# AA SS3 SS8 ASA HSEa-u HSEa-d CN13 theta tau phi psi P(3-C) P(3-E) P(3-H) P(8-C) P(8-S) P(8-T) P(8-H) P(8-G) P(8-I) P(8-E) P(8-B) 0 M C C 110.51 6.72 14.46 22.28 116.88 -157.26 -95.31 131.72 99.86 0.13 0.00 99.85 0.05 0.01 0.00 0.00 0.00 0.07 0.01 1 S C C 71.85 6.00 12.19 19.89 116.53 -154.39 -92.55 140.93 92.32 6.43 1.24 83.19 1.66 7.57 0.28 0.75 0.00 5.36 1.19 2 G C C 40.30 6.45 14.90 22.45 117.60 83.86 120.44 -174.32 83.76 14.79 1.45 45.64 22.91 15.56 0.19 1.56 0.00 12.68 1.46 3 R C C 116.57 9.09 16.86 26.58 118.21 -82.26 -100.78 134.96 72.66 26.25 1.09 55.60 13.29 3.06 0.19 1.05 0.00 25.08 1.73 4 L C E 36.45 17.64 16.78 34.04 115.06 -147.80 -96.03 130.97 54.27 45.20 0.53 41.44 10.38 1.78 0.11 0.47 0.00 44.62 1.19 5 W E E 85.77 13.60 21.30 34.54 133.35 48.98 -133.41 149.43 21.71 78.11 0.18 17.20 4.02 0.58 0.04 0.13 0.00 77.32 0.70 6 S E E 10.39 20.74 18.19 38.83 135.11 -174.07 -138.35 152.33 8.33 91.63 0.04 7.22 0.90 0.08 0.01 0.02 0.00 91.59 0.18 7 K E E 90.23 9.38 25.67 35.44 120.57 -128.25 -104.59 137.33 3.41 96.58 0.01 2.96 0.22 0.01 0.00 0.00 0.00 96.75 0.05 8 A E E 5.29 24.22 16.79 41.19 136.75 172.17 -142.46 157.31 2.21 97.79 0.00 1.97 0.06 0.00 0.00 0.00 0.00 97.94 0.02 9 I E E 49.97 9.97 26.36 37.35 121.36 -135.21 -114.23 133.34 0.33 99.67 0.00 0.29 0.01 0.00 0.00 0.00 0.00 99.70 0.00 10 F E E 24.28 22.45 17.30 39.71 112.34 -130.59 -84.02 125.86 0.28 99.72 0.00 0.25 0.01 0.00 0.00 0.00 0.00 99.73 0.01 11 A E E 36.81 10.22 23.03 33.91 101.80 177.39 -98.61 -24.66 4.87 95.09 0.04 3.57 0.83 0.12 0.01 0.02 0.00 95.38 0.07 12 G E E 15.37 10.13 23.59 34.62 145.39 -31.99 172.19 172.99 19.30 80.60 0.10 12.23 6.47 0.54 0.02 0.06 0.00 80.47 0.21 13 Y E E 67.45 17.43 15.90 32.81 131.55 -129.33 -133.54 150.07 30.44 69.08 0.48 28.03 2.04 0.38 0.25 0.24 0.00 66.07 2.99 14 K C C 90.28 8.72 17.29 26.96 117.94 -132.50 -99.64 133.61 62.99 35.85 1.16 53.37 6.84 1.87 0.46 0.76 0.00 32.34 4.36 15 R C C 136.57 6.85 13.49 21.70 113.50 -140.19 -90.86 132.53 76.46 19.97 3.57 37.87 26.31 13.82 0.94 2.72 0.03 14.84 3.47 16 G C C 37.18 5.21 12.50 19.15 122.77 25.09 118.34 172.71 85.26 9.19 5.55 37.43 29.24 19.25 1.18 4.58 0.01 5.51 2.80 17 L C T 123.33 3.25 10.53 14.97 100.27 -81.77 -75.92 -23.73 77.43 3.34 19.22 14.28 28.35 35.11 2.39 16.43 0.03 1.67 1.74 18 R C T 188.32 0.90 12.04 12.59 99.39 31.95 -80.56 -21.83 79.12 1.68 19.19 8.39 25.16 45.37 2.23 17.00 0.02 0.86 0.96 19 N C T 106.12 3.81 11.58 16.64 105.74 22.33 -98.17 56.56 74.44 7.69 17.87 20.56 24.63 30.75 2.25 14.75 0.05 4.50 2.52 20 Q C C 86.43 9.27 10.41 20.78 115.86 133.06 -87.50 133.78 75.75 19.82 4.43 53.18 14.92 6.80 1.56 3.14 0.01 12.00 8.39 21 R C C 114.89 7.78 14.73 23.72 116.99 -155.16 -101.96 129.60 78.28 18.92 2.80 66.67 7.44 3.44 0.89 1.98 0.00 14.43 5.13 22 E C S 103.62 7.70 17.31 25.82 104.76 -151.16 -73.52 -19.27 85.63 12.73 1.64 16.49 36.26 33.47 0.18 1.52 0.00 10.96 1.13 23 H C T 85.21 11.41 18.68 30.08 99.96 31.51 -74.16 27.61 76.50 22.68 0.82 19.20 25.78 30.84 0.05 0.89 0.00 22.74 0.51 24 T E E 25.03 14.72 19.95 35.49 125.39 125.34 -114.83 143.79 27.30 72.67 0.03 24.13 2.07 0.12 0.00 0.03 0.00 73.29 0.36 25 A E E 6.68 21.25 20.61 41.95 127.18 -163.83 -124.25 143.73 1.75 98.24 0.00 1.58 0.07 0.00 0.00 0.00 0.00 98.31 0.04 26 L E E 25.88 15.51 25.73 41.37 116.78 -143.27 -104.38 126.78 0.43 99.57 0.00 0.36 0.01 0.00 0.00 0.00 0.00 99.62 0.01 27 L E E 4.49 25.19 20.50 45.92 120.12 -161.78 -110.13 130.71 0.72 99.28 0.00 0.57 0.04 0.00 0.00 0.00 0.00 99.38 0.01 28 K E E 72.54 11.36 27.09 38.53 119.06 -162.51 -113.32 127.05 0.34 99.66 0.00 0.28 0.01 0.00 0.00 0.00 0.00 99.71 0.01 29 I E E 6.57 24.75 17.27 42.52 118.50 -165.08 -111.86 126.23 1.23 98.77 0.00 1.17 0.02 0.00 0.00 0.00 0.00 98.77 0.04 30 E E E 89.91 7.51 24.60 32.34 123.00 -157.38 -100.35 144.11 8.78 91.17 0.04 3.22 2.99 1.47 0.00 0.04 0.00 92.18 0.10 31 G E E 30.89 6.84 23.79 32.00 95.63 20.89 80.52 13.54 33.05 66.89 0.06 7.17 17.51 5.68 0.00 0.08 0.00 69.38 0.17 32 V E E 9.12 23.54 12.55 36.36 113.05 150.73 -84.75 127.16 30.63 69.31 0.07 30.47 0.64 0.05 0.03 0.04 0.00 64.94 3.84 33 Y C C 115.61 7.40 22.34 30.40 103.82 171.55 -109.95 -14.10 85.93 14.00 0.07 69.32 16.91 0.36 0.02 0.06 0.00 11.97 1.35 34 A C S 42.87 6.03 22.18 28.59 131.53 41.72 -128.60 154.65 94.83 1.87 3.29 17.31 76.04 1.66 3.23 0.30 0.00 0.67 0.78 35 R H H 116.81 12.21 14.19 26.69 91.79 -113.39 -59.13 -38.60 5.16 0.02 94.83 0.48 0.71 3.64 87.53 7.61 