# 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 Q C C 114.35 5.17 16.69 23.15 116.59 -144.87 -93.35 133.24 99.95 0.05 0.00 99.92 0.05 0.01 0.00 0.00 0.00 0.02 0.00 1 P C C 73.69 10.05 13.19 23.98 112.87 -117.86 -71.72 144.01 93.47 5.96 0.56 91.36 0.96 1.31 0.10 0.28 0.00 5.42 0.57 2 V C C 69.41 10.34 15.21 26.37 119.06 -151.01 -105.69 132.70 60.72 38.30 0.98 46.98 11.29 2.37 0.25 0.85 0.00 35.67 2.59 3 L E E 54.14 15.33 14.59 29.91 118.37 -146.69 -103.68 131.02 37.79 61.59 0.62 31.78 4.00 0.75 0.26 0.45 0.00 55.25 7.50 4 T E E 62.75 10.66 18.75 29.92 124.62 -167.21 -117.70 137.64 47.51 52.18 0.30 40.29 5.37 0.63 0.11 0.26 0.00 48.32 5.03 5 Q C C 75.73 13.55 16.17 29.73 125.33 -162.58 -116.65 139.43 75.38 24.54 0.08 60.62 13.78 0.39 0.01 0.07 0.00 24.17 0.96 6 P C C 55.26 10.98 17.03 28.68 115.70 -101.51 -67.56 152.12 82.84 16.78 0.38 71.96 8.26 1.30 0.05 0.37 0.00 17.36 0.71 7 A C S 60.88 9.92 16.79 27.27 95.84 -133.39 -73.73 -26.20 83.39 16.40 0.21 31.73 49.09 1.72 0.02 0.21 0.00 16.76 0.48 8 S E E 58.05 7.30 20.40 28.70 134.20 13.79 -142.67 148.87 25.31 74.46 0.23 19.41 5.38 0.72 0.02 0.24 0.00 73.74 0.49 9 V E E 30.28 19.69 14.74 33.89 130.99 -173.80 -135.32 143.01 3.71 96.27 0.02 3.45 0.24 0.02 0.00 0.01 0.00 95.99 0.29 10 S E E 62.78 6.95 23.14 31.34 128.45 -163.58 -124.03 144.96 2.77 97.22 0.01 2.55 0.18 0.01 0.00 0.00 0.00 97.05 0.21 11 G E E 12.63 15.93 16.62 32.94 142.81 150.16 -163.87 173.45 20.10 79.88 0.02 17.07 2.37 0.08 0.00 0.01 0.00 79.61 0.86 12 S C C 55.32 5.12 23.50 28.66 126.23 -91.60 -109.53 155.28 91.81 8.16 0.03 88.63 3.41 0.12 0.01 0.02 0.00 7.03 0.78 13 P C T 62.56 13.75 14.29 28.11 109.93 -83.79 -60.05 136.92 99.01 0.67 0.33 0.51 3.69 95.05 0.02 0.24 0.00 0.39 0.12 14 G C T 49.36 3.60 19.43 23.79 95.30 22.53 86.94 -5.83 99.47 0.32 0.21 0.64 4.13 94.79 0.01 0.17 0.00 0.22 0.03 15 Q C C 78.98 8.07 17.52 26.76 125.06 118.31 -90.49 154.60 92.76 7.11 0.13 66.73 26.04 0.47 0.02 0.13 0.00 5.81 0.81 16 S C C 61.82 8.73 19.02 28.74 124.09 -130.61 -103.58 146.61 68.43 31.55 0.02 67.90 0.73 0.04 0.00 0.01 0.00 30.79 0.54 17 I E E 13.73 22.48 14.77 37.32 127.11 -165.25 -128.20 140.73 1.43 98.57 0.00 1.42 0.03 0.00 0.00 0.00 0.00 98.48 0.08 