#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k3t n ALA -2 N 0.00 2.50 -3.63 4.61 0.00 -1.26 -4.81 120.51 117.91 2k3t n ALA -2 Ca 0.00 -0.14 -0.12 0.00 0.00 0.00 0.00 53.44 53.18 2k3t n ALA -2 Cb 0.00 -1.43 -0.13 0.00 0.00 0.00 0.00 19.45 17.90 2k3t n ALA -2 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 2k3t s MET -1 N -2.94 0.23 0.77 0.00 -2.45 -1.26 -4.74 119.30 108.92 2k3t s MET -1 Ca 0.16 0.52 -0.11 0.00 -1.25 0.00 0.00 55.69 55.01 2k3t s MET -1 Cb 0.19 -0.07 0.07 0.00 1.25 0.00 0.00 34.83 36.26 2k3t s MET -1 CO 0.54 -0.14 1.14 0.20 1.05 0.00 0.00 175.02 177.80 2k3t s GLY 2427N 1.10 1.61 -0.15 2.11 0.00 -0.40 -4.96 107.32 106.64 2k3t s GLY 2427Ca -0.08 -0.66 -0.16 0.00 0.00 0.00 0.00 44.72 43.82 2k3t s GLY 2427CO -0.07 -0.20 0.37 0.99 0.00 0.00 0.00 173.10 174.19 2k3t s ASP 2428N -4.54 6.53 0.52 1.64 1.01 -1.26 -4.88 116.67 115.70 2k3t s ASP 2428Ca 0.61 0.63 0.21 0.00 0.71 0.00 0.00 52.55 54.71 2k3t s ASP 2428Cb -0.11 -2.23 1.33 0.00 1.01 0.00 0.00 42.92 42.92 2k3t s ASP 2428CO 0.49 0.05 2.04 -0.65 0.21 0.00 0.00 175.17 177.30 2k3t h PRO 2429N 6.75 0.03 0.00 8.23 0.11 -1.90 -1.61 132.00 143.62 2k3t h PRO 2429Ca -0.41 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.68 2k3t h PRO 2429Cb 1.17 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 2k3t h PRO 2429CO 0.75 0.02 -0.10 0.78 -0.21 0.00 0.00 178.00 179.25 2k3t h GLY 2430N 0.03 0.00 1.03 -0.55 0.00 -1.92 -1.85 103.07 99.81 2k3t h GLY 2430Ca 0.18 0.00 -0.30 0.00 0.00 0.00 0.00 47.33 47.21 2k3t h GLY 2430CO -0.01 0.00 -1.68 1.41 0.00 0.00 0.00 176.54 176.26 2k3t h LEU 2431N 0.00 0.10 -9.75 3.11 -0.00 -1.68 -3.43 115.31 103.66 2k3t h LEU 2431Ca -0.00 -0.19 -0.52 0.00 -0.00 0.00 0.00 57.88 57.16 2k3t h LEU 2431Cb 0.84 -0.03 0.05 0.00 -0.00 0.00 0.00 40.66 41.52 2k3t h LEU 2431CO 0.01 1.17 0.67 -0.69 -0.00 0.00 0.00 178.44 179.60 2k3t s VAL 2432N -2.60 2.97 0.00 1.22 1.01 -0.74 -4.54 120.40 117.72 2k3t s VAL 2432Ca -0.07 0.85 -0.01 0.00 0.00 0.00 0.00 61.98 62.75 2k3t s VAL 2432Cb 0.08 -3.54 -0.01 0.00 0.00 0.00 0.00 36.38 32.91 2k3t s VAL 2432CO 0.82 0.15 0.01 -0.44 0.00 0.00 0.00 175.10 175.64 2k3t s SER 2433N 0.08 0.09 0.03 3.32 0.01 -1.19 -3.16 113.70 112.87 2k3t s SER 2433Ca 0.55 -0.19 -0.01 0.00 1.31 0.00 0.00 55.95 57.61 2k3t s SER 2433Cb -0.38 0.08 -0.04 0.00 0.21 0.00 0.00 66.02 65.89 2k3t s SER 2433CO 0.43 -0.15 0.18 0.00 0.41 0.00 0.00 173.24 174.11 2k3t s ALA 2434N -0.69 3.94 -0.02 1.44 0.00 -1.26 -1.13 121.76 124.04 2k3t s ALA 2434Ca -0.08 -0.82 -0.06 0.00 0.00 0.00 0.00 51.96 51.01 2k3t s ALA 2434Cb -0.05 -1.81 0.00 0.00 0.00 0.00 0.00 23.12 21.27 2k3t s ALA 2434CO -0.00 0.78 0.12 0.71 0.00 0.00 0.00 175.76 177.37 2k3t s TYR 2435N -1.41 -0.01 0.00 0.00 2.02 -0.31 -4.97 117.35 112.67 2k3t s TYR 2435Ca 0.31 0.01 0.00 0.00 -0.37 0.00 0.00 57.07 57.02 2k3t s TYR 2435Cb -0.13 -0.03 0.00 0.00 -0.40 0.00 0.00 41.96 41.41 2k3t s TYR 2435CO 0.23 -0.20 0.00 0.41 -1.57 0.00 0.00 175.55 174.42 2k3t n GLY 2436N 2.04 3.25 0.24 0.71 0.00 -1.26 -0.43 105.19 109.74 2k3t n GLY 2436Ca -0.19 -1.93 0.06 0.00 0.00 0.00 0.00 46.02 43.96 2k3t n GLY 2436CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k3t