# 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 119.02 4.98 12.47 19.04 113.96 -161.86 -91.39 130.05 99.94 0.05 0.01 99.90 0.04 0.02 0.00 0.00 0.00 0.02 0.01 1 A C C 71.33 5.50 10.34 17.53 113.52 -147.73 -89.05 137.42 92.56 3.97 3.47 87.63 1.31 4.56 0.84 1.78 0.00 2.90 0.98 2 E C C 130.71 3.61 12.07 17.43 115.23 -145.52 -96.90 133.41 84.85 9.82 5.32 53.55 18.43 12.74 0.80 4.98 0.00 8.11 1.40 3 S C C 56.95 9.36 11.91 22.16 122.02 -149.65 -105.99 145.84 77.10 18.70 4.20 52.92 13.91 9.45 0.50 4.11 0.00 18.00 1.11 4 H C C 86.72 10.70 15.73 27.07 122.97 -162.33 -118.40 138.51 55.00 43.22 1.78 44.06 8.34 2.63 0.40 1.49 0.00 41.21 1.88 5 R E E 102.26 11.47 18.19 29.82 121.22 -147.40 -108.40 135.87 38.95 60.59 0.46 34.34 3.35 0.75 0.13 0.33 0.00 59.72 1.38 6 L E E 28.95 18.49 17.37 35.54 118.53 -153.65 -102.44 132.80 30.11 69.62 0.26 24.31 4.75 0.66 0.07 0.19 0.00 69.52 0.50 7 Y E E 81.22 13.10 22.27 34.99 128.44 -168.71 -125.91 140.95 18.13 81.70 0.17 14.56 2.81 0.42 0.04 0.13 0.00 81.72 0.33 8 V E E 13.64 21.56 17.92 39.49 129.23 -171.67 -132.02 142.18 11.99 87.97 0.05 10.83 0.78 0.08 0.01 0.03 0.00 87.99 0.29 9 K E E 92.69 8.96 25.38 34.67 120.74 -149.26 -104.92 135.90 9.27 90.70 0.03 8.06 0.68 0.07 0.01 0.02 0.00 90.99 0.18 10 G E E 6.15 20.37 17.85 38.22 142.90 153.87 -155.12 172.49 4.61 95.39 0.01 3.75 0.49 0.03 0.00 0.00 0.00 95.68 0.04 11 K E E 86.31 7.69 25.52 34.14 124.17 -89.73 -118.93 138.87 0.74 99.26 0.00 0.66 0.03 0.00 0.00 0.00 0.00 99.30 0.02 12 H E E 36.72 20.70 15.95 36.45 109.49 -119.32 -76.89 124.22 0.54 99.46 0.00 0.51 0.01 0.00 0.00 0.00 0.00 99.45 0.03 13 I E E 60.90 9.34 21.70 31.98 101.56 175.56 -99.59 -28.45 4.50 95.47 0.02 3.22 0.88 0.09 0.00 0.01 0.00 95.75 0.05 14 S E E 30.96 8.13 23.82 33.05 143.71 -12.71 -164.56 162.03 10.77 89.20 0.03 6.93 3.20 0.25 0.01 0.02 0.00 89.51 0.08 15 Y E E 60.37 19.83 14.59 33.38 132.33 -153.31 -139.01 146.15 14.58 85.27 0.14 13.40 0.89 0.12 0.05 0.06 0.00 84.69 0.79 16 Q E E 72.19 8.20 19.43 28.73 121.98 -155.98 -121.47 134.34 33.18 66.60 0.23 29.42 2.90 0.46 0.07 0.15 0.00 64.99 2.01 17 R C E 120.20 9.30 13.95 24.34 118.06 -150.96 -99.89 134.24 50.91 48.80 0.29 39.98 9.61 1.43 0.07 0.27 0.00 46.05 2.59 18 S C C 41.78 7.64 11.22 20.66 127.60 -150.89 -123.85 160.27 72.71 26.88 0.41 60.24 9.63 2.07 0.12 0.38 0.00 23.80 3.76 19 K C T 168.71 1.27 11.50 13.33 95.84 -93.14 -65.65 -29.02 97.28 1.53 1.19 6.69 43.44 47.27 0.09 1.16 0.00 1.00 0.36 20 S C T 97.20 0.85 11.86 12.21 101.63 23.43 -91.44 -12.77 98.15 0.73 1.12 5.10 44.64 48.45 0.07 1.08 0.00 0.44 0.22 21 V