A0A087WXL9_HUMAN Loading...

Contactin associated protein family member 3B

AlphaFold DB , UniProt , Accession A0A087WXL9, Species HUMAN (Homo sapiens, Human), Gene CNTNAP3B, Length 745 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.7	Very low	32.4	Very low	246 Å²	246	146.4 Å²	146.4	100%	1.212	83%	0.826	S	S	*	*				0	127.1	0	-72.4	-171.8	-81.9	0	0	107
2	A	31.8	Very low	32.3	Very low	93 Å²	93	147.2 Å²	147.2	77%	0.769	83%	0.826	S	S	*	*			cis	-161.3	152.6	5.4	0	0	0	0	0	109.3
3	S	41.7	Very low	32.3	Very low	110 Å²	110	148.3 Å²	148.3	77%	0.769	83%	0.827	S	S	*	*			trans	19.3	137.8	145.4	-163.2	0	0	0	0	120.5
4	V	33.3	Very low	32.2	Very low	128 Å²	128	149.2 Å²	149.2	78%	0.776	83%	0.828	S	S	*	*				178.2	142.7	102.8	161	0	0	0	0	111.8
5	A	32.9	Very low	31.9	Very low	75 Å²	75	149 Å²	149	62%	0.62	82%	0.824	S	S	*	*			trans	-18.8	160.9	160	0	0	0	0	0	119.3
6	W	28.8	Very low	31.7	Very low	248 Å²	248	147.5 Å²	147.5	94%	0.939	82%	0.823	S	S	*	*			cis	-169.6	163.3	14.3	-124.7	34	0	0	0	110
7	A	32.9	Very low	31.4	Very low	84 Å²	84	146 Å²	146	69%	0.694	82%	0.819	S	S	*	*			trans	69.2	125.7	152.8	0	0	0	0	0	121.3
8	V	30.5	Very low	31.3	Very low	139 Å²	139	148.1 Å²	148.1	84%	0.842	82%	0.821	S	S	*	*				-168.9	123.4	120.6	169.7	0	0	0	0	110.4
9	L	29.6	Very low	31	Very low	154 Å²	154	146.4 Å²	146.4	81%	0.806	82%	0.816	S	S	*	*			trans	25.9	116.5	141.5	-133.8	74.6	0	0	0	120.1
10	K	29.1	Very low	30.9	Very low	208 Å²	208	151.6 Å²	151.6	90%	0.904	82%	0.822	S	S	*	*			trans	-103	115.8	162.8	-87.7	-172.9	175.6	-177.6	0	110.9
11	V	31.3	Very low	30.6	Very low	125 Å²	125	148.8 Å²	148.8	76%	0.758	81%	0.814	S	S	*	*			trans	-84.1	129.9	163.1	171.6	0	0	0	0	108.2	L13	V11-L13 PolarHBondContact O-N 3.03Å
12	L	31.1	Very low	30.5	Very low	156 Å²	156	143 Å²	143	82%	0.817	80%	0.795	S	S	*	*			trans	-66.7	124.4	174.2	-96	90.9	0	0	0	110.9
13	L	32.2	Very low	30.5	Very low	162 Å²	162	145.5 Å²	145.5	85%	0.848	80%	0.8	S	S	*	*			trans	-114.3	113.5	157.8	-99.2	152.4	0	0	0	107.1	V11 L15	V11-L13 PolarHBondContact O-N 3.03Å; L13-L15 PolarHBondContact O-N 3.13Å
14	L	30.7	Very low	29.9	Very low	161 Å²	161	143.1 Å²	143.1	84%	0.843	79%	0.793	S	S	*	*			trans	-75.8	111.3	172.5	-78.7	158	0	0	0	109
15	L	28.6	Very low	30.2	Very low	146 Å²	146	142.5 Å²	142.5	76%	0.764	80%	0.802	S	S	*	*			trans	-109.6	134.7	159.7	-79.5	162.4	0	0	0	107.6	L13 T17	L13-L15 PolarHBondContact O-N 3.13Å; L15-T17 PolarHBondContact O-N 2.96Å
16	P	27.8	Very low	30	Very low	125 Å²	125	142.1 Å²	142.1	81%	0.812	81%	0.805	S	S	*	*			trans	-74.6	109.7	177.6	29.5	-29.4	0	0	0	109	Q18	P16-Q18 PolarHBondContact O-N 3.4Å
17	T	27.1	Very low	30.3	Very low	122 Å²	122	138 Å²	138	75%	0.748	80%	0.801	S	S	*	*			trans	-74.1	109.2	167.1	50.1	0	0	0	0	108.5	L15 T19	L15-T17 PolarHBondContact O-N 2.96Å; T17-T19 PolarHBondContact O-N 3.25Å; T17-T19 VanDerWaalsContact O-N 3.14Å
18	Q	30.1	Very low	30.8	Very low	183 Å²	183	137.1 Å²	137.1	86%	0.855	79%	0.789	S	S	*	*			trans	-60.2	112	159	-90.9	178.5	-14.4	0	0	107.9	P16 W20	P16-Q18 PolarHBondContact O-N 3.4Å; Q18-W20 PolarHBondContact O-N 3.34Å
19	T	25	Very low	31.9	Very low	117 Å²	117	136.9 Å²	136.9	72%	0.718	79%	0.79	S	S	*	*			trans	-73.3	101.9	172.6	47.9	0	0	0	0	108.9	T17 S21	T17-T19 PolarHBondContact O-N 3.25Å; T17-T19 VanDerWaalsContact O-N 3.14Å; T19-S21 PolarHBondContact O-N 3.29Å
20	W	28	Very low	34	Very low	249 Å²	249	135.1 Å²	135.1	94%	0.943	78%	0.781	S	S	*	*			trans	-68.9	108.9	156	-84.6	-9.7	0	0	0	108.1	Q18	Q18-W20 PolarHBondContact O-N 3.34Å
21	S	24.9	Very low	36.9	Very low	93 Å²	93	126.3 Å²	126.3	65%	0.65	75%	0.746	S	S	*	*			trans	-83.3	132.6	168.5	-59.5	0	0	0	0	108.3	T19 V23	T19-S21 PolarHBondContact O-N 3.29Å; S21-V23 PolarHBondContact O-N 2.86Å
22	P	33.3	Very low	39.8	Very low	125 Å²	125	122.3 Å²	122.3	81%	0.812	72%	0.72	S	S	*	*			trans	-71.4	117.8	172.9	30.1	-30.6	0	0	0	108.1	G24	P22-G24 PolarHBondContact O-N 3.46Å; P22-G24 VanDerWaalsContact O-N 3.11Å
23	V	32.3	Very low	42.8	Very low	145 Å²	145	117.8 Å²	117.8	88%	0.879	70%	0.701	S	S	*	*			trans	-65.7	110.4	174.7	175.6	0	0	0	0	108	S21	S21-V23 PolarHBondContact O-N 2.86Å
24	G	28.8	Very low	45.8	Very low	61 Å²	61	113.5 Å²	113.5	63%	0.629	68%	0.683	S	S	*	*			trans	-68.8	149	171.5	0	0	0	0	0	111.6	P22	P22-G24 PolarHBondContact O-N 3.46Å; P22-G24 VanDerWaalsContact O-N 3.11Å
25	A	38.5	Very low	48.9	Very low	115 Å²	115	106.9 Å²	106.9	95%	0.95	65%	0.648	S	S	*	*	S	Bend	trans	-57	132	-178.8	0	0	0	0	0	113.4
26	G	29.7	Very low	52	Low	67 Å²	67	99.9 Å²	99.9	69%	0.691	61%	0.612	S	S	*	*			trans	159.4	119.3	171.8	0	0	0	0	0	108.2
27	N	35.6	Very low	54.9	Low	161 Å²	161	96.5 Å²	96.5	86%	0.861	59%	0.591	S	S	*	*			trans	-51.4	130	168.9	-76.2	-21.1	0	0	0	108.1
28	P	42.6	Very low	57.8	Low	66 Å²	66	95.1 Å²	95.1	43%	0.429	59%	0.592	S	S	.	*			trans	-57.8	147.6	178.7	22.7	-30.9	0	0	0	109.8	D30 C177	P28-D30 PolarHBondContact O-N 2.89Å; P28-C177 HydrophobicContact CG-CB 4.25Å
29	P	54.3	Low	60.8	Low	133 Å²	133	87.8 Å²	87.8	86%	0.864	56%	0.559	S	S	*	*	S	Bend	trans	-68	-10.2	-166.6	-13.4	27.7	0	0	0	114.5
30	D	73	Confident	64.1	Low	117 Å²	117	85.8 Å²	85.8	63%	0.626	55%	0.548	S	S	*	.	S	Bend	trans	-150.7	125.2	164.7	-89.9	-41.3	0	0	0	108.1	P28 D32	P28-D30 PolarHBondContact O-N 2.89Å; D30-D32 PolarHBondContact O-N 2.97Å
31	C	89.2	Confident	67.2	Low	24 Å²	24	81 Å²	81	16%	0.162	53%	0.529	C	S	.	.	S	Bend	trans	-74.8	58.5	177.2	-174.5	0	0	0	0	110.7	T92 G176 C177	C31-T92 HydrophobicContact CB-CG2 4.17Å; C31-T92 WeakPolarHBondContact O-CB 3.35Å; C31-T92 WeakPolarHBondContact O-CG2 3.47Å; C31-T92 PolarHBondContact O-OG1 3.45Å; C31-G176 WeakPolarHBondContact O-CA 3.22Å; C31-C177 HydrophobicContact CB-CB 3.98Å; C31-C177 WeakPolarHBondContact CB-SG 3.15Å; C31-C177 WeakPolarHBondContact SG-CB 3.46Å; C31-C177 PolarHBondContact SG-N 3.3Å; C31-C177 CovalentContact SG-SG 2.04Å; C31-C177 PolarHBondContact SG-SG 3.01Å
32	D	92.5	Very high	70.5	Confident	40 Å²	40	81.8 Å²	81.8	21%	0.214	54%	0.535	C	S	.	.			trans	-134.4	28.2	-171.5	-71	-40.8	0	0	0	113	D30 T92 R145 Y175	D30-D32 PolarHBondContact O-N 2.97Å; D32-T92 WeakPolarHBondContact OD1-CB 3.5Å; D32-T92 PolarHBondContact OD1-OG1 2.8Å; D32-R145 VanDerWaalsContact CG-NH1 3.3Å; D32-R145 IonicContact OD1-CZ 2.62Å; D32-R145 IonicContact OD1-NH1 2.77Å; D32-R145 PolarHBondContact OD1-NH1 3.02Å; D32-R145 IonicContact OD1-NH2 3.12Å; D32-R145 PolarHBondContact OD1-NH2 3.18Å; D32-R145 VanDerWaalsContact OD1-NH2 3.16Å; D32-R145 IonicContact OD2-CZ 3.64Å; D32-R145 IonicContact OD2-NH1 3.36Å; D32-R145 PolarHBondContact OD2-NH1 3.19Å; D32-R145 IonicContact OD2-NH2 3.95Å; D32-R145 PolarHBondContact OD2-NH2 2.97Å; D32-Y175 WeakPolarHBondContact O-CD1 3.32Å
33	S	94.9	Very high	73.5	Confident	62 Å²	62	76.5 Å²	76.5	43%	0.434	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	143.3	179.2	-65.5	0	0	0	0	111.4	L35 Y175 G176	S33-L35 PolarHBondContact O-N 3.07Å; S33-Y175 CarbonylContact O-C 3.35Å; S33-Y175 VanDerWaalsContact O-CA 3.28Å; S33-Y175 WeakPolarHBondContact O-CA 3.46Å; S33-G176 PolarHBondContact N-O 3.38Å; S33-G176 PolarHBondContact O-N 2.82Å
34	P	95.7	Very high	76.6	Confident	72 Å²	72	70.1 Å²	70.1	47%	0.468	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	130.1	174.9	27.8	-33.7	0	0	0	110.7	E173 Y175	P34-E173 HydrophobicContact CB-CG 4.15Å; P34-Y175 HydrophobicContact CB-CD1 4.26Å; P34-Y175 HydrophobicContact CB-CE1 4.11Å
35	L	95.4	Very high	79.8	Confident	21 Å²	21	69.2 Å²	69.2	11%	0.11	45%	0.445	C	S	.	.			trans	-105.2	-38.8	-174.4	-55.4	-177.1	0	0	0	111.9	S33 L39 L85 M89 E173 V174	S33-L35 PolarHBondContact O-N 3.07Å; L35-L39 WeakPolarHBondContact O-CG 3.41Å; L35-L85 HydrophobicContact CB-CD2 4.13Å; L35-L85 HydrophobicContact CD1-CD1 4.18Å; L35-M89 HydrophobicContact CD1-CB 3.98Å; L35-M89 HydrophobicContact CD1-CE 4.25Å; L35-M89 HydrophobicContact CD1-CG 4.22Å; L35-M89 HydrophobicContact CD2-CE 3.77Å; L35-E173 PolarHBondContact N-OE1 2.98Å; L35-V174 WeakPolarHBondContact CB-O 3.46Å; L35-V174 HydrophobicContact CD1-CG1 4.3Å; L35-V174 PolarHBondContact N-O 2.78Å
36	A	92.9	Very high	82.5	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	41%	0.408	C	S	.	.	S	Bend	trans	-74.4	-34.9	-174.2	0	0	0	0	0	113	A38 L39 F44 I83 E173	A36-A38 PolarHBondContact O-N 3.15Å; A36-L39 PolarHBondContact O-N 2.77Å; A36-F44 HydrophobicContact CB-CE1 4.45Å; A36-F44 HydrophobicContact CB-CZ 4.11Å; A36-I83 HydrophobicContact CB-CD1 3.28Å; A36-E173 WeakPolarHBondContact CA-OE1 3.43Å; A36-E173 WeakPolarHBondContact CB-OE1 3.34Å; A36-E173 PolarHBondContact N-OE1 3.02Å
37	S	89.1	Confident	85.6	Confident	54 Å²	54	63.6 Å²	63.6	38%	0.378	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-31.3	-177.4	-80.4	0	0	0	0	114.2	E173	S37-E173 VanDerWaalsContact CB-OE2 3.24Å; S37-E173 WeakPolarHBondContact CB-OE2 3.45Å; S37-E173 PolarHBondContact N-OE1 3.34Å; S37-E173 PolarHBondContact N-OE2 2.76Å; S37-E173 PolarHBondContact OG-OE2 3.34Å
38	A	87.8	Confident	88.4	Confident	92 Å²	92	57.4 Å²	57.4	76%	0.76	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-13.4	-178.5	0	0	0	0	0	113.8	A36	A36-A38 PolarHBondContact O-N 3.15Å
39	L	94.1	Very high	90.9	Very high	30 Å²	30	58.5 Å²	58.5	16%	0.157	36%	0.357	C	S	.	.	S	Bend	trans	-78	149	-172.9	-68	171.4	0	0	0	112.8	L35 A36 F44 R60 I83 L85	L35-L39 WeakPolarHBondContact O-CG 3.41Å; A36-L39 PolarHBondContact O-N 2.77Å; L39-F44 HydrophobicContact CB-CE2 4.11Å; L39-R60 PolarHBondContact O-NE 2.91Å; L39-R60 PolarHBondContact O-NH2 2.74Å; L39-I83 HydrophobicContact CD1-CD1 3.83Å; L39-I83 HydrophobicContact CD1-CG1 3.96Å; L39-L85 HydrophobicContact CD1-CD2 3.88Å
40	P	94.6	Very high	92.9	Very high	75 Å²	75	54.8 Å²	54.8	49%	0.487	33%	0.33	S	S	.	.			trans	-66.5	161.7	174.2	29.6	-35.8	0	0	0	112	S42 S43 F44 R60	P40-S42 PolarHBondContact O-N 2.81Å; P40-S43 WeakPolarHBondContact O-CB 3.25Å; P40-S43 PolarHBondContact O-N 3.31Å; P40-S43 VanDerWaalsContact O-N 3.1Å; P40-F44 WeakPolarHBondContact O-CD2 3.46Å; P40-R60 PolarHBondContact O-NH2 2.99Å
41	R	91.8	Very high	94	Very high	148 Å²	148	51.3 Å²	51.3	56%	0.558	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-60.6	-28.6	178.5	-69.8	-176.3	179.2	-178.3	0.6	113.1	S43 F44	R41-S43 PolarHBondContact O-N 2.75Å; R41-F44 PolarHBondContact O-N 2.78Å; R41-F44 VanDerWaalsContact O-N 3.16Å
42	S	94.3	Very high	94.2	Very high	109 Å²	109	55 Å²	55	76%	0.762	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-65.6	-19.2	176.8	53.1	0	0	0	0	113.9	P40 F44	P40-S42 PolarHBondContact O-N 2.81Å; S42-F44 PolarHBondContact O-N 3.46Å
43	S	96.8	Very high	94.3	Very high	15 Å²	15	55.1 Å²	55.1	11%	0.105	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-73.1	-11.4	174.5	-68.6	0	0	0	0	113.2	P40 R41 I83 D84	P40-S43 WeakPolarHBondContact O-CB 3.25Å; P40-S43 PolarHBondContact O-N 3.31Å; P40-S43 VanDerWaalsContact O-N 3.1Å; R41-S43 PolarHBondContact O-N 2.75Å; S43-I83 CarbonylContact O-C 3.53Å; S43-I83 WeakPolarHBondContact O-CA 3.29Å; S43-D84 VanDerWaalsContact CB-O 3.26Å; S43-D84 WeakPolarHBondContact CB-O 3.4Å; S43-D84 PolarHBondContact O-N 3.21Å; S43-D84 PolarHBondContact OG-O 2.87Å
44	F	96.6	Very high	94.4	Very high	10 Å²	10	53.7 Å²	53.7	4%	0.044	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	130.2	-177.7	-62.9	-100.3	0	0	0	110	A36 L39 P40 R41 S42 P56 S59 R60 Q82 I83 I172	A36-F44 HydrophobicContact CB-CE1 4.45Å; A36-F44 HydrophobicContact CB-CZ 4.11Å; L39-F44 HydrophobicContact CB-CE2 4.11Å; P40-F44 WeakPolarHBondContact O-CD2 3.46Å; R41-F44 PolarHBondContact O-N 2.78Å; R41-F44 VanDerWaalsContact O-N 3.16Å; S42-F44 PolarHBondContact O-N 3.46Å; F44-P56 HydrophobicContact CB-CB 4Å; F44-P56 WeakPolarHBondContact CB-O 3.48Å; F44-S59 WeakPolarHBondContact CD1-OG 3.48Å; F44-R60 HydrophobicContact CE1-CG 4.38Å; F44-R60 HydrophobicContact CE2-CG 4.4Å; F44-R60 VanDerWaalsContact CE2-NH2 3.34Å; F44-R60 HydrophobicContact CZ-CG 3.86Å; F44-Q82 WeakPolarHBondContact CA-O 3.44Å; F44-I83 HydrophobicContact CD1-CB 4.48Å; F44-I83 HydrophobicContact CD1-CD1 4.34Å; F44-I83 HydrophobicContact CD1-CG1 4.27Å; F44-I83 HydrophobicContact CE1-CB 4.48Å; F44-I83 HydrophobicContact CE1-CD1 3.58Å; F44-I83 HydrophobicContact CE1-CG1 3.99Å; F44-I83 HydrophobicContact CZ-CD1 3.68Å; F44-I83 HydrophobicContact CZ-CG1 4.19Å; F44-I172 HydrophobicContact CE1-CD1 4.47Å
45	S	96.2	Very high	94.4	Very high	42 Å²	42	50.5 Å²	50.5	29%	0.294	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	161.4	176.1	63.6	0	0	0	0	110.8	Q82	S45-Q82 PolarHBondContact N-O 3.1Å; S45-Q82 PolarHBondContact O-N 3.03Å
46	S	95.4	Very high	94.4	Very high	24 Å²	24	50.2 Å²	50.2	17%	0.168	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	161	-179.5	53.4	0	0	0	0	112	S48 P56 W70 W80	S46-S48 VanDerWaalsContact C-N 3.32Å; S46-S48 PolarHBondContact O-N 2.84Å; S46-S48 PolarHBondContact OG-O 2.77Å; S46-S48 VanDerWaalsContact OG-O 3.12Å; S46-P56 WeakPolarHBondContact OG-CD 3.25Å; S46-P56 WeakPolarHBondContact OG-CG 3.46Å; S46-W70 PolarHBondContact OG-NE1 3.4Å; S46-W80 WeakPolarHBondContact CA-O 3.34Å; S46-W80 WeakPolarHBondContact CB-O 3.28Å; S46-W80 WeakPolarHBondContact O-CH2 3.1Å
47	S	94.1	Very high	94.5	Very high	40 Å²	40	50.7 Å²	50.7	28%	0.28	32%	0.315	S	S	.	.	S	Bend	trans	-51.5	-45.5	170	44.4	0	0	0	0	114.1	Q79 W80	S47-Q79 WeakPolarHBondContact OG-CA 3.44Å; S47-Q79 PolarHBondContact OG-OE1 2.85Å; S47-W80 PolarHBondContact N-O 3.06Å; S47-W80 PolarHBondContact OG-N 2.62Å; S47-W80 PolarHBondContact OG-O 3.14Å; S47-W80 VanDerWaalsContact OG-O 3.07Å
48	S	94.4	Very high	94.8	Very high	31 Å²	31	49.6 Å²	49.6	22%	0.217	30%	0.304	C	S	.	.			trans	-161	171	177	64.8	0	0	0	0	109.8	S46 W70 P72 L73 Q79	S46-S48 VanDerWaalsContact C-N 3.32Å; S46-S48 PolarHBondContact O-N 2.84Å; S46-S48 PolarHBondContact OG-O 2.77Å; S46-S48 VanDerWaalsContact OG-O 3.12Å; S48-W70 PolarHBondContact O-NE1 3.15Å; S48-P72 WeakPolarHBondContact OG-CB 3.42Å; S48-L73 PolarHBondContact OG-N 2.89Å; S48-Q79 PolarHBondContact OG-OE1 2.81Å
49	E	96.1	Very high	95.1	Very high	89 Å²	89	45.2 Å²	45.2	42%	0.416	27%	0.268	S	S	.	.			trans	-135.5	141	172.5	60.1	-179.1	-148.1	0	0	110.3	G55	E49-G55 WeakPolarHBondContact OE2-CA 3.4Å
50	L	96.1	Very high	95.2	Very high	55 Å²	55	45 Å²	45	29%	0.288	27%	0.265	S	S	.	.	S	Bend	trans	-68.7	-38.4	-179.9	177.4	60.6	0	0	0	112.5	H54 T71 L73	L50-H54 HydrophobicContact CB-CB 4.09Å; L50-T71 HydrophobicContact CB-CG2 4.14Å; L50-T71 HydrophobicContact CD2-CG2 3.96Å; L50-T71 PolarHBondContact N-O 3.45Å; L50-L73 HydrophobicContact CD1-CD1 4.33Å
51	S	95.8	Very high	95.2	Very high	44 Å²	44	42 Å²	42	31%	0.308	25%	0.245	S	C	.	.	S	Bend	trans	-158.6	172.8	172.6	74.5	0	0	0	0	109.2	S53 H54 G55	S51-S53 PolarHBondContact O-N 3.32Å; S51-S53 PolarHBondContact OG-N 2.75Å; S51-S53 PolarHBondContact OG-OG 3.48Å; S51-H54 PolarHBondContact O-N 2.9Å; S51-H54 PolarHBondContact OG-ND1 3.31Å; S51-G55 PolarHBondContact O-N 3.04Å
52	S	94.4	Very high	95.3	Very high	102 Å²	102	39.8 Å²	39.8	71%	0.713	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-18.8	177.6	58.3	0	0	0	0	114.3	F58	S52-F58 WeakPolarHBondContact O-CE2 3.34Å
53	S	95	Very high	95.1	Very high	43 Å²	43	40.6 Å²	40.6	30%	0.301	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-7.5	175	60.1	0	0	0	0	114.4	S51 F58 A67	S51-S53 PolarHBondContact O-N 3.32Å; S51-S53 PolarHBondContact OG-N 2.75Å; S51-S53 PolarHBondContact OG-OG 3.48Å; S53-F58 WeakPolarHBondContact O-CD2 3.26Å; S53-A67 PolarHBondContact O-N 2.96Å
54	H	95.9	Very high	94.9	Very high	32 Å²	32	47.4 Å²	47.4	15%	0.148	25%	0.254	C	S	.	.	S	Bend	trans	-108.8	13.1	176.2	-61.3	83.5	0	0	0	112.3	L50 S51 A67 W70 T71	L50-H54 HydrophobicContact CB-CB 4.09Å; S51-H54 PolarHBondContact O-N 2.9Å; S51-H54 PolarHBondContact OG-ND1 3.31Å; H54-A67 WeakPolarHBondContact CE1-CB 3.45Å; H54-A67 WeakPolarHBondContact NE2-CB 3.41Å; H54-W70 WeakPolarHBondContact O-CA 3.44Å; H54-T71 PolarHBondContact O-N 3.34Å; H54-T71 VanDerWaalsContact O-N 3.17Å
55	G	95.8	Very high	94.5	Very high	4 Å²	4	50.4 Å²	50.4	4%	0.041	27%	0.27	C	S	.	.	S	Bend	trans	-63.3	161.3	-178.5	0	0	0	0	0	113.2	E49 S51 G57 F58	E49-G55 WeakPolarHBondContact OE2-CA 3.4Å; S51-G55 PolarHBondContact O-N 3.04Å; G55-G57 PolarHBondContact O-N 3.07Å; G55-G57 VanDerWaalsContact O-N 3.1Å; G55-F58 PolarHBondContact O-N 2.94Å
56	P	95.9	Very high	94.2	Very high	15 Å²	15	50.5 Å²	50.5	10%	0.097	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-60.8	-26.4	-175.6	25.9	-35.2	0	0	0	112.7	F44 S46 F58 S59 L81	F44-P56 HydrophobicContact CB-CB 4Å; F44-P56 WeakPolarHBondContact CB-O 3.48Å; S46-P56 WeakPolarHBondContact OG-CD 3.25Å; S46-P56 WeakPolarHBondContact OG-CG 3.46Å; P56-F58 PolarHBondContact O-N 2.98Å; P56-F58 VanDerWaalsContact O-N 3.14Å; P56-S59 VanDerWaalsContact O-CB 3.25Å; P56-S59 WeakPolarHBondContact O-CB 3.49Å; P56-S59 PolarHBondContact O-N 3.11Å; P56-S59 PolarHBondContact O-OG 3.17Å; P56-L81 HydrophobicContact CB-CD1 3.68Å
57	G	94.4	Very high	94	Very high	10 Å²	10	51.2 Å²	51.2	10%	0.103	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-64.2	-12.6	175.5	0	0	0	0	0	115.3	G55 R60	G55-G57 PolarHBondContact O-N 3.07Å; G55-G57 VanDerWaalsContact O-N 3.1Å; G57-R60 PolarHBondContact O-NH1 2.84Å
58	F	94.8	Very high	93.9	Very high	31 Å²	31	49.4 Å²	49.4	14%	0.136	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-95.1	0.8	174.1	-61.3	-73.3	0	0	0	113.3	S52 S53 G55 P56 R60 D65	S52-F58 WeakPolarHBondContact O-CE2 3.34Å; S53-F58 WeakPolarHBondContact O-CD2 3.26Å; G55-F58 PolarHBondContact O-N 2.94Å; P56-F58 PolarHBondContact O-N 2.98Å; P56-F58 VanDerWaalsContact O-N 3.14Å; F58-R60 PolarHBondContact O-N 2.98Å; F58-R60 VanDerWaalsContact O-N 3.13Å; F58-D65 HydrophobicContact CD1-CB 3.8Å; F58-D65 HydrophobicContact CE1-CB 4.12Å
59	S	95.5	Very high	93.9	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.263	C	S	.	.			trans	-79.2	17.9	-177.9	68.5	0	0	0	0	114.7	F44 P56 R171 I172	F44-S59 WeakPolarHBondContact CD1-OG 3.48Å; P56-S59 VanDerWaalsContact O-CB 3.25Å; P56-S59 WeakPolarHBondContact O-CB 3.49Å; P56-S59 PolarHBondContact O-N 3.11Å; P56-S59 PolarHBondContact O-OG 3.17Å; S59-R171 CarbonylContact O-C 3.57Å; S59-R171 WeakPolarHBondContact O-CA 2.96Å; S59-I172 WeakPolarHBondContact O-CG1 3.25Å; S59-I172 PolarHBondContact O-N 3.3Å
60	R	95.2	Very high	94	Very high	25 Å²	25	43.7 Å²	43.7	9%	0.094	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-77.1	138.4	177.2	-71.2	-177.6	-166.6	73.4	5.5	110.7	L39 P40 F44 G57 F58 R63	L39-R60 PolarHBondContact O-NE 2.91Å; L39-R60 PolarHBondContact O-NH2 2.74Å; P40-R60 PolarHBondContact O-NH2 2.99Å; F44-R60 HydrophobicContact CE1-CG 4.38Å; F44-R60 HydrophobicContact CE2-CG 4.4Å; F44-R60 VanDerWaalsContact CE2-NH2 3.34Å; F44-R60 HydrophobicContact CZ-CG 3.86Å; G57-R60 PolarHBondContact O-NH1 2.84Å; F58-R60 PolarHBondContact O-N 2.98Å; F58-R60 VanDerWaalsContact O-N 3.13Å; R60-R63 HydrophobicContact CB-CB 4.38Å; R60-R63 HydrophobicContact CB-CG 3.72Å; R60-R63 WeakPolarHBondContact O-CB 3.39Å; R60-R63 PolarHBondContact O-N 2.9Å
61	L	94.9	Very high	94.1	Very high	12 Å²	12	41.3 Å²	41.3	6%	0.063	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	142.2	177.1	-162	76.7	0	0	0	112	R63 A95 Q97 V141 I172 E173	L61-R63 PolarHBondContact O-N 2.95Å; L61-A95 HydrophobicContact CD1-CB 4.43Å; L61-A95 HydrophobicContact CD2-CB 4.19Å; L61-Q97 HydrophobicContact CD1-CB 3.58Å; L61-V141 HydrophobicContact CD1-CG1 4.09Å; L61-V141 HydrophobicContact CD1-CG2 4.07Å; L61-V141 HydrophobicContact CD2-CG1 4Å; L61-V141 HydrophobicContact CD2-CG2 4.26Å; L61-V141 HydrophobicContact CG-CG2 4.28Å; L61-I172 PolarHBondContact N-O 3.11Å; L61-E173 HydrophobicContact CB-CB 3.79Å; L61-E173 HydrophobicContact CD2-CB 3.76Å; L61-E173 HydrophobicContact CD2-CG 4.49Å; L61-E173 HydrophobicContact CG-CB 4.29Å
62	N	94	Very high	94.1	Very high	102 Å²	102	39.2 Å²	39.2	55%	0.545	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.9	-2.4	179	-62.7	-42.4	0	0	0	116.4	Q97	N62-Q97 PolarHBondContact OD1-NE2 3.4Å; N62-Q97 VanDerWaalsContact OD1-NE2 3.12Å
63	R	90.4	Very high	94.2	Very high	127 Å²	127	39.3 Å²	39.3	48%	0.479	21%	0.208	S	C	.	.			trans	-74.5	144.5	173.7	-66.1	-64.4	-174.7	142.8	-7	110.4	R60 L61 D65 R171	R60-R63 HydrophobicContact CB-CB 4.38Å; R60-R63 HydrophobicContact CB-CG 3.72Å; R60-R63 WeakPolarHBondContact O-CB 3.39Å; R60-R63 PolarHBondContact O-N 2.9Å; L61-R63 PolarHBondContact O-N 2.95Å; R63-D65 IonicContact NH1-OD2 3.76Å; R63-R171 VanDerWaalsContact O-CD 3.25Å; R63-R171 WeakPolarHBondContact O-CD 3.13Å; R63-R171 PolarHBondContact O-NH1 3.45Å
64	R	92.4	Very high	94.1	Very high	158 Å²	158	41 Å²	41	60%	0.596	22%	0.216	S	C	*	.			trans	-115.6	12.8	176.5	-58.6	-179.7	179.8	-167.6	3.1	111.6	Y100	R64-Y100 HydrophobicContact CB-CD1 3.79Å; R64-Y100 HydrophobicContact CB-CE1 4.04Å; R64-Y100 HydrophobicContact CB-CG 4.24Å; R64-Y100 HydrophobicContact CG-CD1 3.76Å; R64-Y100 HydrophobicContact CG-CD2 4.01Å; R64-Y100 HydrophobicContact CG-CE1 3.91Å; R64-Y100 HydrophobicContact CG-CE2 4.16Å; R64-Y100 HydrophobicContact CG-CG 3.81Å; R64-Y100 PolarHBondContact NH1-OH 3.24Å
65	D	88.8	Confident	94.1	Very high	72 Å²	72	41.2 Å²	41.2	39%	0.385	22%	0.221	S	C	.	.			trans	-70.6	156.9	-178.6	-56.1	-36.9	0	0	0	110.5	F58 R63 G68	F58-D65 HydrophobicContact CD1-CB 3.8Å; F58-D65 HydrophobicContact CE1-CB 4.12Å; R63-D65 IonicContact NH1-OD2 3.76Å; D65-G68 PolarHBondContact O-N 3.25Å
66	G	89.6	Confident	93.9	Very high	45 Å²	45	43.4 Å²	43.4	46%	0.464	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.7	-138.2	-179.3	0	0	0	0	0	111.8	G68	G66-G68 VanDerWaalsContact C-N 3.27Å
67	A	91.2	Very high	93.6	Very high	38 Å²	38	47.7 Å²	47.7	31%	0.314	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	20.7	173.9	0	0	0	0	0	113	S53 H54	S53-A67 PolarHBondContact O-N 2.96Å; H54-A67 WeakPolarHBondContact CE1-CB 3.45Å; H54-A67 WeakPolarHBondContact NE2-CB 3.41Å
68	G	91.3	Very high	93.4	Very high	2 Å²	2	51 Å²	51	2%	0.021	26%	0.26	C	S	.	.	S	Bend	trans	94.8	0.6	172.4	0	0	0	0	0	116.2	D65 G66 G99 Y100 R171	D65-G68 PolarHBondContact O-N 3.25Å; G66-G68 VanDerWaalsContact C-N 3.27Å; G68-G99 WeakPolarHBondContact O-CA 3.35Å; G68-Y100 PolarHBondContact O-N 2.98Å; G68-R171 VanDerWaalsContact O-CD 3.25Å; G68-R171 WeakPolarHBondContact O-CD 3.32Å; G68-R171 PolarHBondContact O-NE 3.26Å
69	G	95.1	Very high	93.4	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.01	26%	0.257	C	S	.	.	S	Bend	trans	163.2	-174.2	176.4	0	0	0	0	0	112.8