18 T E E 66.23 7.67 25.24 33.49 118.87 -151.40 -109.04 129.69 0.32 99.68 0.00 0.32 0.01 0.00 0.00 0.00 0.00 99.67 0.01 19 I E E 5.31 25.68 16.34 42.83 119.80 -166.69 -114.39 127.85 1.93 98.07 0.00 1.85 0.05 0.00 0.00 0.00 0.00 98.05 0.04 20 S E E 44.85 8.93 26.64 36.00 125.06 -169.32 -117.75 143.09 19.03 80.96 0.01 17.58 0.52 0.02 0.00 0.00 0.00 81.75 0.12 21 C E E 6.98 24.70 16.71 41.36 131.39 -174.06 -135.14 145.81 25.39 74.59 0.02 23.69 0.86 0.05 0.00 0.01 0.00 75.07 0.31 22 T E E 58.32 8.28 26.89 35.83 121.87 -157.99 -115.42 132.97 12.92 87.02 0.06 11.85 0.97 0.09 0.03 0.03 0.00 83.50 3.53 23 A E E 10.06 23.39 15.25 38.04 130.16 -171.43 -125.55 148.03 28.28 71.56 0.16 25.27 2.44 0.26 0.07 0.11 0.00 68.17 3.68 24 T C C 59.59 7.15 23.12 30.56 124.62 -143.02 -105.72 154.41 63.87 35.37 0.76 53.71 8.27 1.20 0.21 0.58 0.00 33.78 2.25 25 S C C 53.22 13.06 14.83 27.80 96.82 -112.43 -66.56 -16.04 58.08 6.59 35.34 29.28 15.70 15.48 6.80 26.72 0.04 4.28 1.70 26 S C G 83.48 2.56 18.78 21.45 95.93 68.43 -78.11 -15.56 56.79 3.35 39.86 18.21 16.00 24.79 7.40 30.30 0.05 1.86 1.39 27 D C G 63.49 11.02 16.66 28.05 102.10 57.78 -94.86 20.88 56.55 4.64 38.81 25.80 13.14 19.60 6.88 30.28 0.03 2.67 1.60 28 V C C 26.64 21.42 12.05 32.07 103.48 108.00 -86.76 18.24 67.93 8.12 23.95 33.38 15.80 20.01 7.41 15.22 0.07 4.03 4.07 29 G C T 42.70 5.52 20.13 26.38 106.37 51.68 58.36 -102.40 85.87 2.89 11.24 14.62 18.57 52.57 2.16 9.00 0.01 1.72 1.35 30 N C T 109.42 3.79 20.90 24.91 98.35 8.19 -93.35 -3.02 88.92 3.19 7.90 14.41 24.55 49.94 0.95 7.07 0.00 2.15 0.93 31 Y C C 34.70 20.73 13.47 33.54 120.93 91.84 -106.98 136.33 73.69 24.72 1.59 59.76 9.56 3.33 0.38 1.48 0.00 21.18 4.31 32 N C C 71.52 9.89 23.56 33.57 100.88 -173.81 -99.27 -17.04 74.05 25.66 0.29 37.99 34.00 2.20 0.04 0.28 0.00 24.77 0.72 33 Y E E 50.83 13.95 24.93 39.13 135.32 24.29 -144.74 146.81 17.21 82.64 0.15 12.43 4.34 0.65 0.02 0.12 0.00 82.12 0.31 34 V E E 2.57 26.68 21.06 48.29 124.69 -163.72 -122.99 134.61 1.77 98.22 0.01 1.59 0.09 0.01 0.00 0.00 0.00 98.27 0.04 35 S E E 9.98 18.54 27.92 46.04 131.32 -174.70 -127.81 149.14 0.48 99.51 0.00 0.45 0.01 0.00 0.00 0.00 0.00 99.53 0.00 36 W E E 7.33 24.69 23.45 47.92 126.08 -156.27 -119.49 141.38 0.50 99.49 0.00 0.45 0.02 0.00 0.00 0.00 0.00 99.52 0.01 37 Y E E 23.58 18.12 24.48 42.28 131.39 -172.44 -131.24 147.32 1.35 98.65 0.00 1.17 0.05 0.00 0.00 0.00 0.00 98.71 0.05 38 Q E E 30.72 16.20 21.64 37.88 123.66 -154.48 -115.46 137.36 7.51 92.47 0.01 6.60 0.59 0.04 0.00 0.01 0.00 92.55 0.20 39 H E E 65.06 12.89 17.49 30.97 116.17 -142.45 -99.66 128.41 35.45 64.51 0.05 31.24 3.19 0.18 0.01 0.04 0.00 64.11 1.23 40 H C C 67.75 9.62 13.83 24.99 121.02 -156.43 -101.32 144.87 93.01 6.95 0.05 89.87 3.29 0.25 0.01 0.04 0.00 4.91 1.63 41 P C T 104.74 3.40 12.46 17.60 108.84 -84.57 -58.67 133.79 99.45 0.15 0.40 0.61 4.88 93.96 0.01 0.41 0.00 0.10 0.03 42 G C T 68.07 0.41 13.09 11.37 96.53 15.91 83.79 -2.41 99.47 0.11 0.41 0.64 4.95 93.85 0.01 0.45 0.00 0.08 0.02 43 K C S 110.08 4.53 11.32 17.98 129.74 86.79 -120.73 160.08 88.12 11.45 0.44 27.44 59.34 1.71 0.10 0.32 0.00 4.10 6.98 44 A C C 68.68 3.70 17.03 21.35 116.81 -97.84 -70.29 150.64 95.58 4.40 0.03 86.56 9.01 0.17 0.00 0.02 0.00 3.81 0.42 45 P C C 37.30 19.14 11.72 30.16 115.28 -102.33 -65.80 145.43 88.38 11.60 0.02 86.52 1.81 0.11 0.00 0.02 0.00 11.19 0.35 46 K E E 96.79 7.43 22.25 30.42 124.81 -159.14 -120.84 139.10 10.33 89.64 0.03 8.98 1.09 0.07 0.01 0.02 0.00 89.34 0.49 47 L E E 58.00 16.96 17.84 34.20 110.65 -114.59 -75.10 127.21 0.82 99.18 0.00 0.76 0.03 0.00 0.00 0.00 0.00 99.19 0.02 48 M E E 29.33 17.26 21.29 38.59 101.52 175.63 -97.41 -34.77 1.78 98.21 0.00 1.26 0.38 0.01 0.00 0.00 0.00 98.33 0.01 49 I E E 17.26 19.64 21.77 41.30 136.73 5.39 -148.13 143.42 0.38 99.62 0.00 0.32 0.02 0.00 0.00 0.00 0.00 99.65 0.01 50 Y E E 51.52 18.46 21.27 38.70 127.02 -171.42 -131.42 133.13 2.10 97.88 0.03 1.82 0.10 0.01 0.01 0.00 0.00 97.99 0.06 51 E E E 53.27 12.74 22.34 35.24 113.08 -162.47 -109.61 114.82 18.84 80.73 0.43 15.45 2.52 0.68 0.12 0.27 0.00 80.41 0.54 52 V C C 33.66 17.59 15.90 33.19 106.45 167.91 -100.94 8.66 57.19 38.18 4.63 35.84 13.50 9.49 0.94 3.49 0.01 35.22 1.50 53 S C S 64.04 6.32 18.48 25.38 105.27 102.96 -94.39 -22.37 82.50 14.28 3.22 27.04 31.32 25.18 0.41 2.84 0.00 11.70 1.51 54 N C S 113.72 3.26 18.73 22.50 102.53 32.07 -99.41 53.78 91.01 6.68 2.31 31.26 39.62 20.37 