C S 80.39 5.52 9.98 17.30 124.50 39.15 -125.90 141.25 75.86 22.85 1.29 19.54 39.09 18.22 0.18 1.26 0.01 17.92 3.77 22 T C C 88.34 5.27 12.20 19.06 112.93 -151.26 -95.46 121.73 60.59 38.88 0.53 37.57 20.08 3.98 0.15 0.51 0.00 30.72 6.98 23 N C C 64.56 9.12 13.60 24.07 110.97 -150.72 -114.17 104.72 71.16 28.66 0.18 56.99 13.13 0.88 0.05 0.19 0.00 26.03 2.73 24 P C T 68.27 8.58 15.82 25.77 101.33 -159.72 -68.23 -2.90 74.74 24.67 0.58 12.71 17.35 44.59 0.03 0.65 0.00 24.06 0.61 25 N C T 77.16 9.99 18.82 28.94 97.40 48.85 -91.15 23.43 69.79 29.79 0.42 11.96 17.13 38.98 0.02 0.49 0.00 31.11 0.30 26 V E E 29.57 14.72 19.21 34.75 125.79 109.64 -116.40 140.81 27.98 72.00 0.03 24.94 1.94 0.12 0.00 0.03 0.00 72.62 0.35 27 S E E 8.20 19.89 20.67 40.57 131.61 -172.08 -128.61 149.46 2.99 97.01 0.00 2.71 0.10 0.00 0.00 0.00 0.00 97.13 0.06 28 L E E 23.95 16.52 25.20 41.61 118.41 -140.24 -105.31 129.27 0.52 99.48 0.00 0.41 0.03 0.00 0.00 0.00 0.00 99.55 0.00 29 I E E 4.96 24.62 21.27 46.04 120.28 -165.01 -114.71 128.50 0.15 99.85 0.00 0.13 0.00 0.00 0.00 0.00 0.00 99.86 0.00 30 Q E E 56.08 11.81 26.99 38.98 117.23 -159.85 -107.80 125.15 0.13 99.87 0.00 0.12 0.00 0.00 0.00 0.00 0.00 99.88 0.00 31 I E E 5.81 25.01 16.81 42.50 116.40 -162.90 -108.49 124.05 1.42 98.58 0.00 1.39 0.02 0.00 0.00 0.00 0.00 98.56 0.03 32 E E E 102.03 6.02 23.98 30.58 118.72 -150.00 -90.49 141.06 16.43 83.46 0.11 6.26 4.68 4.13 0.00 0.11 0.00 84.60 0.22 33 G C E 36.62 5.76 23.14 29.88 96.39 21.61 79.96 5.02 62.58 37.31 0.10 13.30 31.89 16.04 0.00 0.14 0.00 38.33 0.31 34 V C C 9.17 23.76 10.88 34.50 112.21 150.06 -85.75 124.17 59.86 40.06 0.08 59.36 1.08 0.13 0.03 0.05 0.00 35.07 4.27 35 A C C 68.35 5.11 21.95 27.75 101.85 170.01 -105.97 -13.04 97.32 2.64 0.04 77.50 19.76 0.30 0.01 0.03 0.00 1.97 0.42 36 S C S 47.08 4.23 23.27 27.35 135.74 25.70 -142.45 160.92 98.82 0.39 0.79 16.92 81.61 0.31 0.82 0.04 0.00 0.07 0.23 37 P H H 64.49 14.01 13.75 27.73 91.53 -109.28 -60.13 -36.43 1.93 0.00 98.07 0.12 0.17 1.49 96.11 2.11 0.00 0.00 0.00 38 K H H 145.21 1.43 21.62 21.86 91.25 54.02 -63.33 -40.19 1.07 0.00 98.92 0.07 0.05 0.84 96.57 2.46 0.00 0.00 0.00 39 D H H 39.68 11.35 18.56 30.83 92.13 48.93 -66.22 -38.97 0.58 0.00 99.41 0.07 0.04 0.39 96.34 3.15 0.00 0.00 0.00 40 A H H 2.44 25.70 13.22 39.27 91.20 52.94 -64.10 -40.12 0.63 0.00 99.37 0.07 0.04 0.42 97.46 2.01 0.00 0.00 0.00 41 K H H 114.75 7.45 22.62 30.90 91.25 56.58 -63.47 -35.17 2.39 0.00 97.61 0.09 0.07 2.16 87.90 9.77 0.00 0.00 0.00 42 F H H 97.87 7.12 23.98 31.60 91.52 56.77 -67.43 -28.08 7.43 0.00 92.57 