70	W	97.3	Very high	93.4	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-82	134.7	169.4	168	71.1	0	0	0	111.1	S46 S48 H54 P72 Q79 W80 L81 P159 I168 G169 M170	S46-W70 PolarHBondContact OG-NE1 3.4Å; S48-W70 PolarHBondContact O-NE1 3.15Å; H54-W70 WeakPolarHBondContact O-CA 3.44Å; W70-P72 HydrophobicContact CH2-CB 4.35Å; W70-P72 HydrophobicContact CH2-CG 4.18Å; W70-P72 HydrophobicContact CZ2-CB 3.8Å; W70-P72 HydrophobicContact CZ2-CG 4.08Å; W70-Q79 HydrophobicContact CH2-CB 4.09Å; W70-W80 WeakPolarHBondContact CH2-O 3.36Å; W70-W80 VanDerWaalsContact CZ2-O 3.28Å; W70-W80 WeakPolarHBondContact CZ2-O 3.44Å; W70-L81 HydrophobicContact CB-CD1 4.21Å; W70-L81 HydrophobicContact CB-CD2 4.47Å; W70-L81 HydrophobicContact CD2-CB 4.08Å; W70-L81 HydrophobicContact CD2-CD1 4.05Å; W70-L81 HydrophobicContact CD2-CD2 4.46Å; W70-L81 HydrophobicContact CD2-CG 4.43Å; W70-L81 HydrophobicContact CE3-CB 3.69Å; W70-L81 HydrophobicContact CE3-CD1 4.37Å; W70-L81 HydrophobicContact CE3-CD2 4.05Å; W70-L81 HydrophobicContact CE3-CG 4.25Å; W70-L81 HydrophobicContact CG-CD1 3.97Å; W70-L81 HydrophobicContact CH2-CB 4.12Å; W70-L81 HydrophobicContact CZ3-CB 3.7Å; W70-P159 HydrophobicContact CH2-CG 4.48Å; W70-P159 HydrophobicContact CZ3-CG 4.21Å; W70-I168 HydrophobicContact CE3-CG2 4.36Å; W70-I168 HydrophobicContact CH2-CG2 4.13Å; W70-I168 HydrophobicContact CZ3-CG2 3.69Å; W70-G169 WeakPolarHBondContact O-CA 3.3Å; W70-M170 HydrophobicContact CE3-CB 4.1Å; W70-M170 HydrophobicContact CE3-CG 4.22Å; W70-M170 HydrophobicContact CE3-SD 4.41Å; W70-M170 HydrophobicContact CZ3-CG 4.28Å; W70-M170 HydrophobicContact CZ3-SD 4.04Å; W70-M170 PolarHBondContact N-O 2.84Å; W70-M170 PolarHBondContact O-N 3.2Å
71	T	97.6	Very high	93.6	Very high	4 Å²	4	51 Å²	51	3%	0.025	26%	0.259	C	S	.	.			trans	-139.1	126.1	172	-66	0	0	0	0	109.6	L50 H54 R167 I168	L50-T71 HydrophobicContact CB-CG2 4.14Å; L50-T71 HydrophobicContact CD2-CG2 3.96Å; L50-T71 PolarHBondContact N-O 3.45Å; H54-T71 PolarHBondContact O-N 3.34Å; H54-T71 VanDerWaalsContact O-N 3.17Å; T71-R167 HydrophobicContact CG2-CB 4.28Å; T71-I168 WeakPolarHBondContact CA-O 3.45Å; T71-I168 WeakPolarHBondContact CB-O 3.34Å; T71-I168 VanDerWaalsContact CG2-O 3.29Å; T71-I168 WeakPolarHBondContact CG2-O 3.5Å; T71-I168 PolarHBondContact OG1-O 3.06Å; T71-I168 VanDerWaalsContact OG1-O 3.11Å
72	P	96.9	Very high	93.6	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.261	C	S	.	.			trans	-70.9	161	177.7	28.8	-33.2	0	0	0	112.1	S48 W70 V74 Q79 I168	S48-P72 WeakPolarHBondContact OG-CB 3.42Å; W70-P72 HydrophobicContact CH2-CB 4.35Å; W70-P72 HydrophobicContact CH2-CG 4.18Å; W70-P72 HydrophobicContact CZ2-CB 3.8Å; W70-P72 HydrophobicContact CZ2-CG 4.08Å; P72-V74 VanDerWaalsContact C-N 3.29Å; P72-V74 PolarHBondContact O-N 3.13Å; P72-Q79 HydrophobicContact CB-CB 4.18Å; P72-Q79 HydrophobicContact CB-CG 3.74Å; P72-Q79 HydrophobicContact CG-CB 4.09Å; P72-Q79 HydrophobicContact CG-CG 3.75Å; P72-I168 WeakPolarHBondContact CD-O 3.29Å; P72-I168 HydrophobicContact CG-CB 3.77Å; P72-I168 HydrophobicContact CG-CD1 4.1Å; P72-I168 HydrophobicContact CG-CG1 4.49Å; P72-I168 HydrophobicContact CG-CG2 3.91Å
73	L	95.8	Very high	93.8	Very high	104 Å²	104	46.5 Å²	46.5	55%	0.545	24%	0.235	S	C	.	.	S	Bend	trans	-60.1	-40.9	176.1	-178.2	63.3	0	0	0	111.8	S48 L50	S48-L73 PolarHBondContact OG-N 2.89Å; L50-L73 HydrophobicContact CD1-CD1 4.33Å
74	V	94.3	Very high	94.1	Very high	79 Å²	79	42.1 Å²	42.1	48%	0.479	22%	0.22	S	C	.	.	S	Bend	trans	-126	131.9	177.7	-177.6	0	0	0	0	109	P72 N76 Q79	P72-V74 VanDerWaalsContact C-N 3.29Å; P72-V74 PolarHBondContact O-N 3.13Å; V74-N76 HydrophobicContact CG1-CB 4.5Å; V74-N76 PolarHBondContact O-N 2.89Å; V74-Q79 WeakPolarHBondContact O-CG 3.2Å; V74-Q79 PolarHBondContact O-NE2 3.12Å
75	S	95	Very high	94.3	Very high	36 Å²	36	35.2 Å²	35.2	25%	0.252	20%	0.195	S	C	.	.			trans	-87.1	97.4	174.4	-66.3	0	0	0	0	110.5	W162 R167 I168	S75-W162 WeakPolarHBondContact O-CZ2 3.34Å; S75-R167 WeakPolarHBondContact OG-CB 3.12Å; S75-I168 PolarHBondContact OG-N 2.77Å; S75-I168 VanDerWaalsContact OG-N 3.11Å
76	N	92.6	Very high	94.6	Very high	51 Å²	51	33.7 Å²	33.7	27%	0.273	20%	0.197	S	C	.	.	S	Bend	trans	-142.3	175	174.2	67.8	34.9	0	0	0	110.6	V74 Y78 Q79	V74-N76 HydrophobicContact CG1-CB 4.5Å; V74-N76 PolarHBondContact O-N 2.89Å; N76-Y78 PolarHBondContact O-N 3.31Å; N76-Y78 VanDerWaalsContact O-N 3.15Å; N76-Y78 WeakPolarHBondContact OD1-CB 3.26Å; N76-Y78 PolarHBondContact OD1-N 2.69Å; N76-Q79 WeakPolarHBondContact O-CG 3.47Å; N76-Q79 PolarHBondContact O-N 2.72Å; N76-Q79 PolarHBondContact OD1-NE2 2.96Å
77	K	89.2	Confident	94.7	Very high	104 Å²	104	37.4 Å²	37.4	45%	0.452	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-2.3	-177.4	68.5	178.9	-179	-178.8	0	115.8	D539	K77-D539 IonicContact NZ-OD1 2.64Å; K77-D539 PolarHBondContact NZ-OD1 2.98Å
78	Y	90.6	Very high	94.7	Very high	81 Å²	81	37.3 Å²	37.3	32%	0.318	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-2	-179.9	-55.2	-62.8	0	0	0	112.7	N76 F537 D539	N76-Y78 PolarHBondContact O-N 3.31Å; N76-Y78 VanDerWaalsContact O-N 3.15Å; N76-Y78 WeakPolarHBondContact OD1-CB 3.26Å; N76-Y78 PolarHBondContact OD1-N 2.69Å; Y78-F537 AromaticContact CD1-CE2 3.84Å; Y78-F537 HydrophobicContact CD1-CE2 3.84Å; Y78-F537 HydrophobicContact CD1-CZ 4.21Å; Y78-F537 HydrophobicContact CE1-CD2 4.45Å; Y78-F537 AromaticContact CE1-CE2 3.56Å; Y78-F537 HydrophobicContact CE1-CE2 3.56Å; Y78-F537 HydrophobicContact CE1-CZ 4.33Å; Y78-F537 HydrophobicContact CG-CE2 4.42Å; Y78-F537 HydrophobicContact CG-CZ 4.42Å; Y78-F537 AromaticContact CZ-CE2 3.91Å; Y78-D539 PolarHBondContact OH-N 3.13Å
79	Q	94.9	Very high	94.9	Very high	16 Å²	16	38.1 Å²	38.1	8%	0.075	20%	0.197	C	C	.	.			trans	-74	149.8	178.6	-54	-51.3	-58.3	0	0	110.6	S47 S48 W70 P72 V74 N76 P159 I168	S47-Q79 WeakPolarHBondContact OG-CA 3.44Å; S47-Q79 PolarHBondContact OG-OE1 2.85Å; S48-Q79 PolarHBondContact OG-OE1 2.81Å; W70-Q79 HydrophobicContact CH2-CB 4.09Å; P72-Q79 HydrophobicContact CB-CB 4.18Å; P72-Q79 HydrophobicContact CB-CG 3.74Å; P72-Q79 HydrophobicContact CG-CB 4.09Å; P72-Q79 HydrophobicContact CG-CG 3.75Å; V74-Q79 WeakPolarHBondContact O-CG 3.2Å; V74-Q79 PolarHBondContact O-NE2 3.12Å; N76-Q79 WeakPolarHBondContact O-CG 3.47Å; N76-Q79 PolarHBondContact O-N 2.72Å; N76-Q79 PolarHBondContact OD1-NE2 2.96Å; Q79-P159 VanDerWaalsContact O-CD 3.28Å; Q79-P159 WeakPolarHBondContact O-CD 3.16Å; Q79-I168 HydrophobicContact CB-CD1 4.01Å; Q79-I168 HydrophobicContact CG-CD1 4Å
80	W	95.6	Very high	94.9	Very high	39 Å²	39	40.6 Å²	40.6	15%	0.148	21%	0.209	C	C	.	.			trans	-150.2	149.8	176.1	55.9	-97.1	0	0	0	111	S46 S47 W70 Q82 R156 F157 L158	S46-W80 WeakPolarHBondContact CA-O 3.34Å; S46-W80 WeakPolarHBondContact CB-O 3.28Å; S46-W80 WeakPolarHBondContact O-CH2 3.1Å; S47-W80 PolarHBondContact N-O 3.06Å; S47-W80 PolarHBondContact OG-N 2.62Å; S47-W80 PolarHBondContact OG-O 3.14Å; S47-W80 VanDerWaalsContact OG-O 3.07Å; W70-W80 WeakPolarHBondContact CH2-O 3.36Å; W70-W80 VanDerWaalsContact CZ2-O 3.28Å; W70-W80 WeakPolarHBondContact CZ2-O 3.44Å; W80-Q82 HydrophobicContact CE3-CB 3.7Å; W80-Q82 HydrophobicContact CZ3-CB 3.58Å; W80-R156 HydrophobicContact CB-CG 3.75Å; W80-R156 HydrophobicContact CD2-CG 4.42Å; W80-R156 HydrophobicContact CE3-CG 4.25Å; W80-R156 HydrophobicContact CG-CG 4.26Å; W80-F157 VanDerWaalsContact CA-O 3.3Å; W80-F157 WeakPolarHBondContact CA-O 3.49Å; W80-L158 HydrophobicContact CB-CD1 4.44Å; W80-L158 HydrophobicContact CB-CG 4.19Å
81	L	97.4	Very high	94.9	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	133.4	169.5	174.7	65.2	0	0	0	108.3	P56 W70 R156 F157 M170 I172	P56-L81 HydrophobicContact CB-CD1 3.68Å; W70-L81 HydrophobicContact CB-CD1 4.21Å; W70-L81 HydrophobicContact CB-CD2 4.47Å; W70-L81 HydrophobicContact CD2-CB 4.08Å; W70-L81 HydrophobicContact CD2-CD1 4.05Å; W70-L81 HydrophobicContact CD2-CD2 4.46Å; W70-L81 HydrophobicContact CD2-CG 4.43Å; W70-L81 HydrophobicContact CE3-CB 3.69Å; W70-L81 HydrophobicContact CE3-CD1 4.37Å; W70-L81 HydrophobicContact CE3-CD2 4.05Å; W70-L81 HydrophobicContact CE3-CG 4.25Å; W70-L81 HydrophobicContact CG-CD1 3.97Å; W70-L81 HydrophobicContact CH2-CB 4.12Å; W70-L81 HydrophobicContact CZ3-CB 3.7Å; L81-R156 CarbonylContact O-C 3.49Å; L81-R156 WeakPolarHBondContact O-CA 3.35Å; L81-F157 PolarHBondContact N-O 2.89Å; L81-F157 PolarHBondContact O-N 2.89Å; L81-M170 HydrophobicContact CD2-CB 4.15Å; L81-I172 HydrophobicContact CD2-CD1 3.87Å; L81-I172 HydrophobicContact CD2-CG1 4.11Å; L81-I172 HydrophobicContact CD2-CG2 4Å; L81-I172 HydrophobicContact CG-CD1 4.27Å
82	Q	96.5	Very high	94.8	Very high	20 Å²	20	40.8 Å²	40.8	9%	0.093	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	148.3	-172.8	176.7	178.6	-50.2	0	0	111.1	F44 S45 W80 W120 L155 R156	F44-Q82 WeakPolarHBondContact CA-O 3.44Å; S45-Q82 PolarHBondContact N-O 3.1Å; S45-Q82 PolarHBondContact O-N 3.03Å; W80-Q82 HydrophobicContact CE3-CB 3.7Å; W80-Q82 HydrophobicContact CZ3-CB 3.58Å; Q82-W120 HydrophobicContact CG-CH2 3.89Å; Q82-W120 HydrophobicContact CG-CZ2 4.43Å; Q82-L155 CarbonylContact C-O 3.43Å; Q82-L155 VanDerWaalsContact CA-O 3.28Å; Q82-L155 WeakPolarHBondContact CA-O 3.37Å; Q82-L155 WeakPolarHBondContact CG-O 3.45Å; Q82-R156 HydrophobicContact CB-CB 4.39Å; Q82-R156 HydrophobicContact CB-CG 4.31Å; Q82-R156 VanDerWaalsContact OE1-NE 3.14Å
83	I	97.4	Very high	94.8	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	135.1	174	-168.9	172.2	0	0	0	110.6	A36 L39 S43 F44 L85 F154 L155 V174	A36-I83 HydrophobicContact CB-CD1 3.28Å; L39-I83 HydrophobicContact CD1-CD1 3.83Å; L39-I83 HydrophobicContact CD1-CG1 3.96Å; S43-I83 CarbonylContact O-C 3.53Å; S43-I83 WeakPolarHBondContact O-CA 3.29Å; F44-I83 HydrophobicContact CD1-CB 4.48Å; F44-I83 HydrophobicContact CD1-CD1 4.34Å; F44-I83 HydrophobicContact CD1-CG1 4.27Å; F44-I83 HydrophobicContact CE1-CB 4.48Å; F44-I83 HydrophobicContact CE1-CD1 3.58Å; F44-I83 HydrophobicContact CE1-CG1 3.99Å; F44-I83 HydrophobicContact CZ-CD1 3.68Å; F44-I83 HydrophobicContact CZ-CG1 4.19Å; I83-L85 HydrophobicContact CD1-CD2 4.09Å; I83-L85 HydrophobicContact CG1-CD2 4.26Å; I83-F154 WeakPolarHBondContact O-CA 3.1Å; I83-L155 HydrophobicContact CG2-CB 3.75Å; I83-L155 HydrophobicContact CG2-CD1 4.45Å; I83-L155 PolarHBondContact N-O 3.08Å; I83-L155 PolarHBondContact O-N 2.95Å; I83-V174 HydrophobicContact CG2-CG2 4.25Å
84	D	97.5	Very high	94.9	Very high	34 Å²	34	35.9 Å²	35.9	18%	0.182	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	111.8	167.9	-177.7	2.1	0	0	0	109	S43 G86 R153 F154	S43-D84 VanDerWaalsContact CB-O 3.26Å; S43-D84 WeakPolarHBondContact CB-O 3.4Å; S43-D84 PolarHBondContact O-N 3.21Å; S43-D84 PolarHBondContact OG-O 2.87Å; D84-G86 PolarHBondContact O-N 2.87Å; D84-G86 WeakPolarHBondContact OD1-CA 3.25Å; D84-G86 PolarHBondContact OD1-N 3.41Å; D84-R153 VanDerWaalsContact OD1-CG 3.31Å; D84-R153 WeakPolarHBondContact OD1-CG 3.46Å; D84-R153 IonicContact OD1-CZ 2.67Å; D84-R153 IonicContact OD1-NE 2.82Å; D84-R153 PolarHBondContact OD1-NE 3.26Å; D84-R153 IonicContact OD1-NH2 3.64Å; D84-R153 PolarHBondContact OD1-NH2 2.96Å; D84-R153 IonicContact OD2-CZ 3.16Å; D84-R153 IonicContact OD2-NE 3.58Å; D84-R153 IonicContact OD2-NH2 3.36Å; D84-R153 PolarHBondContact OD2-NH2 3.26Å; D84-F154 HydrophobicContact CB-CD1 3.71Å; D84-F154 HydrophobicContact CB-CE1 3.5Å; D84-F154 HydrophobicContact CB-CZ 4.43Å; D84-F154 WeakPolarHBondContact OD2-CE1 3.16Å
85	L	96.6	Very high	95	Very high	13 Å²	13	32.1 Å²	32.1	7%	0.068	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	-5.4	178.7	-57.6	179.4	0	0	0	112.9	L35 L39 I83 E87 M89 V91 R153 L155	L35-L85 HydrophobicContact CB-CD2 4.13Å; L35-L85 HydrophobicContact CD1-CD1 4.18Å; L39-L85 HydrophobicContact CD1-CD2 3.88Å; I83-L85 HydrophobicContact CD1-CD2 4.09Å; I83-L85 HydrophobicContact CG1-CD2 4.26Å; L85-E87 VanDerWaalsContact C-N 3.25Å; L85-E87 PolarHBondContact O-N 3.46Å; L85-M89 HydrophobicContact CB-CG 3.83Å; L85-M89 HydrophobicContact CD1-CB 3.79Å; L85-M89 HydrophobicContact CD1-CG 3.74Å; L85-M89 HydrophobicContact CG-CG 4.41Å; L85-V91 HydrophobicContact CD1-CG2 4.12Å; L85-R153 VanDerWaalsContact CB-O 3.31Å; L85-R153 WeakPolarHBondContact CB-O 3.49Å; L85-R153 WeakPolarHBondContact CG-O 3.34Å; L85-R153 PolarHBondContact N-O 2.8Å; L85-L155 HydrophobicContact CD1-CD1 3.58Å; L85-L155 HydrophobicContact CG-CD1 4.04Å
86	G	93.9	Very high	95.1	Very high	41 Å²	41	30.4 Å²	30.4	42%	0.423	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	88.1	-49.6	179.4	0	0	0	0	0	112.7	D84 R153	D84-G86 PolarHBondContact O-N 2.87Å; D84-G86 WeakPolarHBondContact OD1-CA 3.25Å; D84-G86 PolarHBondContact OD1-N 3.41Å; G86-R153 VanDerWaalsContact O-CZ 3.25Å; G86-R153 PolarHBondContact O-NE 3.43Å
87	E	91.9	Very high	95.4	Very high	122 Å²	122	28.3 Å²	28.3	57%	0.57	14%	0.138	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-127.2	175.3	174.1	68.6	-170.3	147.4	0	0	111.5	L85 M89 R153	L85-E87 VanDerWaalsContact C-N 3.25Å; L85-E87 PolarHBondContact O-N 3.46Å; E87-M89 HydrophobicContact CG-SD 3.52Å; E87-M89 VanDerWaalsContact CG-SD 3.52Å; E87-M89 PolarHBondContact O-N 2.93Å; E87-R153 WeakPolarHBondContact O-CA 3.49Å
88	R	92.1	Very high	95.7	Very high	36 Å²	36	23.4 Å²	23.4	14%	0.136	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	119.4	179.1	-165	170.7	175.2	-143.3	-9.1	108.5	D115 E151 Y179 E334	R88-D115 IonicContact NE-OD1 3.24Å; R88-D115 PolarHBondContact NE-OD1 2.75Å; R88-D115 IonicContact NE-OD2 3.57Å; R88-E151 HydrophobicContact CG-CB 4.24Å; R88-E151 IonicContact NH2-OE2 3.79Å; R88-Y179 PolarHBondContact O-N 2.82Å; R88-E334 IonicContact CZ-OE1 2.97Å; R88-E334 IonicContact CZ-OE2 3.85Å; R88-E334 IonicContact NH1-OE1 3.96Å; R88-E334 PolarHBondContact NH1-OE1 3.36Å; R88-E334 IonicContact NH1-OE2 3.71Å; R88-E334 PolarHBondContact NH1-OE2 3.43Å; R88-E334 IonicContact NH2-OE2 2.82Å; R88-E334 PolarHBondContact NH2-OE2 3.29Å
89	M	94.9	Very high	96	Very high	19 Å²	19	19.6 Å²	19.6	9%	0.094	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	151.3	-177.3	-54.2	-59.1	-81.3	0	0	109.4	L35 L85 E87 E151 A152 C177 A178	L35-M89 HydrophobicContact CD1-CB 3.98Å; L35-M89 HydrophobicContact CD1-CE 4.25Å; L35-M89 HydrophobicContact CD1-CG 4.22Å; L35-M89 HydrophobicContact CD2-CE 3.77Å; L85-M89 HydrophobicContact CB-CG 3.83Å; L85-M89 HydrophobicContact CD1-CB 3.79Å; L85-M89 HydrophobicContact CD1-CG 3.74Å; L85-M89 HydrophobicContact CG-CG 4.41Å; E87-M89 HydrophobicContact CG-SD 3.52Å; E87-M89 VanDerWaalsContact CG-SD 3.52Å; E87-M89 PolarHBondContact O-N 2.93Å; M89-E151 VanDerWaalsContact O-CA 3.26Å; M89-E151 WeakPolarHBondContact O-CA 3.3Å; M89-A152 PolarHBondContact N-O 3.18Å; M89-A152 PolarHBondContact O-N 3.09Å; M89-C177 WeakPolarHBondContact CA-O 3.4Å; M89-A178 HydrophobicContact CE-CB 4.16Å; M89-A178 HydrophobicContact SD-CB 4.37Å
90	E	95.8	Very high	96	Very high	54 Å²	54	22.8 Å²	22.8	25%	0.252	11%	0.114	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	120.5	164.1	-177.7	173.7	-176.8	0	0	107.9	T92 P149 G176 C177 Y179	E90-T92 HydrophobicContact CG-CG2 4.48Å; E90-P149 HydrophobicContact CG-CB 4.29Å; E90-G176 CarbonylContact O-C 3.59Å; E90-G176 WeakPolarHBondContact O-CA 3.29Å; E90-C177 PolarHBondContact N-O 2.97Å; E90-C177 PolarHBondContact O-N 2.81Å; E90-C177 VanDerWaalsContact O-N 3.07Å; E90-Y179 HydrophobicContact CB-CD2 4.46Å
91	V	96.7	Very high	95.9	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	118.9	-174.6	-177.5	0	0	0	0	109.8	L85 L146 P149 F150 L155 V174	L85-V91 HydrophobicContact CD1-CG2 4.12Å; V91-L146 HydrophobicContact CG1-CD1 3.7Å; V91-P149 VanDerWaalsContact O-CA 3.27Å; V91-P149 WeakPolarHBondContact O-CA 3.45Å; V91-P149 VanDerWaalsContact O-CB 3.28Å; V91-P149 WeakPolarHBondContact O-CB 3.27Å; V91-F150 HydrophobicContact CB-CE1 4.38Å; V91-F150 HydrophobicContact CB-CE2 4.21Å; V91-F150 HydrophobicContact CB-CZ 4.14Å; V91-F150 HydrophobicContact CG1-CE1 4.33Å; V91-F150 HydrophobicContact CG1-CZ 4.14Å; V91-F150 HydrophobicContact CG2-CE2 4.34Å; V91-F150 PolarHBondContact N-O 3.12Å; V91-F150 PolarHBondContact O-N 2.74Å; V91-L155 HydrophobicContact CG1-CD2 4.04Å; V91-L155 HydrophobicContact CG2-CD1 4.22Å; V91-L155 HydrophobicContact CG2-CD2 4.46Å; V91-V174 HydrophobicContact CG1-CG1 3.54Å; V91-V174 HydrophobicContact CG2-CG1 4.21Å
92	T	96.2	Very high	95.7	Very high	8 Å²	8	26 Å²	26	5%	0.049	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	-24.1	-172.4	60.4	0	0	0	0	113.3	C31 D32 E90 L146 P149 Y175	C31-T92 HydrophobicContact CB-CG2 4.17Å; C31-T92 WeakPolarHBondContact O-CB 3.35Å; C31-T92 WeakPolarHBondContact O-CG2 3.47Å; C31-T92 PolarHBondContact O-OG1 3.45Å; D32-T92 WeakPolarHBondContact OD1-CB 3.5Å; D32-T92 PolarHBondContact OD1-OG1 2.8Å; E90-T92 HydrophobicContact CG-CG2 4.48Å; T92-L146 WeakPolarHBondContact O-CB 3.45Å; T92-L146 PolarHBondContact O-N 3.32Å; T92-P149 HydrophobicContact CG2-CB 4.08Å; T92-Y175 PolarHBondContact N-O 2.85Å; T92-Y175 PolarHBondContact OG1-O 3.07Å
93	A	96	Very high	95.6	Very high	1 Å²	1	28 Å²	28	1%	0.008	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	160.7	175	0	0	0	0	0	112.9	H143 Y144 Y175	A93-H143 WeakPolarHBondContact CB-NE2 3.3Å; A93-Y144 CarbonylContact C-O 3.58Å; A93-Y144 WeakPolarHBondContact CA-O 3.33Å; A93-Y144 WeakPolarHBondContact CB-O 3.39Å; A93-Y175 HydrophobicContact CB-CD2 4.02Å; A93-Y175 HydrophobicContact CB-CG 4.36Å; A93-Y175 PolarHBondContact N-O 3.27Å; A93-Y175 PolarHBondContact O-N 2.74Å
94	V	96.9	Very high	95.6	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	147.4	169.5	-65.1	0	0	0	0	109.8	L111 Y144 L146 L155 F157 E173	V94-L111 HydrophobicContact CG1-CD1 4.41Å; V94-L111 HydrophobicContact CG1-CD2 3.99Å; V94-L111 HydrophobicContact CG2-CD2 4.26Å; V94-Y144 PolarHBondContact N-O 3.33Å; V94-Y144 PolarHBondContact O-N 3.27Å; V94-L146 HydrophobicContact CG1-CD1 4.3Å; V94-L155 HydrophobicContact CG1-CD2 4.26Å; V94-F157 HydrophobicContact CB-CE1 4.16Å; V94-F157 HydrophobicContact CB-CZ 4.22Å; V94-F157 HydrophobicContact CG1-CE1 4.34Å; V94-F157 HydrophobicContact CG1-CZ 4.04Å; V94-F157 HydrophobicContact CG2-CE1 4.48Å; V94-E173 WeakPolarHBondContact CA-O 3.43Å
95	A	97.5	Very high	95.6	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	148.4	171.4	0	0	0	0	0	111.7	L61 V141 V142 H143 I172 E173 Y175	L61-A95 HydrophobicContact CD1-CB 4.43Å; L61-A95 HydrophobicContact CD2-CB 4.19Å; A95-V141 HydrophobicContact CB-CG1 3.88Å; A95-V142 CarbonylContact C-O 3.37Å; A95-V142 WeakPolarHBondContact CA-O 3.38Å; A95-H143 HydrophobicContact CB-CB 4.34Å; A95-I172 CarbonylContact O-C 3.2Å; A95-I172 VanDerWaalsContact O-CA 3.24Å; A95-I172 WeakPolarHBondContact O-CA 3.21Å; A95-E173 HydrophobicContact CB-CB 4.3Å; A95-E173 PolarHBondContact N-O 3.44Å; A95-E173 PolarHBondContact O-N 3.32Å; A95-Y175 HydrophobicContact CB-CE2 3.87Å
96	T	97.5	Very high	95.6	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	148.6	179.2	56.9	0	0	0	0	110.9	Y109 N135 V142 F157 M170 R171 I172	T96-Y109 HydrophobicContact CG2-CD1 4.3Å; T96-Y109 HydrophobicContact CG2-CE1 3.61Å; T96-Y109 HydrophobicContact CG2-CE2 4.37Å; T96-N135 VanDerWaalsContact C-ND2 3.34Å; T96-N135 PolarHBondContact O-ND2 2.99Å; T96-N135 PolarHBondContact OG1-OD1 2.78Å; T96-V142 PolarHBondContact N-O 3.18Å; T96-V142 PolarHBondContact O-N 3.38Å; T96-F157 HydrophobicContact CG2-CD1 4.39Å; T96-F157 HydrophobicContact CG2-CE1 4.31Å; T96-M170 HydrophobicContact CG2-CE 4.06Å; T96-R171 CarbonylContact C-O 3.5Å; T96-R171 WeakPolarHBondContact CA-O 3.44Å; T96-I172 HydrophobicContact CG2-CG2 4.34Å
97	Q	97.4	Very high	95.7	Very high	7 Å²	7	29.5 Å²	29.5	3%	0.033	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	147.4	177.8	-170.6	-178.9	42.1	0	0	108.5	L61 N62 N135 A138 D139 V141 M170 R171	L61-Q97 HydrophobicContact CD1-CB 3.58Å; N62-Q97 PolarHBondContact OD1-NE2 3.4Å; N62-Q97 VanDerWaalsContact OD1-NE2 3.12Å; Q97-N135 VanDerWaalsContact CA-ND2 3.27Å; Q97-N135 WeakPolarHBondContact CA-ND2 3.28Å; Q97-N135 PolarHBondContact N-OD1 2.9Å; Q97-A138 WeakPolarHBondContact CG-O 3.15Å; Q97-D139 PolarHBondContact NE2-O 2.84Å; Q97-V141 HydrophobicContact CG-CG2 4.39Å; Q97-M170 CarbonylContact O-C 3.59Å; Q97-M170 WeakPolarHBondContact O-CA 3.44Å; Q97-R171 HydrophobicContact CB-CB 4.14Å; Q97-R171 VanDerWaalsContact CD-CZ 3.47Å; Q97-R171 PolarHBondContact N-O 3.23Å; Q97-R171 PolarHBondContact O-N 2.95Å
98	G	96.9	Very high	95.8	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	15%	0.151	C	C	.	.			trans	-73.5	177	178.1	0	0	0	0	0	113.4	Y100 A138 R171	G98-Y100 PolarHBondContact O-N 3.44Å; G98-A138 CarbonylContact C-O 3.53Å; G98-A138 PolarHBondContact N-O 2.97Å; G98-A138 VanDerWaalsContact O-O 3.12Å; G98-R171 PolarHBondContact O-NE 2.8Å; G98-R171 PolarHBondContact O-NH2 2.87Å
99	G	95.8	Very high	96	Very high	2 Å²	2	23.4 Å²	23.4	2%	0.021	14%	0.144	C	C	.	.			trans	-67.6	123.9	173.9	0	0	0	0	0	111.5	G68 G101 S102 D104 A138	G68-G99 WeakPolarHBondContact O-CA 3.35Å; G99-G101 PolarHBondContact O-N 3.27Å; G99-S102 PolarHBondContact O-N 2.94Å; G99-S102 PolarHBondContact O-OG 3.43Å; G99-D104 PolarHBondContact N-O 3.32Å; G99-A138 WeakPolarHBondContact O-CB 3.46Å
100	Y	95.5	Very high	95.9	Very high	82 Å²	82	23.7 Å²	23.7	32%	0.322	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	130.9	-176.4	177.3	-110.8	0	0	0	112.3	R64 G68 G98 S102	R64-Y100 HydrophobicContact CB-CD1 3.79Å; R64-Y100 HydrophobicContact CB-CE1 4.04Å; R64-Y100 HydrophobicContact CB-CG 4.24Å; R64-Y100 HydrophobicContact CG-CD1 3.76Å; R64-Y100 HydrophobicContact CG-CD2 4.01Å; R64-Y100 HydrophobicContact CG-CE1 3.91Å; R64-Y100 HydrophobicContact CG-CE2 4.16Å; R64-Y100 HydrophobicContact CG-CG 3.81Å; R64-Y100 PolarHBondContact NH1-OH 3.24Å; G68-Y100 PolarHBondContact O-N 2.98Å; G98-Y100 PolarHBondContact O-N 3.44Å; Y100-S102 PolarHBondContact O-N 2.95Å
101	G	92.8	Very high	95.8	Very high	72 Å²	72	21.1 Å²	21.1	74%	0.742	13%	0.134	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.6	13.4	175.6	0	0	0	0	0	114.8	G99	G99-G101 PolarHBondContact O-N 3.27Å
102	S	93.2	Very high	95.7	Very high	35 Å²	35	21.3 Å²	21.3	25%	0.245	14%	0.135	C	C	.	.	S	Bend	trans	-123.2	177.3	179.5	83.2	0	0	0	0	112.7	G99 Y100 D104	G99-S102 PolarHBondContact O-N 2.94Å; G99-S102 PolarHBondContact O-OG 3.43Å; Y100-S102 PolarHBondContact O-N 2.95Å; S102-D104 VanDerWaalsContact C-N 3.26Å; S102-D104 WeakPolarHBondContact CB-OD2 3.28Å; S102-D104 VanDerWaalsContact OG-CB 3.25Å; S102-D104 WeakPolarHBondContact OG-CB 2.92Å; S102-D104 VanDerWaalsContact OG-CG 3.29Å; S102-D104 PolarHBondContact OG-N 2.84Å; S102-D104 PolarHBondContact OG-OD2 3.4Å
103	S	95.6	Very high	95.7	Very high	62 Å²	62	22.4 Å²	22.4	43%	0.434	14%	0.139	S	C	.	.	S	Bend	trans	-90.6	13.6	169.2	-67.2	0	0	0	0	112.6	W105 N163	S103-W105 VanDerWaalsContact CA-CZ3 3.49Å; S103-W105 VanDerWaalsContact O-CE3 3.3Å; S103-W105 WeakPolarHBondContact O-CZ3 3.37Å; S103-N163 WeakPolarHBondContact O-CB 3.44Å; S103-N163 PolarHBondContact O-ND2 2.94Å