0.26 2.38 0.00 4.70 1.41 55 R C C 86.13 15.26 11.84 26.53 118.97 122.25 -98.98 134.69 94.73 5.04 0.22 65.26 29.04 0.93 0.06 0.18 0.00 2.84 1.69 56 P C C 55.14 9.59 14.04 25.04 114.33 -106.06 -66.09 151.15 94.79 2.44 2.77 77.84 6.75 9.60 0.39 2.95 0.00 1.61 0.86 57 S C T 87.94 2.90 15.24 19.53 109.86 -94.14 -68.69 138.45 91.35 3.04 5.61 18.86 19.51 52.59 0.68 5.38 0.00 1.77 1.21 58 G C T 52.55 3.46 16.86 21.07 100.28 25.40 85.35 -4.16 88.05 5.81 6.14 23.25 20.32 44.81 0.77 5.59 0.01 3.69 1.57 59 V C C 33.57 18.24 10.45 27.76 108.82 104.55 -95.19 90.34 81.94 10.50 7.55 62.57 11.82 6.59 2.13 5.89 0.01 6.19 4.80 60 S C C 62.79 7.93 16.30 25.01 109.98 104.63 -77.85 133.18 73.27 8.80 17.92 36.88 12.88 24.17 2.90 14.90 0.02 5.71 2.54 61 N C T 114.67 4.34 18.99 24.03 96.69 12.65 -65.52 5.51 73.04 4.82 22.14 19.79 18.99 35.74 2.60 18.39 0.03 3.17 1.29 62 R C S 78.41 13.97 17.83 31.44 99.00 78.35 -91.85 -11.50 73.00 10.46 16.54 23.92 27.17 23.60 1.92 13.53 0.02 8.56 1.26 63 F E E 16.56 23.67 14.10 37.38 126.83 51.66 -125.30 137.46 20.95 77.13 1.91 15.84 5.11 1.89 0.81 1.09 0.01 72.10 3.16 64 S E E 51.84 7.32 24.23 32.48 134.13 161.51 -138.07 154.33 8.70 91.17 0.13 7.79 0.82 0.14 0.06 0.06 0.00 90.18 0.95 65 G E E 21.88 19.77 14.79 32.99 140.87 173.98 -152.61 162.64 12.52 87.43 0.06 10.98 1.18 0.16 0.01 0.03 0.00 87.43 0.21 66 S E E 60.92 4.74 23.44 29.19 134.46 -159.24 -142.47 153.09 10.84 89.10 0.06 9.11 1.35 0.18 0.01 0.04 0.00 89.08 0.22 67 K E E 89.75 16.90 12.42 28.35 126.23 -155.21 -126.46 138.09 13.03 86.83 0.14 10.11 2.78 0.52 0.03 0.12 0.00 85.68 0.77 68 S E E 72.47 2.99 18.80 22.38 116.66 -174.33 -129.97 113.77 29.90 69.89 0.21 23.96 5.17 1.18 0.05 0.21 0.00 67.47 1.96 69 G C T 50.29 2.66 18.40 21.52 109.91 -48.54 60.95 -128.59 99.14 0.58 0.28 1.03 28.16 70.05 0.01 0.27 0.00 0.42 0.06 70 N C T 65.30 14.27 14.98 29.43 96.60 -17.69 -96.50 8.57 99.35 0.44 0.21 0.94 28.79 69.70 0.01 0.21 0.00 0.32 0.04 71 T E E 43.93 10.54 21.70 33.62 125.28 86.74 -114.16 139.14 14.69 85.29 0.02 11.51 3.08 0.15 0.00 0.02 0.00 83.47 1.77 72 A E E 3.20 24.80 16.83 42.37 126.34 -170.40 -125.57 140.51 3.86 96.13 0.00 3.66 0.10 0.00 0.00 0.00 0.00 96.03 0.20 73 S E E 29.19 10.64 27.45 