0.02 0.01 0.01 36 D H H 108.20 1.51 21.04 21.46 91.54 53.70 -63.71 -37.26 3.43 0.01 96.55 0.43 0.29 2.48 88.21 8.58 0.00 0.00 0.00 37 E H H 54.18 11.68 18.08 30.48 92.40 49.21 -67.91 -37.63 2.25 0.02 97.73 0.45 0.21 1.42 89.12 8.79 0.00 0.01 0.00 38 T H H 3.97 25.23 13.07 38.40 92.32 51.83 -67.44 -38.08 2.81 0.01 97.18 0.39 0.24 1.91 91.30 6.15 0.00 0.00 0.00 39 E H H 102.12 8.13 21.78 30.52 91.18 58.28 -62.71 -35.82 5.52 0.01 94.47 0.26 0.20 4.81 64.83 29.88 0.00 0.01 0.00 40 F H H 103.52 6.51 23.23 30.05 91.24 57.03 -68.10 -27.12 15.20 0.01 84.80 0.21 0.29 15.38 52.65 31.46 0.00 0.00 0.00 41 Y H H 10.80 23.20 17.19 40.78 95.32 48.28 -91.04 -7.99 31.40 0.06 68.54 0.96 0.98 28.94 36.26 32.78 0.01 0.03 0.04 42 L C T 44.01 17.72 17.15 35.01 111.78 114.12 -62.68 132.24 97.15 0.77 2.08 0.74 1.29 95.88 0.86 0.41 0.00 0.23 0.60 43 G C T 35.51 6.88 22.76 30.85 95.41 21.14 87.40 -4.91 99.39 0.32 0.30 0.55 1.79 97.24 0.05 0.15 0.00 0.20 0.03 44 K C C 62.43 14.87 20.07 34.80 119.26 129.32 -79.34 147.54 96.52 3.47 0.01 90.53 5.76 0.06 0.00 0.01 0.00 3.54 0.10 45 R E E 88.25 13.85 23.69 36.84 122.06 -139.84 -103.19 140.51 2.81 97.18 0.00 3.02 0.06 0.00 0.00 0.00 0.00 96.07 0.85 46 C E E 4.49 23.64 20.41 43.91 137.57 -170.41 -142.07 157.00 0.49 99.50 0.00 0.44 0.02 0.00 0.00 0.00 0.00 99.52 0.01 47 A E E 11.21 17.96 25.29 43.35 123.61 -133.01 -113.35 140.17 0.19 99.81 0.00 0.16 0.01 0.00 0.00 0.00 0.00 99.83 0.00 48 Y E E 14.03 22.34 22.32 44.16 127.15 -168.40 -123.78 140.94 0.22 99.78 0.00 0.19 0.01 0.00 0.00 0.00 0.00 99.81 0.00 49 V E E 22.74 15.69 23.87 39.98 117.87 -149.80 -107.03 127.31 1.30 98.69 0.00 1.11 0.04 0.00 0.00 0.00 0.00 98.83 0.02 50 Y E E 25.83 18.81 18.74 37.64 128.46 -174.48 -122.88 145.35 3.51 96.49 0.01 3.08 0.20 0.01 0.00 0.00 0.00 96.57 0.13 51 K E E 96.72 7.89 22.24 30.55 118.05 -139.79 -100.78 130.51 16.45 83.49 0.07 14.53 1.50 0.16 0.01 0.05 0.00 82.96 0.78 52 A C C 18.83 17.46 10.77 28.13 116.23 -125.81 -85.35 144.25 61.04 37.82 1.13 55.73 3.41 1.02 0.29 0.80 0.00 36.53 2.22 53 K C S 138.51 2.93 16.20 19.79 99.79 -136.04 -72.98 -28.79 76.19 19.99 3.82 21.21 30.10 26.08 0.41 3.39 0.01 17.08 1.73 54 N C S 112.36 2.25 15.12 17.50 105.82 15.48 -107.64 80.44 