104	D	96.5	Very high	95.6	Very high	26 Å²	26	22.6 Å²	22.6	14%	0.139	14%	0.14	C	C	.	.			trans	-99.5	106.6	-168.7	-49.1	-41.2	0	0	0	110.5	G99 S102 R167	G99-D104 PolarHBondContact N-O 3.32Å; S102-D104 VanDerWaalsContact C-N 3.26Å; S102-D104 WeakPolarHBondContact CB-OD2 3.28Å; S102-D104 VanDerWaalsContact OG-CB 3.25Å; S102-D104 WeakPolarHBondContact OG-CB 2.92Å; S102-D104 VanDerWaalsContact OG-CG 3.29Å; S102-D104 PolarHBondContact OG-N 2.84Å; S102-D104 PolarHBondContact OG-OD2 3.4Å; D104-R167 VanDerWaalsContact CA-O 3.26Å; D104-R167 WeakPolarHBondContact CA-O 3.16Å; D104-R167 HydrophobicContact CB-CB 4.33Å; D104-R167 WeakPolarHBondContact CB-O 3.09Å; D104-R167 WeakPolarHBondContact OD1-CB 3.41Å; D104-R167 PolarHBondContact OD1-N 2.88Å
105	W	97.5	Very high	95.3	Very high	40 Å²	40	24.2 Å²	24.2	15%	0.152	15%	0.149	C	C	.	.			trans	-152.6	149.9	175.1	64	84.6	0	0	0	111.5	S103 N135 T136 A138 W162 N163 R167 G169	S103-W105 VanDerWaalsContact CA-CZ3 3.49Å; S103-W105 VanDerWaalsContact O-CE3 3.3Å; S103-W105 WeakPolarHBondContact O-CZ3 3.37Å; W105-N135 HydrophobicContact CB-CB 4.18Å; W105-N135 VanDerWaalsContact CD1-O 3.26Å; W105-N135 HydrophobicContact CG-CB 4.45Å; W105-T136 WeakPolarHBondContact CZ2-O 3.34Å; W105-A138 HydrophobicContact CE3-CB 4.48Å; W105-W162 VanDerWaalsContact O-CA 3.26Å; W105-W162 WeakPolarHBondContact O-CA 3.48Å; W105-W162 WeakPolarHBondContact O-CB 3.32Å; W105-N163 HydrophobicContact CD2-CB 3.87Å; W105-N163 VanDerWaalsContact CE2-CB 3.5Å; W105-N163 HydrophobicContact CE3-CB 4.41Å; W105-N163 HydrophobicContact CG-CB 4.32Å; W105-N163 HydrophobicContact CH2-CB 4.3Å; W105-N163 WeakPolarHBondContact CH2-ND2 3.43Å; W105-N163 HydrophobicContact CZ2-CB 3.71Å; W105-N163 VanDerWaalsContact CZ2-ND2 3.28Å; W105-N163 WeakPolarHBondContact CZ2-ND2 3.44Å; W105-N163 PolarHBondContact O-N 3.25Å; W105-R167 PolarHBondContact N-O 2.99Å; W105-G169 WeakPolarHBondContact CA-O 3.24Å
106	V	97.5	Very high	95	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	127.9	178.4	172.7	0	0	0	0	109.4	S108 G134 N135 P159 A161 I168 M170	V106-S108 WeakPolarHBondContact CG1-O 3.45Å; V106-G134 CarbonylContact O-C 3.42Å; V106-G134 WeakPolarHBondContact O-CA 3.45Å; V106-N135 PolarHBondContact O-N 2.91Å; V106-P159 HydrophobicContact CG1-CB 4.04Å; V106-P159 HydrophobicContact CG2-CB 3.81Å; V106-P159 HydrophobicContact CG2-CG 3.95Å; V106-A161 CarbonylContact C-O 3.49Å; V106-A161 WeakPolarHBondContact CG1-O 3.16Å; V106-I168 HydrophobicContact CG2-CG2 3.86Å; V106-M170 HydrophobicContact CB-CE 4.36Å; V106-M170 HydrophobicContact CB-CG 4.12Å; V106-M170 HydrophobicContact CB-SD 4.29Å; V106-M170 HydrophobicContact CG1-CE 4.46Å; V106-M170 HydrophobicContact CG2-CE 4.44Å; V106-M170 HydrophobicContact CG2-CG 3.46Å; V106-M170 VanDerWaalsContact CG2-CG 3.46Å; V106-M170 HydrophobicContact CG2-SD 3.74Å
107	T	95.9	Very high	94.6	Very high	54 Å²	54	25.8 Å²	25.8	33%	0.331	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	-15.7	-179.4	58.7	0	0	0	0	112.6	G134 N135 A161 W162	T107-G134 VanDerWaalsContact C-N 3.29Å; T107-G134 WeakPolarHBondContact O-CA 3.41Å; T107-G134 PolarHBondContact O-N 2.82Å; T107-N135 WeakPolarHBondContact CG2-O 3.22Å; T107-A161 PolarHBondContact N-O 2.62Å; T107-A161 VanDerWaalsContact OG1-C 3.23Å; T107-A161 WeakPolarHBondContact OG1-CB 3.3Å; T107-A161 PolarHBondContact OG1-O 3.48Å; T107-W162 PolarHBondContact OG1-N 3.34Å
108	S	94.7	Very high	94.3	Very high	30 Å²	30	30.3 Å²	30.3	21%	0.21	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159	150.7	167.5	61.4	0	0	0	0	111.9	V106 F132 L160 A161	V106-S108 WeakPolarHBondContact CG1-O 3.45Å; S108-F132 CarbonylContact C-O 3.52Å; S108-F132 WeakPolarHBondContact CA-O 3.28Å; S108-F132 WeakPolarHBondContact CB-O 3.29Å; S108-L160 PolarHBondContact O-N 3.25Å; S108-A161 PolarHBondContact N-O 3.03Å; S108-A161 PolarHBondContact O-N 2.81Å; S108-A161 WeakPolarHBondContact OG-CB 3.27Å; S108-A161 PolarHBondContact OG-N 2.82Å
109	Y	94.4	Very high	94	Very high	0 Å²	0	31 Å²	31	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	158.7	-177.2	63.3	-84.2	0	0	0	113	T96 G131 F132 F157 L158	T96-Y109 HydrophobicContact CG2-CD1 4.3Å; T96-Y109 HydrophobicContact CG2-CE1 3.61Å; T96-Y109 HydrophobicContact CG2-CE2 4.37Å; Y109-G131 CarbonylContact O-C 3.44Å; Y109-G131 WeakPolarHBondContact O-CA 3.45Å; Y109-F132 HydrophobicContact CD1-CB 4.07Å; Y109-F132 HydrophobicContact CD2-CB 4.09Å; Y109-F132 HydrophobicContact CE1-CB 3.63Å; Y109-F132 HydrophobicContact CE2-CB 3.66Å; Y109-F132 HydrophobicContact CE2-CD2 4.14Å; Y109-F132 AromaticContact CE2-CG 3.97Å; Y109-F132 HydrophobicContact CE2-CG 3.97Å; Y109-F132 HydrophobicContact CG-CB 4.28Å; Y109-F132 VanDerWaalsContact CZ-CB 3.41Å; Y109-F132 AromaticContact CZ-CG 4Å; Y109-F132 PolarHBondContact N-O 2.97Å; Y109-F132 PolarHBondContact O-N 3.39Å; Y109-F157 AromaticContact CD2-CD1 3.81Å; Y109-F157 HydrophobicContact CD2-CD1 3.81Å; Y109-F157 AromaticContact CE2-CD1 3.68Å; Y109-F157 HydrophobicContact CE2-CD1 3.68Å; Y109-F157 AromaticContact CE2-CE1 3.99Å; Y109-F157 HydrophobicContact CE2-CE1 3.99Å; Y109-L158 CarbonylContact C-O 3.58Å; Y109-L158 WeakPolarHBondContact CA-O 3.14Å; Y109-L158 WeakPolarHBondContact CB-O 3.3Å
110	L	93.3	Very high	93.9	Very high	24 Å²	24	31.2 Å²	31.2	13%	0.126	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	144	163.9	-59.7	176.5	0	0	0	110.1	F157 L158 L160	L110-F157 WeakPolarHBondContact O-CA 3.33Å; L110-L158 HydrophobicContact CB-CB 4.23Å; L110-L158 PolarHBondContact N-O 2.98Å; L110-L158 PolarHBondContact O-N 2.89Å; L110-L160 HydrophobicContact CD1-CD2 4Å; L110-L160 HydrophobicContact CD2-CD1 3.76Å; L110-L160 HydrophobicContact CD2-CG 4.48Å; L110-L160 HydrophobicContact CG-CD1 3.76Å; L110-L160 HydrophobicContact CG-CD2 3.88Å; L110-L160 HydrophobicContact CG-CG 3.93Å
111	L	94.6	Very high	93.7	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	123	170.4	-174.2	64.6	0	0	0	109	V94 Y123 F132 L146 F150 L155 F157	V94-L111 HydrophobicContact CG1-CD1 4.41Å; V94-L111 HydrophobicContact CG1-CD2 3.99Å; V94-L111 HydrophobicContact CG2-CD2 4.26Å; L111-Y123 PolarHBondContact O-N 2.79Å; L111-F132 HydrophobicContact CB-CD2 4.01Å; L111-F132 HydrophobicContact CB-CE2 3.67Å; L111-F132 HydrophobicContact CB-CZ 4.5Å; L111-F132 HydrophobicContact CD2-CE2 4.39Å; L111-F132 HydrophobicContact CD2-CZ 4.44Å; L111-L146 HydrophobicContact CD2-CD2 3.98Å; L111-F150 HydrophobicContact CD2-CE1 4.17Å; L111-F150 HydrophobicContact CD2-CZ 4.24Å; L111-L155 HydrophobicContact CD1-CD2 4.3Å; L111-F157 HydrophobicContact CD1-CD1 4.04Å; L111-F157 HydrophobicContact CD1-CD2 4.46Å; L111-F157 HydrophobicContact CD1-CE1 3.78Å; L111-F157 HydrophobicContact CD1-CE2 4.21Å; L111-F157 HydrophobicContact CD1-CG 4.37Å; L111-F157 HydrophobicContact CD1-CZ 3.87Å
112	M	94.6	Very high	93.6	Very high	5 Å²	5	28.1 Å²	28.1	3%	0.025	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	150	175.6	-53.9	-70.6	-63.5	0	0	109.5	W120 K121 Q122 L155 R156 L158	M112-W120 HydrophobicContact CB-CB 4.23Å; M112-W120 HydrophobicContact CB-CE3 3.86Å; M112-W120 HydrophobicContact CE-CB 3.59Å; M112-K121 CarbonylContact C-O 3.35Å; M112-K121 VanDerWaalsContact CA-O 3.24Å; M112-K121 WeakPolarHBondContact CA-O 3.36Å; M112-Q122 HydrophobicContact CE-CB 4.05Å; M112-Q122 WeakPolarHBondContact SD-CA 2.96Å; M112-Q122 HydrophobicContact SD-CB 3.5Å; M112-Q122 VanDerWaalsContact SD-CB 3.5Å; M112-Q122 HydrophobicContact SD-CG 3.8Å; M112-L155 CarbonylContact O-C 3.52Å; M112-L155 WeakPolarHBondContact O-CA 3.45Å; M112-R156 HydrophobicContact CB-CB 4.21Å; M112-R156 PolarHBondContact N-O 2.78Å; M112-R156 PolarHBondContact O-N 2.94Å; M112-L158 HydrophobicContact CB-CD1 4.26Å; M112-L158 HydrophobicContact CG-CD1 3.42Å; M112-L158 VanDerWaalsContact CG-CD1 3.42Å; M112-L158 HydrophobicContact CG-CD2 4.47Å
113	F	95.3	Very high	93.5	Very high	30 Å²	30	27.3 Å²	27.3	13%	0.132	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	155.8	177.2	66.3	-85	0	0	0	112.4	K121 F150 A152 F154	F113-K121 HydrophobicContact CD1-CB 4.33Å; F113-K121 WeakPolarHBondContact CD1-O 3.24Å; F113-K121 HydrophobicContact CD2-CB 4.45Å; F113-K121 HydrophobicContact CE1-CB 3.87Å; F113-K121 HydrophobicContact CE1-CG 3.9Å; F113-K121 HydrophobicContact CE2-CB 4.01Å; F113-K121 HydrophobicContact CE2-CD 4.28Å; F113-K121 HydrophobicContact CE2-CG 4.36Å; F113-K121 HydrophobicContact CZ-CB 3.7Å; F113-K121 HydrophobicContact CZ-CD 3.77Å; F113-K121 HydrophobicContact CZ-CG 3.65Å; F113-K121 PolarHBondContact N-O 2.96Å; F113-K121 PolarHBondContact O-N 3.43Å; F113-F150 HydrophobicContact CB-CD2 4.04Å; F113-F150 HydrophobicContact CB-CE2 3.38Å; F113-F150 HydrophobicContact CB-CZ 4.02Å; F113-F150 HydrophobicContact CD1-CD2 4.1Å; F113-F150 AromaticContact CD1-CE2 3.98Å; F113-F150 HydrophobicContact CD1-CE2 3.98Å; F113-F150 HydrophobicContact CD1-CZ 4.29Å; F113-F150 AromaticContact CD2-CD2 3.79Å; F113-F150 HydrophobicContact CD2-CD2 3.79Å; F113-F150 HydrophobicContact CD2-CE2 4.05Å; F113-F150 HydrophobicContact CE2-CD2 4.23Å; F113-F150 AromaticContact CG-CD2 3.72Å; F113-F150 HydrophobicContact CG-CD2 3.72Å; F113-F150 AromaticContact CG-CE2 3.55Å; F113-F150 HydrophobicContact CG-CE2 3.55Å; F113-F150 HydrophobicContact CG-CZ 4.25Å; F113-A152 HydrophobicContact CB-CB 3.83Å; F113-A152 HydrophobicContact CD2-CB 4.09Å; F113-A152 HydrophobicContact CG-CB 4.39Å; F113-F154 VanDerWaalsContact CA-O 3.26Å; F113-F154 WeakPolarHBondContact CA-O 3.11Å
114	S	94.4	Very high	92.8	Very high	5 Å²	5	29.4 Å²	29.4	4%	0.035	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	153.3	177.9	176.5	0	0	0	0	110.9	G116 G117 R118 R153 F154	S114-G116 PolarHBondContact OG-N 2.02Å; S114-G116 VanDerWaalsContact OG-N 3.12Å; S114-G117 PolarHBondContact OG-N 2.95Å; S114-R118 PolarHBondContact OG-N 2.96Å; S114-R118 PolarHBondContact OG-O 3.14Å; S114-R153 PolarHBondContact O-N 3Å; S114-F154 PolarHBondContact N-O 3.17Å; S114-F154 WeakPolarHBondContact O-CB 3.27Å; S114-F154 PolarHBondContact O-N 3Å
115	D	91.3	Very high	91.4	Very high	34 Å²	34	34.8 Å²	34.8	18%	0.182	16%	0.163	C	C	.	.	S	Bend	trans	-87.4	-23	170.8	-65.5	-32.9	0	0	0	113.1	R88 W272	R88-D115 IonicContact NE-OD1 3.24Å; R88-D115 PolarHBondContact NE-OD1 2.75Å; R88-D115 IonicContact NE-OD2 3.57Å; D115-W272 PolarHBondContact OD2-NE1 3.49Å
116	G	89.3	Confident	89.3	Confident	23 Å²	23	40.8 Å²	40.8	24%	0.237	19%	0.193	C	C	.	.	S	Bend	trans	-120.2	4.3	-173.8	0	0	0	0	0	114.9	S114 R118	S114-G116 PolarHBondContact OG-N 2.02Å; S114-G116 VanDerWaalsContact OG-N 3.12Å; G116-R118 PolarHBondContact O-N 2.91Å
117	G	90.3	Very high	86.9	Confident	11 Å²	11	48.2 Å²	48.2	11%	0.113	23%	0.227	C	C	.	.	S	Bend	trans	71.2	8.9	-175.5	0	0	0	0	0	114.1	S114 W120	S114-G117 PolarHBondContact OG-N 2.95Å; G117-W120 WeakPolarHBondContact O-CZ2 3.46Å; G117-W120 PolarHBondContact O-NE1 3.37Å; G117-W120 VanDerWaalsContact O-NE1 3.11Å
118	R	90.7	Very high	84.4	Confident	102 Å²	102	47 Å²	47	39%	0.385	22%	0.221	S	C	.	.	S	Bend	trans	-131.5	164.2	177	-63.4	-61.9	-167.5	-164.3	5.9	110.1	S114 G116 D543	S114-R118 PolarHBondContact OG-N 2.96Å; S114-R118 PolarHBondContact OG-O 3.14Å; G116-R118 PolarHBondContact O-N 2.91Å; R118-D543 IonicContact NH1-OD2 3.85Å
119	N	90.8	Very high	82.4	Confident	15 Å²	15	52 Å²	52	8%	0.08	24%	0.244	C	C	.	.	S	Bend	trans	47.3	68.7	-179.6	-173.6	35.5	0	0	0	111	D269 H271 P371 D543	N119-D269 PolarHBondContact ND2-O 2.53Å; N119-H271 PolarHBondContact ND2-CE1 3.5Å; N119-H271 VanDerWaalsContact ND2-CE1 3.34Å; N119-H271 PolarHBondContact O-CE1 3.22Å; N119-H271 PolarHBondContact O-NE2 3.3Å; N119-P371 WeakPolarHBondContact OD1-CG 3.08Å; N119-D543 CarbonylContact C-O 3.55Å; N119-D543 WeakPolarHBondContact CA-O 3.39Å; N119-D543 PolarHBondContact N-OD1 2.93Å
120	W	93.1	Very high	80.8	Confident	5 Å²	5	62.5 Å²	62.5	2%	0.019	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-72.7	134.2	-173.1	-66	81.8	0	0	0	111.5	Q82 M112 G117 F154 R156 D543 S544	Q82-W120 HydrophobicContact CG-CH2 3.89Å; Q82-W120 HydrophobicContact CG-CZ2 4.43Å; M112-W120 HydrophobicContact CB-CB 4.23Å; M112-W120 HydrophobicContact CB-CE3 3.86Å; M112-W120 HydrophobicContact CE-CB 3.59Å; G117-W120 WeakPolarHBondContact O-CZ2 3.46Å; G117-W120 PolarHBondContact O-NE1 3.37Å; G117-W120 VanDerWaalsContact O-NE1 3.11Å; W120-F154 HydrophobicContact CH2-CB 3.56Å; W120-F154 HydrophobicContact CZ2-CB 4.42Å; W120-F154 HydrophobicContact CZ3-CB 3.95Å; W120-R156 HydrophobicContact CD2-CB 4.46Å; W120-R156 VanDerWaalsContact CE2-NH2 3.27Å; W120-R156 HydrophobicContact CE3-CB 3.83Å; W120-R156 HydrophobicContact CH2-CB 3.73Å; W120-R156 HydrophobicContact CZ2-CB 4.42Å; W120-R156 VanDerWaalsContact CZ2-CZ 3.45Å; W120-R156 HydrophobicContact CZ3-CB 3.42Å; W120-R156 VanDerWaalsContact CZ3-CB 3.42Å; W120-R156 VanDerWaalsContact NE1-CZ 3.25Å; W120-R156 VanDerWaalsContact NE1-NH1 3.2Å; W120-R156 VanDerWaalsContact NE1-NH2 3.17Å; W120-D543 PolarHBondContact N-O 3.3Å; W120-D543 PolarHBondContact NE1-OD2 3.46Å; W120-S544 WeakPolarHBondContact O-CB 3.35Å
121	K	92	Very high	80.2	Confident	51 Å²	51	62.4 Å²	62.4	22%	0.222	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	135.2	170.2	-167	154.6	-177.7	159.3	0	109.5	M112 F113 D269 H271 H273	M112-K121 CarbonylContact C-O 3.35Å; M112-K121 VanDerWaalsContact CA-O 3.24Å; M112-K121 WeakPolarHBondContact CA-O 3.36Å; F113-K121 HydrophobicContact CD1-CB 4.33Å; F113-K121 WeakPolarHBondContact CD1-O 3.24Å; F113-K121 HydrophobicContact CD2-CB 4.45Å; F113-K121 HydrophobicContact CE1-CB 3.87Å; F113-K121 HydrophobicContact CE1-CG 3.9Å; F113-K121 HydrophobicContact CE2-CB 4.01Å; F113-K121 HydrophobicContact CE2-CD 4.28Å; F113-K121 HydrophobicContact CE2-CG 4.36Å; F113-K121 HydrophobicContact CZ-CB 3.7Å; F113-K121 HydrophobicContact CZ-CD 3.77Å; F113-K121 HydrophobicContact CZ-CG 3.65Å; F113-K121 PolarHBondContact N-O 2.96Å; F113-K121 PolarHBondContact O-N 3.43Å; K121-D269 IonicContact NZ-OD2 3.49Å; K121-D269 PolarHBondContact NZ-OD2 3.47Å; K121-H271 HydrophobicContact CD-CB 3.8Å; K121-H273 PolarHBondContact NZ-CE1 3.24Å
122	Q	91.1	Very high	79.9	Confident	38 Å²	38	63.7 Å²	63.7	18%	0.178	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	130.9	172.9	-173.5	-172.6	-15.6	0	0	109.1	M112 R124	M112-Q122 HydrophobicContact CE-CB 4.05Å; M112-Q122 WeakPolarHBondContact SD-CA 2.96Å; M112-Q122 HydrophobicContact SD-CB 3.5Å; M112-Q122 VanDerWaalsContact SD-CB 3.5Å; M112-Q122 HydrophobicContact SD-CG 3.8Å; Q122-R124 HydrophobicContact CB-CG 4.44Å; Q122-R124 HydrophobicContact CG-CG 4.06Å; Q122-R124 PolarHBondContact O-N 3.2Å
123	Y	90.6	Very high	79.8	Confident	19 Å²	19	66.5 Å²	66.5	8%	0.075	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-74.4	121	165.6	-174.3	-85.6	0	0	0	109.2	L111 F132 L146 Q147 P148 F150	L111-Y123 PolarHBondContact O-N 2.79Å; Y123-F132 AromaticContact CD1-CE2 3.81Å; Y123-F132 HydrophobicContact CD1-CE2 3.81Å; Y123-F132 AromaticContact CD1-CZ 3.42Å; Y123-F132 HydrophobicContact CD1-CZ 3.42Å; Y123-F132 VanDerWaalsContact CD1-CZ 3.42Å; Y123-F132 AromaticContact CE1-CZ 3.7Å; Y123-F132 HydrophobicContact CE1-CZ 3.7Å; Y123-F132 HydrophobicContact CG-CZ 4.49Å; Y123-L146 HydrophobicContact CD1-CD2 4.05Å; Y123-L146 HydrophobicContact CE1-CD2 3.63Å; Y123-L146 HydrophobicContact CE2-CB 4.42Å; Y123-L146 HydrophobicContact CE2-CD2 4.21Å; Y123-L146 HydrophobicContact CG-CD2 4.47Å; Y123-Q147 VanDerWaalsContact OH-C 3.24Å; Y123-Q147 PolarHBondContact OH-N 2.67Å; Y123-Q147 PolarHBondContact OH-O 3.2Å; Y123-P148 WeakPolarHBondContact CE2-O 3.42Å; Y123-P148 PolarHBondContact OH-O 3.48Å; Y123-F150 AromaticContact CD2-CD1 3.33Å; Y123-F150 HydrophobicContact CD2-CD1 3.33Å; Y123-F150 AromaticContact CD2-CE1 3.54Å; Y123-F150 HydrophobicContact CD2-CE1 3.54Å; Y123-F150 HydrophobicContact CD2-CG 4.2Å; Y123-F150 AromaticContact CE2-CD1 3.46Å; Y123-F150 HydrophobicContact CE2-CD1 3.46Å; Y123-F150 VanDerWaalsContact CE2-CD1 3.46Å; Y123-F150 AromaticContact CE2-CE1 3.95Å; Y123-F150 HydrophobicContact CE2-CE1 3.95Å; Y123-F150 HydrophobicContact CE2-CG 4.43Å; Y123-F150 HydrophobicContact CG-CD1 4.41Å; Y123-F150 HydrophobicContact CG-CE1 4.23Å
124	R	80.2	Confident	79.7	Confident	106 Å²	106	65.5 Å²	65.5	40%	0.4	31%	0.312	S	S	.	.			trans	-120.3	132.9	179.2	-65	-176.1	-179.4	171.2	2.3	109.9	Q122 G546 T548	Q122-R124 HydrophobicContact CB-CG 4.44Å; Q122-R124 HydrophobicContact CG-CG 4.06Å; Q122-R124 PolarHBondContact O-N 3.2Å; R124-G546 PolarHBondContact NH2-O 2.71Å; R124-T548 PolarHBondContact NH1-OG1 2.89Å
125	R	66.9	Low	79.8	Confident	139 Å²	139	65.4 Å²	65.4	53%	0.525	31%	0.31	S	S	.	.	B	Isolated β-bridge	trans	-89.6	140.6	170.8	-174	177.6	68.7	-169.7	0.5	108.8	E127 S128	R125-E127 PolarHBondContact O-N 3.29Å; R125-S128 PolarHBondContact O-N 3.23Å
126	E	53.9	Low	80.1	Confident	166 Å²	166	69 Å²	69	78%	0.776	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-5.6	91.7	168.3	-66.8	174.8	169	0	0	113.8	S128	E126-S128 PolarHBondContact O-N 3.1Å
127	E	46.4	Very low	80.4	Confident	156 Å²	156	70.5 Å²	70.5	73%	0.729	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	-0.8	177.4	-59.7	-176.2	-166.2	0	0	117.9	R125 I129 Y555	R125-E127 PolarHBondContact O-N 3.29Å; E127-I129 PolarHBondContact O-N 2.87Å; E127-I129 VanDerWaalsContact O-N 3.13Å; E127-Y555 PolarHBondContact OE1-OH 3.41Å; E127-Y555 VanDerWaalsContact OE1-OH 3.11Å
128	S	44.8	Very low	80.6	Confident	29 Å²	29	70.2 Å²	70.2	20%	0.203	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-78.7	100.8	176.2	-178.5	0	0	0	0	110.3	R125 E126 W130	R125-S128 PolarHBondContact O-N 3.23Å; E126-S128 PolarHBondContact O-N 3.1Å; S128-W130 PolarHBondContact O-N 2.99Å; S128-W130 PolarHBondContact OG-O 3.16Å
129	I	52.1	Low	80.7	Confident	135 Å²	135	69.8 Å²	69.8	69%	0.692	34%	0.338	S	S	*	.			trans	-66.1	-20.9	171	-52.2	173.5	0	0	0	110.9	E127	E127-I129 PolarHBondContact O-N 2.87Å; E127-I129 VanDerWaalsContact O-N 3.13Å
130	W	60.9	Low	80.9	Confident	220 Å²	220	71 Å²	71	83%	0.833	35%	0.348	S	S	*	.	S	Bend	trans	-79.2	131.7	-176.9	-54.3	105.3	0	0	0	111.3	S128	S128-W130 PolarHBondContact O-N 2.99Å; S128-W130 PolarHBondContact OG-O 3.16Å
131	G	80.6	Confident	81.1	Confident	22 Å²	22	73.7 Å²	73.7	23%	0.227	37%	0.365	C	S	.	.			trans	-60.2	176.5	-179.6	0	0	0	0	0	114.4	Y109	Y109-G131 CarbonylContact O-C 3.44Å; Y109-G131 WeakPolarHBondContact O-CA 3.45Å
132	F	89.5	Confident	81.4	Confident	26 Å²	26	72.6 Å²	72.6	11%	0.114	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	134.2	178	-72.6	-94.4	0	0	0	110.7	S108 Y109 L111 Y123 G134 Y144 L146	S108-F132 CarbonylContact C-O 3.52Å; S108-F132 WeakPolarHBondContact CA-O 3.28Å; S108-F132 WeakPolarHBondContact CB-O 3.29Å; Y109-F132 HydrophobicContact CD1-CB 4.07Å; Y109-F132 HydrophobicContact CD2-CB 4.09Å; Y109-F132 HydrophobicContact CE1-CB 3.63Å; Y109-F132 HydrophobicContact CE2-CB 3.66Å; Y109-F132 HydrophobicContact CE2-CD2 4.14Å; Y109-F132 AromaticContact CE2-CG 3.97Å; Y109-F132 HydrophobicContact CE2-CG 3.97Å; Y109-F132 HydrophobicContact CG-CB 4.28Å; Y109-F132 VanDerWaalsContact CZ-CB 3.41Å; Y109-F132 AromaticContact CZ-CG 4Å; Y109-F132 PolarHBondContact N-O 2.97Å; Y109-F132 PolarHBondContact O-N 3.39Å; L111-F132 HydrophobicContact CB-CD2 4.01Å; L111-F132 HydrophobicContact CB-CE2 3.67Å; L111-F132 HydrophobicContact CB-CZ 4.5Å; L111-F132 HydrophobicContact CD2-CE2 4.39Å; L111-F132 HydrophobicContact CD2-CZ 4.44Å; Y123-F132 AromaticContact CD1-CE2 3.81Å; Y123-F132 HydrophobicContact CD1-CE2 3.81Å; Y123-F132 AromaticContact CD1-CZ 3.42Å; Y123-F132 HydrophobicContact CD1-CZ 3.42Å; Y123-F132 VanDerWaalsContact CD1-CZ 3.42Å; Y123-F132 AromaticContact CE1-CZ 3.7Å; Y123-F132 HydrophobicContact CE1-CZ 3.7Å; Y123-F132 HydrophobicContact CG-CZ 4.49Å; F132-G134 PolarHBondContact O-N 2.86Å; F132-Y144 HydrophobicContact CD1-CD1 4.39Å; F132-Y144 HydrophobicContact CD1-CD2 4.13Å; F132-Y144 AromaticContact CD1-CG 3.99Å; F132-Y144 HydrophobicContact CD1-CG 3.99Å; F132-Y144 HydrophobicContact CE1-CG 4.48Å; F132-L146 HydrophobicContact CE1-CD2 4.07Å; F132-L146 HydrophobicContact CZ-CD2 3.83Å
133	P	92.2	Very high	81.6	Confident	64 Å²	64	75.2 Å²	75.2	42%	0.416	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	132.8	170.8	-0.2	11.6	0	0	0	109.2	Y144	P133-Y144 WeakPolarHBondContact CB-OH 3.18Å; P133-Y144 WeakPolarHBondContact CD-OH 3.49Å; P133-Y144 HydrophobicContact CG-CE1 4.21Å; P133-Y144 WeakPolarHBondContact CG-OH 3.33Å; P133-Y144 WeakPolarHBondContact O-CE2 3.24Å; P133-Y144 PolarHBondContact O-OH 3.29Å
134	G	93.3	Very high	81.7	Confident	10 Å²	10	76.6 Å²	76.6	10%	0.103	38%	0.38	C	S	.	.			trans	-95.2	-148.5	179.6	0	0	0	0	0	112.5	V106 T107 F132	V106-G134 CarbonylContact O-C 3.42Å; V106-G134 WeakPolarHBondContact O-CA 3.45Å; T107-G134 VanDerWaalsContact C-N 3.29Å; T107-G134 WeakPolarHBondContact O-CA 3.41Å; T107-G134 PolarHBondContact O-N 2.82Å; F132-G134 PolarHBondContact O-N 2.86Å
135	N	96.9	Very high	82.3	Confident	2 Å²	2	77.9 Å²	77.9	1%	0.011	39%	0.385	C	S	.	.			trans	-83.9	156.2	-177	-55.4	95.9	0	0	0	112.8	T96 Q97 W105 V106 T107 N137 S140	T96-N135 VanDerWaalsContact C-ND2 3.34Å; T96-N135 PolarHBondContact O-ND2 2.99Å; T96-N135 PolarHBondContact OG1-OD1 2.78Å; Q97-N135 VanDerWaalsContact CA-ND2 3.27Å; Q97-N135 WeakPolarHBondContact CA-ND2 3.28Å; Q97-N135 PolarHBondContact N-OD1 2.9Å; W105-N135 HydrophobicContact CB-CB 4.18Å; W105-N135 VanDerWaalsContact CD1-O 3.26Å; W105-N135 HydrophobicContact CG-CB 4.45Å; V106-N135 PolarHBondContact O-N 2.91Å; T107-N135 WeakPolarHBondContact CG2-O 3.22Å; N135-N137 WeakPolarHBondContact CB-O 3.08Å; N135-S140 PolarHBondContact ND2-O 3.44Å
136	T	96.4	Very high	83.5	Confident	110 Å²	110	71.5 Å²	71.5	68%	0.675	36%	0.361	S	S	*	.	S	Bend	trans	-104.5	-9.5	171.2	54.9	0	0	0	0	113	W105	W105-T136 WeakPolarHBondContact CZ2-O 3.34Å
137	N	95.4	Very high	85.2	Confident	55 Å²	55	70.5 Å²	70.5	29%	0.294	36%	0.356	S	S	.	.	S	Bend	trans	-158.1	-178.5	178.8	62.5	66.8	0	0	0	110.7	N135 D139 S140	N135-N137 WeakPolarHBondContact CB-O 3.08Å; N137-D139 PolarHBondContact OD1-N 2.76Å; N137-S140 PolarHBondContact ND2-OG 2.77Å; N137-S140 VanDerWaalsContact ND2-OG 3.07Å; N137-S140 PolarHBondContact OD1-N 3.28Å; N137-S140 PolarHBondContact OD1-OG 3.19Å; N137-S140 VanDerWaalsContact OD1-OG 3.07Å