0.09 0.11 8.21 82.45 9.13 0.00 0.00 0.00 43 Y H H 7.74 24.09 17.61 42.16 95.60 47.67 -90.68 -10.93 22.09 0.03 77.89 0.39 0.53 22.71 68.85 7.45 0.03 0.01 0.02 44 L C T 40.88 18.38 17.41 35.83 111.33 112.39 -62.70 131.52 90.00 0.75 9.24 0.57 1.23 88.36 8.31 0.72 0.00 0.24 0.57 45 G C T 36.78 6.59 23.13 30.93 95.45 21.73 87.27 -5.60 98.53 0.27 1.20 0.56 1.76 96.42 0.81 0.24 0.00 0.16 0.04 46 K C C 59.33 15.29 19.95 35.01 119.89 125.88 -79.64 147.98 96.32 3.67 0.01 91.13 4.85 0.08 0.00 0.01 0.00 3.85 0.09 47 R E E 87.25 13.28 24.50 37.30 119.03 -125.11 -94.98 136.79 3.22 96.77 0.01 3.30 0.08 0.00 0.00 0.00 0.00 96.19 0.43 48 I E E 4.87 24.41 20.57 45.02 134.21 -174.43 -134.45 152.51 0.28 99.72 0.00 0.25 0.01 0.00 0.00 0.00 0.00 99.74 0.00 49 A E E 7.49 20.18 25.33 45.20 121.77 -138.27 -109.05 136.99 0.12 99.88 0.00 0.10 0.00 0.00 0.00 0.00 0.00 99.89 0.00 50 Y E E 13.51 22.09 24.06 45.38 128.15 -169.33 -124.02 142.32 0.12 99.88 0.00 0.10 0.00 0.00 0.00 0.00 0.00 99.90 0.00 51 V E E 16.51 18.61 23.14 41.66 118.00 -149.52 -108.64 127.19 0.66 99.34 0.00 0.55 0.02 0.00 0.00 0.00 0.00 99.42 0.01 52 Y E E 33.90 16.49 20.30 37.00 129.46 -173.51 -124.92 147.32 3.32 96.65 0.04 2.84 0.23 0.03 0.01 0.01 0.00 96.79 0.08 53 R E E 107.86 9.49 19.88 29.78 115.54 -124.82 -92.04 132.10 17.90 81.92 0.18 16.14 1.51 0.21 0.07 0.09 0.00 81.28 0.71 54 A C C 21.59 14.78 10.98 26.42 118.23 -137.02 -91.42 144.02 70.32 28.05 1.63 64.34 3.61 0.88 0.63 0.78 0.00 28.79 0.97 55 P C C 99.69 2.85 15.01 18.60 97.10 -127.40 -73.00 -24.85 68.53 13.72 17.75 35.69 22.16 12.08 9.12 7.90 0.08 11.22 1.75 56 K C C 137.58 2.20 13.01 15.93 122.48 40.24 -116.32 145.60 60.19 12.16 27.66 24.05 23.43 14.92 14.94 11.30 0.49 8.19 2.67 57 E C C 126.23 4.38 10.57 16.70 112.36 -104.26 -84.07 129.10 61.51 13.52 24.98 40.44 12.05 9.33 14.26 10.85 0.11 10.52 2.45 58 I C C 98.67 5.86 9.06 16.56 112.39 -160.06 -99.38 121.59 62.72 15.98 21.30 38.94 12.93 11.31 13.32 7.95 0.22 11.30 4.03 59 R C T 173.89 1.96 11.07 14.20 109.57 -33.65 -91.51 103.49 75.16 8.19 16.64 25.39 16.85 34.25 8.32 7.41 0.11 5.24 2.43 60 G C T 54.34 1.94 12.72 15.28 110.41 -16.58 82.28 -106.10 88.60 2.56 8.84 18.06 22.20 49.03 2.18 6.08 0.00 1.67 0.78 61 S C C 69.24 5.62 11.70 18.78 114.15 5.38 -92.30 129.25 81.04 12.88 6.08 40.06 19.25 22.55 1.19 4.60 0.01 10.91 1.44 62 K C C 106.92 7.02 14.34 22.67 113.51 103.86 -92.94 128.33 65.73 32.44 1.82 43.16 16.23 6.53 0.36 1.49 0.00 30.74 1.48 63 I E E 60.34 13.03 14.36 28.06 119.92 -154.58 -108.23 134.03 31.04 68.80 0.16 27.09 2.93 0.32 0.05 0.10 0.00 68.82 0.69 64 