.34 0.00 0.00 43.02 40.45 3fun s PHE 577 CO 0.67 -0.66 1.99 0.38 -1.46 0.00 0.00 175.22 176.14 3fun h ASP 578 N 8.24 0.31 0.62 6.13 3.04 -1.85 0.25 116.42 133.16 3fun h ASP 578 Ca -0.24 0.01 -0.07 0.00 -3.24 0.00 0.00 57.03 53.49 3fun h ASP 578 Cb 1.09 -0.06 -0.01 0.00 -1.04 0.00 0.00 39.33 39.31 3fun h ASP 578 CO 0.92 0.18 -0.32 0.11 -2.04 0.00 0.00 179.24 178.10 3fun h LYS 579 N 0.34 0.00 -0.01 4.15 1.79 -1.92 -3.12 116.57 117.81 3fun h LYS 579 Ca 0.26 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.73 3fun h LYS 579 Cb 0.57 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.22 3fun h LYS 579 CO -0.06 0.32 -0.32 -1.13 -1.08 0.00 0.00 179.45 177.18 3fun n SER 580 N -3.70 1.05 -0.06 0.86 3.41 -0.51 -4.75 113.62 109.92 3fun n SER 580 Ca -0.01 -1.03 -0.08 0.00 -0.26 0.00 0.00 58.87 57.49 3fun n SER 580 Cb 0.42 0.63 -0.02 0.00 -0.26 0.00 0.00 64.21 64.99 3fun n SER 580 CO 0.00 0.00 0.00 -0.74 -0.16 0.00 0.00 175.04 174.14 3fun h HIS 581 N 0.87 -0.70 -0.50 7.33 6.17 -0.80 -0.13 115.15 127.39 3fun h HIS 581 Ca 0.00 0.04 -0.07 0.00 0.71 0.00 0.00 60.37 61.05 3fun h HIS 581 Cb 0.34 0.35 -0.02 0.00 2.52 0.00 0.00 27.41 30.60 3fun h HIS 581 CO 0.00 -0.33 0.03 -0.44 0.71 0.00 0.00 177.93 177.89 3fun h ASP 582 N -0.25 0.84 -0.27 3.26 3.32 -1.85 -2.03 116.42 119.43 3fun h ASP 582 Ca 0.14 -0.29 -0.05 0.00 0.02 0.00 0.00 57.03 56.86 3fun h ASP 582 Cb 0.48 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.79 3fun h ASP 582 CO -0.42 0.92 0.03 -0.61 -1.72 0.00 0.00 179.24 177.45 3fun h GLN 583 N 0.73 0.55 -0.24 3.56 4.15 -1.81 -1.21 115.11 120.83 3fun h GLN 583 Ca 0.14 -0.11 -0.02 0.00 0.77 0.00 0.00 58.65 59.43 3fun h GLN 583 Cb 0.48 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 28.07 3fun h GLN 583 CO 0.02 0.55 0.07 0.00 -1.93 0.00 0.00 178.83 177.54 3fun h ALA 584 N 1.51 0.32 -0.44 3.38 0.00 -0.48 0.44 119.26 123.99 3fun h ALA 584 Ca 0.12 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 3fun h ALA 584 Cb 0.29 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 3fun h ALA 584 CO 0.01 -0.04 0.18 0.28 0.00 0.00 0.00 179.25 179.68 3fun h VAL 585 N 0.22 1.20 -0.75 0.00 2.07 -1.22 -1.25 116.25 116.52 3fun h VAL 585 Ca 0.08 -0.60 -0.01 0.00 0.82 0.00 0.00 66.70 66.99 3fun h VAL 585 Cb 0.26 0.78 -0.04 0.00 -1.52 0.00 0.00 31.29 30.77 3fun h VAL 585 CO -0.00 0.22 0.42 0.03 0.02 0.00 0.00 177.57 178.27 3fun h ARG 586 N 0.56 1.04 -0.55 1.57 3.08 -1.06 -0.27 114.38 118.76 3fun h ARG 586 Ca 0.15 -0.11 -0.01 0.00 0.07 0.00 0.00 59.98 60.07 3fun h ARG 586 Cb 0.18 -0.21 -0.03 0.00 0.08 0.00 0.00 29.97 29.99 3fun h ARG 586 CO -0.01 0.76 0.30 1.15 -1.07 0.00 0.00 179.97 181.10 3fun h THR 587 N 1.04 1.18 -0.30 2.04 2.02 -0.70 -0.70 112.91 117.50 3fun h THR 587 Ca 0.27 -0.47 -0.01 0.00 0.77 0.00 0.00 66.41 66.96 3fun h THR 587 Cb 0.02 0.50 -0.01 0.00 -1.74 0.00 0.00 68.15 66.91 3fun h THR 587 CO -0.04 0.20 0.14 0.22 0.37 0.00 0.00 175.52 176.40 