138	A	93.8	Very high	87.2	Confident	5 Å²	5	65.5 Å²	65.5	4%	0.041	34%	0.338	C	S	.	.	S	Bend	trans	-72.2	-28	-179.6	0	0	0	0	0	115.3	Q97 G98 G99 W105 R171	Q97-A138 WeakPolarHBondContact CG-O 3.15Å; G98-A138 CarbonylContact C-O 3.53Å; G98-A138 PolarHBondContact N-O 2.97Å; G98-A138 VanDerWaalsContact O-O 3.12Å; G99-A138 WeakPolarHBondContact O-CB 3.46Å; W105-A138 HydrophobicContact CE3-CB 4.48Å; A138-R171 PolarHBondContact O-NH2 3.29Å
139	D	93.4	Very high	89.5	Confident	92 Å²	92	66.7 Å²	66.7	49%	0.492	34%	0.344	S	S	.	.	S	Bend	trans	-108.5	-31.8	-162.2	-63	-63.2	0	0	0	114.2	Q97 N137 V141	Q97-D139 PolarHBondContact NE2-O 2.84Å; N137-D139 PolarHBondContact OD1-N 2.76Å; D139-V141 PolarHBondContact O-N 3.02Å
140	S	95.3	Very high	91.4	Very high	42 Å²	42	61 Å²	61	29%	0.294	31%	0.314	S	S	.	.			trans	-71.8	128.9	-178.3	61.2	0	0	0	0	111.2	N135 N137	N135-S140 PolarHBondContact ND2-O 3.44Å; N137-S140 PolarHBondContact ND2-OG 2.77Å; N137-S140 VanDerWaalsContact ND2-OG 3.07Å; N137-S140 PolarHBondContact OD1-N 3.28Å; N137-S140 PolarHBondContact OD1-OG 3.19Å; N137-S140 VanDerWaalsContact OD1-OG 3.07Å
141	V	97.5	Very high	93	Very high	60 Å²	60	52.3 Å²	52.3	36%	0.364	28%	0.283	S	S	.	.			trans	-79.4	128.1	171.6	178.5	0	0	0	0	109.1	L61 A95 Q97 D139	L61-V141 HydrophobicContact CD1-CG1 4.09Å; L61-V141 HydrophobicContact CD1-CG2 4.07Å; L61-V141 HydrophobicContact CD2-CG1 4Å; L61-V141 HydrophobicContact CD2-CG2 4.26Å; L61-V141 HydrophobicContact CG-CG2 4.28Å; A95-V141 HydrophobicContact CB-CG1 3.88Å; Q97-V141 HydrophobicContact CG-CG2 4.39Å; D139-V141 PolarHBondContact O-N 3.02Å
142	V	97.1	Very high	93.7	Very high	28 Å²	28	51.3 Å²	51.3	17%	0.17	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	115.2	170.9	-178.1	0	0	0	0	107.6	A95 T96 Y144	A95-V142 CarbonylContact C-O 3.37Å; A95-V142 WeakPolarHBondContact CA-O 3.38Å; T96-V142 PolarHBondContact N-O 3.18Å; T96-V142 PolarHBondContact O-N 3.38Å; V142-Y144 HydrophobicContact CB-CE2 4.46Å; V142-Y144 HydrophobicContact CG1-CD2 4.1Å; V142-Y144 HydrophobicContact CG1-CE2 3.24Å; V142-Y144 WeakPolarHBondContact CG1-OH 3.48Å
143	H	96	Very high	94	Very high	93 Å²	93	53.7 Å²	53.7	43%	0.431	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	130.4	-176.1	176.8	-79.3	0	0	0	110.4	A93 A95 Y175	A93-H143 WeakPolarHBondContact CB-NE2 3.3Å; A95-H143 HydrophobicContact CB-CB 4.34Å; H143-Y175 AromaticContact CD2-CE2 3.62Å; H143-Y175 AromaticContact NE2-CD2 3.86Å; H143-Y175 AromaticContact NE2-CE2 3.86Å
144	Y	93.4	Very high	94.2	Very high	48 Å²	48	51.6 Å²	51.6	19%	0.188	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	120.4	176.1	-72	-74.1	0	0	0	111.6	A93 V94 F132 P133 V142	A93-Y144 CarbonylContact C-O 3.58Å; A93-Y144 WeakPolarHBondContact CA-O 3.33Å; A93-Y144 WeakPolarHBondContact CB-O 3.39Å; V94-Y144 PolarHBondContact N-O 3.33Å; V94-Y144 PolarHBondContact O-N 3.27Å; F132-Y144 HydrophobicContact CD1-CD1 4.39Å; F132-Y144 HydrophobicContact CD1-CD2 4.13Å; F132-Y144 AromaticContact CD1-CG 3.99Å; F132-Y144 HydrophobicContact CD1-CG 3.99Å; F132-Y144 HydrophobicContact CE1-CG 4.48Å; P133-Y144 WeakPolarHBondContact CB-OH 3.18Å; P133-Y144 WeakPolarHBondContact CD-OH 3.49Å; P133-Y144 HydrophobicContact CG-CE1 4.21Å; P133-Y144 WeakPolarHBondContact CG-OH 3.33Å; P133-Y144 WeakPolarHBondContact O-CE2 3.24Å; P133-Y144 PolarHBondContact O-OH 3.29Å; V142-Y144 HydrophobicContact CB-CE2 4.46Å; V142-Y144 HydrophobicContact CG1-CD2 4.1Å; V142-Y144 HydrophobicContact CG1-CE2 3.24Å; V142-Y144 WeakPolarHBondContact CG1-OH 3.48Å
145	R	93.3	Very high	94.4	Very high	133 Å²	133	51.1 Å²	51.1	50%	0.502	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	128.1	164.7	-166.4	119.9	-172.8	162.6	5.2	109.2	D32 Q147	D32-R145 VanDerWaalsContact CG-NH1 3.3Å; D32-R145 IonicContact OD1-CZ 2.62Å; D32-R145 IonicContact OD1-NH1 2.77Å; D32-R145 PolarHBondContact OD1-NH1 3.02Å; D32-R145 IonicContact OD1-NH2 3.12Å; D32-R145 PolarHBondContact OD1-NH2 3.18Å; D32-R145 VanDerWaalsContact OD1-NH2 3.16Å; D32-R145 IonicContact OD2-CZ 3.64Å; D32-R145 IonicContact OD2-NH1 3.36Å; D32-R145 PolarHBondContact OD2-NH1 3.19Å; D32-R145 IonicContact OD2-NH2 3.95Å; D32-R145 PolarHBondContact OD2-NH2 2.97Å; R145-Q147 HydrophobicContact CG-CG 4.46Å
146	L	91.9	Very high	94.4	Very high	5 Å²	5	51.8 Å²	51.8	3%	0.026	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	125	177.8	-62.3	163.7	0	0	0	108.3	V91 T92 V94 L111 Y123 F132 P148 F150	V91-L146 HydrophobicContact CG1-CD1 3.7Å; T92-L146 WeakPolarHBondContact O-CB 3.45Å; T92-L146 PolarHBondContact O-N 3.32Å; V94-L146 HydrophobicContact CG1-CD1 4.3Å; L111-L146 HydrophobicContact CD2-CD2 3.98Å; Y123-L146 HydrophobicContact CD1-CD2 4.05Å; Y123-L146 HydrophobicContact CE1-CD2 3.63Å; Y123-L146 HydrophobicContact CE2-CB 4.42Å; Y123-L146 HydrophobicContact CE2-CD2 4.21Å; Y123-L146 HydrophobicContact CG-CD2 4.47Å; F132-L146 HydrophobicContact CE1-CD2 4.07Å; F132-L146 HydrophobicContact CZ-CD2 3.83Å; L146-P148 CarbonylContact C-O 3.39Å; L146-P148 CarbonylContact O-C 3.58Å; L146-F150 HydrophobicContact CD1-CD1 4.09Å; L146-F150 HydrophobicContact CD1-CE1 3.5Å; L146-F150 VanDerWaalsContact CD1-CE1 3.5Å; L146-F150 HydrophobicContact CD1-CZ 4.37Å; L146-F150 HydrophobicContact CD2-CE1 4.43Å; L146-F150 HydrophobicContact CG-CE1 4.48Å
147	Q	89.1	Confident	94.4	Very high	146 Å²	146	46.5 Å²	46.5	68%	0.682	23%	0.231	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-130.2	106	177.9	-71.7	-176	-13.9	0	0	108.6	Y123 R145	Y123-Q147 VanDerWaalsContact OH-C 3.24Å; Y123-Q147 PolarHBondContact OH-N 2.67Å; Y123-Q147 PolarHBondContact OH-O 3.2Å; R145-Q147 HydrophobicContact CG-CG 4.46Å
148	P	88.6	Confident	94.4	Very high	51 Å²	51	45.3 Å²	45.3	33%	0.331	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	cis	-76.3	166.9	-1.1	38.5	-41.5	0	0	0	111.7	Y123 L146	Y123-P148 WeakPolarHBondContact CE2-O 3.42Å; Y123-P148 PolarHBondContact OH-O 3.48Å; L146-P148 CarbonylContact C-O 3.39Å; L146-P148 CarbonylContact O-C 3.58Å
149	P	92.6	Very high	94.5	Very high	53 Å²	53	45.1 Å²	45.1	34%	0.344	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	165.7	160.4	31.2	-36.6	0	0	0	111.1	E90 V91 T92	E90-P149 HydrophobicContact CG-CB 4.29Å; V91-P149 VanDerWaalsContact O-CA 3.27Å; V91-P149 WeakPolarHBondContact O-CA 3.45Å; V91-P149 VanDerWaalsContact O-CB 3.28Å; V91-P149 WeakPolarHBondContact O-CB 3.27Å; T92-P149 HydrophobicContact CG2-CB 4.08Å
150	F	92.9	Very high	94.5	Very high	15 Å²	15	44.2 Å²	44.2	7%	0.066	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	155.3	175.7	65.9	-90.8	0	0	0	110.8	V91 L111 F113 Y123 L146 A152 L155	V91-F150 HydrophobicContact CB-CE1 4.38Å; V91-F150 HydrophobicContact CB-CE2 4.21Å; V91-F150 HydrophobicContact CB-CZ 4.14Å; V91-F150 HydrophobicContact CG1-CE1 4.33Å; V91-F150 HydrophobicContact CG1-CZ 4.14Å; V91-F150 HydrophobicContact CG2-CE2 4.34Å; V91-F150 PolarHBondContact N-O 3.12Å; V91-F150 PolarHBondContact O-N 2.74Å; L111-F150 HydrophobicContact CD2-CE1 4.17Å; L111-F150 HydrophobicContact CD2-CZ 4.24Å; F113-F150 HydrophobicContact CB-CD2 4.04Å; F113-F150 HydrophobicContact CB-CE2 3.38Å; F113-F150 HydrophobicContact CB-CZ 4.02Å; F113-F150 HydrophobicContact CD1-CD2 4.1Å; F113-F150 AromaticContact CD1-CE2 3.98Å; F113-F150 HydrophobicContact CD1-CE2 3.98Å; F113-F150 HydrophobicContact CD1-CZ 4.29Å; F113-F150 AromaticContact CD2-CD2 3.79Å; F113-F150 HydrophobicContact CD2-CD2 3.79Å; F113-F150 HydrophobicContact CD2-CE2 4.05Å; F113-F150 HydrophobicContact CE2-CD2 4.23Å; F113-F150 AromaticContact CG-CD2 3.72Å; F113-F150 HydrophobicContact CG-CD2 3.72Å; F113-F150 AromaticContact CG-CE2 3.55Å; F113-F150 HydrophobicContact CG-CE2 3.55Å; F113-F150 HydrophobicContact CG-CZ 4.25Å; Y123-F150 AromaticContact CD2-CD1 3.33Å; Y123-F150 HydrophobicContact CD2-CD1 3.33Å; Y123-F150 AromaticContact CD2-CE1 3.54Å; Y123-F150 HydrophobicContact CD2-CE1 3.54Å; Y123-F150 HydrophobicContact CD2-CG 4.2Å; Y123-F150 AromaticContact CE2-CD1 3.46Å; Y123-F150 HydrophobicContact CE2-CD1 3.46Å; Y123-F150 VanDerWaalsContact CE2-CD1 3.46Å; Y123-F150 AromaticContact CE2-CE1 3.95Å; Y123-F150 HydrophobicContact CE2-CE1 3.95Å; Y123-F150 HydrophobicContact CE2-CG 4.43Å; Y123-F150 HydrophobicContact CG-CD1 4.41Å; Y123-F150 HydrophobicContact CG-CE1 4.23Å; L146-F150 HydrophobicContact CD1-CD1 4.09Å; L146-F150 HydrophobicContact CD1-CE1 3.5Å; L146-F150 VanDerWaalsContact CD1-CE1 3.5Å; L146-F150 HydrophobicContact CD1-CZ 4.37Å; L146-F150 HydrophobicContact CD2-CE1 4.43Å; L146-F150 HydrophobicContact CG-CE1 4.48Å; F150-A152 HydrophobicContact CD2-CB 3.88Å; F150-A152 HydrophobicContact CE2-CB 3.69Å; F150-L155 HydrophobicContact CE2-CD2 4.49Å; F150-L155 HydrophobicContact CZ-CD2 3.99Å; F150-L155 HydrophobicContact CZ-CG 4.41Å
151	E	94.1	Very high	94.5	Very high	39 Å²	39	44 Å²	44	18%	0.182	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	129.2	176.4	-50.1	82.5	-176.2	0	0	111.5	R88 M89 Y179 K211	R88-E151 HydrophobicContact CG-CB 4.24Å; R88-E151 IonicContact NH2-OE2 3.79Å; M89-E151 VanDerWaalsContact O-CA 3.26Å; M89-E151 WeakPolarHBondContact O-CA 3.3Å; E151-Y179 HydrophobicContact CB-CD1 4.27Å; E151-Y179 HydrophobicContact CB-CE1 4.4Å; E151-Y179 HydrophobicContact CB-CG 4.43Å; E151-Y179 HydrophobicContact CG-CD1 3.97Å; E151-Y179 HydrophobicContact CG-CD2 3.7Å; E151-Y179 HydrophobicContact CG-CE1 3.98Å; E151-Y179 HydrophobicContact CG-CE2 3.72Å; E151-Y179 HydrophobicContact CG-CG 3.81Å; E151-K211 IonicContact OE1-NZ 3.82Å; E151-K211 PolarHBondContact OE1-NZ 3.22Å; E151-K211 IonicContact OE2-NZ 2.72Å; E151-K211 PolarHBondContact OE2-NZ 3.08Å
152	A	95.4	Very high	94.4	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	160	177	0	0	0	0	0	111.4	M89 F113 F150	M89-A152 PolarHBondContact N-O 3.18Å; M89-A152 PolarHBondContact O-N 3.09Å; F113-A152 HydrophobicContact CB-CB 3.83Å; F113-A152 HydrophobicContact CD2-CB 4.09Å; F113-A152 HydrophobicContact CG-CB 4.39Å; F150-A152 HydrophobicContact CD2-CB 3.88Å; F150-A152 HydrophobicContact CE2-CB 3.69Å
153	R	94.9	Very high	94.4	Very high	77 Å²	77	43.6 Å²	43.6	29%	0.291	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	-38.6	167.4	174.5	176	164.5	175	-0.2	112.1	D84 L85 G86 E87 S114	D84-R153 VanDerWaalsContact OD1-CG 3.31Å; D84-R153 WeakPolarHBondContact OD1-CG 3.46Å; D84-R153 IonicContact OD1-CZ 2.67Å; D84-R153 IonicContact OD1-NE 2.82Å; D84-R153 PolarHBondContact OD1-NE 3.26Å; D84-R153 IonicContact OD1-NH2 3.64Å; D84-R153 PolarHBondContact OD1-NH2 2.96Å; D84-R153 IonicContact OD2-CZ 3.16Å; D84-R153 IonicContact OD2-NE 3.58Å; D84-R153 IonicContact OD2-NH2 3.36Å; D84-R153 PolarHBondContact OD2-NH2 3.26Å; L85-R153 VanDerWaalsContact CB-O 3.31Å; L85-R153 WeakPolarHBondContact CB-O 3.49Å; L85-R153 WeakPolarHBondContact CG-O 3.34Å; L85-R153 PolarHBondContact N-O 2.8Å; G86-R153 VanDerWaalsContact O-CZ 3.25Å; G86-R153 PolarHBondContact O-NE 3.43Å; E87-R153 WeakPolarHBondContact O-CA 3.49Å; S114-R153 PolarHBondContact O-N 3Å
154	F	96.7	Very high	94.4	Very high	20 Å²	20	45 Å²	45	9%	0.088	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	136.4	-176.2	-60.2	-93.6	0	0	0	110.9	I83 D84 F113 S114 W120	I83-F154 WeakPolarHBondContact O-CA 3.1Å; D84-F154 HydrophobicContact CB-CD1 3.71Å; D84-F154 HydrophobicContact CB-CE1 3.5Å; D84-F154 HydrophobicContact CB-CZ 4.43Å; D84-F154 WeakPolarHBondContact OD2-CE1 3.16Å; F113-F154 VanDerWaalsContact CA-O 3.26Å; F113-F154 WeakPolarHBondContact CA-O 3.11Å; S114-F154 PolarHBondContact N-O 3.17Å; S114-F154 WeakPolarHBondContact O-CB 3.27Å; S114-F154 PolarHBondContact O-N 3Å; W120-F154 HydrophobicContact CH2-CB 3.56Å; W120-F154 HydrophobicContact CZ2-CB 4.42Å; W120-F154 HydrophobicContact CZ3-CB 3.95Å
155	L	97.8	Very high	94.5	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	144.3	170.9	-67	80.6	0	0	0	109.5	Q82 I83 L85 V91 V94 L111 M112 F150 F157 V174	Q82-L155 CarbonylContact C-O 3.43Å; Q82-L155 VanDerWaalsContact CA-O 3.28Å; Q82-L155 WeakPolarHBondContact CA-O 3.37Å; Q82-L155 WeakPolarHBondContact CG-O 3.45Å; I83-L155 HydrophobicContact CG2-CB 3.75Å; I83-L155 HydrophobicContact CG2-CD1 4.45Å; I83-L155 PolarHBondContact N-O 3.08Å; I83-L155 PolarHBondContact O-N 2.95Å; L85-L155 HydrophobicContact CD1-CD1 3.58Å; L85-L155 HydrophobicContact CG-CD1 4.04Å; V91-L155 HydrophobicContact CG1-CD2 4.04Å; V91-L155 HydrophobicContact CG2-CD1 4.22Å; V91-L155 HydrophobicContact CG2-CD2 4.46Å; V94-L155 HydrophobicContact CG1-CD2 4.26Å; L111-L155 HydrophobicContact CD1-CD2 4.3Å; M112-L155 CarbonylContact O-C 3.52Å; M112-L155 WeakPolarHBondContact O-CA 3.45Å; F150-L155 HydrophobicContact CE2-CD2 4.49Å; F150-L155 HydrophobicContact CZ-CD2 3.99Å; F150-L155 HydrophobicContact CZ-CG 4.41Å; L155-F157 HydrophobicContact CB-CE2 4.37Å; L155-V174 HydrophobicContact CD2-CG1 3.91Å; L155-V174 HydrophobicContact CD2-CG2 4.1Å
156	R	96.6	Very high	94.5	Very high	15 Å²	15	48.1 Å²	48.1	6%	0.057	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	125.2	178.7	-175.1	-169.9	-75.2	175.1	-4.9	110.1	W80 L81 Q82 M112 W120 L158	W80-R156 HydrophobicContact CB-CG 3.75Å; W80-R156 HydrophobicContact CD2-CG 4.42Å; W80-R156 HydrophobicContact CE3-CG 4.25Å; W80-R156 HydrophobicContact CG-CG 4.26Å; L81-R156 CarbonylContact O-C 3.49Å; L81-R156 WeakPolarHBondContact O-CA 3.35Å; Q82-R156 HydrophobicContact CB-CB 4.39Å; Q82-R156 HydrophobicContact CB-CG 4.31Å; Q82-R156 VanDerWaalsContact OE1-NE 3.14Å; M112-R156 HydrophobicContact CB-CB 4.21Å; M112-R156 PolarHBondContact N-O 2.78Å; M112-R156 PolarHBondContact O-N 2.94Å; W120-R156 HydrophobicContact CD2-CB 4.46Å; W120-R156 VanDerWaalsContact CE2-NH2 3.27Å; W120-R156 HydrophobicContact CE3-CB 3.83Å; W120-R156 HydrophobicContact CH2-CB 3.73Å; W120-R156 HydrophobicContact CZ2-CB 4.42Å; W120-R156 VanDerWaalsContact CZ2-CZ 3.45Å; W120-R156 HydrophobicContact CZ3-CB 3.42Å; W120-R156 VanDerWaalsContact CZ3-CB 3.42Å; W120-R156 VanDerWaalsContact NE1-CZ 3.25Å; W120-R156 VanDerWaalsContact NE1-NH1 3.2Å; W120-R156 VanDerWaalsContact NE1-NH2 3.17Å; R156-L158 HydrophobicContact CB-CD1 4.32Å; R156-L158 HydrophobicContact CG-CD1 3.69Å
157	F	96.9	Very high	94.7	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	121.6	178	-62.3	-102.4	0	0	0	108.5	W80 L81 V94 T96 Y109 L110 L111 L155 M170 I172 V174	W80-F157 VanDerWaalsContact CA-O 3.3Å; W80-F157 WeakPolarHBondContact CA-O 3.49Å; L81-F157 PolarHBondContact N-O 2.89Å; L81-F157 PolarHBondContact O-N 2.89Å; V94-F157 HydrophobicContact CB-CE1 4.16Å; V94-F157 HydrophobicContact CB-CZ 4.22Å; V94-F157 HydrophobicContact CG1-CE1 4.34Å; V94-F157 HydrophobicContact CG1-CZ 4.04Å; V94-F157 HydrophobicContact CG2-CE1 4.48Å; T96-F157 HydrophobicContact CG2-CD1 4.39Å; T96-F157 HydrophobicContact CG2-CE1 4.31Å; Y109-F157 AromaticContact CD2-CD1 3.81Å; Y109-F157 HydrophobicContact CD2-CD1 3.81Å; Y109-F157 AromaticContact CE2-CD1 3.68Å; Y109-F157 HydrophobicContact CE2-CD1 3.68Å; Y109-F157 AromaticContact CE2-CE1 3.99Å; Y109-F157 HydrophobicContact CE2-CE1 3.99Å; L110-F157 WeakPolarHBondContact O-CA 3.33Å; L111-F157 HydrophobicContact CD1-CD1 4.04Å; L111-F157 HydrophobicContact CD1-CD2 4.46Å; L111-F157 HydrophobicContact CD1-CE1 3.78Å; L111-F157 HydrophobicContact CD1-CE2 4.21Å; L111-F157 HydrophobicContact CD1-CG 4.37Å; L111-F157 HydrophobicContact CD1-CZ 3.87Å; L155-F157 HydrophobicContact CB-CE2 4.37Å; F157-M170 HydrophobicContact CB-CE 4.15Å; F157-M170 HydrophobicContact CD1-CE 4.41Å; F157-I172 HydrophobicContact CD1-CG2 4.33Å; F157-I172 HydrophobicContact CD2-CD1 3.83Å; F157-I172 HydrophobicContact CD2-CG2 4.42Å; F157-I172 HydrophobicContact CE1-CG2 4.31Å; F157-I172 HydrophobicContact CE2-CB 4.46Å; F157-I172 HydrophobicContact CE2-CD1 3.53Å; F157-I172 HydrophobicContact CE2-CG2 4.42Å; F157-I172 HydrophobicContact CG-CG2 4.4Å; F157-I172 HydrophobicContact CZ-CB 4.37Å; F157-I172 HydrophobicContact CZ-CD1 4.24Å; F157-I172 HydrophobicContact CZ-CG2 4.36Å; F157-V174 HydrophobicContact CZ-CG2 4.38Å
158	L	95	Very high	95.1	Very high	30 Å²	30	46.3 Å²	46.3	16%	0.157	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	106.4	179.4	-72.3	71.5	0	0	0	108.7	W80 Y109 L110 M112 R156 L160	W80-L158 HydrophobicContact CB-CD1 4.44Å; W80-L158 HydrophobicContact CB-CG 4.19Å; Y109-L158 CarbonylContact C-O 3.58Å; Y109-L158 WeakPolarHBondContact CA-O 3.14Å; Y109-L158 WeakPolarHBondContact CB-O 3.3Å; L110-L158 HydrophobicContact CB-CB 4.23Å; L110-L158 PolarHBondContact N-O 2.98Å; L110-L158 PolarHBondContact O-N 2.89Å; M112-L158 HydrophobicContact CB-CD1 4.26Å; M112-L158 HydrophobicContact CG-CD1 3.42Å; M112-L158 VanDerWaalsContact CG-CD1 3.42Å; M112-L158 HydrophobicContact CG-CD2 4.47Å; R156-L158 HydrophobicContact CB-CD1 4.32Å; R156-L158 HydrophobicContact CG-CD1 3.69Å; L158-L160 PolarHBondContact O-N 2.78Å
159	P	96	Very high	95.5	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.1	127.1	174.5	-24.9	36	0	0	0	111.7	W70 Q79 V106 I168 M170	W70-P159 HydrophobicContact CH2-CG 4.48Å; W70-P159 HydrophobicContact CZ3-CG 4.21Å; Q79-P159 VanDerWaalsContact O-CD 3.28Å; Q79-P159 WeakPolarHBondContact O-CD 3.16Å; V106-P159 HydrophobicContact CG1-CB 4.04Å; V106-P159 HydrophobicContact CG2-CB 3.81Å; V106-P159 HydrophobicContact CG2-CG 3.95Å; P159-I168 HydrophobicContact CB-CD1 3.85Å; P159-I168 HydrophobicContact CB-CG1 4.16Å; P159-I168 HydrophobicContact CB-CG2 4.18Å; P159-I168 HydrophobicContact CG-CD1 4.15Å; P159-I168 HydrophobicContact CG-CG2 3.69Å; P159-M170 HydrophobicContact CG-SD 3.81Å
160	L	93.1	Very high	95.7	Very high	74 Å²	74	41.4 Å²	41.4	39%	0.387	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	-43.4	174.8	-68.7	-178	0	0	0	111.6	S108 L110 L158	S108-L160 PolarHBondContact O-N 3.25Å; L110-L160 HydrophobicContact CD1-CD2 4Å; L110-L160 HydrophobicContact CD2-CD1 3.76Å; L110-L160 HydrophobicContact CD2-CG 4.48Å; L110-L160 HydrophobicContact CG-CD1 3.76Å; L110-L160 HydrophobicContact CG-CD2 3.88Å; L110-L160 HydrophobicContact CG-CG 3.93Å; L158-L160 PolarHBondContact O-N 2.78Å
161	A	95	Very high	95.9	Very high	37 Å²	37	40.8 Å²	40.8	31%	0.306	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	153.8	176.1	0	0	0	0	0	110.4	V106 T107 S108	V106-A161 CarbonylContact C-O 3.49Å; V106-A161 WeakPolarHBondContact CG1-O 3.16Å; T107-A161 PolarHBondContact N-O 2.62Å; T107-A161 VanDerWaalsContact OG1-C 3.23Å; T107-A161 WeakPolarHBondContact OG1-CB 3.3Å; T107-A161 PolarHBondContact OG1-O 3.48Å; S108-A161 PolarHBondContact N-O 3.03Å; S108-A161 PolarHBondContact O-N 2.81Å; S108-A161 WeakPolarHBondContact OG-CB 3.27Å; S108-A161 PolarHBondContact OG-N 2.82Å
162	W	96.8	Very high	96.1	Very high	65 Å²	65	39 Å²	39	25%	0.246	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	172.1	-178.5	55.9	91.2	0	0	0	110.1	S75 W105 T107 P164 I168	S75-W162 WeakPolarHBondContact O-CZ2 3.34Å; W105-W162 VanDerWaalsContact O-CA 3.26Å; W105-W162 WeakPolarHBondContact O-CA 3.48Å; W105-W162 WeakPolarHBondContact O-CB 3.32Å; T107-W162 PolarHBondContact OG1-N 3.34Å; W162-P164 WeakPolarHBondContact O-CD 3.09Å; W162-I168 HydrophobicContact CB-CG1 4.22Å; W162-I168 HydrophobicContact CD2-CD1 4.21Å; W162-I168 HydrophobicContact CD2-CG1 3.59Å; W162-I168 HydrophobicContact CE3-CD1 3.82Å; W162-I168 HydrophobicContact CE3-CG1 3.61Å; W162-I168 HydrophobicContact CG-CG1 3.87Å; W162-I168 HydrophobicContact CH2-CD1 4.44Å; W162-I168 HydrophobicContact CZ3-CD1 3.95Å; W162-I168 HydrophobicContact CZ3-CG1 4.25Å
163	N	97.1	Very high	96.2	Very high	15 Å²	15	39.1 Å²	39.1	8%	0.08	19%	0.187	C	C	.	.			trans	-54.4	121.3	177.7	-177.8	14.9	0	0	0	111.5	S103 W105 R165 G166	S103-N163 WeakPolarHBondContact O-CB 3.44Å; S103-N163 PolarHBondContact O-ND2 2.94Å; W105-N163 HydrophobicContact CD2-CB 3.87Å; W105-N163 VanDerWaalsContact CE2-CB 3.5Å; W105-N163 HydrophobicContact CE3-CB 4.41Å; W105-N163 HydrophobicContact CG-CB 4.32Å; W105-N163 HydrophobicContact CH2-CB 4.3Å; W105-N163 WeakPolarHBondContact CH2-ND2 3.43Å; W105-N163 HydrophobicContact CZ2-CB 3.71Å; W105-N163 VanDerWaalsContact CZ2-ND2 3.28Å; W105-N163 WeakPolarHBondContact CZ2-ND2 3.44Å; W105-N163 PolarHBondContact O-N 3.25Å; N163-R165 PolarHBondContact O-N 2.94Å; N163-R165 VanDerWaalsContact O-N 3.13Å; N163-R165 PolarHBondContact OD1-N 3.22Å; N163-R165 VanDerWaalsContact OD1-N 3.15Å; N163-G166 CarbonylContact O-C 3.59Å; N163-G166 PolarHBondContact O-N 3.16Å
164	P	95.3	Very high	96.3	Very high	122 Å²	122	35.5 Å²	35.5	79%	0.792	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65	-18	179.4	26.3	-35.9	0	0	0	113.4	W162	W162-P164 WeakPolarHBondContact O-CD 3.09Å
165	R	94.9	Very high	96.4	Very high	224 Å²	224	36.8 Å²	36.8	85%	0.845	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-1.7	176.2	-57.2	-174	-170.1	167	3.7	113.7	N163	N163-R165 PolarHBondContact O-N 2.94Å; N163-R165 VanDerWaalsContact O-N 3.13Å; N163-R165 PolarHBondContact OD1-N 3.22Å; N163-R165 VanDerWaalsContact OD1-N 3.15Å
166	G	94.7	Very high	96.3	Very high	22 Å²	22	36.8 Å²	36.8	23%	0.227	18%	0.178	C	C	.	.	S	Bend	trans	-139.8	-154.8	-177.6	0	0	0	0	0	112.6	N163	N163-G166 CarbonylContact O-C 3.59Å; N163-G166 PolarHBondContact O-N 3.16Å
167	R	95.8	Very high	96.2	Very high	113 Å²	113	37 Å²	37	43%	0.426	18%	0.182	S	C	.	.			trans	-116	178.8	179.9	-60.4	-177.8	179.7	-155.2	0.3	110.9	T71 S75 D104 W105 G169	T71-R167 HydrophobicContact CG2-CB 4.28Å; S75-R167 WeakPolarHBondContact OG-CB 3.12Å; D104-R167 VanDerWaalsContact CA-O 3.26Å; D104-R167 WeakPolarHBondContact CA-O 3.16Å; D104-R167 HydrophobicContact CB-CB 4.33Å; D104-R167 WeakPolarHBondContact CB-O 3.09Å; D104-R167 WeakPolarHBondContact OD1-CB 3.41Å; D104-R167 PolarHBondContact OD1-N 2.88Å; W105-R167 PolarHBondContact N-O 2.99Å; R167-G169 PolarHBondContact O-N 2.95Å
168	I	97.8	Very high	96	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.208	C	C	.	.			trans	-65.3	120.2	163.5	-65.9	172.5	0	0	0	108.4	W70 T71 P72 S75 Q79 V106 P159 W162	W70-I168 HydrophobicContact CE3-CG2 4.36Å; W70-I168 HydrophobicContact CH2-CG2 4.13Å; W70-I168 HydrophobicContact CZ3-CG2 3.69Å; T71-I168 WeakPolarHBondContact CA-O 3.45Å; T71-I168 WeakPolarHBondContact CB-O 3.34Å; T71-I168 VanDerWaalsContact CG2-O 3.29Å; T71-I168 WeakPolarHBondContact CG2-O 3.5Å; T71-I168 PolarHBondContact OG1-O 3.06Å; T71-I168 VanDerWaalsContact OG1-O 3.11Å; P72-I168 WeakPolarHBondContact CD-O 3.29Å; P72-I168 HydrophobicContact CG-CB 3.77Å; P72-I168 HydrophobicContact CG-CD1 4.1Å; P72-I168 HydrophobicContact CG-CG1 4.49Å; P72-I168 HydrophobicContact CG-CG2 3.91Å; S75-I168 PolarHBondContact OG-N 2.77Å; S75-I168 VanDerWaalsContact OG-N 3.11Å; Q79-I168 HydrophobicContact CB-CD1 4.01Å; Q79-I168 HydrophobicContact CG-CD1 4Å; V106-I168 HydrophobicContact CG2-CG2 3.86Å; P159-I168 HydrophobicContact CB-CD1 3.85Å; P159-I168 HydrophobicContact CB-CG1 4.16Å; P159-I168 HydrophobicContact CB-CG2 4.18Å; P159-I168 HydrophobicContact CG-CD1 4.15Å; P159-I168 HydrophobicContact CG-CG2 3.69Å; W162-I168 HydrophobicContact CB-CG1 4.22Å; W162-I168 HydrophobicContact CD2-CD1 4.21Å; W162-I168 HydrophobicContact CD2-CG1 3.59Å; W162-I168 HydrophobicContact CE3-CD1 3.82Å; W162-I168 HydrophobicContact CE3-CG1 3.61Å; W162-I168 HydrophobicContact CG-CG1 3.87Å; W162-I168 HydrophobicContact CH2-CD1 4.44Å; W162-I168 HydrophobicContact CZ3-CD1 3.95Å; W162-I168 HydrophobicContact CZ3-CG1 4.25Å