79.31 17.03 3.66 11.45 36.71 31.97 0.31 3.19 0.01 14.86 1.50 55 N C C 107.13 5.94 11.83 19.27 99.47 -105.64 55.36 36.20 75.79 21.67 2.54 43.87 22.93 9.44 0.33 2.47 0.00 18.96 2.00 56 T C C 69.75 5.22 12.78 19.80 119.88 142.06 -99.23 141.82 56.29 43.34 0.37 42.91 11.14 1.53 0.11 0.34 0.00 38.76 5.21 57 V E B 89.12 5.80 11.84 19.48 116.90 -129.27 -95.31 132.76 23.04 76.78 0.18 19.57 2.53 0.17 0.14 0.07 0.00 35.66 41.86 58 T C C 51.04 7.81 9.07 18.77 121.21 -139.01 -88.10 158.00 94.92 5.01 0.08 92.81 2.27 0.26 0.02 0.05 0.00 3.50 1.09 59 P C T 112.72 2.06 10.58 13.94 106.62 -91.77 -62.52 133.83 96.59 1.00 2.42 2.68 5.92 87.63 0.12 2.69 0.00 0.73 0.23 60 G C T 66.01 0.57 11.09 10.75 96.50 17.79 77.41 1.13 96.80 0.19 3.02 1.25 5.39 89.65 0.13 3.39 0.00 0.11 0.07 61 G C S 52.53 2.86 10.24 14.59 101.22 -95.01 85.88 3.38 95.74 1.37 2.88 17.34 71.24 7.12 0.26 2.63 0.00 0.72 0.69 62 K C C 131.87 2.14 11.37 14.98 117.74 128.79 -89.21 141.88 95.62 4.31 0.06 81.26 14.30 0.37 0.02 0.05 0.00 3.10 0.91 63 P E B 81.17 5.79 11.82 19.26 114.35 -104.07 -65.36 148.27 22.37 77.40 0.24 19.10 1.43 0.20 0.16 0.09 0.00 27.22 51.80 64 N C C 75.22 9.79 11.50 22.29 114.22 -135.50 -91.40 138.62 76.62 23.04 0.34 64.42 9.84 1.47 0.06 0.36 0.00 22.19 1.67 65 K C C 111.46 6.96 15.74 23.91 119.54 -145.04 -107.38 134.26 64.05 35.69 0.26 52.06 10.27 1.02 0.04 0.29 0.00 33.87 2.46 66 T E E 56.02 12.36 14.38 27.31 124.58 -167.31 -113.39 139.60 41.88 58.07 0.05 38.41 2.40 0.15 0.01 0.04 0.00 58.20 0.79 67 R E E 88.66 11.75 17.61 29.88 122.82 -163.22 -114.99 134.93 10.51 89.48 0.01 9.81 0.57 0.03 0.00 0.01 0.00 88.62 0.96 68 V E E 51.06 12.83 19.34 32.70 121.15 -151.42 -111.28 131.14 6.98 93.01 0.00 6.40 0.49 0.01 0.00 0.00 0.00 92.97 0.13 69 I E E 21.87 18.45 18.35 37.14 121.54 -165.65 -112.83 131.57 2.87 97.12 0.00 2.77 0.09 0.00 0.00 0.00 0.00 97.06 0.08 70 W E E 90.58 11.57 23.42 34.97 123.61 -166.82 -115.92 137.26 3.32 96.67 0.00 2.82 0.36 0.03 0.00 0.00 0.00 96.71 0.09 71 G E E 10.31 15.87 20.08 36.01 142.49 147.55 -155.73 -174.25 4.58 95.41 0.00 3.24 0.98 0.07 0.00 0.00 0.00 95.67 0.03 72 K E E 94.07 7.11 25.24 33.20 123.60 -88.22 -109.79 143.10 3.01 96.98 0.00 2.61 0.21 0.01 0.00 0.00 0.00 97.09 0.08 73 