h ALA 2437N 0.00 1.77 0.00 4.61 0.00 -1.87 -2.77 119.26 120.99 2k3t h ALA 2437Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2k3t h ALA 2437Cb 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2k3t h ALA 2437CO 0.00 0.18 0.00 0.41 0.00 0.00 0.00 179.25 179.84 2k3t n GLY 2438N -1.19 -1.03 0.16 0.00 0.00 -0.10 -1.29 105.19 101.74 2k3t n GLY 2438Ca -0.02 0.08 0.05 0.00 0.00 0.00 0.00 46.02 46.13 2k3t n GLY 2438CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2k3t h LEU 2439N 0.00 0.00 0.05 0.99 3.38 -1.74 -3.37 115.31 114.62 2k3t h LEU 2439Ca 0.00 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.63 2k3t h LEU 2439Cb 0.20 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.91 2k3t h LEU 2439CO 0.00 0.39 -2.00 -0.62 0.09 0.00 0.00 178.44 176.29 2k3t n GLU 2440N -3.20 0.69 -1.27 1.13 1.02 -0.41 -2.98 120.64 115.62 2k3t n GLU 2440Ca 0.02 0.23 0.00 0.00 -0.02 0.00 0.00 57.16 57.39 2k3t n GLU 2440Cb 0.69 -1.69 0.00 0.00 -0.02 0.00 0.00 31.44 30.41 2k3t n GLU 2440CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2k3t n GLY 2441N 1.83 -0.47 0.00 0.62 0.00 -1.04 -1.51 105.19 104.62 2k3t n GLY 2441Ca -0.28 -0.90 0.00 0.00 0.00 0.00 0.00 46.02 44.84 2k3t n GLY 2441CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k3t n GLY 2442N 0.00 -1.22 3.12 -0.02 0.00 -1.21 -4.31 105.19 101.55 2k3t n GLY 2442Ca 0.00 -1.00 -0.23 0.00 0.00 0.00 0.00 46.02 44.79 2k3t n GLY 2442CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2k3t s VAL 2443N -3.00 1.20 0.40 1.61 1.01 -1.26 -1.94 120.40 118.42 2k3t s VAL 2443Ca 0.00 -0.64 -0.27 0.00 0.00 0.00 0.00 61.98 61.08 2k3t s VAL 2443Cb 0.00 -1.00 -0.10 0.00 0.00 0.00 0.00 36.38 35.27 2k3t s VAL 2443CO 0.00 0.34 1.38 0.35 0.00 0.00 0.00 175.10 177.17 2k3t n THR 2444N 2.80 2.37 -0.02 3.92 -2.24 -0.66 -2.58 114.28 117.88 2k3t n THR 2444Ca -0.15 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.13 2k3t n THR 2444Cb 0.54 -1.76 0.00 0.00 -2.10 0.00 0.00 70.33 67.01 2k3t n THR 2444CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2k3t n GLY 2445N 0.64 2.68 3.58 3.38 0.00 -0.59 -4.90 105.19 109.97 2k3t n GLY 2445Ca 0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.75 2k3t n GLY 2445CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2k3t s ASN 2446N -3.80 4.52 0.48 1.61 0.01 -1.06 -5.01 114.94 111.69 2k3t s ASN 2446Ca 0.00 -0.19 -0.21 0.00 -0.71 0.00 0.00 52.86 51.75 2k3t s ASN 2446Cb 0.00 -1.01 -0.08 0.00 0.41 0.00 0.00 41.25 40.56 2k3t s ASN 2446CO 0.00 0.27 1.05 -2.16 -1.51 0.00 0.00 177.10 174.74 2k3t s PRO 2447N -1.50 3.83 0.03 -0.60 0.04 -1.26 -4.30 135.00 131.24 2k3t s PRO 2447Ca 0.17 1.40 0.02 0.00 0.04 0.00 0.00 61.00 62.63 2k3t s PRO 2447Cb -0.11 -2.15 -0.02 0.00 0.04 0.00 0.00 34.50 32.26 2k3t s PRO 2447CO 0.08 -0.41 -0.06 0.00 0.04 0.00 0.00 177.00 176.64 2k3t s ALA 2448N -1.92 0.46 0.05 8.56 0.00 -0.21 -4.93 121.76 123.75 2k3t s ALA 2448Ca 0.66 -0.65 -0.02 0.00 0.00 0.00 0.00 51.96 51.95 2k3t s ALA 2448Cb -0.17 0.04 -0.03 0.00 0.00 0.00 0.00 23.12 22.96 2k3t s ALA 2448CO 0.21 -0.03 0.01 -1.83 0.00 0.00 0.00 175.76 174.12 2k3t s GLU 2449N -1.35 0.57 0.17 0.00 1.03 -1.26 -1.31 118.70 116.56 2k3t s