169	G	96.8	Very high	95.9	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.208	C	C	.	.			trans	-136.4	127.6	172.1	0	0	0	0	0	109.4	W70 W105 R167	W70-G169 WeakPolarHBondContact O-CA 3.3Å; W105-G169 WeakPolarHBondContact CA-O 3.24Å; R167-G169 PolarHBondContact O-N 2.95Å
170	M	97	Very high	95.3	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.005	24%	0.241	C	C	.	.	B	Isolated β-bridge	trans	-140	139.3	-179.7	-56.4	-173.1	77.3	0	0	113.5	W70 L81 T96 Q97 V106 F157 P159 I172	W70-M170 HydrophobicContact CE3-CB 4.1Å; W70-M170 HydrophobicContact CE3-CG 4.22Å; W70-M170 HydrophobicContact CE3-SD 4.41Å; W70-M170 HydrophobicContact CZ3-CG 4.28Å; W70-M170 HydrophobicContact CZ3-SD 4.04Å; W70-M170 PolarHBondContact N-O 2.84Å; W70-M170 PolarHBondContact O-N 3.2Å; L81-M170 HydrophobicContact CD2-CB 4.15Å; T96-M170 HydrophobicContact CG2-CE 4.06Å; Q97-M170 CarbonylContact O-C 3.59Å; Q97-M170 WeakPolarHBondContact O-CA 3.44Å; V106-M170 HydrophobicContact CB-CE 4.36Å; V106-M170 HydrophobicContact CB-CG 4.12Å; V106-M170 HydrophobicContact CB-SD 4.29Å; V106-M170 HydrophobicContact CG1-CE 4.46Å; V106-M170 HydrophobicContact CG2-CE 4.44Å; V106-M170 HydrophobicContact CG2-CG 3.46Å; V106-M170 VanDerWaalsContact CG2-CG 3.46Å; V106-M170 HydrophobicContact CG2-SD 3.74Å; F157-M170 HydrophobicContact CB-CE 4.15Å; F157-M170 HydrophobicContact CD1-CE 4.41Å; P159-M170 HydrophobicContact CG-SD 3.81Å; M170-I172 HydrophobicContact CE-CG2 4.28Å
171	R	97.3	Very high	94.9	Very high	3 Å²	3	46.6 Å²	46.6	1%	0.011	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	142.3	158.1	-69.4	175.7	-72.5	173.1	0.5	108.2	S59 R63 G68 T96 Q97 G98 A138	S59-R171 CarbonylContact O-C 3.57Å; S59-R171 WeakPolarHBondContact O-CA 2.96Å; R63-R171 VanDerWaalsContact O-CD 3.25Å; R63-R171 WeakPolarHBondContact O-CD 3.13Å; R63-R171 PolarHBondContact O-NH1 3.45Å; G68-R171 VanDerWaalsContact O-CD 3.25Å; G68-R171 WeakPolarHBondContact O-CD 3.32Å; G68-R171 PolarHBondContact O-NE 3.26Å; T96-R171 CarbonylContact C-O 3.5Å; T96-R171 WeakPolarHBondContact CA-O 3.44Å; Q97-R171 HydrophobicContact CB-CB 4.14Å; Q97-R171 VanDerWaalsContact CD-CZ 3.47Å; Q97-R171 PolarHBondContact N-O 3.23Å; Q97-R171 PolarHBondContact O-N 2.95Å; G98-R171 PolarHBondContact O-NE 2.8Å; G98-R171 PolarHBondContact O-NH2 2.87Å; A138-R171 PolarHBondContact O-NH2 3.29Å
172	I	97.3	Very high	94.7	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	154.1	-169.7	62.8	167	0	0	0	111.7	F44 S59 L61 L81 A95 T96 F157 M170	F44-I172 HydrophobicContact CE1-CD1 4.47Å; S59-I172 WeakPolarHBondContact O-CG1 3.25Å; S59-I172 PolarHBondContact O-N 3.3Å; L61-I172 PolarHBondContact N-O 3.11Å; L81-I172 HydrophobicContact CD2-CD1 3.87Å; L81-I172 HydrophobicContact CD2-CG1 4.11Å; L81-I172 HydrophobicContact CD2-CG2 4Å; L81-I172 HydrophobicContact CG-CD1 4.27Å; A95-I172 CarbonylContact O-C 3.2Å; A95-I172 VanDerWaalsContact O-CA 3.24Å; A95-I172 WeakPolarHBondContact O-CA 3.21Å; T96-I172 HydrophobicContact CG2-CG2 4.34Å; F157-I172 HydrophobicContact CD1-CG2 4.33Å; F157-I172 HydrophobicContact CD2-CD1 3.83Å; F157-I172 HydrophobicContact CD2-CG2 4.42Å; F157-I172 HydrophobicContact CE1-CG2 4.31Å; F157-I172 HydrophobicContact CE2-CB 4.46Å; F157-I172 HydrophobicContact CE2-CD1 3.53Å; F157-I172 HydrophobicContact CE2-CG2 4.42Å; F157-I172 HydrophobicContact CG-CG2 4.4Å; F157-I172 HydrophobicContact CZ-CB 4.37Å; F157-I172 HydrophobicContact CZ-CD1 4.24Å; F157-I172 HydrophobicContact CZ-CG2 4.36Å; M170-I172 HydrophobicContact CE-CG2 4.28Å
173	E	97.3	Very high	94.5	Very high	4 Å²	4	44.1 Å²	44.1	2%	0.019	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	150.5	164.2	-176.8	57.1	-89.9	0	0	108.7	P34 L35 A36 S37 L61 V94 A95 Y175	P34-E173 HydrophobicContact CB-CG 4.15Å; L35-E173 PolarHBondContact N-OE1 2.98Å; A36-E173 WeakPolarHBondContact CA-OE1 3.43Å; A36-E173 WeakPolarHBondContact CB-OE1 3.34Å; A36-E173 PolarHBondContact N-OE1 3.02Å; S37-E173 VanDerWaalsContact CB-OE2 3.24Å; S37-E173 WeakPolarHBondContact CB-OE2 3.45Å; S37-E173 PolarHBondContact N-OE1 3.34Å; S37-E173 PolarHBondContact N-OE2 2.76Å; S37-E173 PolarHBondContact OG-OE2 3.34Å; L61-E173 HydrophobicContact CB-CB 3.79Å; L61-E173 HydrophobicContact CD2-CB 3.76Å; L61-E173 HydrophobicContact CD2-CG 4.49Å; L61-E173 HydrophobicContact CG-CB 4.29Å; V94-E173 WeakPolarHBondContact CA-O 3.43Å; A95-E173 HydrophobicContact CB-CB 4.3Å; A95-E173 PolarHBondContact N-O 3.44Å; A95-E173 PolarHBondContact O-N 3.32Å; E173-Y175 HydrophobicContact CB-CE2 3.94Å; E173-Y175 HydrophobicContact CG-CD1 4.49Å; E173-Y175 HydrophobicContact CG-CD2 4.14Å; E173-Y175 HydrophobicContact CG-CE1 3.95Å; E173-Y175 HydrophobicContact CG-CE2 3.54Å; E173-Y175 VanDerWaalsContact CG-CZ 3.44Å
174	V	97.6	Very high	94.4	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	133.2	174.4	-177.1	0	0	0	0	107.1	L35 I83 V91 L155 F157	L35-V174 WeakPolarHBondContact CB-O 3.46Å; L35-V174 HydrophobicContact CD1-CG1 4.3Å; L35-V174 PolarHBondContact N-O 2.78Å; I83-V174 HydrophobicContact CG2-CG2 4.25Å; V91-V174 HydrophobicContact CG1-CG1 3.54Å; V91-V174 HydrophobicContact CG2-CG1 4.21Å; L155-V174 HydrophobicContact CD2-CG1 3.91Å; L155-V174 HydrophobicContact CD2-CG2 4.1Å; F157-V174 HydrophobicContact CZ-CG2 4.38Å
175	Y	97.4	Very high	94.5	Very high	48 Å²	48	39.6 Å²	39.6	19%	0.188	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	145.4	-179.7	-58.1	-95.6	0	0	0	110.6	D32 S33 P34 T92 A93 A95 H143 E173	D32-Y175 WeakPolarHBondContact O-CD1 3.32Å; S33-Y175 CarbonylContact O-C 3.35Å; S33-Y175 VanDerWaalsContact O-CA 3.28Å; S33-Y175 WeakPolarHBondContact O-CA 3.46Å; P34-Y175 HydrophobicContact CB-CD1 4.26Å; P34-Y175 HydrophobicContact CB-CE1 4.11Å; T92-Y175 PolarHBondContact N-O 2.85Å; T92-Y175 PolarHBondContact OG1-O 3.07Å; A93-Y175 HydrophobicContact CB-CD2 4.02Å; A93-Y175 HydrophobicContact CB-CG 4.36Å; A93-Y175 PolarHBondContact N-O 3.27Å; A93-Y175 PolarHBondContact O-N 2.74Å; A95-Y175 HydrophobicContact CB-CE2 3.87Å; H143-Y175 AromaticContact CD2-CE2 3.62Å; H143-Y175 AromaticContact NE2-CD2 3.86Å; H143-Y175 AromaticContact NE2-CE2 3.86Å; E173-Y175 HydrophobicContact CB-CE2 3.94Å; E173-Y175 HydrophobicContact CG-CD1 4.49Å; E173-Y175 HydrophobicContact CG-CD2 4.14Å; E173-Y175 HydrophobicContact CG-CE1 3.95Å; E173-Y175 HydrophobicContact CG-CE2 3.54Å; E173-Y175 VanDerWaalsContact CG-CZ 3.44Å
176	G	96.4	Very high	94.4	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	165.3	-155.3	-178.2	0	0	0	0	0	113.6	C31 S33 E90	C31-G176 WeakPolarHBondContact O-CA 3.22Å; S33-G176 PolarHBondContact N-O 3.38Å; S33-G176 PolarHBondContact O-N 2.82Å; E90-G176 CarbonylContact O-C 3.59Å; E90-G176 WeakPolarHBondContact O-CA 3.29Å
177	C	94.9	Very high	94.3	Very high	18 Å²	18	30.5 Å²	30.5	12%	0.122	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	169	178	64.7	0	0	0	0	112	P28 C31 M89 E90 Y179	P28-C177 HydrophobicContact CG-CB 4.25Å; C31-C177 HydrophobicContact CB-CB 3.98Å; C31-C177 WeakPolarHBondContact CB-SG 3.15Å; C31-C177 WeakPolarHBondContact SG-CB 3.46Å; C31-C177 PolarHBondContact SG-N 3.3Å; C31-C177 CovalentContact SG-SG 2.04Å; C31-C177 PolarHBondContact SG-SG 3.01Å; M89-C177 WeakPolarHBondContact CA-O 3.4Å; E90-C177 PolarHBondContact N-O 2.97Å; E90-C177 PolarHBondContact O-N 2.81Å; E90-C177 VanDerWaalsContact O-N 3.07Å; C177-Y179 PolarHBondContact O-N 2.88Å
178	A	93.3	Very high	94	Very high	68 Å²	68	26.2 Å²	26.2	56%	0.562	14%	0.142	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-65.3	132.4	178	0	0	0	0	0	110.7	M89	M89-A178 HydrophobicContact CE-CB 4.16Å; M89-A178 HydrophobicContact SD-CB 4.37Å
179	Y	91.1	Very high	93.6	Very high	40 Å²	40	34.2 Å²	34.2	16%	0.157	18%	0.179	C	C	.	.			trans	-106.9	120.6	179.8	177	-101.1	0	0	0	110.7	R88 E90 E151 C177 K211 E334 N335	R88-Y179 PolarHBondContact O-N 2.82Å; E90-Y179 HydrophobicContact CB-CD2 4.46Å; E151-Y179 HydrophobicContact CB-CD1 4.27Å; E151-Y179 HydrophobicContact CB-CE1 4.4Å; E151-Y179 HydrophobicContact CB-CG 4.43Å; E151-Y179 HydrophobicContact CG-CD1 3.97Å; E151-Y179 HydrophobicContact CG-CD2 3.7Å; E151-Y179 HydrophobicContact CG-CE1 3.98Å; E151-Y179 HydrophobicContact CG-CE2 3.72Å; E151-Y179 HydrophobicContact CG-CG 3.81Å; C177-Y179 PolarHBondContact O-N 2.88Å; Y179-K211 PolarHBondContact OH-NZ 2.82Å; Y179-K211 VanDerWaalsContact OH-NZ 3.12Å; Y179-E334 WeakPolarHBondContact CE1-OE1 3.49Å; Y179-E334 PolarHBondContact OH-OE2 3.19Å; Y179-N335 PolarHBondContact OH-ND2 2.88Å; Y179-N335 VanDerWaalsContact OH-ND2 3.08Å
180	K	85.2	Confident	93.4	Very high	159 Å²	159	34.2 Å²	34.2	69%	0.691	18%	0.179	S	C	*	.			trans	-82.1	121.8	176.2	-166.9	-176	179.9	-163.6	0	110	E182	K180-E182 VanDerWaalsContact CE-OE1 3.27Å; K180-E182 WeakPolarHBondContact CE-OE1 3.45Å; K180-E182 IonicContact NZ-OE1 2.73Å
181	S	84.3	Confident	93.1	Very high	39 Å²	39	34.3 Å²	34.3	27%	0.273	18%	0.18	S	C	.	.			trans	-123.9	118.4	-175.4	172	0	0	0	0	110.5	V183 E334	S181-V183 VanDerWaalsContact OG-CG2 3.26Å; S181-V183 WeakPolarHBondContact OG-CG2 3.43Å; S181-E334 WeakPolarHBondContact CB-OE1 3.08Å; S181-E334 PolarHBondContact OG-OE1 3.33Å
182	E	90	Very high	93	Very high	37 Å²	37	34.2 Å²	34.2	17%	0.173	18%	0.18	C	C	.	.			trans	-107.7	114.5	170.8	-59.7	-64.5	161.5	0	0	108.7	K180 E334 N335 T344 K348	K180-E182 VanDerWaalsContact CE-OE1 3.27Å; K180-E182 WeakPolarHBondContact CE-OE1 3.45Å; K180-E182 IonicContact NZ-OE1 2.73Å; E182-E334 WeakPolarHBondContact O-CA 3.02Å; E182-N335 PolarHBondContact N-OD1 3.01Å; E182-N335 PolarHBondContact O-N 3.48Å; E182-T344 HydrophobicContact CB-CG2 3.82Å; E182-K348 WeakPolarHBondContact OE2-CD 3.47Å; E182-K348 WeakPolarHBondContact OE2-CE 3.49Å; E182-K348 IonicContact OE2-NZ 3.58Å; E182-K348 PolarHBondContact OE2-NZ 3.49Å
183	V	93.7	Very high	92.8	Very high	13 Å²	13	35.2 Å²	35.2	8%	0.079	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	146.9	-173.9	-173.6	0	0	0	0	111.8	S181 W272 C332 L333 E334 K348 F362 C364	S181-V183 VanDerWaalsContact OG-CG2 3.26Å; S181-V183 WeakPolarHBondContact OG-CG2 3.43Å; V183-W272 HydrophobicContact CG1-CH2 3.81Å; V183-W272 HydrophobicContact CG1-CZ2 4.28Å; V183-W272 HydrophobicContact CG2-CH2 4.27Å; V183-W272 HydrophobicContact CG2-CZ2 4.29Å; V183-C332 HydrophobicContact CG1-CB 3.91Å; V183-L333 CarbonylContact C-O 3.58Å; V183-L333 WeakPolarHBondContact CA-O 3.38Å; V183-L333 WeakPolarHBondContact CG1-O 3.37Å; V183-E334 HydrophobicContact CG2-CB 4.21Å; V183-K348 WeakPolarHBondContact O-CE 3.15Å; V183-F362 CarbonylContact O-C 3.6Å; V183-F362 VanDerWaalsContact O-CA 3.32Å; V183-F362 WeakPolarHBondContact O-CA 3.46Å; V183-C364 HydrophobicContact CG1-CB 3.87Å
184	V	95.3	Very high	92.5	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	136.2	167.5	58.1	0	0	0	0	110	F186 L192 C332 L333 T344 V360 S361 F362	V184-F186 HydrophobicContact CB-CE2 4.42Å; V184-F186 HydrophobicContact CG1-CE2 3.65Å; V184-F186 HydrophobicContact CG1-CZ 4.02Å; V184-F186 HydrophobicContact CG2-CE2 4.04Å; V184-F186 HydrophobicContact CG2-CZ 4.02Å; V184-L192 HydrophobicContact CG1-CD1 4.44Å; V184-L192 HydrophobicContact CG2-CD1 4.19Å; V184-C332 CarbonylContact O-C 3.58Å; V184-C332 VanDerWaalsContact O-CA 3.27Å; V184-C332 WeakPolarHBondContact O-CA 3.29Å; V184-L333 HydrophobicContact CG1-CB 3.86Å; V184-L333 PolarHBondContact N-O 2.9Å; V184-L333 PolarHBondContact O-N 3.35Å; V184-T344 HydrophobicContact CB-CG2 4.43Å; V184-V360 HydrophobicContact CG2-CG1 3.22Å; V184-S361 CarbonylContact C-O 3.59Å; V184-S361 WeakPolarHBondContact CA-O 3.05Å; V184-F362 HydrophobicContact CB-CD1 4.42Å; V184-F362 HydrophobicContact CG2-CE1 4.46Å
185	Y	95.4	Very high	92.2	Very high	42 Å²	42	37.8 Å²	37.8	17%	0.165	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	136.4	179.4	169.8	-105	0	0	0	111	D187 H330 G331 S361 S363 P365	Y185-D187 HydrophobicContact CE1-CB 3.94Å; Y185-H330 PolarHBondContact OH-NE2 3.45Å; Y185-H330 VanDerWaalsContact OH-NE2 3.11Å; Y185-G331 WeakPolarHBondContact CD2-O 3.32Å; Y185-S361 PolarHBondContact N-O 3Å; Y185-S363 WeakPolarHBondContact CB-O 3.01Å; Y185-P365 HydrophobicContact CD1-CG 4.41Å; Y185-P365 HydrophobicContact CD2-CG 3.9Å; Y185-P365 HydrophobicContact CE1-CG 4.27Å; Y185-P365 HydrophobicContact CE2-CG 3.73Å; Y185-P365 HydrophobicContact CG-CG 4.21Å
186	F	94.5	Very high	91.6	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	128.5	175.7	-58.3	-90.3	0	0	0	110.4	V184 S190 L192 F312 F329 H330 G331 L333	V184-F186 HydrophobicContact CB-CE2 4.42Å; V184-F186 HydrophobicContact CG1-CE2 3.65Å; V184-F186 HydrophobicContact CG1-CZ 4.02Å; V184-F186 HydrophobicContact CG2-CE2 4.04Å; V184-F186 HydrophobicContact CG2-CZ 4.02Å; F186-S190 VanDerWaalsContact CA-OG 3.24Å; F186-S190 WeakPolarHBondContact CA-OG 3.26Å; F186-S190 WeakPolarHBondContact CD1-O 3.46Å; F186-L192 HydrophobicContact CE1-CG 3.98Å; F186-L192 HydrophobicContact CZ-CD1 4.06Å; F186-L192 HydrophobicContact CZ-CG 3.98Å; F186-F312 WeakPolarHBondContact CE1-O 3.18Å; F186-F312 HydrophobicContact CZ-CB 4.35Å; F186-F329 HydrophobicContact CB-CD1 4.28Å; F186-F329 VanDerWaalsContact CB-O 3.3Å; F186-F329 WeakPolarHBondContact CB-O 3.34Å; F186-F329 HydrophobicContact CD2-CD1 4.1Å; F186-F329 HydrophobicContact CD2-CE1 4.46Å; F186-F329 HydrophobicContact CG-CD1 4.44Å; F186-H330 WeakPolarHBondContact O-CA 3.36Å; F186-H330 PolarHBondContact O-CD2 3.33Å; F186-G331 PolarHBondContact N-O 3.13Å; F186-G331 PolarHBondContact O-N 2.85Å; F186-L333 HydrophobicContact CD2-CD1 4.37Å; F186-L333 HydrophobicContact CD2-CG 4.1Å; F186-L333 HydrophobicContact CE2-CB 4.12Å; F186-L333 HydrophobicContact CE2-CD1 3.52Å; F186-L333 HydrophobicContact CE2-CG 3.58Å; F186-L333 HydrophobicContact CZ-CD1 4.07Å
187	D	91.8	Very high	90.6	Very high	55 Å²	55	41.4 Å²	41.4	29%	0.294	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	6.6	-177.2	65.2	-2.8	0	0	0	114	Y185 Q189 S190	Y185-D187 HydrophobicContact CE1-CB 3.94Å; D187-Q189 VanDerWaalsContact C-N 3.34Å; D187-Q189 WeakPolarHBondContact OD1-CA 3.16Å; D187-Q189 PolarHBondContact OD1-N 2.77Å; D187-S190 PolarHBondContact N-OG 2.87Å; D187-S190 PolarHBondContact OD1-N 2.95Å; D187-S190 PolarHBondContact OD1-OG 2.82Å
188	G	90.6	Very high	89.2	Confident	23 Å²	23	49 Å²	49	24%	0.237	25%	0.254	C	S	.	.	S	Bend	trans	83.7	3	-172	0	0	0	0	0	114.5	S328 F329	G188-S328 VanDerWaalsContact O-CB 3.29Å; G188-S328 WeakPolarHBondContact O-CB 3.5Å; G188-F329 WeakPolarHBondContact CA-O 3.23Å; G188-F329 PolarHBondContact N-O 3.4Å
189	Q	89.2	Confident	87.5	Confident	168 Å²	168	53.6 Å²	53.6	79%	0.785	26%	0.261	S	S	*	.	S	Bend	trans	-127.9	-24.6	173.3	-58.5	-177.1	19.5	0	0	112.4	D187	D187-Q189 VanDerWaalsContact C-N 3.34Å; D187-Q189 WeakPolarHBondContact OD1-CA 3.16Å; D187-Q189 PolarHBondContact OD1-N 2.77Å
190	S	90.8	Very high	85.6	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.293	C	S	.	.			trans	-78.7	153.5	175.5	62.6	0	0	0	0	113.2	F186 D187 M357	F186-S190 VanDerWaalsContact CA-OG 3.24Å; F186-S190 WeakPolarHBondContact CA-OG 3.26Å; F186-S190 WeakPolarHBondContact CD1-O 3.46Å; D187-S190 PolarHBondContact N-OG 2.87Å; D187-S190 PolarHBondContact OD1-N 2.95Å; D187-S190 PolarHBondContact OD1-OG 2.82Å; S190-M357 CarbonylContact C-O 3.55Å; S190-M357 WeakPolarHBondContact CA-O 3.38Å; S190-M357 WeakPolarHBondContact CB-O 3.38Å
191	A	92.6	Very high	84	Confident	4 Å²	4	57.1 Å²	57.1	3%	0.033	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	156.7	173.5	0	0	0	0	0	111.3	F312 L316 M357	A191-F312 CarbonylContact C-O 3.57Å; A191-F312 WeakPolarHBondContact CA-O 3.32Å; A191-L316 HydrophobicContact CB-CD2 4.13Å; A191-M357 PolarHBondContact N-O 2.91Å; A191-M357 PolarHBondContact O-N 2.97Å
192	L	93.6	Very high	82.6	Confident	0 Å²	0	62 Å²	62	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	135.8	169	-64.7	-177.9	0	0	0	109.4	V184 F186 S311 F312 A347 I354 M356 V360	V184-L192 HydrophobicContact CG1-CD1 4.44Å; V184-L192 HydrophobicContact CG2-CD1 4.19Å; F186-L192 HydrophobicContact CE1-CG 3.98Å; F186-L192 HydrophobicContact CZ-CD1 4.06Å; F186-L192 HydrophobicContact CZ-CG 3.98Å; L192-S311 CarbonylContact O-C 3.54Å; L192-S311 VanDerWaalsContact O-CA 3.23Å; L192-S311 WeakPolarHBondContact O-CA 3.33Å; L192-F312 HydrophobicContact CB-CB 4.36Å; L192-F312 PolarHBondContact N-O 3.49Å; L192-F312 PolarHBondContact O-N 2.84Å; L192-A347 HydrophobicContact CD1-CB 4.13Å; L192-A347 HydrophobicContact CD2-CB 4.27Å; L192-I354 HydrophobicContact CD2-CG2 4.29Å; L192-M356 HydrophobicContact CD2-CB 4.16Å; L192-M356 HydrophobicContact CD2-CG 3.56Å; L192-M356 HydrophobicContact CD2-SD 4.32Å; L192-V360 HydrophobicContact CD2-CG1 4.29Å; L192-V360 HydrophobicContact CD2-CG2 4.09Å
193	L	93.1	Very high	80.9	Confident	22 Å²	22	63.5 Å²	63.5	12%	0.115	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	120.6	169.7	-177.1	61.8	0	0	0	109	E309 L316 I354 L355	L193-E309 HydrophobicContact CD1-CB 3.97Å; L193-L316 HydrophobicContact CB-CD1 3.66Å; L193-L316 HydrophobicContact CD1-CD1 3.91Å; L193-L316 HydrophobicContact CD2-CD1 3.84Å; L193-L316 HydrophobicContact CG-CD1 4.01Å; L193-I354 WeakPolarHBondContact O-CA 3.35Å; L193-L355 HydrophobicContact CB-CB 4.21Å; L193-L355 HydrophobicContact CD2-CD2 4.3Å; L193-L355 PolarHBondContact N-O 3.12Å; L193-L355 PolarHBondContact O-N 2.95Å
194	Y	92.3	Very high	79.3	Confident	8 Å²	8	69 Å²	69	3%	0.031	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	124.5	175.5	175.2	-128.8	0	0	0	110.4	L196 E309 I310 Y338 V343 L346 Q353 I354	Y194-L196 HydrophobicContact CD1-CD2 4.29Å; Y194-L196 HydrophobicContact CE1-CD2 3.69Å; Y194-L196 HydrophobicContact CE1-CG 4.31Å; Y194-E309 WeakPolarHBondContact O-CA 3.17Å; Y194-I310 HydrophobicContact CD1-CG2 3.81Å; Y194-I310 HydrophobicContact CG-CG2 4.35Å; Y194-I310 PolarHBondContact N-O 3.32Å; Y194-I310 PolarHBondContact O-N 3.15Å; Y194-Y338 HydrophobicContact CE1-CD1 4.16Å; Y194-Y338 HydrophobicContact CE1-CG 4.43Å; Y194-V343 HydrophobicContact CD1-CG2 4.2Å; Y194-V343 HydrophobicContact CG-CG2 4.44Å; Y194-L346 HydrophobicContact CD2-CD1 4.35Å; Y194-L346 HydrophobicContact CE2-CD1 3.82Å; Y194-Q353 HydrophobicContact CD2-CB 4.34Å; Y194-Q353 HydrophobicContact CE2-CB 4.07Å; Y194-I354 HydrophobicContact CD2-CD1 3.47Å; Y194-I354 VanDerWaalsContact CD2-CD1 3.47Å; Y194-I354 HydrophobicContact CD2-CG1 4.34Å; Y194-I354 HydrophobicContact CE2-CD1 4.48Å; Y194-I354 HydrophobicContact CG-CD1 3.91Å
195	T	90.5	Very high	78.4	Confident	49 Å²	49	74.8 Å²	74.8	30%	0.301	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	119.3	175.5	-52.6	0	0	0	0	110.1	F308 E309 Q353	T195-F308 CarbonylContact C-O 3.44Å; T195-F308 WeakPolarHBondContact CA-O 3.45Å; T195-E309 HydrophobicContact CG2-CG 4.48Å; T195-Q353 PolarHBondContact N-O 2.82Å
196	L	84.3	Confident	77.7	Confident	23 Å²	23	73.6 Å²	73.6	12%	0.12	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-72.3	144.9	178.9	-64.1	154.2	0	0	0	110.8	Y194 K198 F308 Y338	Y194-L196 HydrophobicContact CD1-CD2 4.29Å; Y194-L196 HydrophobicContact CE1-CD2 3.69Å; Y194-L196 HydrophobicContact CE1-CG 4.31Å; L196-K198 PolarHBondContact O-N 2.85Å; L196-F308 HydrophobicContact CB-CB 4.13Å; L196-F308 HydrophobicContact CB-CD1 4.3Å; L196-F308 WeakPolarHBondContact CB-O 3.44Å; L196-F308 PolarHBondContact N-O 2.96Å; L196-Y338 HydrophobicContact CD2-CD1 3.66Å; L196-Y338 HydrophobicContact CD2-CE1 3.24Å; L196-Y338 HydrophobicContact CG-CE1 4.49Å
197	D	75.9	Confident	77.6	Confident	102 Å²	102	75.2 Å²	75.2	55%	0.545	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-64	130.3	175.4	-71.3	-28.8	0	0	0	110.6	K199 Q353	D197-K199 PolarHBondContact O-N 3.45Å; D197-Q353 PolarHBondContact OD1-NE2 2.85Å
198	K	64.9	Low	77.6	Confident	176 Å²	176	72.8 Å²	72.8	77%	0.765	37%	0.369	S	S	*	.			trans	-70.8	29.1	-174.6	-61.4	-178.3	178.5	179.4	0	115.1	L196	L196-K198 PolarHBondContact O-N 2.85Å
199	K	59.1	Low	77.9	Confident	165 Å²	165	73.8 Å²	73.8	72%	0.717	37%	0.372	S	S	*	.			trans	-69.3	133.8	176.8	-76.5	-175.9	179.6	175.8	0	109.5	D197 L201	D197-K199 PolarHBondContact O-N 3.45Å; K199-L201 PolarHBondContact O-N 2.75Å
200	P	50	Low	78.2	Confident	129 Å²	129	66 Å²	66	84%	0.838	34%	0.335	S	S	*	.	S	Bend	trans	-79.1	23.8	-169.2	33.3	-36.6	0	0	0	114.5
201	L	51.5	Low	78.5	Confident	144 Å²	144	67.6 Å²	67.6	75%	0.754	34%	0.342	S	S	*	.			trans	-96.9	110.5	167.6	-83.9	105.2	0	0	0	108.3	K199 P203	K199-L201 PolarHBondContact O-N 2.75Å; L201-P203 WeakPolarHBondContact O-CD 3.24Å
202	K	54.9	Low	78.7	Confident	143 Å²	143	67.4 Å²	67.4	62%	0.622	34%	0.341	S	S	*	.			trans	-48.9	121.8	160.5	-69.1	175.9	176.6	173.4	0	107.2	I204 N303	K202-I204 PolarHBondContact O-N 2.81Å; K202-I204 VanDerWaalsContact O-N 3.1Å; K202-N303 PolarHBondContact NZ-OD1 3.35Å
203	P	55.5	Low	78.8	Confident	68 Å²	68	68.3 Å²	68.3	44%	0.442	35%	0.345	S	S	.	.			trans	-60.9	120.8	175.8	22.2	-29.1	0	0	0	107.9	L201 R205 D206	L201-P203 WeakPolarHBondContact O-CD 3.24Å; P203-R205 WeakPolarHBondContact CB-O 3.26Å; P203-R205 PolarHBondContact O-N 3.4Å; P203-D206 WeakPolarHBondContact CG-OD1 3.18Å
204	I	60	Low	78.9	Confident	128 Å²	128	67.2 Å²	67.2	66%	0.656	34%	0.339	S	S	*	.	S	Bend	trans	-59.8	-20.6	170.4	-61.3	165.5	0	0	0	109.7	K202	K202-I204 PolarHBondContact O-N 2.81Å; K202-I204 VanDerWaalsContact O-N 3.1Å
205	R	75	Confident	78.8	Confident	121 Å²	121	68.9 Å²	68.9	46%	0.457	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	125.8	-178.6	-172.4	-176.7	-173.6	178.1	-3.8	111.3	P203 V207 E278 L279 L280	P203-R205 WeakPolarHBondContact CB-O 3.26Å; P203-R205 PolarHBondContact O-N 3.4Å; R205-V207 HydrophobicContact CG-CG2 3.73Å; R205-V207 VanDerWaalsContact NE-CG2 3.28Å; R205-E278 IonicContact CZ-OE1 2.67Å; R205-E278 IonicContact NH2-OE1 2.59Å; R205-E278 PolarHBondContact NH2-OE1 3.42Å; R205-L279 CarbonylContact C-O 3.52Å; R205-L279 VanDerWaalsContact CA-O 3.24Å; R205-L279 WeakPolarHBondContact CA-O 3.32Å; R205-L280 HydrophobicContact CB-CD2 3.72Å; R205-L280 HydrophobicContact CG-CD2 3.48Å; R205-L280 VanDerWaalsContact CG-CD2 3.48Å; R205-L280 HydrophobicContact CG-CG 3.97Å