V E E 18.37 22.62 13.95 36.97 110.18 -115.35 -74.55 126.02 3.62 96.37 0.01 3.55 0.09 0.00 0.00 0.00 0.00 96.19 0.16 74 T E E 62.46 6.98 21.74 29.71 101.79 176.57 -100.77 -25.82 13.48 86.51 0.01 8.98 3.89 0.13 0.00 0.01 0.00 86.87 0.12 75 R E E 116.06 4.01 23.64 28.38 136.16 2.06 -151.75 151.64 8.37 91.61 0.02 5.45 2.61 0.17 0.00 0.01 0.00 91.63 0.13 76 A E E 45.13 16.64 14.32 30.29 115.95 -114.75 -83.80 136.98 18.01 81.92 0.07 17.43 0.65 0.07 0.02 0.04 0.00 80.76 1.03 77 H E E 72.42 10.56 15.32 26.88 110.53 -147.90 -98.97 119.49 42.59 57.08 0.33 38.84 2.45 0.47 0.15 0.20 0.00 50.69 7.20 78 G C T 44.47 6.11 15.83 23.10 109.47 -146.72 13.13 -132.58 86.28 2.63 11.10 6.27 20.46 58.09 0.27 12.46 0.00 1.90 0.55 79 N C T 126.17 2.86 15.69 18.67 95.62 -8.65 -74.66 -18.84 85.86 0.98 13.17 1.59 12.49 70.33 0.27 14.41 0.00 0.59 0.33 80 S C T 58.78 6.41 16.97 24.18 97.04 50.30 -94.89 -4.29 86.80 0.43 12.76 1.51 9.68 73.53 0.25 14.62 0.00 0.25 0.18 81 G C T 19.06 13.09 15.85 30.04 95.99 -111.02 82.37 9.82 96.96 1.23 1.81 19.79 23.61 53.46 0.18 1.88 0.00 0.86 0.23 82 M E E 46.80 11.84 20.01 32.99 119.27 140.87 -82.09 144.24 47.82 52.14 0.04 44.98 2.42 0.13 0.01 0.03 0.00 50.57 1.86 83 V E E 11.07 21.97 18.11 40.54 120.37 -142.35 -107.07 133.80 2.59 97.41 0.00 2.64 0.07 0.00 0.00 0.00 0.00 96.47 0.81 84 R E E 79.30 11.71 26.17 37.90 120.41 -156.80 -109.25 133.46 2.84 97.16 0.00 2.69 0.07 0.00 0.00 0.00 0.00 97.19 0.05 85 A E E 5.05 24.75 16.82 41.86 125.78 -170.69 -118.57 140.90 3.62 96.38 0.00 3.58 0.06 0.00 0.00 0.00 0.00 96.34 0.03 86 K E E 90.80 7.94 26.16 34.73 122.78 -160.49 -121.68 134.85 1.21 98.79 0.00 1.21 0.03 0.00 0.00 0.00 0.00 98.59 0.16 87 F E E 24.22 22.35 12.86 34.70 117.75 -141.65 -93.29 134.10 6.98 93.02 0.01 7.28 0.12 0.01 0.00 0.00 0.00 91.56 1.03 88 R C C 142.80 4.22 20.53 25.31 97.77 -165.49 -88.24 -21.63 81.83 17.70 0.47 43.17 34.74 3.33 0.03 0.57 0.00 17.62 0.54 89 S C S 54.35 4.28 20.86 25.34 137.49 14.20 -145.89 167.01 94.13 5.39 0.48 5.30 73.34 15.60 0.02 0.53 0.00 4.83 0.39 90 N C C 101.59 6.92 20.98 28.53 106.71 -77.33 -72.78 114.25 96.09 3.28 0.63 64.28 21.04 10.38 0.04 1.01 0.00 2.59 0.66 91 L C C 13.67 23.91 12.15 35.72 117.59 -146.81 -83.38 141.09 