39.10 125.59 -162.17 -121.76 139.36 5.84 94.16 0.00 5.00 0.24 0.01 0.00 0.00 0.00 94.72 0.03 74 L E E 3.13 26.39 18.32 45.60 123.28 -167.74 -122.07 132.17 1.05 98.95 0.00 0.97 0.02 0.00 0.00 0.00 0.00 99.01 0.01 75 T E E 46.23 9.44 27.48 37.70 120.16 -162.61 -115.39 128.23 0.19 99.81 0.00 0.20 0.00 0.00 0.00 0.00 0.00 99.79 0.01 76 I E E 5.63 25.16 16.53 42.43 117.68 -166.47 -115.12 123.80 1.54 98.46 0.00 1.62 0.01 0.00 0.00 0.00 0.00 98.04 0.32 77 S C C 51.64 6.72 23.50 30.67 128.84 -172.91 -122.01 150.78 81.61 18.30 0.09 43.87 24.58 10.44 0.01 0.11 0.00 20.58 0.41 78 G C S 45.28 3.40 23.90 27.76 94.09 18.19 70.64 26.82 98.93 1.04 0.03 6.26 80.74 11.89 0.00 0.04 0.00 0.99 0.07 79 L C C 13.55 24.55 9.94 33.93 115.92 -169.10 -73.55 139.10 99.31 0.68 0.01 98.63 0.86 0.02 0.00 0.00 0.00 0.28 0.20 80 Q C C 84.38 4.46 24.26 28.49 131.16 -167.69 -121.76 158.97 99.29 0.67 0.04 99.12 0.30 0.01 0.01 0.01 0.00 0.11 0.44 81 A H G 53.16 13.26 15.04 28.38 91.50 -102.95 -58.75 -34.02 3.12 0.02 96.86 0.20 0.21 1.92 0.33 97.32 0.00 0.02 0.00 82 E H G 130.62 2.99 21.43 24.84 89.95 62.47 -69.93 -17.20 2.73 0.04 97.23 0.13 0.18 1.80 0.24 97.63 0.00 0.03 0.00 83 D H G 17.28 20.37 15.30 35.85 93.36 64.45 -83.35 -3.05 3.86 0.05 96.09 0.63 0.41 1.56 0.36 97.00 0.00 0.04 0.00 84 E C C 72.55 14.23 19.91 34.02 114.37 115.60 -71.99 134.95 97.90 1.87 0.23 94.86 3.11 0.11 0.02 0.20 0.00 1.58 0.12 85 A E E 21.18 14.55 21.85 36.40 145.42 119.88 -164.40 174.13 13.12 86.85 0.03 12.27 0.66 0.05 0.01 0.02 0.00 84.64 2.35 86 D E E 57.11 10.56 25.49 36.42 118.08 -76.66 -95.07 134.69 2.97 97.02 0.01 2.66 0.25 0.01 0.00 0.00 0.00 96.91 0.16 87 Y E E 7.25 25.77 18.20 44.33 126.36 -168.59 -119.61 141.20 1.86 98.13 0.01 1.57 0.19 0.02 0.00 0.01 0.00 98.11 0.09 88 Y E E 40.68 15.19 28.05 43.38 128.99 -170.77 -126.94 145.22 3.20 96.76 0.05 2.65 0.34 0.06 0.01 0.03 0.00 96.70 0.21 89 C E E 2.78 26.11 21.87 48.08 126.75 -165.76 -121.05 140.01 7.83 92.00 0.17 6.52 0.91 0.19 0.05 0.10 0.00 91.95 0.29 90 S E E 14.25 17.08 26.84 43.59 133.16 -175.72 -133.33 151.84 7.95 91.73 0.32 6.64 1.01 0.27 0.08 0.16 0.00 91.56 0.27 91 S E E 11.99 20.86 21.21 41.47 130.13 -165.05 -127.85 147.31 8.32 91.23 0.45 6.58 1.43 0.45 