GLU 2449Ca -0.09 -1.02 -0.19 0.00 0.03 0.00 0.00 54.97 53.70 2k3t s GLU 2449Cb -0.09 0.21 0.04 0.00 -0.80 0.00 0.00 34.13 33.49 2k3t s GLU 2449CO 0.00 -0.12 0.53 -0.59 -1.33 0.00 0.00 175.26 173.75 2k3t s PHE 2450N -3.27 -0.25 -0.06 4.83 -0.71 -0.34 -0.93 117.98 117.24 2k3t s PHE 2450Ca 0.01 -0.05 0.05 0.00 -1.04 0.00 0.00 56.93 55.89 2k3t s PHE 2450Cb 0.03 0.42 -0.00 0.00 -1.21 0.00 0.00 43.02 42.26 2k3t s PHE 2450CO -0.08 -0.87 -0.21 0.54 -1.34 0.00 0.00 175.22 173.27 2k3t s VAL 2451N -3.83 1.75 -0.59 -2.49 0.11 0.42 -0.39 120.40 115.39 2k3t s VAL 2451Ca 0.06 -0.88 -0.22 0.00 -2.93 0.00 0.00 61.98 58.01 2k3t s VAL 2451Cb -0.01 -1.50 0.07 0.00 -1.53 0.00 0.00 36.38 33.41 2k3t s VAL 2451CO -0.07 0.49 0.84 -0.69 -3.33 0.00 0.00 175.10 172.35 2k3t s VAL 2452N 0.07 4.54 -0.29 2.04 1.01 0.55 -1.16 120.40 127.16 2k3t s VAL 2452Ca -0.07 -0.35 -0.24 0.00 0.00 0.00 0.00 61.98 61.32 2k3t s VAL 2452Cb -0.14 -4.54 -0.00 0.00 0.00 0.00 0.00 36.38 31.70 2k3t s VAL 2452CO 0.04 -1.19 0.79 0.21 0.00 0.00 0.00 175.10 174.95 2k3t s ASN 2453N 3.28 6.70 0.00 3.32 3.84 -0.29 -1.92 114.94 129.86 2k3t s ASN 2453Ca 0.21 0.75 0.23 0.00 0.21 0.00 0.00 52.86 54.26 2k3t s ASN 2453Cb -0.18 -2.41 0.13 0.00 -0.55 0.00 0.00 41.25 38.24 2k3t s ASN 2453CO 0.12 -0.58 1.17 0.35 -2.79 0.00 0.00 177.10 175.37 2k3t n THR 2454N 5.46 0.00 0.13 -5.21 -2.24 -1.25 -3.20 114.28 107.97 2k3t n THR 2454Ca 0.04 -0.20 0.17 0.00 -2.27 0.00 0.00 64.05 61.79 2k3t n THR 2454Cb 0.48 1.04 0.73 0.00 -2.10 0.00 0.00 70.33 70.48 2k3t n THR 2454CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2k3t h SER 2455N 1.87 0.00 1.24 3.42 0.02 -1.81 0.78 113.55 119.06 2k3t h SER 2455Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2k3t h SER 2455Cb 0.67 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.21 2k3t h SER 2455CO 0.00 0.00 -0.25 0.59 -1.14 0.00 0.00 176.83 176.03 2k3t n ASN 2456N -4.18 0.77 -0.00 3.07 3.02 -1.26 -4.28 115.26 112.39 2k3t n ASN 2456Ca 0.04 0.39 0.02 0.00 -0.03 0.00 0.00 54.58 55.01 2k3t n ASN 2456Cb 0.40 -0.42 -0.04 0.00 -0.61 0.00 0.00 39.78 39.11 2k3t n ASN 2456CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2k3t n ALA 2457N -1.80 2.19 0.00 5.41 0.00 0.06 -4.87 120.51 121.50 2k3t n ALA 2457Ca 0.05 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.37 2k3t n ALA 2457Cb 0.43 -0.17 0.00 0.00 0.00 0.00 0.00 19.45 19.72 2k3t n ALA 2457CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k3t n GLY 2458N 2.19 1.03 3.54 0.00 0.00 0.00 -4.17 105.19 107.78 2k3t n GLY 2458Ca -0.01 -0.84 -0.10 0.00 0.00 0.00 0.00 46.02 45.07 2k3t n GLY 2458CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k3t s ALA 2459N -1.45 -1.32 0.00 4.61 0.00 -1.26 -4.48 121.76 117.86 2k3t s ALA 2459Ca 0.00 0.11 0.00 0.00 0.00 0.00 0.00 51.96 52.07 2k3t s ALA 2459Cb 0.00 0.86 0.00 0.00 0.00 0.00 0.00 23.12 23.98 2k3t s ALA 2459CO 0.00 -0.83 0.00 0.41 0.00 0.00 0.00 175.76 175.34 2k3t n GLY 2460N -0.38 0.21 3.70 0.00 0.00 -1.26 -1.27 105.19 106.19 2k3t n GLY 2460Ca -0.12 -1.10 -0.42 0.00 0.00 0.00 0.00 46.02 44.37 2k3t n GLY 2460CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k3t s ALA 2461N -2.00 3.32 -0.01 4.61 0.00 -1.26 -4.96 121.76 121.46 2k3t s ALA 2461Ca 0.00 0.58 0.00 0.00 0.00 0.00 0.00 51.96 52.55 2k3t s ALA 2461Cb 0.00 -3.41 -0.04 0.00 0.00 0.00 0.00 23.12 19.67 2k3t s ALA 2461CO 0.00 -0.45 0.03 -1.17 0.00 0.00 0.00 175.76 174.17 2k3t s LEU 2462N 1.45 3.64 -0.27 0.00 2.96 -1.26 -1.07 118.68 124.13 2k3t s LEU 2462Ca 0.53 0.06 0.20 0.00 -0.22 0.00 0.00 54.13 54.70 2k3t s LEU 2462Cb -0.23 -2.06 0.50 0.00 0.50 0.00 0.00 46.19 44.89 2k3t s LEU 2462CO 0.25 0.29 1.11 -0.24 -1.32 0.00 0.00 176.35 176.44 2k3t n SER 2463N 1.43 2.20 -4.74 3.68 2.88 0.44 -4.99 113.62 114.52 2k3t n SER 2463Ca -0.15 -2.40 -0.42 0.00 -1.33 0.00 0.00 58.87 54.58 2k3t n SER 2463Cb 0.53 -0.46 -0.02 0.00 -0.75 0.00 0.00 64.21 63.50 2k3t n SER 2463CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2k3t s VAL 2464N -3.93 2.55 0.01 2.46 0.11 -1.25 -4.14 120.40 116.22 2k3t s VAL 2464Ca 0.32 0.44 0.03 0.00 -2.93 0.00 0.00 61.98 59.83 2k3t s VAL 2464Cb 0.35 -3.28 -0.01 0.00 -1.53 0.00 0.00 36.38 31.90 2k3t s VAL 2464CO -0.02 0.06 -0.08 -0.89 -3.33 0.00 0.00 175.10 170.83 2k3t s THR 2465N 0.37 0.64 -0.17 5.04 2.01 -0.39 -4.98 115.64 118.15 2k3t s THR 2465Ca 0.63 -0.56 0.01 0.00 0.31 0.00 0.00 61.69 62.08 2k3t s THR 2465Cb -0.43 -0.58 0.01 0.00 0.01 0.00 0.00 72.50 71.51 2k3t s THR 2465CO 0.40 0.03 -0.18 -0.63 -0.69 0.00 0.00 174.62 173.55 2k3t s ILE 2466N -0.51 2.30 0.25 1.82 1.01 -1.26 -0.52 121.20 124.28 2k3t s ILE 2466Ca 0.00 -0.87 0.07 0.00 0.00 0.00 0.00 60.65 59.85 2k3t s ILE 2466Cb -0.05 -1.97 -0.04 0.00 0.01 0.00 0.00 42.46 40.42 2k3t s ILE 2466CO 0.00 0.52 0.20 -0.62 0.00 0.00 0.00 174.94 175.05 2k3t s ASP 2467N 1.16 5.57 0.00 3.58 2.15 -0.32 -4.86 116.67 123.95 2k3t s ASP 2467Ca 0.01 -0.23 0.00 0.00 0.43 0.00 0.00 52.55 52.77 2k3t s ASP 2467Cb -0.14 -1.43 0.00 0.00 -0.30 0.00 0.00 42.92 41.05 2k3t s ASP 2467CO -0.08 -0.03 0.00 0.61 -0.17 0.00 0.00 175.17 175.50 2k3t n GLY 2468N -1.15 -1.15 0.23 2.66 0.00 -1.26 -0.69 105.19 103.82 2k3t n GLY 2468Ca -0.08 -0.92 0.08 0.00 0.00 0.00 0.00 46.02 45.10 2k3t n GLY 2468CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2k3t h PRO 2469N 0.00 0.00 -4.19 1.61 0.13 -1.90 -3.45 132.00 124.21 2k3t h PRO 2469Ca 0.00 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.98 2k3t h PRO 2469Cb 0.00 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 30.99 2k3t h PRO 2469CO 0.00 0.22 -0.49 -1.12 -0.23 0.00 0.00 178.00 176.38 2k3t s SER 2470N -6.54 0.16 0.13 1.44 0.01 -1.26 -5.07 113.70 102.57 2k3t s SER 2470Ca -0.03 -1.08 -0.31 0.00 1.31 0.00 0.00 55.95 55.85 2k3t s SER 2470Cb 0.14 0.38 -0.07 0.00 0.21 0.00 0.00 66.02 66.67 2k3t s SER 2470CO 0.65 -0.83 1.27 -0.54 0.41 0.00 0.00 173.24 174.20 2k3t s LYS 2471N -4.03 4.41 0.39 12.44 1.02 -1.26 -4.95 119.74 127.76 2k3t s LYS 2471Ca 0.23 1.93 -0.09 0.00 0.02 0.00 0.00 55.97 58.06 2k3t s LYS 2471Cb 0.05 -3.27 -0.06 0.00 -0.52 0.00 0.00 37.83 34.04 2k3t s LYS 2471CO 0.03 -0.26 0.73 0.14 -0.92 0.00 0.00 175.35 175.06 2k3t s VAL 2472N 0.64 4.85 -1.41 3.17 -7.23 -1.26 -4.73 120.40 114.43 2k3t s VAL 2472Ca 0.59 0.45 -0.15 0.00 -1.81 0.00 0.00 61.98 61.06 2k3t s VAL 2472Cb -0.33 -3.75 0.06 0.00 0.56 0.00 0.00 36.38 32.91 2k3t s