206	D	82.3	Confident	78.9	Confident	18 Å²	18	70.4 Å²	70.4	10%	0.096	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	123.8	165.6	-86.7	-30.1	0	0	0	109.1	P203 R224 E278 L279 Y338 N339	P203-D206 WeakPolarHBondContact CG-OD1 3.18Å; D206-R224 IonicContact OD2-NH1 3.03Å; D206-R224 PolarHBondContact OD2-NH1 3.13Å; D206-E278 WeakPolarHBondContact O-CA 3.24Å; D206-L279 HydrophobicContact CB-CB 4.14Å; D206-L279 HydrophobicContact CB-CD1 4.04Å; D206-L279 PolarHBondContact N-O 2.83Å; D206-L279 PolarHBondContact O-N 2.03Å; D206-Y338 PolarHBondContact OD1-OH 2.85Å; D206-Y338 PolarHBondContact OD2-OH 3.42Å; D206-N339 WeakPolarHBondContact CA-OD1 3.45Å; D206-N339 PolarHBondContact OD1-ND2 2.94Å
207	V	90.8	Very high	79.3	Confident	33 Å²	33	70.7 Å²	70.7	20%	0.2	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	118.9	177.6	-175.4	0	0	0	0	109.1	R205 L276 I277 E278 N339	R205-V207 HydrophobicContact CG-CG2 3.73Å; R205-V207 VanDerWaalsContact NE-CG2 3.28Å; V207-L276 HydrophobicContact CG1-CD1 3.84Å; V207-I277 WeakPolarHBondContact CA-O 3.32Å; V207-E278 HydrophobicContact CG1-CG 4.44Å; V207-N339 PolarHBondContact N-OD1 3.36Å; V207-N339 PolarHBondContact O-N 3.25Å; V207-N339 PolarHBondContact O-OD1 3.03Å
208	I	93.3	Very high	80.1	Confident	5 Å²	5	68.1 Å²	68.1	3%	0.026	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	121.5	175.7	-51	175.9	0	0	0	107.8	L222 L276 I277 I310 Y337 Y338	I208-L222 HydrophobicContact CD1-CD1 4.45Å; I208-L222 HydrophobicContact CD1-CD2 4.32Å; I208-L222 HydrophobicContact CG2-CD2 4.04Å; I208-L276 WeakPolarHBondContact O-CA 3.5Å; I208-I277 HydrophobicContact CB-CB 4.3Å; I208-I277 PolarHBondContact N-O 3.11Å; I208-I277 PolarHBondContact O-N 3.37Å; I208-I310 HydrophobicContact CD1-CD1 4.17Å; I208-Y337 WeakPolarHBondContact CA-O 3.49Å; I208-Y338 HydrophobicContact CD1-CD2 4.22Å; I208-Y338 HydrophobicContact CD1-CE2 4.06Å; I208-Y338 HydrophobicContact CG1-CD2 3.79Å; I208-Y338 HydrophobicContact CG1-CE2 3.92Å
209	S	95.8	Very high	81.5	Confident	44 Å²	44	59.8 Å²	59.8	31%	0.308	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	131.1	177.6	176.9	0	0	0	0	109.5	V275 Y337	S209-V275 WeakPolarHBondContact CA-O 3.35Å; S209-Y337 PolarHBondContact N-O 3.49Å; S209-Y337 PolarHBondContact O-N 2.93Å
210	L	96.2	Very high	83.2	Confident	3 Å²	3	52 Å²	52	2%	0.016	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	158.3	175.7	60	85.1	0	0	0	110.6	F212 L221 L222 V275 L333 L336	L210-F212 HydrophobicContact CD1-CB 4.08Å; L210-F212 HydrophobicContact CD1-CD1 4.17Å; L210-L221 HydrophobicContact CD1-CD2 4.39Å; L210-L222 HydrophobicContact CD2-CD2 4.43Å; L210-V275 HydrophobicContact CD1-CB 3.96Å; L210-V275 HydrophobicContact CD1-CG2 4.1Å; L210-V275 HydrophobicContact CG-CB 4.26Å; L210-V275 PolarHBondContact N-O 2.91Å; L210-V275 PolarHBondContact O-N 2.85Å; L210-L333 HydrophobicContact CD1-CD2 4.29Å; L210-L336 HydrophobicContact CB-CD1 3.72Å; L210-L336 HydrophobicContact CD2-CD1 3.65Å; L210-L336 HydrophobicContact CG-CD1 4.33Å
211	K	96.6	Very high	85.3	Confident	34 Å²	34	45.9 Å²	45.9	15%	0.148	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	143.4	159.6	-72.8	175.8	178.2	-179.7	0	108.7	E151 Y179 W272 H273 L333 E334	E151-K211 IonicContact OE1-NZ 3.82Å; E151-K211 PolarHBondContact OE1-NZ 3.22Å; E151-K211 IonicContact OE2-NZ 2.72Å; E151-K211 PolarHBondContact OE2-NZ 3.08Å; Y179-K211 PolarHBondContact OH-NZ 2.82Å; Y179-K211 VanDerWaalsContact OH-NZ 3.12Å; K211-W272 HydrophobicContact CB-CE3 4Å; K211-H273 CarbonylContact C-O 3.27Å; K211-H273 WeakPolarHBondContact CA-O 3.24Å; K211-L333 CarbonylContact O-C 3.53Å; K211-L333 VanDerWaalsContact O-CA 3.31Å; K211-L333 WeakPolarHBondContact O-CA 3.48Å; K211-E334 HydrophobicContact CB-CB 3.98Å; K211-E334 HydrophobicContact CB-CG 4.23Å; K211-E334 HydrophobicContact CD-CG 4.49Å; K211-E334 WeakPolarHBondContact CD-OE2 3.09Å; K211-E334 PolarHBondContact N-O 3.44Å; K211-E334 PolarHBondContact O-N 2.82Å
212	F	97	Very high	87.3	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	151.6	174.5	77.6	-84.5	0	0	0	111.8	L210 A214 L221 L236 L241 L267 W272 H273 V275 F329 C332 L333	L210-F212 HydrophobicContact CD1-CB 4.08Å; L210-F212 HydrophobicContact CD1-CD1 4.17Å; F212-A214 HydrophobicContact CD2-CB 4.25Å; F212-A214 HydrophobicContact CE2-CB 4.19Å; F212-L221 HydrophobicContact CB-CD2 3.9Å; F212-L221 HydrophobicContact CD1-CD2 3.71Å; F212-L221 HydrophobicContact CD2-CD2 4.03Å; F212-L221 HydrophobicContact CE1-CD2 4.22Å; F212-L221 HydrophobicContact CG-CD2 3.6Å; F212-L236 HydrophobicContact CE2-CD1 4.4Å; F212-L241 HydrophobicContact CE1-CD1 4.46Å; F212-L241 HydrophobicContact CE1-CD2 4.11Å; F212-L241 HydrophobicContact CZ-CD1 4.36Å; F212-L267 HydrophobicContact CE2-CB 4.17Å; F212-L267 HydrophobicContact CZ-CB 3.9Å; F212-L267 HydrophobicContact CZ-CD1 4.09Å; F212-L267 HydrophobicContact CZ-CG 4.4Å; F212-W272 VanDerWaalsContact C-CE3 3.47Å; F212-W272 CarbonylContact O-C 3.54Å; F212-W272 WeakPolarHBondContact O-CA 3.43Å; F212-H273 HydrophobicContact CD1-CB 4.13Å; F212-H273 HydrophobicContact CE1-CB 3.66Å; F212-H273 HydrophobicContact CZ-CB 3.9Å; F212-H273 PolarHBondContact N-O 2.73Å; F212-H273 PolarHBondContact O-N 3.34Å; F212-V275 HydrophobicContact CD1-CG2 3.69Å; F212-V275 HydrophobicContact CE1-CG2 3.6Å; F212-F329 HydrophobicContact CB-CZ 4.15Å; F212-F329 HydrophobicContact CD2-CE2 4.2Å; F212-F329 HydrophobicContact CD2-CZ 4.12Å; F212-C332 CarbonylContact C-O 3.5Å; F212-C332 VanDerWaalsContact CA-O 3.27Å; F212-C332 WeakPolarHBondContact CA-O 3.24Å; F212-L333 HydrophobicContact CB-CD2 3.46Å; F212-L333 VanDerWaalsContact CB-CD2 3.46Å
213	K	95.4	Very high	89.1	Confident	19 Å²	19	33.2 Å²	33.2	8%	0.083	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	112.2	171.9	171.1	170.3	168.8	145.2	0	108.4	Q270 H271 W272 G331 C332	K213-Q270 WeakPolarHBondContact CD-O 3.31Å; K213-Q270 WeakPolarHBondContact CE-O 3.42Å; K213-Q270 PolarHBondContact NZ-O 2.75Å; K213-H271 WeakPolarHBondContact CA-O 3.47Å; K213-W272 HydrophobicContact CB-CD2 3.86Å; K213-W272 HydrophobicContact CB-CE3 3.71Å; K213-W272 HydrophobicContact CB-CG 4.48Å; K213-W272 HydrophobicContact CB-CH2 4.26Å; K213-W272 HydrophobicContact CB-CZ2 4.38Å; K213-W272 HydrophobicContact CB-CZ3 3.91Å; K213-G331 CarbonylContact O-C 3.56Å; K213-G331 WeakPolarHBondContact O-CA 3.49Å; K213-C332 HydrophobicContact CB-CB 4.44Å; K213-C332 PolarHBondContact N-O 3.26Å; K213-C332 PolarHBondContact O-N 3.34Å
214	A	94.9	Very high	90.5	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	135.3	-174.7	0	0	0	0	0	112	F212 L236 F329	F212-A214 HydrophobicContact CD2-CB 4.25Å; F212-A214 HydrophobicContact CE2-CB 4.19Å; A214-L236 HydrophobicContact CB-CD2 3.52Å; A214-F329 HydrophobicContact CB-CE2 4.03Å
215	M	91.9	Very high	91.6	Very high	42 Å²	42	29.5 Å²	29.5	21%	0.207	14%	0.144	C	C	.	.	S	Bend	trans	-97.1	-17.6	171.1	-59.3	-60.8	-178.7	0	0	112	Q270 H330 P365 P367	M215-Q270 HydrophobicContact SD-CG 4.31Å; M215-H330 PolarHBondContact N-O 3.01Å; M215-P365 WeakPolarHBondContact CE-O 3.48Å; M215-P367 HydrophobicContact CE-CG 4.1Å; M215-P367 HydrophobicContact SD-CG 4.02Å
216	Q	91.8	Very high	91.5	Very high	82 Å²	82	23.9 Å²	23.9	38%	0.383	12%	0.124	S	C	.	.	S	Bend	trans	-128	154.3	176.2	-65.8	-173.9	-2.5	0	0	110.3	N218 L236 H330	Q216-N218 VanDerWaalsContact C-N 3.25Å; Q216-N218 PolarHBondContact O-N 2.97Å; Q216-L236 VanDerWaalsContact O-CD2 3.27Å; Q216-L236 WeakPolarHBondContact O-CD2 3.28Å; Q216-H330 HydrophobicContact CB-CB 4.45Å; Q216-H330 HydrophobicContact CG-CB 4.01Å; Q216-H330 PolarHBondContact NE2-ND1 3.04Å; Q216-H330 VanDerWaalsContact NE2-ND1 3.15Å
217	S	92.5	Very high	90.7	Very high	29 Å²	29	30.1 Å²	30.1	20%	0.203	15%	0.153	C	C	.	.	S	Bend	trans	-78.5	-5	-178.7	58.9	0	0	0	0	114.3	I237 K238 G239	S217-I237 CarbonylContact O-C 3.59Å; S217-K238 WeakPolarHBondContact O-CA 3.44Å; S217-K238 PolarHBondContact O-N 2.86Å; S217-G239 PolarHBondContact O-N 2.74Å
218	N	93.4	Very high	89.4	Confident	48 Å²	48	34.8 Å²	34.8	26%	0.257	17%	0.172	S	C	.	.			trans	-136.7	140.1	179.8	-60.4	-86	0	0	0	111	Q216 L236 I237 K238	Q216-N218 VanDerWaalsContact C-N 3.25Å; Q216-N218 PolarHBondContact O-N 2.97Å; N218-L236 CarbonylContact C-O 3.58Å; N218-L236 WeakPolarHBondContact CA-O 3.35Å; N218-I237 WeakPolarHBondContact OD1-CA 3.41Å; N218-K238 PolarHBondContact OD1-N 3.36Å
219	G	93.9	Very high	88.1	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	164.9	148.1	175.4	0	0	0	0	0	114.3	L221 L236 K327	G219-L221 WeakPolarHBondContact O-CD1 3.25Å; G219-L236 PolarHBondContact N-O 2.67Å; G219-L236 PolarHBondContact O-N 3.02Å; G219-K327 WeakPolarHBondContact CA-O 3.32Å
220	I	93.8	Very high	87.1	Confident	3 Å²	3	34.4 Å²	34.4	2%	0.015	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	115	177.6	-61.4	176	0	0	0	110.6	H223 T233 E235 G313 G314 I315 R326 K327 F329	I220-H223 HydrophobicContact CG2-CB 4.15Å; I220-T233 HydrophobicContact CG2-CG2 4.17Å; I220-E235 HydrophobicContact CG1-CG 4.04Å; I220-G313 CarbonylContact O-C 3.56Å; I220-G313 VanDerWaalsContact O-C 3.27Å; I220-G314 PolarHBondContact O-N 3.2Å; I220-I315 HydrophobicContact CD1-CD1 3.4Å; I220-I315 VanDerWaalsContact CD1-CD1 3.4Å; I220-I315 HydrophobicContact CD1-CG1 3.55Å; I220-I315 HydrophobicContact CG2-CG1 4.3Å; I220-R326 HydrophobicContact CD1-CB 3.76Å; I220-R326 HydrophobicContact CG1-CB 4.39Å; I220-K327 PolarHBondContact N-O 3.12Å; I220-K327 VanDerWaalsContact N-O 3.1Å; I220-F329 WeakPolarHBondContact O-CB 3.28Å
221	L	95	Very high	86.4	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	-47.1	179.1	-82.8	72.3	0	0	0	111.2	L210 F212 G219 L234 L236 L241 F312 G313 F329	L210-L221 HydrophobicContact CD1-CD2 4.39Å; F212-L221 HydrophobicContact CB-CD2 3.9Å; F212-L221 HydrophobicContact CD1-CD2 3.71Å; F212-L221 HydrophobicContact CD2-CD2 4.03Å; F212-L221 HydrophobicContact CE1-CD2 4.22Å; F212-L221 HydrophobicContact CG-CD2 3.6Å; G219-L221 WeakPolarHBondContact O-CD1 3.25Å; L221-L234 HydrophobicContact CB-CB 4.45Å; L221-L234 HydrophobicContact CB-CD2 4.12Å; L221-L234 HydrophobicContact CB-CG 4.41Å; L221-L234 HydrophobicContact CD2-CD2 4.09Å; L221-L234 PolarHBondContact N-O 2.77Å; L221-L236 HydrophobicContact CD1-CB 3.85Å; L221-L241 HydrophobicContact CD1-CD1 4.22Å; L221-L241 HydrophobicContact CD2-CD1 4.07Å; L221-F312 CarbonylContact O-C 3.42Å; L221-F312 VanDerWaalsContact O-CA 3.3Å; L221-F312 WeakPolarHBondContact O-CA 3.24Å; L221-G313 PolarHBondContact O-N 3.16Å; L221-F329 HydrophobicContact CD1-CD2 3.55Å; L221-F329 HydrophobicContact CD1-CE2 3.78Å; L221-F329 HydrophobicContact CD1-CG 4.27Å; L221-F329 HydrophobicContact CG-CD2 3.97Å; L221-F329 HydrophobicContact CG-CE2 4.04Å; L221-F329 HydrophobicContact CG-CG 4.33Å; L221-F329 HydrophobicContact CG-CZ 4.46Å
222	L	93.8	Very high	85.9	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	151	175.4	74	91.8	0	0	0	111.6	I208 L210 I232 T233 L234 I277 I310 S311 F312	I208-L222 HydrophobicContact CD1-CD1 4.45Å; I208-L222 HydrophobicContact CD1-CD2 4.32Å; I208-L222 HydrophobicContact CG2-CD2 4.04Å; L210-L222 HydrophobicContact CD2-CD2 4.43Å; L222-I232 HydrophobicContact CD1-CG2 4.16Å; L222-T233 WeakPolarHBondContact O-CA 3.43Å; L222-L234 HydrophobicContact CD1-CB 4.28Å; L222-L234 HydrophobicContact CD2-CB 3.82Å; L222-L234 HydrophobicContact CD2-CD2 3.87Å; L222-L234 HydrophobicContact CG-CB 3.58Å; L222-L234 HydrophobicContact CG-CD2 4.47Å; L222-L234 PolarHBondContact N-O 3.05Å; L222-L234 PolarHBondContact O-N 2.92Å; L222-I277 HydrophobicContact CD2-CD1 4.28Å; L222-I310 HydrophobicContact CD1-CD1 4.32Å; L222-S311 CarbonylContact C-O 3.56Å; L222-S311 VanDerWaalsContact CA-O 3.22Å; L222-S311 WeakPolarHBondContact CA-O 3.34Å; L222-F312 HydrophobicContact CB-CD1 3.65Å; L222-F312 HydrophobicContact CB-CE1 3.79Å; L222-F312 HydrophobicContact CD2-CE1 4.42Å
223	H	91.3	Very high	85.6	Confident	20 Å²	20	35.2 Å²	35.2	9%	0.093	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	137.8	174.3	-178.7	68.3	0	0	0	111.1	I220 I232 T233 S311 I315	I220-H223 HydrophobicContact CG2-CB 4.15Å; H223-I232 CarbonylContact C-O 3.56Å; H223-I232 WeakPolarHBondContact CA-O 3.4Å; H223-T233 PolarHBondContact ND1-OG1 2.81Å; H223-S311 PolarHBondContact N-O 3.14Å; H223-S311 PolarHBondContact O-N 3.29Å; H223-S311 PolarHBondContact O-OG 2.85Å; H223-I315 HydrophobicContact CB-CG1 3.83Å
224	R	86.8	Confident	85.5	Confident	19 Å²	19	34.3 Å²	34.3	7%	0.072	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	119.7	173.6	-177.8	169.8	179.7	-148.2	-4.8	108.6	D206 H231 I232 L306 N307 E309 I310 Y338	D206-R224 IonicContact OD2-NH1 3.03Å; D206-R224 PolarHBondContact OD2-NH1 3.13Å; R224-H231 CarbonylContact O-C 3.47Å; R224-H231 WeakPolarHBondContact O-CA 3.16Å; R224-H231 WeakPolarHBondContact O-CB 3.34Å; R224-I232 PolarHBondContact N-O 3.3Å; R224-I232 PolarHBondContact O-N 3.14Å; R224-L306 HydrophobicContact CG-CB 4.15Å; R224-L306 HydrophobicContact CG-CD1 4.38Å; R224-L306 HydrophobicContact CG-CD2 4.35Å; R224-L306 PolarHBondContact NH2-O 2.89Å; R224-N307 PolarHBondContact NE-O 2.95Å; R224-N307 PolarHBondContact NH2-O 2.84Å; R224-E309 WeakPolarHBondContact CG-O 3.5Å; R224-I310 HydrophobicContact CB-CB 4.39Å; R224-I310 HydrophobicContact CB-CD1 4.49Å; R224-I310 HydrophobicContact CB-CG1 4.19Å; R224-Y338 PolarHBondContact NH1-OH 3.39Å
225	E	82.4	Confident	85.5	Confident	99 Å²	99	35 Å²	35	46%	0.463	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	145.1	178	-169.9	173.6	-169.8	0	0	110.4	N230 N307	E225-N230 CarbonylContact C-O 3.47Å; E225-N307 WeakPolarHBondContact O-CB 3.34Å; E225-N307 PolarHBondContact O-N 2.6Å; E225-N307 VanDerWaalsContact O-N 3.14Å; E225-N307 PolarHBondContact O-ND2 2.82Å
226	G	73.4	Confident	85.7	Confident	4 Å²	4	33 Å²	33	4%	0.041	17%	0.168	C	C	.	.			trans	-110.5	166.9	175.9	0	0	0	0	0	113	H228 G229 N230 D305	G226-H228 PolarHBondContact O-N 3.29Å; G226-H228 VanDerWaalsContact O-N 3.16Å; G226-G229 PolarHBondContact O-N 2.85Å; G226-N230 PolarHBondContact N-O 3.31Å; G226-D305 WeakPolarHBondContact CA-O 3.48Å
227	Q	64.6	Low	85.8	Confident	149 Å²	149	31.6 Å²	31.6	70%	0.696	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-26.3	-173.9	-59.3	-167.4	-9.8	0	0	113.9	N307	Q227-N307 WeakPolarHBondContact CG-OD1 3.39Å; Q227-N307 PolarHBondContact N-OD1 2.87Å
228	H	64.1	Low	85.8	Confident	131 Å²	131	35.9 Å²	35.9	61%	0.606	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.3	19.9	-174.9	-60.4	100.8	0	0	0	113.8	G226 N230 D305	G226-H228 PolarHBondContact O-N 3.29Å; G226-H228 VanDerWaalsContact O-N 3.16Å; H228-N230 VanDerWaalsContact C-N 3.26Å; H228-N230 PolarHBondContact O-N 3Å; H228-D305 IonicContact CE1-OD2 3.22Å; H228-D305 PolarHBondContact CE1-OD2 2.94Å; H228-D305 VanDerWaalsContact CE1-OD2 3.22Å; H228-D305 IonicContact ND1-OD2 2.75Å; H228-D305 PolarHBondContact ND1-OD2 2.83Å
229	G	66.7	Low	85.8	Confident	31 Å²	31	33.6 Å²	33.6	32%	0.32	17%	0.165	S	C	.	.	S	Bend	trans	80.7	3.3	-179.2	0	0	0	0	0	114.7	G226 H231 N246	G226-G229 PolarHBondContact O-N 2.85Å; G229-H231 PolarHBondContact O-ND1 3.18Å; G229-N246 PolarHBondContact O-ND2 2.87Å
230	N	73.2	Confident	85.8	Confident	9 Å²	9	37 Å²	37	5%	0.048	18%	0.18	C	C	.	.			trans	-61.2	133	167.2	-66.4	-22.6	0	0	0	109	E225 G226 H228 N246 S247 G248 L306	E225-N230 CarbonylContact C-O 3.47Å; G226-N230 PolarHBondContact N-O 3.31Å; H228-N230 VanDerWaalsContact C-N 3.26Å; H228-N230 PolarHBondContact O-N 3Å; N230-N246 VanDerWaalsContact CA-O 3.28Å; N230-N246 WeakPolarHBondContact CA-O 3.16Å; N230-S247 WeakPolarHBondContact OD1-CA 3.48Å; N230-S247 PolarHBondContact OD1-O 2.82Å; N230-S247 VanDerWaalsContact OD1-O 3.08Å; N230-G248 WeakPolarHBondContact OD1-CA 3.23Å; N230-G248 PolarHBondContact OD1-N 3.49Å; N230-G248 VanDerWaalsContact OD1-N 3.07Å; N230-L306 HydrophobicContact CB-CD2 4.13Å
231	H	82.1	Confident	85.8	Confident	49 Å²	49	36.9 Å²	36.9	23%	0.227	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	150.3	175.6	61.9	-90.6	0	0	0	112.1	R224 G229 N246	R224-H231 CarbonylContact O-C 3.47Å; R224-H231 WeakPolarHBondContact O-CA 3.16Å; R224-H231 WeakPolarHBondContact O-CB 3.34Å; G229-H231 PolarHBondContact O-ND1 3.18Å; H231-N246 VanDerWaalsContact CE1-CB 3.45Å; H231-N246 WeakPolarHBondContact CE1-CB 3.34Å; H231-N246 PolarHBondContact N-O 3.5Å; H231-N246 PolarHBondContact O-N 3.44Å
232	I	86.6	Confident	85.7	Confident	4 Å²	4	37.4 Å²	37.4	2%	0.021	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	124.5	167.4	-60.3	-178.5	0	0	0	106.7	L222 H223 R224 F243 F244 L245 L279 L304 L306	L222-I232 HydrophobicContact CD1-CG2 4.16Å; H223-I232 CarbonylContact C-O 3.56Å; H223-I232 WeakPolarHBondContact CA-O 3.4Å; R224-I232 PolarHBondContact N-O 3.3Å; R224-I232 PolarHBondContact O-N 3.14Å; I232-F243 HydrophobicContact CG2-CD2 4.43Å; I232-F243 HydrophobicContact CG2-CE2 3.42Å; I232-F243 VanDerWaalsContact CG2-CE2 3.42Å; I232-F243 HydrophobicContact CG2-CZ 3.82Å; I232-F244 WeakPolarHBondContact CA-O 3.38Å; I232-L245 HydrophobicContact CD1-CD1 4.24Å; I232-L245 HydrophobicContact CG1-CD1 3.74Å; I232-L279 HydrophobicContact CD1-CD1 3.57Å; I232-L304 HydrophobicContact CD1-CD2 4.15Å; I232-L304 HydrophobicContact CG1-CD2 4.05Å; I232-L306 HydrophobicContact CD1-CD1 3.4Å; I232-L306 HydrophobicContact CG1-CD1 3.85Å; I232-L306 HydrophobicContact CG1-CD2 4.4Å
233	T	89.9	Confident	85.6	Confident	2 Å²	2	37.4 Å²	37.4	1%	0.012	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	130.8	175.7	-52	0	0	0	0	109.6	I220 L222 H223 E235 F244	I220-T233 HydrophobicContact CG2-CG2 4.17Å; L222-T233 WeakPolarHBondContact O-CA 3.43Å; H223-T233 PolarHBondContact ND1-OG1 2.81Å; T233-E235 HydrophobicContact CG2-CB 4.43Å; T233-F244 PolarHBondContact N-O 3.05Å; T233-F244 PolarHBondContact O-N 2.85Å
234	L	94.1	Very high	85.4	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	117.9	166.4	-168.9	69.6	0	0	0	108.2	L221 L222 L241 F243 V275 I277 F286	L221-L234 HydrophobicContact CB-CB 4.45Å; L221-L234 HydrophobicContact CB-CD2 4.12Å; L221-L234 HydrophobicContact CB-CG 4.41Å; L221-L234 HydrophobicContact CD2-CD2 4.09Å; L221-L234 PolarHBondContact N-O 2.77Å; L222-L234 HydrophobicContact CD1-CB 4.28Å; L222-L234 HydrophobicContact CD2-CB 3.82Å; L222-L234 HydrophobicContact CD2-CD2 3.87Å; L222-L234 HydrophobicContact CG-CB 3.58Å; L222-L234 HydrophobicContact CG-CD2 4.47Å; L222-L234 PolarHBondContact N-O 3.05Å; L222-L234 PolarHBondContact O-N 2.92Å; L234-L241 HydrophobicContact CD1-CD1 4.15Å; L234-L241 HydrophobicContact CD1-CD2 3.81Å; L234-L241 HydrophobicContact CD1-CG 3.65Å; L234-L241 HydrophobicContact CD2-CD1 4.35Å; L234-L241 HydrophobicContact CD2-CD2 4.12Å; L234-L241 HydrophobicContact CD2-CG 4.47Å; L234-L241 HydrophobicContact CG-CD1 3.92Å; L234-L241 HydrophobicContact CG-CD2 4.15Å; L234-L241 HydrophobicContact CG-CG 3.99Å; L234-F243 HydrophobicContact CD1-CB 4.25Å; L234-F243 HydrophobicContact CD1-CD2 4.22Å; L234-V275 HydrophobicContact CD2-CG1 4Å; L234-I277 HydrophobicContact CD1-CD1 4.28Å; L234-I277 HydrophobicContact CD2-CD1 4.28Å; L234-F286 HydrophobicContact CD1-CE2 3.8Å; L234-F286 HydrophobicContact CD1-CZ 3.74Å
235	E	94.4	Very high	85.2	Confident	15 Å²	15	37.2 Å²	37.2	7%	0.07	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	133.5	-175.5	-168.9	174.6	179.9	0	0	110.3	I220 T233 I237 V242 F244 R326	I220-E235 HydrophobicContact CG1-CG 4.04Å; T233-E235 HydrophobicContact CG2-CB 4.43Å; E235-I237 HydrophobicContact CB-CD1 4.43Å; E235-I237 HydrophobicContact CB-CG1 4.2Å; E235-I237 HydrophobicContact CG-CD1 4.13Å; E235-I237 HydrophobicContact CG-CG1 3.67Å; E235-V242 PolarHBondContact N-O 3.16Å; E235-V242 PolarHBondContact O-N 2.86Å; E235-F244 HydrophobicContact CB-CE2 4.11Å; E235-R326 WeakPolarHBondContact OE2-CD 3.28Å; E235-R326 IonicContact OE2-CZ 3.39Å; E235-R326 IonicContact OE2-NE 3.68Å; E235-R326 IonicContact OE2-NH1 3.29Å; E235-R326 PolarHBondContact OE2-NH1 2.91Å
236	L	95.6	Very high	84.8	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	122.1	164.7	-171.7	70.5	0	0	0	107.7	F212 A214 Q216 N218 G219 L221 K240 L241 L267	F212-L236 HydrophobicContact CE2-CD1 4.4Å; A214-L236 HydrophobicContact CB-CD2 3.52Å; Q216-L236 VanDerWaalsContact O-CD2 3.27Å; Q216-L236 WeakPolarHBondContact O-CD2 3.28Å; N218-L236 CarbonylContact C-O 3.58Å; N218-L236 WeakPolarHBondContact CA-O 3.35Å; G219-L236 PolarHBondContact N-O 2.67Å; G219-L236 PolarHBondContact O-N 3.02Å; L221-L236 HydrophobicContact CD1-CB 3.85Å; L236-K240 CarbonylContact C-O 3.33Å; L236-K240 WeakPolarHBondContact CA-O 3.35Å; L236-L241 HydrophobicContact CB-CD1 4.46Å; L236-L241 HydrophobicContact CD1-CD1 4.39Å; L236-L267 HydrophobicContact CD1-CB 3.93Å; L236-L267 HydrophobicContact CD1-CD1 4.24Å
237	I	93.6	Very high	84.3	Confident	51 Å²	51	37.2 Å²	37.2	26%	0.262	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	116.3	178.9	-57.7	-178.6	0	0	0	107.9	S217 N218 E235 G239 K240 V242 F244	S217-I237 CarbonylContact O-C 3.59Å; N218-I237 WeakPolarHBondContact OD1-CA 3.41Å; E235-I237 HydrophobicContact CB-CD1 4.43Å; E235-I237 HydrophobicContact CB-CG1 4.2Å; E235-I237 HydrophobicContact CG-CD1 4.13Å; E235-I237 HydrophobicContact CG-CG1 3.67Å; I237-G239 PolarHBondContact O-N 2.85Å; I237-K240 PolarHBondContact N-O 3.36Å; I237-K240 WeakPolarHBondContact O-CB 3.39Å; I237-K240 PolarHBondContact O-N 3.31Å; I237-V242 HydrophobicContact CB-CG2 4.14Å; I237-V242 HydrophobicContact CD1-CB 4.17Å; I237-V242 HydrophobicContact CD1-CG2 3.98Å; I237-V242 HydrophobicContact CG1-CG2 4.18Å; I237-F244 HydrophobicContact CD1-CE2 4.09Å; I237-F244 HydrophobicContact CD1-CZ 3.97Å
238	K	92.6	Very high	83.7	Confident	119 Å²	119	31 Å²	31	52%	0.517	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.1	40.3	-179.1	-58.7	-178.1	165.7	-165.9	0	113.2	S217 N218 K240 Q452	S217-K238 WeakPolarHBondContact O-CA 3.44Å; S217-K238 PolarHBondContact O-N 2.86Å; N218-K238 PolarHBondContact OD1-N 3.36Å; K238-K240 VanDerWaalsContact C-N 3.28Å; K238-K240 PolarHBondContact O-N 2.93Å; K238-Q452 HydrophobicContact CB-CG 4.31Å; K238-Q452 VanDerWaalsContact CG-OE1 3.29Å
239	G	93.3	Very high	83	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.4	10.1	-178.4	0	0	0	0	0	115.1	S217 I237 S265 L266 L267	S217-G239 PolarHBondContact O-N 2.74Å; I237-G239 PolarHBondContact O-N 2.85Å; G239-S265 CarbonylContact O-C 3.55Å; G239-S265 WeakPolarHBondContact O-CA 3.47Å; G239-L266 PolarHBondContact O-N 2.64Å; G239-L267 WeakPolarHBondContact O-CB 3.47Å; G239-L267 WeakPolarHBondContact O-CG 3.31Å; G239-L267 PolarHBondContact O-N 2.92Å