R E E 77.37 12.61 18.55 31.61 121.19 -160.98 -109.23 132.52 8.70 91.26 0.04 7.97 0.44 0.05 0.01 0.02 0.00 91.25 0.26 65 V E E 39.55 14.74 19.83 34.91 121.07 -158.13 -111.41 131.06 3.69 96.30 0.01 3.30 0.17 0.01 0.00 0.00 0.00 96.46 0.06 66 I E E 15.71 19.64 19.83 39.81 121.45 -164.73 -112.34 132.43 1.55 98.45 0.00 1.42 0.04 0.00 0.00 0.00 0.00 98.49 0.04 67 W E E 79.46 13.31 23.66 36.77 124.05 -163.80 -112.72 138.76 2.21 97.79 0.00 1.84 0.14 0.01 0.00 0.00 0.00 97.96 0.05 68 G E E 8.82 15.82 21.25 37.28 143.52 141.97 -163.26 -172.99 2.84 97.15 0.00 2.05 0.47 0.02 0.00 0.00 0.00 97.43 0.03 69 K E E 94.32 7.21 25.48 33.57 123.10 -80.02 -106.49 142.28 2.04 97.95 0.00 1.79 0.11 0.00 0.00 0.00 0.00 97.99 0.10 70 V E E 14.62 23.48 13.50 37.46 110.32 -114.96 -74.95 127.11 6.02 93.97 0.01 6.03 0.12 0.01 0.00 0.00 0.00 93.41 0.42 71 T E E 65.76 6.46 21.79 29.10 101.31 175.33 -99.30 -27.02 26.07 73.92 0.02 17.37 8.13 0.21 0.00 0.01 0.00 74.06 0.21 72 R E E 121.37 3.48 23.04 26.98 135.29 3.63 -147.04 152.81 22.11 77.88 0.02 11.87 10.01 0.27 0.00 0.02 0.00 77.57 0.27 73 T E E 62.87 14.58 14.66 28.94 115.60 -108.09 -75.33 138.88 25.44 74.47 0.09 24.31 0.82 0.09 0.03 0.06 0.00 72.50 2.19 74 H E E 69.97 11.62 14.38 26.77 109.73 -152.44 -94.81 112.72 39.88 59.69 0.43 34.71 3.11 0.68 0.19 0.30 0.00 49.51 11.51 75 G C T 42.71 5.39 16.61 23.07 114.47 -122.56 73.84 -151.23 90.09 3.64 6.26 5.77 20.56 62.57 0.19 7.49 0.00 2.80 0.62 76 N C T 125.14 3.46 14.99 18.73 95.73 -35.33 -73.05 -13.06 91.57 0.91 7.52 1.69 13.05 75.83 0.22 8.36 0.00 0.56 0.30 77 N C T 84.77 6.37 17.24 24.41 96.39 49.62 -93.60 -0.70 92.53 0.60 6.88 1.73 9.73 79.89 0.20 7.87 0.00 0.36 0.22 78 G C T 18.31 13.50 15.94 30.47 96.56 -112.32 82.19 9.14 96.66 1.93 1.41 21.91 19.73 55.08 0.13 1.39 0.00 1.46 0.30 79 L E E 37.68 12.32 20.16 33.77 118.91 138.28 -82.61 141.16 39.72 60.24 0.04 36.59 2.70 0.14 0.01 0.03 0.00 59.02 1.49 80 V E E 11.25 22.12 18.38 40.94 119.29 -142.85 -101.14 132.75 2.91 97.09 0.00 2.77 0.11 0.01 0.00 0.00 0.00 96.37 0.74 81 R E E 83.09 11.39 26.24 37.67 121.92 -159.81 -110.71 133.75 2.90 97.10 0.00 2.68 0.08 0.00 0.00 0.00 0.00 97.18 0.05 82 A E E 5.71 24.42 16.43 41.09 129.25 -172.65 -125.27 146.71 2.92 97.08 0.00 2.83 0.05 0.00 0.00 0.00 0.00 97.09 0.02 83 N E E 71.01 7.79 26.09 34.46 123.59 -159.36 -122.03 135.19 1.26 98.74 0.00 1.22 0.04 0.00 0.00 0.00 0.00 98.62 0.12 84 F E E 25.66 22.01 12.48 33.94 118.24 -143.91 -95.34 134.25 9.11 90.89 0.01 9.36 0.16 0.01 0.00 0.00 0.00 89.44 1.03 85 K C C 123.88 4.35 19.81 24.68 98.58 -164.13 -89.02 -24.94 83.41 