0.10 0.26 0.00 90.84 0.33 92 Y E E 68.94 13.28 20.52 33.98 126.54 -163.10 -123.90 140.30 13.90 85.70 0.40 10.81 2.71 0.77 0.08 0.29 0.00 84.51 0.83 93 T E E 53.20 10.98 15.84 27.47 117.97 -176.18 -119.96 127.13 42.09 57.34 0.57 30.92 8.65 3.04 0.09 0.49 0.00 55.83 0.98 94 S C T 79.56 3.65 16.42 20.86 102.09 -59.97 -63.73 -57.71 95.66 3.03 1.31 15.04 36.01 44.80 0.17 1.11 0.00 2.52 0.34 95 S C T 84.26 3.60 15.34 19.59 101.10 -5.28 -101.65 -0.62 96.71 1.72 1.56 13.86 39.12 43.93 0.26 1.24 0.00 1.32 0.27 96 S E E 49.03 8.09 16.56 25.81 130.80 65.33 -126.21 147.82 43.37 56.19 0.45 29.02 12.27 2.92 0.08 0.40 0.00 54.29 1.02 97 L E E 55.28 15.85 16.38 32.06 120.74 -140.89 -108.80 131.96 14.88 85.04 0.08 13.09 1.14 0.19 0.02 0.05 0.00 84.92 0.58 98 L E E 43.95 14.10 21.14 35.54 120.53 -163.14 -114.58 129.77 6.35 93.59 0.06 5.64 0.44 0.10 0.02 0.03 0.00 93.15 0.62 99 F E E 58.80 17.97 19.78 36.68 120.58 -155.49 -105.30 133.92 17.19 82.67 0.13 14.03 2.42 0.64 0.03 0.10 0.00 81.90 0.89 100 G C E 20.42 16.75 20.48 35.72 119.14 -157.73 -83.66 -36.39 61.92 37.83 0.26 36.72 19.69 4.67 0.03 0.27 0.00 37.96 0.66 101 G C C 33.43 10.99 22.93 33.28 103.99 -118.85 -84.92 -1.80 73.89 25.90 0.20 44.67 24.35 3.78 0.02 0.24 0.00 26.27 0.67 102 G C C 16.49 16.81 19.73 35.55 125.76 -133.91 103.86 -170.09 65.49 34.42 0.09 51.47 11.13 0.98 0.01 0.10 0.00 35.71 0.60 103 T E E 24.13 19.58 19.50 38.43 126.59 -89.79 -120.39 141.60 18.12 81.85 0.02 16.27 1.32 0.07 0.00 0.01 0.00 81.81 0.50 104 K E E 99.94 8.84 25.01 34.31 118.57 -139.97 -99.80 129.02 2.89 97.11 0.00 2.53 0.22 0.01 0.00 0.00 0.00 97.11 0.12 105 L E E 9.78 24.72 15.43 40.44 121.99 -166.35 -114.20 132.36 1.96 98.04 0.00 1.83 0.05 0.00 0.00 0.00 0.00 98.08 0.03 106 T E E 57.06 6.93 25.42 32.82 120.43 -159.21 -112.12 132.74 1.27 98.73 0.00 1.18 0.04 0.00 0.00 0.00 0.00 98.73 0.04 107 V E E 27.97 20.20 13.13 32.96 114.61 -147.79 -97.52 123.93 3.56 96.43 0.01 3.45 0.14 0.02 0.00 0.00 0.00 96.07 0.31 108 L E E 84.11 7.00 16.87 24.91 116.60 -162.67 -100.99 136.13 37.45 62.51 0.04 36.52 0.56 0.13 0.01 0.02 0.00 62.10 0.67 109 G C C 47.10 4.48 17.58 22.79 114.73 -19.18 83.34 -22.41 99.61 0.38 0.00 99.19 0.41 0.07 0.00 0.00 0.00 0.31 0.01