VAL 2472CO 0.33 -0.53 2.09 0.29 -0.31 0.00 0.00 175.10 176.96 2k3t n LYS 2473N -1.37 2.99 -2.70 4.82 5.02 -0.64 -4.92 118.16 121.35 2k3t n LYS 2473Ca 0.01 -2.83 -0.40 0.00 -2.02 0.00 0.00 58.31 53.07 2k3t n LYS 2473Cb 0.54 -3.31 -0.06 0.00 -0.02 0.00 0.00 35.03 32.19 2k3t n LYS 2473CO 0.00 0.00 0.00 1.41 -0.52 0.00 0.00 177.40 178.29 2k3t s MET 2474N 3.20 4.82 -0.02 1.97 1.75 -1.26 -3.16 119.30 126.60 2k3t s MET 2474Ca 0.48 1.55 0.00 0.00 -1.25 0.00 0.00 55.69 56.47 2k3t s MET 2474Cb 0.11 -3.27 0.02 0.00 2.84 0.00 0.00 34.83 34.54 2k3t s MET 2474CO -0.05 0.46 0.01 -0.51 -0.65 0.00 0.00 175.02 174.28 2k3t s ASP 2475N -1.11 0.21 -0.02 1.11 1.01 -0.06 -5.00 116.67 112.81 2k3t s ASP 2475Ca 0.42 0.00 0.07 0.00 0.71 0.00 0.00 52.55 53.75 2k3t s ASP 2475Cb -0.27 -0.11 -0.02 0.00 1.01 0.00 0.00 42.92 43.53 2k3t s ASP 2475CO 0.34 -0.08 -0.22 0.00 0.21 0.00 0.00 175.17 175.41 2k3t s GLN 2477N -0.75 0.42 0.11 0.00 -0.21 0.08 -5.01 119.66 114.30 2k3t s GLN 2477Ca 0.11 -0.33 -0.23 0.00 0.02 0.00 0.00 55.36 54.93 2k3t s GLN 2477Cb -0.10 -0.33 -0.07 0.00 1.00 0.00 0.00 33.01 33.50 2k3t s GLN 2477CO 0.00 0.08 0.69 -2.00 -2.12 0.00 0.00 175.29 171.94 2k3t s GLU 2478N -0.52 4.41 0.24 2.91 2.12 -1.26 -0.75 118.70 125.85 2k3t s GLU 2478Ca -0.02 0.97 -0.12 0.00 0.36 0.00 0.00 54.97 56.17 2k3t s GLU 2478Cb -0.04 -3.27 -0.01 0.00 0.26 0.00 0.00 34.13 31.07 2k3t s GLU 2478CO -0.00 0.56 0.44 0.00 -0.54 0.00 0.00 175.26 175.72 2k3t h PRO 2480N 2.30 0.00 -0.01 0.00 0.11 -2.03 -1.84 132.00 130.53 2k3t h PRO 2480Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 2k3t h PRO 2480Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2k3t h PRO 2480CO 0.38 0.00 -0.06 -1.91 -0.21 0.00 0.00 178.00 176.19 2k3t n GLU 2481N -3.83 1.04 0.00 1.05 2.13 -1.26 -4.90 120.64 114.86 2k3t n GLU 2481Ca -0.01 -0.39 0.00 0.00 0.66 0.00 0.00 57.16 57.42 2k3t n GLU 2481Cb 0.19 -1.49 0.00 0.00 0.27 0.00 0.00 31.44 30.40 2k3t n GLU 2481CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2k3t n GLY 2482N 1.19 0.33 3.02 8.31 0.00 -0.69 -3.77 105.19 113.56 2k3t n GLY 2482Ca 0.18 -1.17 -0.31 0.00 0.00 0.00 0.00 46.02 44.72 2k3t n GLY 2482CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2k3t s TYR 2483N 0.00 2.39 -0.11 1.61 2.02 -0.81 -1.30 117.35 121.15 2k3t s TYR 2483Ca 0.00 -1.49 -0.15 0.00 -0.37 0.00 0.00 57.07 55.05 2k3t s TYR 2483Cb 0.00 -1.66 -0.05 0.00 -0.40 0.00 0.00 41.96 39.86 2k3t s TYR 2483CO 0.00 -0.73 0.37 0.50 -1.57 0.00 0.00 175.55 174.13 2k3t s ARG 2484N 1.41 4.18 -0.06 -0.62 3.52 0.07 -0.33 118.95 127.12 2k3t s ARG 2484Ca 0.01 0.27 0.06 0.00 -0.13 0.00 0.00 55.73 55.95 2k3t s ARG 2484Cb -0.15 -3.38 -0.01 0.00 -1.56 0.00 0.00 34.95 29.85 2k3t s ARG 2484CO -0.09 0.33 -0.25 0.08 -0.81 0.00 0.00 175.30 174.55 2k3t s VAL 2485N 0.14 2.06 0.01 7.11 1.01 0.48 -0.74 120.40 130.47 2k3t s VAL 2485Ca 0.21 -1.07 0.05 0.00 0.00 0.00 0.00 61.98 61.17 2k3t s VAL 2485Cb -0.14 -1.74 -0.02 0.00 0.00 0.00 0.00 36.38 34.48 2k3t s VAL 2485CO 0.08 0.57 -0.15 -0.89 0.00 0.00 0.00 175.10 174.71 2k3t s THR 2486N -0.17 1.17 -0.03 3.92 2.01 -0.28 -1.20 115.64 121.06 2k3t s THR 2486Ca -0.03 -0.82 -0.14 0.00 0.31 0.00 0.00 61.69 