95.42 4.50 0.09 90.39 5.08 0.09 0.04 0.04 0.00 1.65 2.71 92 P C C 39.98 8.73 20.77 30.83 113.54 -106.82 -64.27 145.90 97.45 2.32 0.24 97.32 0.49 0.11 0.07 0.08 0.00 0.72 1.21 93 A H G 58.54 10.99 15.77 27.41 91.09 -116.14 -58.66 -32.19 22.67 0.15 77.18 2.30 2.53 15.87 4.86 74.30 0.00 0.09 0.04 94 K H G 141.12 3.05 20.67 24.31 89.82 63.92 -68.15 -19.41 19.90 0.10 80.00 1.20 1.70 15.14 5.31 76.56 0.00 0.07 0.02 95 A H G 10.21 20.94 14.10 35.17 93.35 61.84 -81.78 -13.91 16.67 0.17 83.16 2.54 2.23 9.99 4.84 80.26 0.00 0.11 0.03 96 I C T 61.47 16.33 15.84 31.67 111.14 101.76 -68.93 131.15 80.72 0.79 18.50 1.51 3.60 77.01 4.93 11.80 0.04 0.36 0.74 97 G C T 46.20 4.32 21.51 26.50 95.88 20.62 85.69 -2.72 96.70 0.25 3.05 2.20 4.12 90.84 0.45 2.17 0.00 0.15 0.08 98 H C C 57.42 14.70 16.31 31.20 119.13 124.78 -84.67 146.80 96.22 3.56 0.21 82.44 13.17 0.68 0.05 0.17 0.00 3.01 0.47 99 R E E 116.77 8.19 23.21 31.81 116.36 -126.03 -91.55 132.64 31.80 68.10 0.09 30.13 1.56 0.18 0.03 0.07 0.00 64.81 3.22 100 I E E 10.17 24.94 14.84 40.03 123.56 -164.69 -115.71 136.52 8.47 91.53 0.01 8.11 0.24 0.01 0.00 0.00 0.00 91.45 0.19 101 R E E 93.02 8.38 25.92 34.78 119.58 -151.49 -106.55 133.47 2.26 97.74 0.00 2.15 0.05 0.00 0.00 0.00 0.00 97.76 0.04 102 V E E 16.82 23.35 15.91 39.29 122.06 -163.11 -114.22 130.52 2.36 97.64 0.00 2.34 0.03 0.00 0.00 0.00 0.00 97.55 0.06 103 M E E 68.12 8.45 23.27 32.37 123.60 -169.72 -119.79 137.16 7.25 92.74 0.01 6.83 0.20 0.01 0.00 0.01 0.00 92.76 0.19 104 L E E 62.18 14.74 15.86 30.60 115.12 -135.73 -87.84 132.19 24.52 75.40 0.07 21.38 2.43 0.21 0.02 0.05 0.00 75.34 0.57 105 Y C C 91.84 9.80 14.09 25.20 118.40 -150.68 -105.57 128.01 74.38 25.14 0.48 67.22 5.89 0.66 0.09 0.42 0.00 24.96 0.75 106 P C C 80.61 5.92 13.18 20.58 105.07 -124.58 -68.82 131.53 72.60 10.85 16.55 41.76 13.64 15.94 1.06 17.28 0.00 9.54 0.77 107 S C C 74.77 4.80 10.14 16.59 107.22 -118.15 -86.68 81.82 77.40 4.98 17.62 34.05 19.48 22.83 1.07 18.25 0.00 3.37 0.93 108 R C C 165.97 2.74 9.74 14.15 108.13 79.33 -90.25 82.75 80.55 5.44 14.01 64.13 5.00 10.48 1.49 13.69 0.00 3.94 1.27 109 I C C 106.93 5.85 10.16 17.61 111.02 110.36 -92.32 109.47 99.86 0.12 0.02 99.81 0.07 0.03 0.01 0.00 0.00 0.06 0.01