240	K	94.1	Very high	81.8	Confident	73 Å²	73	33.9 Å²	33.9	32%	0.317	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	142.1	174.4	-55.6	-177.8	-179.8	-171	0	109.9	L236 I237 K238 T262 G264 L552	L236-K240 CarbonylContact C-O 3.33Å; L236-K240 WeakPolarHBondContact CA-O 3.35Å; I237-K240 PolarHBondContact N-O 3.36Å; I237-K240 WeakPolarHBondContact O-CB 3.39Å; I237-K240 PolarHBondContact O-N 3.31Å; K238-K240 VanDerWaalsContact C-N 3.28Å; K238-K240 PolarHBondContact O-N 2.93Å; K240-T262 HydrophobicContact CB-CG2 3.79Å; K240-T262 HydrophobicContact CD-CG2 4.13Å; K240-G264 WeakPolarHBondContact CA-O 3.39Å; K240-L552 HydrophobicContact CD-CD1 3.62Å; K240-L552 VanDerWaalsContact CE-CD1 3.47Å; K240-L552 HydrophobicContact CG-CD1 4.29Å
241	L	94.6	Very high	80.2	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	121.3	179.9	-157.6	65.3	0	0	0	109.7	F212 L221 L234 L236 T262 L263 L267 V275 F286 V288	F212-L241 HydrophobicContact CE1-CD1 4.46Å; F212-L241 HydrophobicContact CE1-CD2 4.11Å; F212-L241 HydrophobicContact CZ-CD1 4.36Å; L221-L241 HydrophobicContact CD1-CD1 4.22Å; L221-L241 HydrophobicContact CD2-CD1 4.07Å; L234-L241 HydrophobicContact CD1-CD1 4.15Å; L234-L241 HydrophobicContact CD1-CD2 3.81Å; L234-L241 HydrophobicContact CD1-CG 3.65Å; L234-L241 HydrophobicContact CD2-CD1 4.35Å; L234-L241 HydrophobicContact CD2-CD2 4.12Å; L234-L241 HydrophobicContact CD2-CG 4.47Å; L234-L241 HydrophobicContact CG-CD1 3.92Å; L234-L241 HydrophobicContact CG-CD2 4.15Å; L234-L241 HydrophobicContact CG-CG 3.99Å; L236-L241 HydrophobicContact CB-CD1 4.46Å; L236-L241 HydrophobicContact CD1-CD1 4.39Å; L241-T262 CarbonylContact O-C 3.58Å; L241-T262 WeakPolarHBondContact O-CA 3.07Å; L241-L263 VanDerWaalsContact CB-O 3.24Å; L241-L263 WeakPolarHBondContact CB-O 3.17Å; L241-L263 PolarHBondContact N-O 3.12Å; L241-L263 PolarHBondContact O-N 2.99Å; L241-L267 HydrophobicContact CB-CD1 3.7Å; L241-V275 HydrophobicContact CD2-CG1 4.27Å; L241-V275 HydrophobicContact CD2-CG2 3.53Å; L241-F286 HydrophobicContact CB-CZ 4.42Å; L241-F286 HydrophobicContact CD2-CE2 4.18Å; L241-F286 HydrophobicContact CD2-CZ 3.81Å; L241-F286 HydrophobicContact CG-CZ 4.1Å; L241-V288 HydrophobicContact CB-CG2 4.45Å; L241-V288 HydrophobicContact CD2-CG1 4.46Å; L241-V288 HydrophobicContact CD2-CG2 3.64Å
242	V	92.6	Very high	78.2	Confident	10 Å²	10	47.6 Å²	47.6	6%	0.061	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	119.6	-177.1	-170.1	0	0	0	0	109.3	E235 I237 F244 T260 L261 T262	E235-V242 PolarHBondContact N-O 3.16Å; E235-V242 PolarHBondContact O-N 2.86Å; I237-V242 HydrophobicContact CB-CG2 4.14Å; I237-V242 HydrophobicContact CD1-CB 4.17Å; I237-V242 HydrophobicContact CD1-CG2 3.98Å; I237-V242 HydrophobicContact CG1-CG2 4.18Å; V242-F244 HydrophobicContact CB-CE2 3.88Å; V242-F244 HydrophobicContact CB-CZ 4.11Å; V242-F244 HydrophobicContact CG1-CD1 4.41Å; V242-F244 HydrophobicContact CG1-CD2 4.11Å; V242-F244 HydrophobicContact CG1-CE1 3.86Å; V242-F244 HydrophobicContact CG1-CE2 3.52Å; V242-F244 HydrophobicContact CG1-CZ 3.38Å; V242-T260 HydrophobicContact CG1-CG2 3.49Å; V242-T260 VanDerWaalsContact CG1-CG2 3.49Å; V242-L261 CarbonylContact C-O 3.58Å; V242-L261 WeakPolarHBondContact CA-O 3.28Å; V242-T262 HydrophobicContact CG2-CG2 4.21Å
243	F	91.2	Very high	75.9	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	120.5	173.7	-178.4	-106	0	0	0	109.4	I232 L234 L245 L261 I277 L279 V284 F286 F295	I232-F243 HydrophobicContact CG2-CD2 4.43Å; I232-F243 HydrophobicContact CG2-CE2 3.42Å; I232-F243 VanDerWaalsContact CG2-CE2 3.42Å; I232-F243 HydrophobicContact CG2-CZ 3.82Å; L234-F243 HydrophobicContact CD1-CB 4.25Å; L234-F243 HydrophobicContact CD1-CD2 4.22Å; F243-L245 HydrophobicContact CD1-CB 4.49Å; F243-L245 HydrophobicContact CE1-CB 3.83Å; F243-L245 HydrophobicContact CZ-CB 4.4Å; F243-L261 PolarHBondContact N-O 2.85Å; F243-L261 PolarHBondContact O-N 2.98Å; F243-I277 HydrophobicContact CD2-CD1 4.03Å; F243-I277 HydrophobicContact CE2-CD1 3.95Å; F243-I277 HydrophobicContact CE2-CG2 4.07Å; F243-I277 HydrophobicContact CZ-CG2 4.21Å; F243-L279 HydrophobicContact CZ-CD2 4.31Å; F243-V284 HydrophobicContact CE1-CG1 4.16Å; F243-F286 HydrophobicContact CB-CD1 4.19Å; F243-F286 HydrophobicContact CB-CE1 3.94Å; F243-F286 HydrophobicContact CB-CZ 4.13Å; F243-F295 HydrophobicContact CD1-CZ 4.25Å; F243-F295 HydrophobicContact CE1-CZ 4.14Å
244	F	87.4	Confident	73.3	Confident	31 Å²	31	56.4 Å²	56.4	14%	0.136	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	123.9	175.7	-61.4	-83.2	0	0	0	109.5	I232 T233 E235 I237 V242 T260	I232-F244 WeakPolarHBondContact CA-O 3.38Å; T233-F244 PolarHBondContact N-O 3.05Å; T233-F244 PolarHBondContact O-N 2.85Å; E235-F244 HydrophobicContact CB-CE2 4.11Å; I237-F244 HydrophobicContact CD1-CE2 4.09Å; I237-F244 HydrophobicContact CD1-CZ 3.97Å; V242-F244 HydrophobicContact CB-CE2 3.88Å; V242-F244 HydrophobicContact CB-CZ 4.11Å; V242-F244 HydrophobicContact CG1-CD1 4.41Å; V242-F244 HydrophobicContact CG1-CD2 4.11Å; V242-F244 HydrophobicContact CG1-CE1 3.86Å; V242-F244 HydrophobicContact CG1-CE2 3.52Å; V242-F244 HydrophobicContact CG1-CZ 3.38Å; F244-T260 HydrophobicContact CD1-CG2 3.92Å; F244-T260 HydrophobicContact CE1-CG2 3.54Å; F244-T260 HydrophobicContact CZ-CG2 4.28Å
245	L	83.3	Confident	70.7	Confident	5 Å²	5	63.2 Å²	63.2	3%	0.026	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	115.7	172	-177	68.1	0	0	0	109.2	I232 F243 V259 V284 F295 A297 L304	I232-L245 HydrophobicContact CD1-CD1 4.24Å; I232-L245 HydrophobicContact CG1-CD1 3.74Å; F243-L245 HydrophobicContact CD1-CB 4.49Å; F243-L245 HydrophobicContact CE1-CB 3.83Å; F243-L245 HydrophobicContact CZ-CB 4.4Å; L245-V259 HydrophobicContact CB-CB 4.43Å; L245-V259 PolarHBondContact N-O 2.72Å; L245-V259 PolarHBondContact O-N 3.19Å; L245-V284 HydrophobicContact CD2-CG2 4.23Å; L245-F295 HydrophobicContact CD2-CE2 4.47Å; L245-A297 HydrophobicContact CD2-CB 4.02Å; L245-L304 HydrophobicContact CD1-CD1 4.16Å; L245-L304 HydrophobicContact CD1-CD2 3.56Å; L245-L304 HydrophobicContact CD1-CG 4.49Å
246	N	74.4	Confident	68.5	Low	48 Å²	48	67.6 Å²	67.6	26%	0.257	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	124.2	173.6	-172.2	12.4	0	0	0	110.5	G229 N230 H231 G248	G229-N246 PolarHBondContact O-ND2 2.87Å; N230-N246 VanDerWaalsContact CA-O 3.28Å; N230-N246 WeakPolarHBondContact CA-O 3.16Å; H231-N246 VanDerWaalsContact CE1-CB 3.45Å; H231-N246 WeakPolarHBondContact CE1-CB 3.34Å; H231-N246 PolarHBondContact N-O 3.5Å; H231-N246 PolarHBondContact O-N 3.44Å; N246-G248 PolarHBondContact OD1-N 2.79Å; N246-G248 VanDerWaalsContact OD1-N 3.11Å
247	S	61.9	Low	66.2	Low	54 Å²	54	71.3 Å²	71.3	38%	0.378	41%	0.41	S	S	.	.			trans	-101.9	8.7	179.2	-51.1	0	0	0	0	113.7	N230	N230-S247 WeakPolarHBondContact OD1-CA 3.48Å; N230-S247 PolarHBondContact OD1-O 2.82Å; N230-S247 VanDerWaalsContact OD1-O 3.08Å
248	G	52.1	Low	64.6	Low	19 Å²	19	72.8 Å²	72.8	20%	0.196	42%	0.423	C	S	.	.			trans	57.2	86.7	158.2	0	0	0	0	0	116.6	N230 N246	N230-G248 WeakPolarHBondContact OD1-CA 3.23Å; N230-G248 PolarHBondContact OD1-N 3.49Å; N230-G248 VanDerWaalsContact OD1-N 3.07Å; N246-G248 PolarHBondContact OD1-N 2.79Å; N246-G248 VanDerWaalsContact OD1-N 3.11Å
249	N	48.8	Very low	63.5	Low	117 Å²	117	69.4 Å²	69.4	63%	0.626	41%	0.412	S	S	*	.			trans	-136.1	76.1	163	-94	-28.1	0	0	0	111.1	K251	N249-K251 VanDerWaalsContact C-N 3.26Å; N249-K251 PolarHBondContact O-N 3.19Å
250	A	42.3	Very low	63	Low	105 Å²	105	73 Å²	73	87%	0.868	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	11	179.8	0	0	0	0	0	114.9
251	K	39.8	Very low	62.6	Low	214 Å²	214	70.5 Å²	70.5	93%	0.93	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.9	0.4	-178.5	-76.1	-171.5	179.5	179.2	0	115.6	N249	N249-K251 VanDerWaalsContact C-N 3.26Å; N249-K251 PolarHBondContact O-N 3.19Å
252	L	40.4	Very low	62.4	Low	132 Å²	132	73.4 Å²	73.4	69%	0.691	44%	0.442	S	S	*	.	S	Bend	trans	-109	157.7	164	-124.4	72.1	0	0	0	107.8	S254	L252-S254 PolarHBondContact O-N 2.8Å
253	P	37.4	Very low	62.3	Low	122 Å²	122	73.8 Å²	73.8	79%	0.792	44%	0.444	S	S	*	.			trans	-65.8	84.7	164.4	8	6.6	0	0	0	106.6	T255	P253-T255 PolarHBondContact O-N 3.19Å; P253-T255 VanDerWaalsContact O-N 3.1Å
254	S	35.9	Very low	62.2	Low	70 Å²	70	74.6 Å²	74.6	49%	0.49	45%	0.452	S	S	.	.			trans	-74.6	103.9	-168	43.6	0	0	0	0	109.2	L252 I256	L252-S254 PolarHBondContact O-N 2.8Å; S254-I256 PolarHBondContact O-N 2.83Å
255	T	38.1	Very low	62.4	Low	143 Å²	143	74.3 Å²	74.3	88%	0.877	45%	0.454	S	S	*	.			trans	-69.3	7.1	165.6	43.2	0	0	0	0	113.2	P253	P253-T255 PolarHBondContact O-N 3.19Å; P253-T255 VanDerWaalsContact O-N 3.1Å
256	I	48.3	Very low	62.9	Low	107 Å²	107	75 Å²	75	55%	0.549	46%	0.458	S	S	.	.			trans	-106.2	103	-174.4	-55	172.4	0	0	0	108.7	S254	S254-I256 PolarHBondContact O-N 2.83Å
257	A	48.2	Very low	63.9	Low	78 Å²	78	72.9 Å²	72.9	65%	0.645	45%	0.446	S	S	*	.			trans	-68.1	144.4	174.3	0	0	0	0	0	111.1	V259	A257-V259 PolarHBondContact O-N 2.83Å
258	P	59.2	Low	65.4	Low	82 Å²	82	71 Å²	71	53%	0.532	43%	0.432	S	S	.	.			trans	-58.1	136.6	173.2	23.6	-32.2	0	0	0	110.5	T260	P258-T260 PolarHBondContact O-N 3.26Å
259	V	70.8	Confident	67.3	Low	48 Å²	48	71.3 Å²	71.3	29%	0.291	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	113.7	178.7	-176.1	0	0	0	0	108	L245 A257 F295	L245-V259 HydrophobicContact CB-CB 4.43Å; L245-V259 PolarHBondContact N-O 2.72Å; L245-V259 PolarHBondContact O-N 3.19Å; A257-V259 PolarHBondContact O-N 2.83Å; V259-F295 HydrophobicContact CB-CE2 4.42Å; V259-F295 HydrophobicContact CG1-CD2 4.07Å; V259-F295 HydrophobicContact CG1-CE2 3.59Å; V259-F295 HydrophobicContact CG1-CZ 3.98Å
260	T	81.8	Confident	69.3	Low	75 Å²	75	66.5 Å²	66.5	46%	0.46	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	114.4	175.4	-55.9	0	0	0	0	107.5	V242 F244 P258	V242-T260 HydrophobicContact CG1-CG2 3.49Å; V242-T260 VanDerWaalsContact CG1-CG2 3.49Å; F244-T260 HydrophobicContact CD1-CG2 3.92Å; F244-T260 HydrophobicContact CE1-CG2 3.54Å; F244-T260 HydrophobicContact CZ-CG2 4.28Å; P258-T260 PolarHBondContact O-N 3.26Å
261	L	85.7	Confident	71.7	Confident	21 Å²	21	62.3 Å²	62.3	11%	0.11	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	126.9	178.8	179.6	62	0	0	0	109.1	V242 F243 F286 H293 F295	V242-L261 CarbonylContact C-O 3.58Å; V242-L261 WeakPolarHBondContact CA-O 3.28Å; F243-L261 PolarHBondContact N-O 2.85Å; F243-L261 PolarHBondContact O-N 2.98Å; L261-F286 HydrophobicContact CD2-CB 3.89Å; L261-F286 HydrophobicContact CD2-CD1 3.55Å; L261-F286 HydrophobicContact CD2-CG 4.19Å; L261-F286 HydrophobicContact CG-CD1 3.95Å; L261-H293 HydrophobicContact CD1-CB 4.48Å; L261-H293 HydrophobicContact CD2-CB 4.06Å; L261-F295 HydrophobicContact CD2-CD1 3.69Å; L261-F295 HydrophobicContact CD2-CE1 3.48Å; L261-F295 VanDerWaalsContact CD2-CE1 3.48Å
262	T	89.9	Confident	74.3	Confident	60 Å²	60	53.9 Å²	53.9	37%	0.368	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	127.2	175.5	-58.7	0	0	0	0	108.8	K240 L241 V242	K240-T262 HydrophobicContact CB-CG2 3.79Å; K240-T262 HydrophobicContact CD-CG2 4.13Å; L241-T262 CarbonylContact O-C 3.58Å; L241-T262 WeakPolarHBondContact O-CA 3.07Å; V242-T262 HydrophobicContact CG2-CG2 4.21Å
263	L	90.8	Very high	76.9	Confident	18 Å²	18	47.9 Å²	47.9	9%	0.094	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	139.9	179.4	-157.7	138.2	0	0	0	110.6	L241 F286 V288 H291 H293	L241-L263 VanDerWaalsContact CB-O 3.24Å; L241-L263 WeakPolarHBondContact CB-O 3.17Å; L241-L263 PolarHBondContact N-O 3.12Å; L241-L263 PolarHBondContact O-N 2.99Å; L263-F286 HydrophobicContact CB-CD1 3.78Å; L263-F286 HydrophobicContact CB-CE1 3.47Å; L263-F286 VanDerWaalsContact CB-CE1 3.47Å; L263-F286 HydrophobicContact CB-CZ 4.37Å; L263-F286 HydrophobicContact CD1-CD1 4.38Å; L263-V288 HydrophobicContact CB-CG2 4.29Å; L263-V288 HydrophobicContact CD2-CB 3.38Å; L263-V288 HydrophobicContact CD2-CG2 3.44Å; L263-V288 VanDerWaalsContact CD2-CG2 3.44Å; L263-H291 HydrophobicContact CD2-CB 4.03Å; L263-H291 VanDerWaalsContact CD2-O 3.23Å; L263-H291 WeakPolarHBondContact CD2-O 3.39Å; L263-H293 HydrophobicContact CD1-CB 3.41Å; L263-H293 VanDerWaalsContact CD1-CB 3.41Å
264	G	89.6	Confident	79.7	Confident	18 Å²	18	44 Å²	44	19%	0.186	27%	0.272	C	S	.	.			trans	72.4	157.5	-170.9	0	0	0	0	0	113.7	K240	K240-G264 WeakPolarHBondContact CA-O 3.39Å
265	S	91.9	Very high	82.6	Confident	24 Å²	24	40.9 Å²	40.9	17%	0.168	25%	0.25	C	S	.	.	S	Bend	trans	-152.7	154.5	-173.5	58	0	0	0	0	110.2	G239 L267 D549	G239-S265 CarbonylContact O-C 3.55Å; G239-S265 WeakPolarHBondContact O-CA 3.47Å; S265-L267 PolarHBondContact O-N 3.25Å; S265-D549 VanDerWaalsContact CB-OD2 3.31Å; S265-D549 WeakPolarHBondContact CB-OD2 3.42Å; S265-D549 WeakPolarHBondContact OG-CB 3.08Å
266	L	93.9	Very high	85.3	Confident	21 Å²	21	36.7 Å²	36.7	11%	0.11	22%	0.222	C	C	.	.			trans	56.6	30.1	-178.9	-54	165.9	0	0	0	112.7	G239 D268 D269 W401 G451 I547 D549	G239-L266 PolarHBondContact O-N 2.64Å; L266-D268 PolarHBondContact O-N 3.34Å; L266-D268 VanDerWaalsContact O-N 3.13Å; L266-D269 WeakPolarHBondContact O-CB 3.41Å; L266-D269 PolarHBondContact O-N 3.07Å; L266-W401 HydrophobicContact CD1-CZ2 4.47Å; L266-W401 HydrophobicContact CD2-CZ2 4.21Å; L266-G451 WeakPolarHBondContact CD2-O 3.35Å; L266-I547 HydrophobicContact CD1-CG2 3.96Å; L266-I547 HydrophobicContact CD2-CG2 4.29Å; L266-D549 HydrophobicContact CD1-CB 4.02Å; L266-D549 HydrophobicContact CG-CB 4.4Å
267	L	94.8	Very high	87.4	Confident	2 Å²	2	31.6 Å²	31.6	1%	0.01	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	5.1	-177.1	-55.2	166.5	0	0	0	112.7	F212 L236 G239 L241 S265 D269 H273 V288	F212-L267 HydrophobicContact CE2-CB 4.17Å; F212-L267 HydrophobicContact CZ-CB 3.9Å; F212-L267 HydrophobicContact CZ-CD1 4.09Å; F212-L267 HydrophobicContact CZ-CG 4.4Å; L236-L267 HydrophobicContact CD1-CB 3.93Å; L236-L267 HydrophobicContact CD1-CD1 4.24Å; G239-L267 WeakPolarHBondContact O-CB 3.47Å; G239-L267 WeakPolarHBondContact O-CG 3.31Å; G239-L267 PolarHBondContact O-N 2.92Å; L241-L267 HydrophobicContact CB-CD1 3.7Å; S265-L267 PolarHBondContact O-N 3.25Å; L267-D269 VanDerWaalsContact C-N 3.3Å; L267-H273 HydrophobicContact CD2-CB 4.31Å; L267-H273 VanDerWaalsContact CD2-CE1 3.48Å; L267-H273 WeakPolarHBondContact CD2-CE1 3.16Å; L267-H273 WeakPolarHBondContact CD2-ND1 3.26Å; L267-V288 HydrophobicContact CD2-CG1 4.33Å
268	D	93.4	Very high	89.5	Confident	14 Å²	14	29.5 Å²	29.5	8%	0.075	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95	22	170.7	73.1	-34.9	0	0	0	111.9	L266 Q270 R399	L266-D268 PolarHBondContact O-N 3.34Å; L266-D268 VanDerWaalsContact O-N 3.13Å; D268-Q270 PolarHBondContact O-N 3.43Å; D268-R399 IonicContact OD1-NH1 3.35Å; D268-R399 PolarHBondContact OD1-NH1 3.23Å
269	D	91.9	Very high	90.7	Very high	27 Å²	27	26.9 Å²	26.9	14%	0.144	15%	0.154	C	C	.	.	S	Bend	trans	-73.5	-5	178.8	69.3	-0.2	0	0	0	113.8	N119 K121 L266 L267 H271 H273	N119-D269 PolarHBondContact ND2-O 2.53Å; K121-D269 IonicContact NZ-OD2 3.49Å; K121-D269 PolarHBondContact NZ-OD2 3.47Å; L266-D269 WeakPolarHBondContact O-CB 3.41Å; L266-D269 PolarHBondContact O-N 3.07Å; L267-D269 VanDerWaalsContact C-N 3.3Å; D269-H271 VanDerWaalsContact C-N 3.26Å; D269-H271 VanDerWaalsContact CG-ND1 3.3Å; D269-H271 PolarHBondContact O-ND1 2.77Å; D269-H271 WeakPolarHBondContact OD1-CA 3.28Å; D269-H271 WeakPolarHBondContact OD1-CB 3.27Å; D269-H271 IonicContact OD1-CG 2.85Å; D269-H271 PolarHBondContact OD1-N 3.37Å; D269-H271 IonicContact OD1-ND1 3.57Å; D269-H271 IonicContact OD2-CG 3.56Å; D269-H271 IonicContact OD2-ND1 2.79Å; D269-H271 PolarHBondContact OD2-ND1 2.99Å; D269-H273 IonicContact OD1-CD2 3.09Å; D269-H273 IonicContact OD1-CE1 2.75Å; D269-H273 IonicContact OD1-NE2 2.9Å; D269-H273 PolarHBondContact OD1-NE2 3.16Å; D269-H273 IonicContact OD2-CE1 2.79Å; D269-H273 IonicContact OD2-NE2 3.23Å; D269-H273 PolarHBondContact OD2-NE2 3.11Å
270	Q	92.1	Very high	91.2	Very high	15 Å²	15	27.2 Å²	27.2	7%	0.07	15%	0.154	C	C	.	.	S	Bend	trans	62.3	29.1	-173.9	-51.1	167.2	2.7	0	0	113.4	K213 M215 D268 P367 T369	K213-Q270 WeakPolarHBondContact CD-O 3.31Å; K213-Q270 WeakPolarHBondContact CE-O 3.42Å; K213-Q270 PolarHBondContact NZ-O 2.75Å; M215-Q270 HydrophobicContact SD-CG 4.31Å; D268-Q270 PolarHBondContact O-N 3.43Å; Q270-P367 HydrophobicContact CB-CG 3.96Å; Q270-P367 HydrophobicContact CG-CG 4.27Å; Q270-T369 PolarHBondContact NE2-OG1 3.47Å; Q270-T369 PolarHBondContact OE1-OG1 2.71Å
271	H	92.5	Very high	90.7	Very high	18 Å²	18	30.5 Å²	30.5	8%	0.083	17%	0.169	C	C	.	.	S	Bend	trans	-107.4	167.8	166.4	-61.3	99.9	0	0	0	110.7	N119 K121 K213 D269 H273	N119-H271 PolarHBondContact ND2-CE1 3.5Å; N119-H271 VanDerWaalsContact ND2-CE1 3.34Å; N119-H271 PolarHBondContact O-CE1 3.22Å; N119-H271 PolarHBondContact O-NE2 3.3Å; K121-H271 HydrophobicContact CD-CB 3.8Å; K213-H271 WeakPolarHBondContact CA-O 3.47Å; D269-H271 VanDerWaalsContact C-N 3.26Å; D269-H271 VanDerWaalsContact CG-ND1 3.3Å; D269-H271 PolarHBondContact O-ND1 2.77Å; D269-H271 WeakPolarHBondContact OD1-CA 3.28Å; D269-H271 WeakPolarHBondContact OD1-CB 3.27Å; D269-H271 IonicContact OD1-CG 2.85Å; D269-H271 PolarHBondContact OD1-N 3.37Å; D269-H271 IonicContact OD1-ND1 3.57Å; D269-H271 IonicContact OD2-CG 3.56Å; D269-H271 IonicContact OD2-ND1 2.79Å; D269-H271 PolarHBondContact OD2-ND1 2.99Å; H271-H273 PolarHBondContact O-CD2 3.49Å
272	W	94.1	Very high	89.9	Confident	36 Å²	36	31.3 Å²	31.3	14%	0.136	17%	0.174	C	C	.	.			trans	-77.1	136.5	173.7	-68.1	104.6	0	0	0	110.5	D115 V183 K211 F212 K213 C332 E334 C364	D115-W272 PolarHBondContact OD2-NE1 3.49Å; V183-W272 HydrophobicContact CG1-CH2 3.81Å; V183-W272 HydrophobicContact CG1-CZ2 4.28Å; V183-W272 HydrophobicContact CG2-CH2 4.27Å; V183-W272 HydrophobicContact CG2-CZ2 4.29Å; K211-W272 HydrophobicContact CB-CE3 4Å; F212-W272 VanDerWaalsContact C-CE3 3.47Å; F212-W272 CarbonylContact O-C 3.54Å; F212-W272 WeakPolarHBondContact O-CA 3.43Å; K213-W272 HydrophobicContact CB-CD2 3.86Å; K213-W272 HydrophobicContact CB-CE3 3.71Å; K213-W272 HydrophobicContact CB-CG 4.48Å; K213-W272 HydrophobicContact CB-CH2 4.26Å; K213-W272 HydrophobicContact CB-CZ2 4.38Å; K213-W272 HydrophobicContact CB-CZ3 3.91Å; W272-C332 HydrophobicContact CH2-CB 3.45Å; W272-C332 VanDerWaalsContact CH2-CB 3.45Å; W272-C332 HydrophobicContact CZ2-CB 4.18Å; W272-C332 HydrophobicContact CZ3-CB 4.06Å; W272-C332 WeakPolarHBondContact CZ3-O 3.34Å; W272-E334 HydrophobicContact CE3-CB 3.96Å; W272-E334 HydrophobicContact CH2-CB 3.57Å; W272-E334 HydrophobicContact CZ2-CB 4.28Å; W272-E334 HydrophobicContact CZ3-CB 3.4Å; W272-C364 HydrophobicContact CZ2-CB 4.45Å
273	H	95.4	Very high	89.4	Confident	6 Å²	6	33.8 Å²	33.8	3%	0.028	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	135.2	172.6	-66.2	-79.9	0	0	0	109.7	K121 K211 F212 L267 D269 H271 D289	K121-H273 PolarHBondContact NZ-CE1 3.24Å; K211-H273 CarbonylContact C-O 3.27Å; K211-H273 WeakPolarHBondContact CA-O 3.24Å; F212-H273 HydrophobicContact CD1-CB 4.13Å; F212-H273 HydrophobicContact CE1-CB 3.66Å; F212-H273 HydrophobicContact CZ-CB 3.9Å; F212-H273 PolarHBondContact N-O 2.73Å; F212-H273 PolarHBondContact O-N 3.34Å; L267-H273 HydrophobicContact CD2-CB 4.31Å; L267-H273 VanDerWaalsContact CD2-CE1 3.48Å; L267-H273 WeakPolarHBondContact CD2-CE1 3.16Å; L267-H273 WeakPolarHBondContact CD2-ND1 3.26Å; D269-H273 IonicContact OD1-CD2 3.09Å; D269-H273 IonicContact OD1-CE1 2.75Å; D269-H273 IonicContact OD1-NE2 2.9Å; D269-H273 PolarHBondContact OD1-NE2 3.16Å; D269-H273 IonicContact OD2-CE1 2.79Å; D269-H273 IonicContact OD2-NE2 3.23Å; D269-H273 PolarHBondContact OD2-NE2 3.11Å; H271-H273 PolarHBondContact O-CD2 3.49Å; H273-D289 WeakPolarHBondContact CA-OD1 3.36Å; H273-D289 WeakPolarHBondContact CB-OD1 3.22Å; H273-D289 IonicContact CE1-OD2 3.89Å; H273-D289 IonicContact CG-OD1 3.05Å; H273-D289 IonicContact CG-OD2 3.12Å; H273-D289 IonicContact ND1-OD1 3.95Å; H273-D289 IonicContact ND1-OD2 3.69Å; H273-D289 PolarHBondContact ND1-OD2 2.93Å
274	S	95.3	Very high	89.1	Confident	42 Å²	42	33.1 Å²	33.1	29%	0.294	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	142.5	178.4	57.2	0	0	0	0	111.3	V288 D289	S274-V288 CarbonylContact O-C 3.58Å; S274-V288 VanDerWaalsContact O-CA 3.25Å; S274-V288 WeakPolarHBondContact O-CA 3.45Å; S274-D289 PolarHBondContact N-OD1 3.05Å; S274-D289 PolarHBondContact O-N 3.07Å; S274-D289 WeakPolarHBondContact OG-CA 3.38Å; S274-D289 PolarHBondContact OG-O 2.98Å
275	V	96.7	Very high	89.2	Confident	4 Å²	4	33.7 Å²	33.7	2%	0.024	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	130.6	176	-179.6	0	0	0	0	108.6	S209 L210 F212 L234 L241 I277 F286 T287 V288	S209-V275 WeakPolarHBondContact CA-O 3.35Å; L210-V275 HydrophobicContact CD1-CB 3.96Å; L210-V275 HydrophobicContact CD1-CG2 4.1Å; L210-V275 HydrophobicContact CG-CB 4.26Å; L210-V275 PolarHBondContact N-O 2.91Å; L210-V275 PolarHBondContact O-N 2.85Å; F212-V275 HydrophobicContact CD1-CG2 3.69Å; F212-V275 HydrophobicContact CE1-CG2 3.6Å; L234-V275 HydrophobicContact CD2-CG1 4Å; L241-V275 HydrophobicContact CD2-CG1 4.27Å; L241-V275 HydrophobicContact CD2-CG2 3.53Å; V275-I277 HydrophobicContact CG1-CD1 4.35Å; V275-I277 HydrophobicContact CG1-CG1 4.11Å; V275-F286 HydrophobicContact CG1-CE2 3.91Å; V275-T287 WeakPolarHBondContact CA-O 3.36Å; V275-V288 HydrophobicContact CG2-CG1 4.41Å; V275-V288 HydrophobicContact CG2-CG2 4.42Å
276	L	95.4	Very high	89.2	Confident	55 Å²	55	32.5 Å²	32.5	29%	0.288	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	122.5	171.5	174	67.4	0	0	0	108.9	V207 I208 E278 T287	V207-L276 HydrophobicContact CG1-CD1 3.84Å; I208-L276 WeakPolarHBondContact O-CA 3.5Å; L276-E278 HydrophobicContact CD1-CG 4.11Å; L276-E278 HydrophobicContact CD2-CG 4.33Å; L276-E278 HydrophobicContact CG-CG 4.02Å; L276-T287 PolarHBondContact N-O 2.98Å; L276-T287 PolarHBondContact O-N 3.11Å
277	I	93	Very high	89.2	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	121.4	174.9	-56.1	166.3	0	0	0	107.1	V207 I208 L222 L234 F243 V275 L279 N285 F286	V207-I277 WeakPolarHBondContact CA-O 3.32Å; I208-I277 HydrophobicContact CB-CB 4.3Å; I208-I277 PolarHBondContact N-O 3.11Å; I208-I277 PolarHBondContact O-N 3.37Å; L222-I277 HydrophobicContact CD2-CD1 4.28Å; L234-I277 HydrophobicContact CD1-CD1 4.28Å; L234-I277 HydrophobicContact CD2-CD1 4.28Å; F243-I277 HydrophobicContact CD2-CD1 4.03Å; F243-I277 HydrophobicContact CE2-CD1 3.95Å; F243-I277 HydrophobicContact CE2-CG2 4.07Å; F243-I277 HydrophobicContact CZ-CG2 4.21Å; V275-I277 HydrophobicContact CG1-CD1 4.35Å; V275-I277 HydrophobicContact CG1-CG1 4.11Å; I277-L279 HydrophobicContact CG2-CD1 4.48Å; I277-L279 HydrophobicContact CG2-CD2 4.25Å; I277-L279 HydrophobicContact CG2-CG 4.1Å; I277-N285 WeakPolarHBondContact CA-O 2.98Å; I277-F286 HydrophobicContact CD1-CE2 4.48Å; I277-F286 HydrophobicContact CG1-CD2 3.76Å; I277-F286 HydrophobicContact CG1-CE2 4.09Å