61.00 2k3t s THR 2486Cb -0.14 -1.01 0.02 0.00 0.01 0.00 0.00 72.50 71.38 2k3t s THR 2486CO 0.04 0.18 0.31 -0.72 -0.69 0.00 0.00 174.62 173.73 2k3t s TYR 2487N -0.59 -0.21 -0.25 4.92 1.13 -0.43 -0.88 117.35 121.05 2k3t s TYR 2487Ca 0.04 0.36 -0.06 0.00 -1.41 0.00 0.00 57.07 56.00 2k3t s TYR 2487Cb -0.07 0.10 -0.01 0.00 -1.10 0.00 0.00 41.96 40.88 2k3t s TYR 2487CO 0.00 -0.35 0.04 0.99 -2.51 0.00 0.00 175.55 173.72 2k3t s THR 2488N -1.07 3.94 0.52 -3.49 2.01 -1.19 -1.05 115.64 115.31 2k3t s THR 2488Ca -0.11 -0.42 -0.11 0.00 0.31 0.00 0.00 61.69 61.36 2k3t s THR 2488Cb -0.05 -2.88 -0.06 0.00 0.01 0.00 0.00 72.50 69.52 2k3t s THR 2488CO 0.04 0.29 0.91 -2.16 -0.69 0.00 0.00 174.62 173.01 2k3t s PRO 2489N 1.54 3.72 0.00 4.92 0.04 -1.26 -1.62 135.00 142.35 2k3t s PRO 2489Ca 0.05 0.64 0.00 0.00 0.04 0.00 0.00 61.00 61.73 2k3t s PRO 2489Cb -0.15 -2.22 0.00 0.00 0.04 0.00 0.00 34.50 32.17 2k3t s PRO 2489CO 0.01 -0.30 0.66 0.00 0.04 0.00 0.00 177.00 177.42 2k3t n MET 2490N -2.02 0.92 -3.72 4.56 0.00 -1.26 -1.55 117.12 114.06 2k3t n MET 2490Ca 0.04 -0.88 -0.14 0.00 0.00 0.00 0.00 57.70 56.72 2k3t n MET 2490Cb 0.54 -0.89 -0.08 0.00 0.00 0.00 0.00 33.22 32.79 2k3t n MET 2490CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2k3t s ALA 2491N -0.43 -0.98 0.60 3.17 0.00 -1.26 -1.45 121.76 121.42 2k3t s ALA 2491Ca 0.00 0.59 -0.15 0.00 0.00 0.00 0.00 51.96 52.40 2k3t s ALA 2491Cb 0.00 -0.02 -0.03 0.00 0.00 0.00 0.00 23.12 23.07 2k3t s ALA 2491CO 0.00 -0.27 1.05 -1.25 0.00 0.00 0.00 175.76 175.29 2k3t s PRO 2492N -1.14 3.31 0.00 0.00 0.04 -1.26 -4.84 135.00 131.11 2k3t s PRO 2492Ca -0.12 1.16 0.00 0.00 0.04 0.00 0.00 61.00 62.08 2k3t s PRO 2492Cb -0.04 -2.03 0.00 0.00 0.04 0.00 0.00 34.50 32.47 2k3t s PRO 2492CO 0.05 -0.82 0.00 0.41 0.04 0.00 0.00 177.00 176.68 2k3t n GLY 2493N -1.14 0.80 3.71 0.56 0.00 -0.44 -4.87 105.19 103.81 2k3t n GLY 2493Ca 0.08 -2.09 -0.40 0.00 0.00 0.00 0.00 46.02 43.61 2k3t n GLY 2493CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2k3t s SER 2494N -2.25 7.00 -0.20 1.61 1.04 -1.26 -0.45 113.70 119.19 2k3t s SER 2494Ca 0.00 1.21 -0.06 0.00 0.48 0.00 0.00 55.95 57.58 2k3t s SER 2494Cb 0.00 -2.42 -0.03 0.00 0.10 0.00 0.00 66.02 63.67 2k3t s SER 2494CO 0.00 -0.13 0.02 -0.31 0.98 0.00 0.00 173.24 173.80 2k3t s TYR 2495N 0.84 3.08 -0.48 5.02 1.51 -0.11 -4.37 117.35 122.84 2k3t s TYR 2495Ca 0.38 -0.33 -0.19 0.00 -1.01 0.00 0.00 57.07 55.93 2k3t s TYR 2495Cb -0.18 -2.10 0.05 0.00 -0.11 0.00 0.00 41.96 39.62 2k3t s TYR 2495CO 0.18 -0.16 0.59 -1.17 -1.11 0.00 0.00 175.55 173.88 2k3t s LEU 2496N 0.91 4.90 -0.58 -1.29 2.96 0.13 -2.13 118.68 123.59 2k3t s LEU 2496Ca 0.02 -0.79 -0.20 0.00 -0.22 0.00 0.00 54.13 52.93 2k3t s LEU 2496Cb -0.14 -2.47 0.08 0.00 0.50 0.00 0.00 46.19 44.16 2k3t s LEU 2496CO 0.02 -0.81 0.76 -0.63 -1.32 0.00 0.00 176.35 174.37 2k3t s ILE 2497N 2.54 4.70 -0.66 6.68 1.01 0.26 -1.18 121.20 134.55 2k3t s ILE 2497Ca 0.15 -0.66 -0.21 0.00 0.00 0.00 0.00 60.65 59.94 2k3t s ILE 2497Cb -0.18 -4.49 0.09 0.00 0.01 0.00 0.00 42.46 37.89 2k3t s ILE 2497CO 0.13 -1.12 0.89 -0.44 0.00 0.00 0.00 174.94 174.40 2k3t s SER 2498N 3.36 6.21 -0.90 3.58 0.01 0.32 -1.58 113.70 124.70 2k3t s SER 2498Ca 0.16 -1.21 -0.17 0.00 1.31 0.00 0.00 55.95 56.04 2k3t s SER 2498Cb -0.21 -2.38 0.17 0.00 0.21 0.00 0.00 66.02 63.81 2k3t s SER 2498CO 0.09 -1.31 1.00 -0.63 0.41 0.00 0.00 173.24 172.80 2k3t s ILE 2499N 3.52 5.07 -0.07 1.44 1.01 -1.26 -1.26 121.20 129.65 2k3t s ILE 2499Ca 0.19 -1.94 -0.06 0.00 0.00 0.00 0.00 60.65 58.84 2k3t s ILE 2499Cb -0.18 -4.67 -0.04 0.00 0.01 0.00 0.00 42.46 37.58 2k3t s ILE 2499CO 0.08 -1.33 0.18 -0.54 0.00 0.00 0.00 174.94 173.32 2k3t s LYS 2500N 1.70 3.47 -0.09 2.79 1.02 -1.26 -1.28 119.74 126.10 2k3t s LYS 2500Ca 0.27 -0.17 -0.08 0.00 0.02 0.00 0.00 55.97 56.02 2k3t s LYS 2500Cb -0.07 -3.15 0.03 0.00 -0.52 0.00 0.00 37.83 34.12 2k3t s LYS 2500CO -0.09 0.73 0.24 -0.47 -0.92 0.00 0.00 175.35 174.83 2k3t s TYR 2501N -1.16 -0.27 -0.25 3.18 5.04 -0.61 -0.42 117.35 122.85 2k3t s TYR 2501Ca 0.21 0.66 0.00 0.00 -2.44 0.00 0.00 57.07 55.49 2k3t s TYR 2501Cb -0.12 0.08 0.00 0.00 0.35 0.00 0.00 41.96 42.26 2k3t s TYR 2501CO 0.10 -0.14 0.00 0.41 -1.34 0.00 0.00 175.55 174.58 2k3t n GLY 2502N 3.20 0.44 0.00 8.97 0.00 -0.23 -4.42 105.19 113.15 2k3t n GLY 2502Ca -0.15 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.77 2k3t n GLY 2502CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k3t n GLY 2503N -0.97 0.78 0.11 -0.02 0.00 -1.26 -4.93 105.19 98.90 2k3t n GLY 2503Ca -0.02 -1.72 0.06 0.00 0.00 0.00 0.00 46.02 44.33 2k3t n GLY 2503CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2k3t n PRO 2504N 0.00 1.14 -3.78 1.61 -0.04 -1.26 -4.86 135.00 127.81 2k3t n PRO 2504Ca 0.00 -0.21 -0.36 0.00 -0.04 0.00 0.00 63.50 62.88 2k3t n PRO 2504Cb 0.00 -1.19 -0.07 0.00 -0.04 0.00 0.00 33.50 32.20 2k3t n PRO 2504CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2k3t s TYR 2505N -1.94 3.54 0.55 0.54 2.02 -1.26 -4.94 117.35 115.86 2k3t s TYR 2505Ca 0.18 0.50 -0.20 0.00 -0.37 0.00 0.00 57.07 57.17 2k3t s TYR 2505Cb 0.08 -2.06 -0.05 0.00 -0.40 0.00 0.00 41.96 39.54 2k3t s TYR 2505CO 0.13 0.56 1.24 -1.01 -1.57 0.00 0.00 175.55 174.90 2k3t s HIS 2506N -0.49 2.45 1.01 2.71 3.76 -1.26 -1.57 115.29 121.90 2k3t s HIS 2506Ca 0.14 1.48 -0.15 0.00 -0.15 0.00 0.00 55.06 56.38 2k3t s HIS 2506Cb -0.12 -3.56 0.20 0.00 1.11 0.00 0.00 32.58 30.21 2k3t s HIS 2506CO 0.03 -2.28 1.15 0.96 -0.85 0.00 0.00 174.74 173.75 2k3t s ILE 2507N -1.49 1.90 0.05 0.60 -4.36 -0.40 -4.79 121.20 112.71 2k3t s ILE 2507Ca 0.73 0.00 -0.31 0.00 -0.26 0.00 0.00 60.65 60.81 2k3t s ILE 2507Cb -0.33 -2.68 -0.10 0.00 1.25 0.00 0.00 42.46 40.60 2k3t s ILE 2507CO 0.38 0.00 1.90 0.61 0.24 0.00 0.00 174.94 178.07 2k3t n GLY 2508N -1.95 1.72 1.69 6.27 0.00 -0.70 -2.05 105.19 110.17 2k3t n GLY 2508Ca 0.09 0.79 0.00 0.00 0.00 0.00 0.00 46.02 46.90 2k3t n GLY 2508CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k3t n GLY 2509N 4.38 1.69 3.83 -0.02 0.00 -1.26 -4.47 105.19 109.34 2k3t n GLY 2509Ca 0.20 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.88 2k3t n GLY 2509CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2k3t s SER 2510N -3.12 6.92 0.60 1.61 0.15 -0.87 -4.38 113.70 114.61 2k3t s SER 2510Ca 0.00 1.39 -0.12 0.00 0.70 0.00 0.00 55.95 57.92 2k3t s SER 2510Cb 