16.18 0.41 42.37 37.46 3.07 0.02 0.50 0.00 16.10 0.49 86 K C S 114.27 2.97 20.24 23.35 134.39 16.52 -142.33 157.09 94.68 4.92 0.40 5.18 74.08 15.52 0.01 0.44 0.00 4.39 0.37 87 N C C 102.78 6.86 19.05 26.91 109.19 -74.63 -68.69 128.32 97.12 2.28 0.61 66.28 18.57 11.85 0.04 1.02 0.00 1.73 0.50 88 L C C 17.23 22.42 11.87 33.86 116.94 -143.94 -94.69 134.94 96.89 3.04 0.07 88.84 7.67 0.07 0.03 0.03 0.00 0.69 2.67 89 P C C 48.88 6.55 22.06 29.52 113.85 -108.38 -65.26 146.63 99.81 0.10 0.09 99.42 0.39 0.06 0.03 0.03 0.00 0.03 0.04 90 P H G 58.36 15.41 13.98 29.08 92.36 -113.49 -59.42 -32.09 26.56 0.17 73.27 4.66 2.89 17.17 8.92 66.21 0.00 0.09 0.06 91 K H G 144.48 3.13 19.23 23.21 91.62 62.45 -68.71 -17.44 20.28 0.21 79.51 2.52 2.21 14.45 10.44 70.19 0.00 0.13 0.05 92 T H G 44.05 14.36 16.48 30.68 96.15 62.55 -81.35 -14.59 17.97 0.39 81.64 3.76 2.96 10.88 9.45 72.61 0.00 0.25 0.09 93 F C T 51.25 19.79 15.44 33.60 102.87 56.90 -86.30 56.66 55.78 1.64 42.57 4.56 7.65 42.51 10.55 32.56 0.12 0.90 1.16 94 G C T 42.70 6.20 22.32 28.88 98.05 -68.20 83.69 6.29 94.12 1.61 4.27 14.41 9.56 70.27 1.11 3.03 0.00 1.19 0.43 95 A C C 21.79 17.65 15.03 32.60 117.76 144.35 -79.73 148.79 89.49 10.11 0.40 82.00 6.04 0.90 0.10 0.29 0.00 9.91 0.76 96 S E E 53.20 7.93 24.12 32.42 122.03 -135.14 -106.18 142.39 35.67 64.15 0.18 32.74 2.30 0.28 0.05 0.12 0.00 62.90 1.60 97 V E E 12.34 24.53 14.88 39.32 127.36 -165.54 -125.67 138.70 8.87 91.11 0.02 8.36 0.41 0.03 0.01 0.01 0.00 90.86 0.33 98 R E E 97.57 8.00 25.59 34.04 121.37 -155.77 -110.46 134.68 2.83 97.17 0.01 2.76 0.08 0.00 0.00 0.00 0.00 97.09 0.05 99 I E E 19.79 23.25 15.98 39.18 121.46 -161.18 -113.65 129.98 1.98 98.02 0.00 1.97 0.04 0.00 0.00 0.00 0.00 97.94 0.05 100 M E E 64.61 8.76 24.03 33.42 124.56 -169.05 -119.35 137.87 3.85 96.14 0.01 3.57 0.11 0.01 0.00 0.00 0.00 96.21 0.09 101 L E E 52.18 16.97 16.04 32.73 116.60 -138.57 -93.46 130.77 13.30 86.67 0.02 11.96 0.83 0.07 0.01 0.01 0.00 86.69 0.44 102 Y C E 88.18 9.76 16.13 27.12 121.39 -161.61 -112.42 136.48 53.20 46.74 0.06 47.74 3.70 0.17 0.01 0.05 0.00 47.78 0.53 103 P C C 75.22 6.92 13.79 22.04 111.95 -106.89 -68.29 146.68 64.74 32.39 2.87 46.84 10.82 6.70 0.33 2.97 0.00 31.08 1.26 104 S C C 71.03 6.30 10.00 17.79 107.09 -131.00 -86.19 90.06 86.55 8.77 4.68 41.42 25.67 19.51 0.44 4.91 0.00 6.89 1.15 105 N C C 127.84 1.67 11.20 13.80 103.70 -145.67 -88.70 31.08 89.06 6.75 4.19 68.22 6.52 13.74 0.59 4.06 0.00 5.51 1.37 106 I C C 101.55 6.49 10.02 17.96 107.74 100.76 -89.37 88.89 99.83 0.16 0.01 99.80 0.07 0.03 0.00 0.00 0.00 0.09 0.01