3fun h TYR 588 N 0.74 0.43 -0.96 3.16 3.20 -0.84 -1.39 116.97 121.31 3fun h TYR 588 Ca 0.19 -0.02 0.03 0.00 3.14 0.00 0.00 58.73 62.07 3fun h TYR 588 Cb 0.05 -0.13 -0.06 0.00 1.54 0.00 0.00 36.73 38.13 3fun h TYR 588 CO -0.01 0.39 0.63 1.96 -1.64 0.00 0.00 178.16 179.49 3fun h GLN 589 N 0.34 1.19 -0.01 1.82 4.20 -0.66 0.84 115.11 122.83 3fun h GLN 589 Ca 0.10 -0.07 -0.14 0.00 0.06 0.00 0.00 58.65 58.60 3fun h GLN 589 Cb 0.13 -0.27 -0.02 0.00 0.30 0.00 0.00 27.48 27.62 3fun h GLN 589 CO -0.01 0.79 -0.63 0.93 -0.67 0.00 0.00 178.83 179.24 3fun h GLU 590 N 1.23 0.04 0.00 1.46 5.08 -0.87 -3.26 114.58 118.26 3fun h GLU 590 Ca 0.38 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.71 3fun h GLU 590 Cb -0.02 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.24 3fun h GLU 590 CO -0.12 0.66 -1.28 0.72 -1.00 0.00 0.00 179.01 178.00 3fun n HIS 591 N -3.80 0.44 -0.20 4.33 8.25 -0.55 -4.61 115.22 119.07 3fun n HIS 591 Ca -0.01 0.13 0.01 0.00 -0.26 0.00 0.00 57.72 57.59 3fun n HIS 591 Cb 0.63 -0.63 0.11 0.00 1.12 0.00 0.00 29.99 31.21 3fun n HIS 591 CO 0.00 0.00 0.00 -0.22 0.64 0.00 0.00 176.34 176.76 3fun h LYS 592 N 0.00 0.16 0.00 -0.41 3.64 -0.89 -0.74 116.57 118.33 3fun h LYS 592 Ca 0.00 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.36 3fun h LYS 592 Cb 0.89 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 32.68 3fun h LYS 592 CO 0.00 0.11 -0.05 0.00 -2.27 0.00 0.00 179.45 177.24 3fun h ALA 593 N 1.54 1.73 -0.52 5.00 0.00 -1.81 -2.49 119.26 122.71 3fun h ALA 593 Ca 0.33 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.19 3fun h ALA 593 Cb 0.52 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.31 3fun h ALA 593 CO -0.49 0.06 0.00 -1.13 0.00 0.00 0.00 179.25 177.69 3fun n SER 594 N -4.20 3.61 -4.90 0.00 3.41 -0.32 -4.97 113.62 106.25 3fun n SER 594 Ca -0.03 -2.13 -0.28 0.00 -0.26 0.00 0.00 58.87 56.18 3fun n SER 594 Cb 0.13 -0.39 0.00 0.00 -0.26 0.00 0.00 64.21 63.70 3fun n SER 594 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 3fun s MET 595 N -1.23 3.49 0.36 4.33 1.00 -0.94 -5.04 119.30 121.27 3fun s MET 595 Ca 0.37 0.29 -0.27 0.00 0.00 0.00 0.00 55.69 56.09 3fun s MET 595 Cb 0.21 -2.30 -0.12 0.00 0.00 0.00 0.00 34.83 32.62 3fun s MET 595 CO 0.23 -0.34 1.23 1.58 0.00 0.00 0.00 175.02 177.73 3fun n HIS 596 N -2.40 2.05 -0.07 -0.03 -0.00 -1.26 -4.80 115.22 108.71 3fun n HIS 596 Ca 0.02 0.55 0.01 0.00 -0.00 0.00 0.00 57.72 58.31 3fun n HIS 596 Cb 0.55 -2.37 0.31 0.00 -0.00 0.00 0.00 29.99 28.48 3fun n HIS 596 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 3fun h PRO 597 N 2.29 0.69 -0.02 1.57 0.13 -1.88 0.10 132.00 134.88 3fun h PRO 597 Ca -0.46 -0.08 -0.14 0.00 -0.87 0.00 0.00 66.00 64.46 3fun h PRO 597 Cb 1.30 -0.14 0.01 0.00 0.13 0.00 0.00 31.00 32.30 3fun h PRO 597 CO 0.61 0.54 -0.52 0.28 -0.23 0.00 0.00 178.00 178.68 3fun h VAL 598 N 0.69 1.44 -0.61 1.56 2.07 -1.91 -1.90 116.25 117.59 3fun h VAL 598 Ca 0.17 -2.00 0.06 0.00 0.82 0.00 0.00 66.70 65.75 3fun h VAL 598 Cb 0.08 2.55 -0.05 0.00 -1.52 0.00 0.00 31.29 32.35 3fun h VAL 598 CO -0.02 0.58 0.32 0.74 0.02 0.00 0.00 177.57 179.21 3fun h THR 599 N -0.14 0.94 -0.80 2.57 2.02 -1.88 -0.55 112.91 115.06 3fun h THR 599 Ca -0.06 -0.20 -0.02 0.00 0.77 0.00 0.00 66.41 66.90 3fun h THR 599 Cb 1.22 0.29 -0.04 0.00 -1.74 0.00 0.00 68.15 67.89 3fun h THR 599 CO 0.10 0.11 0.42 0.00 0.37 0.00 0.00 175.52 176.52 3fun h ALA 600 N 1.34 1.03 -0.30 6.16 0.00 -0.77 -0.19 119.26 126.52 3fun h ALA 600 Ca 0.28 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 3fun h ALA 600 Cb 0.20 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3fun h ALA 600 CO -0.19 0.56 0.15 1.98 0.00 0.00 0.00 179.25 181.75 3fun h MET 601 N 1.12 0.44 -0.14 0.00 -1.53 -0.60 -1.97 114.93 112.24 3fun h MET 601 Ca 0.28 -0.06 -0.18 0.00 -3.44 0.00 0.00 59.70 56.30 3fun h MET 601 Cb 0.07 -0.08 0.01 0.00 -0.55 0.00 0.00 31.60 31.05 3fun h MET 601 CO -0.04 0.41 -0.60 -0.07 0.14 0.00 0.00 176.91 176.75 3fun h LEU 602 N 0.36 0.78 -0.74 3.39 3.38 -0.79 -1.25 115.31 120.45 3fun h LEU 602 Ca 0.10 -0.62 -0.01 0.00 0.09 0.00 0.00 57.88 57.44 3fun h LEU 602 Cb 0.12 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.60 3fun h LEU 602 CO -0.01 1.27 0.43 0.58 0.09 0.00 0.00 178.44 180.79 3fun h VAL 603 N 0.34 1.22 -0.62 1.22 2.07 -1.08 -0.26 116.25 119.13 3fun h VAL 603 Ca -0.03 -0.51 -0.01 0.00 0.82 0.00 0.00 66.70 66.97 3fun h VAL 603 Cb 1.24 0.22 -0.03 0.00 -1.52 0.00 0.00 31.29 31.19 3fun h VAL 603 CO 0.13 0.23 0.36 1.23 0.02 0.00 0.00 177.57 179.54 3fun h GLY 604 N 1.01 0.90 1.00 2.17 0.00 -1.18 -0.29 103.07 106.68 3fun h GLY 604 Ca 0.26 -0.38 0.00 0.00 0.00 0.00 0.00 47.33 47.21 3fun h GLY 604 CO -0.05 0.37 0.32 0.50 0.00 0.00 0.00 176.54 177.68 3fun h LYS 605 N 0.84 0.64 -0.98 4.80 1.57 -0.98 -0.36 116.57 122.09 3fun h LYS 605 Ca 0.22 -0.04 0.01 0.00 -1.87 0.00 0.00 60.65 58.97 3fun h LYS 605 Cb -0.01 -0.14 -0.05 0.00 0.08 0.00 0.00 32.23 32.11 3fun h LYS 605 CO -0.04 0.42 0.64 -0.44 -0.57 0.00 0.00 179.45 179.47 3fun h ASP 606 N 0.65 1.14 0.38 0.86 3.32 -0.35 -2.64 116.42 119.79 3fun h ASP 606 Ca 0.18 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.19 3fun h ASP 606 Cb -0.07 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.19 3fun h ASP 606 CO -0.04 0.83 -0.24 0.18 -1.72 0.00 0.00 179.24 178.25 3fun n LEU 607 N -4.39 0.67 -3.36 1.55 4.32 -0.18 -4.94 117.00 110.66 3fun n LEU 607 Ca 0.11 -0.07 -0.22 0.00 -0.02 0.00 0.00 56.01 55.81 3fun n LEU 607 Cb 0.02 -0.19 0.07 0.00 -1.62 0.00 0.00 43.42 41.70 3fun n LEU 607 CO 0.37 0.13 0.23 0.29 -1.22 0.00 0.00 177.39 177.19 3fun n LYS 608 N -0.98 -7.39 0.00 3.23 5.02 -0.29 -5.07 118.16 112.68 3fun n LYS 608 Ca 0.11 0.77 0.00 0.00 -2.02 0.00 0.00 58.31 57.17 3fun n LYS 608 Cb 0.32 -5.63 0.00 0.00 -0.02 0.00 0.00 35.03 29.70 3fun n LYS 608 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21