0.00 -2.41 -0.04 0.00 -1.71 0.00 0.00 66.02 61.85 2k3t s SER 2510CO 0.00 -0.13 1.02 -2.16 1.20 0.00 0.00 173.24 173.18 2k3t s PRO 2511N -2.60 3.60 -0.10 5.44 0.04 -1.26 -4.78 135.00 135.35 2k3t s PRO 2511Ca 0.51 0.83 -0.02 0.00 0.04 0.00 0.00 61.00 62.35 2k3t s PRO 2511Cb -0.13 -2.08 -0.03 0.00 0.04 0.00 0.00 34.50 32.30 2k3t s PRO 2511CO 0.19 -0.57 -0.01 -0.06 0.04 0.00 0.00 177.00 176.59 2k3t s PHE 2512N -3.03 3.11 -1.06 0.56 0.40 -0.61 -4.93 117.98 112.41 2k3t s PHE 2512Ca 0.56 0.09 0.18 0.00 -0.60 0.00 0.00 56.93 57.16 2k3t s PHE 2512Cb -0.11 -1.82 0.73 0.00 0.51 0.00 0.00 43.02 42.34 2k3t s PHE 2512CO 0.49 0.36 1.64 0.36 0.70 0.00 0.00 175.22 178.76 2k3t n LYS 2513N 2.43 3.86 0.00 0.44 2.85 -1.26 -0.58 118.16 125.91 2k3t n LYS 2513Ca -0.18 -2.88 0.00 0.00 -1.05 0.00 0.00 58.31 54.20 2k3t n LYS 2513Cb 0.53 -1.94 0.00 0.00 -0.65 0.00 0.00 35.03 32.97 2k3t n LYS 2513CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2k3t n ALA 2514N 1.08 0.00 -2.62 0.58 0.00 -0.90 -3.65 120.51 114.99 2k3t n ALA 2514Ca 0.26 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.27 2k3t n ALA 2514Cb 0.92 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 20.31 2k3t n ALA 2514CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2k3t s LYS 2515N 0.00 3.22 -0.01 0.00 1.02 -0.57 -0.94 119.74 122.47 2k3t s LYS 2515Ca 0.00 -0.56 -0.10 0.00 0.02 0.00 0.00 55.97 55.32 2k3t s LYS 2515Cb 0.00 -4.02 -0.05 0.00 -0.52 0.00 0.00 37.83 33.24 2k3t s LYS 2515CO 0.00 -1.14 0.32 0.08 -0.92 0.00 0.00 175.35 173.69 2k3t s VAL 2516N 2.86 5.20 0.51 3.17 1.01 0.41 -3.31 120.40 130.24 2k3t s VAL 2516Ca 0.20 0.49 0.01 0.00 0.00 0.00 0.00 61.98 62.68 2k3t s VAL 2516Cb -0.16 -3.60 -0.01 0.00 0.00 0.00 0.00 36.38 32.61 2k3t s VAL 2516CO 0.16 0.48 0.02 0.42 0.00 0.00 0.00 175.10 176.18 2k3t s THR 2517N -1.18 0.99 0.00 3.92 -4.23 -0.82 -1.33 115.64 112.99 2k3t s THR 2517Ca 0.25 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.76 2k3t s THR 2517Cb -0.14 -2.10 0.00 0.00 1.34 0.00 0.00 72.50 71.60 2k3t s THR 2517CO 0.13 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.82 2k3t n GLY 2518N -1.25 0.52 3.78 3.99 0.00 -1.26 -1.65 105.19 109.33 2k3t n GLY 2518Ca -0.19 -2.10 -0.35 0.00 0.00 0.00 0.00 46.02 43.38 2k3t n GLY 2518CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2k3t s PRO 2519N -1.12 3.79 0.07 1.61 0.04 -1.26 -4.28 135.00 133.84 2k3t s PRO 2519Ca 0.00 1.52 -0.30 0.00 0.04 0.00 0.00 61.00 62.26 2k3t s PRO 2519Cb 0.00 -2.24 -0.05 0.00 0.04 0.00 0.00 34.50 32.25 2k3t s PRO 2519CO 0.00 -0.47 1.05 0.50 0.04 0.00 0.00 177.00 178.12 2k3t s ARG 2520N -2.97 4.56 0.30 4.56 3.52 -1.26 -4.63 118.95 123.03 2k3t s ARG 2520Ca 0.66 1.56 0.25 0.00 -0.13 0.00 0.00 55.73 58.07 2k3t s ARG 2520Cb -0.21 -3.38 0.64 0.00 -1.56 0.00 0.00 34.95 30.43 2k3t s ARG 2520CO 0.26 -0.03 1.72 -0.07 -0.81 0.00 0.00 175.30 176.37 2k3t h LEU 2521N 6.27 0.00 -1.22 -0.88 -0.00 -1.65 -3.49 115.31 114.34 2k3t h LEU 2521Ca -0.42 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.46 2k3t h LEU 2521Cb 1.22 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.88 2k3t h LEU 2521CO 0.75 0.00 0.00 1.33 -0.00 0.00 0.00 178.44 180.52