278	E	90.6	Very high	89.1	Confident	34 Å²	34	32.4 Å²	32.4	16%	0.159	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	122.7	173.2	-47.4	-179.8	96.7	0	0	109.1	R205 D206 V207 L276 V284 N285	R205-E278 IonicContact CZ-OE1 2.67Å; R205-E278 IonicContact NH2-OE1 2.59Å; R205-E278 PolarHBondContact NH2-OE1 3.42Å; D206-E278 WeakPolarHBondContact O-CA 3.24Å; V207-E278 HydrophobicContact CG1-CG 4.44Å; L276-E278 HydrophobicContact CD1-CG 4.11Å; L276-E278 HydrophobicContact CD2-CG 4.33Å; L276-E278 HydrophobicContact CG-CG 4.02Å; E278-V284 CarbonylContact O-C 3.41Å; E278-V284 WeakPolarHBondContact O-CA 3.46Å; E278-N285 HydrophobicContact CB-CB 4.11Å; E278-N285 HydrophobicContact CG-CB 4.44Å; E278-N285 PolarHBondContact N-O 2.86Å; E278-N285 PolarHBondContact O-N 2.82Å; E278-N285 PolarHBondContact OE2-ND2 3.26Å
279	L	85.3	Confident	89	Confident	26 Å²	26	34.7 Å²	34.7	14%	0.136	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	115.2	178.5	-58.2	166.9	0	0	0	107.4	R205 D206 I232 F243 I277 V284	R205-L279 CarbonylContact C-O 3.52Å; R205-L279 VanDerWaalsContact CA-O 3.24Å; R205-L279 WeakPolarHBondContact CA-O 3.32Å; D206-L279 HydrophobicContact CB-CB 4.14Å; D206-L279 HydrophobicContact CB-CD1 4.04Å; D206-L279 PolarHBondContact N-O 2.83Å; D206-L279 PolarHBondContact O-N 2.03Å; I232-L279 HydrophobicContact CD1-CD1 3.57Å; F243-L279 HydrophobicContact CZ-CD2 4.31Å; I277-L279 HydrophobicContact CG2-CD1 4.48Å; I277-L279 HydrophobicContact CG2-CD2 4.25Å; I277-L279 HydrophobicContact CG2-CG 4.1Å; L279-V284 HydrophobicContact CD2-CB 4.02Å; L279-V284 HydrophobicContact CD2-CG1 3.56Å; L279-V284 HydrophobicContact CD2-CG2 3.51Å
280	L	80.5	Confident	88.6	Confident	56 Å²	56	38.8 Å²	38.8	29%	0.293	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	100.7	-178.5	-77.3	160.5	0	0	0	108.7	R205 T282 Q283	R205-L280 HydrophobicContact CB-CD2 3.72Å; R205-L280 HydrophobicContact CG-CD2 3.48Å; R205-L280 VanDerWaalsContact CG-CD2 3.48Å; R205-L280 HydrophobicContact CG-CG 3.97Å; L280-T282 PolarHBondContact O-N 3.16Å; L280-Q283 HydrophobicContact CB-CB 4.46Å; L280-Q283 PolarHBondContact N-O 3.24Å; L280-Q283 PolarHBondContact O-N 2.82Å
281	D	71.9	Confident	88.3	Confident	144 Å²	144	42.7 Å²	42.7	77%	0.77	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.2	-95.1	-173.4	-61.8	-39	0	0	0	113.7
282	T	69.5	Low	88.1	Confident	37 Å²	37	44.8 Å²	44.8	23%	0.227	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.4	-8.9	175.9	58.3	0	0	0	0	113	L280 Q296 A297	L280-T282 PolarHBondContact O-N 3.16Å; T282-Q296 CarbonylContact O-C 3.54Å; T282-Q296 WeakPolarHBondContact O-CA 3.38Å; T282-Q296 PolarHBondContact OG1-NE2 3.34Å; T282-A297 PolarHBondContact O-N 2.85Å
283	Q	78.5	Confident	87.8	Confident	112 Å²	112	46.9 Å²	46.9	52%	0.523	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	131.7	179.7	-65.6	-176.2	-16.8	0	0	110.3	L280	L280-Q283 HydrophobicContact CB-CB 4.46Å; L280-Q283 PolarHBondContact N-O 3.24Å; L280-Q283 PolarHBondContact O-N 2.82Å
284	V	84.9	Confident	87.3	Confident	4 Å²	4	52.6 Å²	52.6	2%	0.024	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	121.9	176.7	-176.7	0	0	0	0	108.9	F243 L245 E278 L279 F295	F243-V284 HydrophobicContact CE1-CG1 4.16Å; L245-V284 HydrophobicContact CD2-CG2 4.23Å; E278-V284 CarbonylContact O-C 3.41Å; E278-V284 WeakPolarHBondContact O-CA 3.46Å; L279-V284 HydrophobicContact CD2-CB 4.02Å; L279-V284 HydrophobicContact CD2-CG1 3.56Å; L279-V284 HydrophobicContact CD2-CG2 3.51Å; V284-F295 HydrophobicContact CB-CD1 3.99Å; V284-F295 HydrophobicContact CB-CD2 4.2Å; V284-F295 HydrophobicContact CB-CE1 3.51Å; V284-F295 HydrophobicContact CB-CE2 3.72Å; V284-F295 HydrophobicContact CB-CG 4.33Å; V284-F295 HydrophobicContact CB-CZ 3.37Å; V284-F295 HydrophobicContact CG1-CD1 4.26Å; V284-F295 HydrophobicContact CG1-CE1 3.4Å; V284-F295 VanDerWaalsContact CG1-CE1 3.4Å; V284-F295 HydrophobicContact CG1-CE2 4.27Å; V284-F295 HydrophobicContact CG1-CZ 3.42Å; V284-F295 VanDerWaalsContact CG1-CZ 3.42Å; V284-F295 HydrophobicContact CG2-CD2 4.36Å; V284-F295 HydrophobicContact CG2-CE1 4.33Å; V284-F295 HydrophobicContact CG2-CE2 3.67Å; V284-F295 HydrophobicContact CG2-CZ 3.68Å; V284-F295 PolarHBondContact N-O 3.02Å; V284-F295 PolarHBondContact O-N 2.97Å
285	N	90.7	Very high	86.5	Confident	30 Å²	30	52.2 Å²	52.2	16%	0.16	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	115.9	168.1	-58.6	-15.9	0	0	0	107.7	I277 E278 T292 H294	I277-N285 WeakPolarHBondContact CA-O 2.98Å; E278-N285 HydrophobicContact CB-CB 4.11Å; E278-N285 HydrophobicContact CG-CB 4.44Å; E278-N285 PolarHBondContact N-O 2.86Å; E278-N285 PolarHBondContact O-N 2.82Å; E278-N285 PolarHBondContact OE2-ND2 3.26Å; N285-T292 HydrophobicContact CB-CG2 4.44Å; N285-H294 VanDerWaalsContact CG-ND1 3.31Å; N285-H294 PolarHBondContact OD1-ND1 2.8Å
286	F	92	Very high	85.4	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	114.8	174.2	178.4	-138.2	0	0	0	109.4	L234 L241 F243 L261 L263 V275 I277 V288 T292 H293	L234-F286 HydrophobicContact CD1-CE2 3.8Å; L234-F286 HydrophobicContact CD1-CZ 3.74Å; L241-F286 HydrophobicContact CB-CZ 4.42Å; L241-F286 HydrophobicContact CD2-CE2 4.18Å; L241-F286 HydrophobicContact CD2-CZ 3.81Å; L241-F286 HydrophobicContact CG-CZ 4.1Å; F243-F286 HydrophobicContact CB-CD1 4.19Å; F243-F286 HydrophobicContact CB-CE1 3.94Å; F243-F286 HydrophobicContact CB-CZ 4.13Å; L261-F286 HydrophobicContact CD2-CB 3.89Å; L261-F286 HydrophobicContact CD2-CD1 3.55Å; L261-F286 HydrophobicContact CD2-CG 4.19Å; L261-F286 HydrophobicContact CG-CD1 3.95Å; L263-F286 HydrophobicContact CB-CD1 3.78Å; L263-F286 HydrophobicContact CB-CE1 3.47Å; L263-F286 VanDerWaalsContact CB-CE1 3.47Å; L263-F286 HydrophobicContact CB-CZ 4.37Å; L263-F286 HydrophobicContact CD1-CD1 4.38Å; V275-F286 HydrophobicContact CG1-CE2 3.91Å; I277-F286 HydrophobicContact CD1-CE2 4.48Å; I277-F286 HydrophobicContact CG1-CD2 3.76Å; I277-F286 HydrophobicContact CG1-CE2 4.09Å; F286-V288 HydrophobicContact CE1-CG2 4.22Å; F286-V288 HydrophobicContact CE2-CG2 3.84Å; F286-V288 HydrophobicContact CZ-CG2 3.65Å; F286-T292 WeakPolarHBondContact O-CA 3.22Å; F286-H293 PolarHBondContact N-O 2.79Å; F286-H293 PolarHBondContact O-N 2.8Å
287	T	93.7	Very high	84	Confident	19 Å²	19	56.5 Å²	56.5	12%	0.117	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	130.3	-179.6	-51.2	0	0	0	0	110	V275 L276 H291 T292	V275-T287 WeakPolarHBondContact CA-O 3.36Å; L276-T287 PolarHBondContact N-O 2.98Å; L276-T287 PolarHBondContact O-N 3.11Å; T287-H291 VanDerWaalsContact CA-O 3.29Å; T287-H291 WeakPolarHBondContact CA-O 3.1Å; T287-T292 VanDerWaalsContact CG2-OG1 3.25Å; T287-T292 WeakPolarHBondContact CG2-OG1 3.36Å; T287-T292 WeakPolarHBondContact OG1-CB 3.27Å; T287-T292 VanDerWaalsContact OG1-CG2 3.24Å; T287-T292 WeakPolarHBondContact OG1-CG2 3.38Å; T287-T292 PolarHBondContact OG1-OG1 2.89Å
288	V	93.8	Very high	82.3	Confident	2 Å²	2	65.3 Å²	65.3	1%	0.012	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	128.7	164.7	-172	0	0	0	0	108.7	L241 L263 L267 S274 V275 F286 K290 H291	L241-V288 HydrophobicContact CB-CG2 4.45Å; L241-V288 HydrophobicContact CD2-CG1 4.46Å; L241-V288 HydrophobicContact CD2-CG2 3.64Å; L263-V288 HydrophobicContact CB-CG2 4.29Å; L263-V288 HydrophobicContact CD2-CB 3.38Å; L263-V288 HydrophobicContact CD2-CG2 3.44Å; L263-V288 VanDerWaalsContact CD2-CG2 3.44Å; L267-V288 HydrophobicContact CD2-CG1 4.33Å; S274-V288 CarbonylContact O-C 3.58Å; S274-V288 VanDerWaalsContact O-CA 3.25Å; S274-V288 WeakPolarHBondContact O-CA 3.45Å; V275-V288 HydrophobicContact CG2-CG1 4.41Å; V275-V288 HydrophobicContact CG2-CG2 4.42Å; F286-V288 HydrophobicContact CE1-CG2 4.22Å; F286-V288 HydrophobicContact CE2-CG2 3.84Å; F286-V288 HydrophobicContact CZ-CG2 3.65Å; V288-K290 PolarHBondContact O-N 2.81Å; V288-H291 PolarHBondContact N-O 2.8Å; V288-H291 PolarHBondContact O-N 3.27Å
289	D	90.8	Very high	80.4	Confident	62 Å²	62	65.5 Å²	65.5	33%	0.332	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.9	-100.4	-169.1	-61.7	-28.1	0	0	0	111.1	H273 S274	H273-D289 WeakPolarHBondContact CA-OD1 3.36Å; H273-D289 WeakPolarHBondContact CB-OD1 3.22Å; H273-D289 IonicContact CE1-OD2 3.89Å; H273-D289 IonicContact CG-OD1 3.05Å; H273-D289 IonicContact CG-OD2 3.12Å; H273-D289 IonicContact ND1-OD1 3.95Å; H273-D289 IonicContact ND1-OD2 3.69Å; H273-D289 PolarHBondContact ND1-OD2 2.93Å; S274-D289 PolarHBondContact N-OD1 3.05Å; S274-D289 PolarHBondContact O-N 3.07Å; S274-D289 WeakPolarHBondContact OG-CA 3.38Å; S274-D289 PolarHBondContact OG-O 2.98Å
290	K	84	Confident	78.5	Confident	112 Å²	112	71.4 Å²	71.4	49%	0.487	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.9	-8.8	179	-60.9	173.2	176.2	179.7	0	114.1	V288	V288-K290 PolarHBondContact O-N 2.81Å
291	H	86.7	Confident	76.7	Confident	97 Å²	97	74.2 Å²	74.2	45%	0.449	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	113.3	-171.7	-60.4	101.5	0	0	0	108.3	L263 T287 V288	L263-H291 HydrophobicContact CD2-CB 4.03Å; L263-H291 VanDerWaalsContact CD2-O 3.23Å; L263-H291 WeakPolarHBondContact CD2-O 3.39Å; T287-H291 VanDerWaalsContact CA-O 3.29Å; T287-H291 WeakPolarHBondContact CA-O 3.1Å; V288-H291 PolarHBondContact N-O 2.8Å; V288-H291 PolarHBondContact O-N 3.27Å
292	T	88.4	Confident	75.5	Confident	62 Å²	62	70.6 Å²	70.6	38%	0.38	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	132	176	-54.9	0	0	0	0	109.6	N285 F286 T287 H294	N285-T292 HydrophobicContact CB-CG2 4.44Å; F286-T292 WeakPolarHBondContact O-CA 3.22Å; T287-T292 VanDerWaalsContact CG2-OG1 3.25Å; T287-T292 WeakPolarHBondContact CG2-OG1 3.36Å; T287-T292 WeakPolarHBondContact OG1-CB 3.27Å; T287-T292 VanDerWaalsContact OG1-CG2 3.24Å; T287-T292 WeakPolarHBondContact OG1-CG2 3.38Å; T287-T292 PolarHBondContact OG1-OG1 2.89Å; T292-H294 WeakPolarHBondContact CG2-CE1 3.43Å; T292-H294 VanDerWaalsContact CG2-NE2 3.34Å; T292-H294 WeakPolarHBondContact CG2-NE2 3.25Å
293	H	85.9	Confident	74.6	Confident	81 Å²	81	73.9 Å²	73.9	38%	0.375	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	124.7	169.1	-172.2	-71.5	0	0	0	109.3	L261 L263 F286 F295	L261-H293 HydrophobicContact CD1-CB 4.48Å; L261-H293 HydrophobicContact CD2-CB 4.06Å; L263-H293 HydrophobicContact CD1-CB 3.41Å; L263-H293 VanDerWaalsContact CD1-CB 3.41Å; F286-H293 PolarHBondContact N-O 2.79Å; F286-H293 PolarHBondContact O-N 2.8Å; H293-F295 AromaticContact ND1-CD1 3.9Å
294	H	85.5	Confident	73.5	Confident	125 Å²	125	71.7 Å²	71.7	58%	0.579	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.5	129.1	178.3	-58.2	-80.4	0	0	0	108.8	N285 T292	N285-H294 VanDerWaalsContact CG-ND1 3.31Å; N285-H294 PolarHBondContact OD1-ND1 2.8Å; T292-H294 WeakPolarHBondContact CG2-CE1 3.43Å; T292-H294 VanDerWaalsContact CG2-NE2 3.34Å; T292-H294 WeakPolarHBondContact CG2-NE2 3.25Å
295	F	79.1	Confident	72.4	Confident	34 Å²	34	74.5 Å²	74.5	15%	0.149	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	155	172	69	-87.2	0	0	0	111.7	F243 L245 V259 L261 V284 H293	F243-F295 HydrophobicContact CD1-CZ 4.25Å; F243-F295 HydrophobicContact CE1-CZ 4.14Å; L245-F295 HydrophobicContact CD2-CE2 4.47Å; V259-F295 HydrophobicContact CB-CE2 4.42Å; V259-F295 HydrophobicContact CG1-CD2 4.07Å; V259-F295 HydrophobicContact CG1-CE2 3.59Å; V259-F295 HydrophobicContact CG1-CZ 3.98Å; L261-F295 HydrophobicContact CD2-CD1 3.69Å; L261-F295 HydrophobicContact CD2-CE1 3.48Å; L261-F295 VanDerWaalsContact CD2-CE1 3.48Å; V284-F295 HydrophobicContact CB-CD1 3.99Å; V284-F295 HydrophobicContact CB-CD2 4.2Å; V284-F295 HydrophobicContact CB-CE1 3.51Å; V284-F295 HydrophobicContact CB-CE2 3.72Å; V284-F295 HydrophobicContact CB-CG 4.33Å; V284-F295 HydrophobicContact CB-CZ 3.37Å; V284-F295 HydrophobicContact CG1-CD1 4.26Å; V284-F295 HydrophobicContact CG1-CE1 3.4Å; V284-F295 VanDerWaalsContact CG1-CE1 3.4Å; V284-F295 HydrophobicContact CG1-CE2 4.27Å; V284-F295 HydrophobicContact CG1-CZ 3.42Å; V284-F295 VanDerWaalsContact CG1-CZ 3.42Å; V284-F295 HydrophobicContact CG2-CD2 4.36Å; V284-F295 HydrophobicContact CG2-CE1 4.33Å; V284-F295 HydrophobicContact CG2-CE2 3.67Å; V284-F295 HydrophobicContact CG2-CZ 3.68Å; V284-F295 PolarHBondContact N-O 3.02Å; V284-F295 PolarHBondContact O-N 2.97Å; H293-F295 AromaticContact ND1-CD1 3.9Å
296	Q	73.8	Confident	71.3	Confident	135 Å²	135	73.7 Å²	73.7	63%	0.631	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.9	118.1	172.3	-165.3	171.3	10.7	0	0	108.7	T282 K298	T282-Q296 CarbonylContact O-C 3.54Å; T282-Q296 WeakPolarHBondContact O-CA 3.38Å; T282-Q296 PolarHBondContact OG1-NE2 3.34Å; Q296-K298 PolarHBondContact O-N 2.66Å
297	A	66.3	Low	70.2	Confident	15 Å²	15	76.1 Å²	76.1	12%	0.124	41%	0.405	C	S	.	.			trans	-62.8	119	171.8	0	0	0	0	0	108.9	L245 T282 G299	L245-A297 HydrophobicContact CD2-CB 4.02Å; T282-A297 PolarHBondContact O-N 2.85Å; A297-G299 PolarHBondContact O-N 2.92Å; A297-G299 VanDerWaalsContact O-N 3.13Å
298	K	55.7	Low	69.5	Low	184 Å²	184	80.2 Å²	80.2	80%	0.8	42%	0.421	S	S	*	.			trans	-72.9	103.2	176.8	-76.7	-174.9	178.4	178.7	0	109.7	Q296	Q296-K298 PolarHBondContact O-N 2.66Å
299	G	52.1	Low	69.2	Low	38 Å²	38	84.7 Å²	84.7	39%	0.392	44%	0.442	S	S	.	.	S	Bend	trans	-166.4	137.5	168.2	0	0	0	0	0	109.5	A297 S301	A297-G299 PolarHBondContact O-N 2.92Å; A297-G299 VanDerWaalsContact O-N 3.13Å; G299-S301 PolarHBondContact O-N 2.88Å
300	D	44.2	Very low	69.2	Low	151 Å²	151	81.8 Å²	81.8	81%	0.807	43%	0.427	S	S	*	.	S	Bend	trans	-55.2	109.5	167.8	-82	-26.6	0	0	0	107.3	S302	D300-S302 VanDerWaalsContact C-N 3.25Å; D300-S302 WeakPolarHBondContact O-CA 3.49Å; D300-S302 WeakPolarHBondContact O-CB 3.44Å; D300-S302 PolarHBondContact O-N 2.92Å; D300-S302 PolarHBondContact O-OG 2.96Å
301	S	42.8	Very low	69.6	Low	114 Å²	114	76.8 Å²	76.8	80%	0.797	41%	0.406	S	S	*	.	S	Bend	trans	3.4	65	170.6	61.2	0	0	0	0	116.4	G299	G299-S301 PolarHBondContact O-N 2.88Å
302	S	46.4	Very low	69.9	Low	69 Å²	69	72.2 Å²	72.2	48%	0.483	38%	0.384	S	S	.	.			trans	-135.8	90.7	-171.8	48.7	0	0	0	0	110.6	D300 L304	D300-S302 VanDerWaalsContact C-N 3.25Å; D300-S302 WeakPolarHBondContact O-CA 3.49Å; D300-S302 WeakPolarHBondContact O-CB 3.44Å; D300-S302 PolarHBondContact O-N 2.92Å; D300-S302 PolarHBondContact O-OG 2.96Å; S302-L304 PolarHBondContact O-N 3.04Å
303	N	51.3	Low	70.1	Confident	105 Å²	105	69.2 Å²	69.2	56%	0.561	37%	0.366	S	S	*	.			trans	32.4	90.3	136.6	-62.3	-49.9	0	0	0	115.4	K202 D305	K202-N303 PolarHBondContact NZ-OD1 3.35Å; N303-D305 VanDerWaalsContact C-N 3.25Å; N303-D305 PolarHBondContact O-N 2.85Å
304	L	55.8	Low	70.1	Confident	66 Å²	66	65.4 Å²	65.4	35%	0.346	35%	0.349	S	S	.	.			trans	-63.6	92.2	158.3	-100.8	110.1	0	0	0	108.7	I232 L245 S302 L306	I232-L304 HydrophobicContact CD1-CD2 4.15Å; I232-L304 HydrophobicContact CG1-CD2 4.05Å; L245-L304 HydrophobicContact CD1-CD1 4.16Å; L245-L304 HydrophobicContact CD1-CD2 3.56Å; L245-L304 HydrophobicContact CD1-CG 4.49Å; S302-L304 PolarHBondContact O-N 3.04Å; L304-L306 HydrophobicContact CB-CD1 4.21Å; L304-L306 HydrophobicContact CB-CG 4.11Å; L304-L306 HydrophobicContact CD2-CD1 3.69Å; L304-L306 HydrophobicContact CD2-CD2 4.02Å; L304-L306 HydrophobicContact CD2-CG 3.87Å; L304-L306 PolarHBondContact O-N 3Å
305	D	61.9	Low	69.9	Low	63 Å²	63	61 Å²	61	34%	0.337	33%	0.329	S	S	.	.			trans	-73.7	73.5	174.7	-177	37.1	0	0	0	110	G226 H228 N303	G226-D305 WeakPolarHBondContact CA-O 3.48Å; H228-D305 IonicContact CE1-OD2 3.22Å; H228-D305 PolarHBondContact CE1-OD2 2.94Å; H228-D305 VanDerWaalsContact CE1-OD2 3.22Å; H228-D305 IonicContact ND1-OD2 2.75Å; H228-D305 PolarHBondContact ND1-OD2 2.83Å; N303-D305 VanDerWaalsContact C-N 3.25Å; N303-D305 PolarHBondContact O-N 2.85Å
306	L	67.3	Low	69.4	Low	14 Å²	14	61.5 Å²	61.5	7%	0.073	33%	0.333	C	S	.	.			trans	-93.1	143.5	179.1	-65.4	172.1	0	0	0	110.5	R224 N230 I232 L304	R224-L306 HydrophobicContact CG-CB 4.15Å; R224-L306 HydrophobicContact CG-CD1 4.38Å; R224-L306 HydrophobicContact CG-CD2 4.35Å; R224-L306 PolarHBondContact NH2-O 2.89Å; N230-L306 HydrophobicContact CB-CD2 4.13Å; I232-L306 HydrophobicContact CD1-CD1 3.4Å; I232-L306 HydrophobicContact CG1-CD1 3.85Å; I232-L306 HydrophobicContact CG1-CD2 4.4Å; L304-L306 HydrophobicContact CB-CD1 4.21Å; L304-L306 HydrophobicContact CB-CG 4.11Å; L304-L306 HydrophobicContact CD2-CD1 3.69Å; L304-L306 HydrophobicContact CD2-CD2 4.02Å; L304-L306 HydrophobicContact CD2-CG 3.87Å; L304-L306 PolarHBondContact O-N 3Å
307	N	69.9	Low	68.6	Low	50 Å²	50	57.7 Å²	57.7	27%	0.267	32%	0.322	S	S	.	.			trans	-64.4	165.5	178.8	-66.2	-25.7	0	0	0	111.7	R224 E225 Q227 E309	R224-N307 PolarHBondContact NE-O 2.95Å; R224-N307 PolarHBondContact NH2-O 2.84Å; E225-N307 WeakPolarHBondContact O-CB 3.34Å; E225-N307 PolarHBondContact O-N 2.6Å; E225-N307 VanDerWaalsContact O-N 3.14Å; E225-N307 PolarHBondContact O-ND2 2.82Å; Q227-N307 WeakPolarHBondContact CG-OD1 3.39Å; Q227-N307 PolarHBondContact N-OD1 2.87Å; N307-E309 PolarHBondContact O-N 3Å; N307-E309 VanDerWaalsContact O-N 3.14Å
308	F	79	Confident	67.6	Low	105 Å²	105	63.2 Å²	63.2	46%	0.461	36%	0.356	S	S	.	.	S	Bend	trans	-78.2	20.2	174.6	-61.1	-80.2	0	0	0	113	T195 L196	T195-F308 CarbonylContact C-O 3.44Å; T195-F308 WeakPolarHBondContact CA-O 3.45Å; L196-F308 HydrophobicContact CB-CB 4.13Å; L196-F308 HydrophobicContact CB-CD1 4.3Å; L196-F308 WeakPolarHBondContact CB-O 3.44Å; L196-F308 PolarHBondContact N-O 2.96Å
309	E	86.9	Confident	67	Low	97 Å²	97	58.3 Å²	58.3	45%	0.453	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	131.8	-177.2	-68.7	-178.7	170.6	0	0	109.9	L193 Y194 T195 R224 N307	L193-E309 HydrophobicContact CD1-CB 3.97Å; Y194-E309 WeakPolarHBondContact O-CA 3.17Å; T195-E309 HydrophobicContact CG2-CG 4.48Å; R224-E309 WeakPolarHBondContact CG-O 3.5Å; N307-E309 PolarHBondContact O-N 3Å; N307-E309 VanDerWaalsContact O-N 3.14Å
310	I	89.7	Confident	66.5	Low	1 Å²	1	66.1 Å²	66.1	1%	0.005	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	131.9	174.9	-177.9	167.2	0	0	0	109	Y194 I208 L222 R224 F312 Y338	Y194-I310 HydrophobicContact CD1-CG2 3.81Å; Y194-I310 HydrophobicContact CG-CG2 4.35Å; Y194-I310 PolarHBondContact N-O 3.32Å; Y194-I310 PolarHBondContact O-N 3.15Å; I208-I310 HydrophobicContact CD1-CD1 4.17Å; L222-I310 HydrophobicContact CD1-CD1 4.32Å; R224-I310 HydrophobicContact CB-CB 4.39Å; R224-I310 HydrophobicContact CB-CD1 4.49Å; R224-I310 HydrophobicContact CB-CG1 4.19Å; I310-F312 HydrophobicContact CD1-CE1 4.11Å; I310-F312 HydrophobicContact CD1-CE2 4.38Å; I310-F312 HydrophobicContact CD1-CZ 3.7Å; I310-F312 HydrophobicContact CG1-CE1 4.37Å; I310-F312 HydrophobicContact CG1-CE2 4.1Å; I310-F312 HydrophobicContact CG1-CZ 3.9Å; I310-F312 HydrophobicContact CG2-CE2 3.84Å; I310-F312 HydrophobicContact CG2-CZ 4.14Å; I310-Y338 HydrophobicContact CD1-CD2 3.94Å; I310-Y338 HydrophobicContact CD1-CE2 3.88Å
311	S	92.4	Very high	65.9	Low	7 Å²	7	65.3 Å²	65.3	5%	0.049	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	144.8	176.8	70	0	0	0	0	111.6	L192 L222 H223 G314	L192-S311 CarbonylContact O-C 3.54Å; L192-S311 VanDerWaalsContact O-CA 3.23Å; L192-S311 WeakPolarHBondContact O-CA 3.33Å; L222-S311 CarbonylContact C-O 3.56Å; L222-S311 VanDerWaalsContact CA-O 3.22Å; L222-S311 WeakPolarHBondContact CA-O 3.34Å; H223-S311 PolarHBondContact N-O 3.14Å; H223-S311 PolarHBondContact O-N 3.29Å; H223-S311 PolarHBondContact O-OG 2.85Å; S311-G314 WeakPolarHBondContact CB-O 3.49Å; S311-G314 PolarHBondContact OG-O 3.02Å
312	F	94.6	Very high	65.7	Low	0 Å²	0	69.5 Å²	69.5	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	140.6	174.1	-58.7	-83.2	0	0	0	109.9	F186 A191 L192 L221 L222 I310 G314 L333 L336 V343	F186-F312 WeakPolarHBondContact CE1-O 3.18Å; F186-F312 HydrophobicContact CZ-CB 4.35Å; A191-F312 CarbonylContact C-O 3.57Å; A191-F312 WeakPolarHBondContact CA-O 3.32Å; L192-F312 HydrophobicContact CB-CB 4.36Å; L192-F312 PolarHBondContact N-O 3.49Å; L192-F312 PolarHBondContact O-N 2.84Å; L221-F312 CarbonylContact O-C 3.42Å; L221-F312 VanDerWaalsContact O-CA 3.3Å; L221-F312 WeakPolarHBondContact O-CA 3.24Å; L222-F312 HydrophobicContact CB-CD1 3.65Å; L222-F312 HydrophobicContact CB-CE1 3.79Å; L222-F312 HydrophobicContact CD2-CE1 4.42Å; I310-F312 HydrophobicContact CD1-CE1 4.11Å; I310-F312 HydrophobicContact CD1-CE2 4.38Å; I310-F312 HydrophobicContact CD1-CZ 3.7Å; I310-F312 HydrophobicContact CG1-CE1 4.37Å; I310-F312 HydrophobicContact CG1-CE2 4.1Å; I310-F312 HydrophobicContact CG1-CZ 3.9Å; I310-F312 HydrophobicContact CG2-CE2 3.84Å; I310-F312 HydrophobicContact CG2-CZ 4.14Å; F312-G314 VanDerWaalsContact C-N 3.3Å; F312-G314 PolarHBondContact O-N 3.29Å; F312-L333 HydrophobicContact CB-CD1 4.27Å; F312-L336 HydrophobicContact CB-CD2 4.28Å; F312-L336 HydrophobicContact CD1-CD1 3.91Å; F312-L336 HydrophobicContact CD1-CD2 3.75Å; F312-L336 HydrophobicContact CD1-CG 4.46Å; F312-L336 HydrophobicContact CD2-CD2 3.75Å; F312-L336 HydrophobicContact CE1-CD1 3.54Å; F312-L336 HydrophobicContact CE1-CD2 3.96Å; F312-L336 HydrophobicContact CE1-CG 4.26Å; F312-L336 HydrophobicContact CE2-CD2 3.92Å; F312-L336 HydrophobicContact CG-CD2 3.65Å; F312-L336 HydrophobicContact CZ-CD1 3.96Å; F312-L336 HydrophobicContact CZ-CD2 4.02Å; F312-L336 HydrophobicContact CZ-CG 4.31Å; F312-V343 HydrophobicContact CD2-CG1 4.35Å; F312-V343 HydrophobicContact CE2-CG1 4.13Å
313	G	91.1	Very high	65.2	Low	0 Å²	0	71 Å²	71	0%	0	40%	0.396	C	S	.	.	S	Bend	trans	86.1	-10.6	-179.6	0	0	0	0	0	115.3	I220 L221 S328 F329	I220-G313 CarbonylContact O-C 3.56Å; I220-G313 VanDerWaalsContact O-C 3.27Å; L221-G313 PolarHBondContact O-N 3.16Å; G313-S328 WeakPolarHBondContact O-CB 3.1Å; G313-F329 PolarHBondContact O-N 3.25Å
314	G	87.1	Confident	65.2	Low	1 Å²	1	71.1 Å²	71.1	1%	0.01	39%	0.392	C	S	.	.	S	Bend	trans	172.6	175.5	178.3	0	0	0	0	0	113	I220 S311 F312	I220-G314 PolarHBondContact O-N 3.2Å; S311-G314 WeakPolarHBondContact CB-O 3.49Å; S311-G314 PolarHBondContact OG-O 3.02Å; F312-G314 VanDerWaalsContact C-N 3.3Å; F312-G314 PolarHBondContact O-N 3.29Å
315	I	81.6	Confident	65.2	Low	33 Å²	33	74.6 Å²	74.6	17%	0.169	42%	0.416	C	S	.	.			trans	-94.1	136.3	172.5	-63.6	178.6	0	0	0	109.2	I220 H223 F324	I220-I315 HydrophobicContact CD1-CD1 3.4Å; I220-I315 VanDerWaalsContact CD1-CD1 3.4Å; I220-I315 HydrophobicContact CD1-CG1 3.55Å; I220-I315 HydrophobicContact CG2-CG1 4.3Å; H223-I315 HydrophobicContact CB-CG1 3.83Å; I315-F324 HydrophobicContact CD1-CD1 4.17Å; I315-F324 HydrophobicContact CD1-CE1 3.78Å; I315-F324 HydrophobicContact CG2-CE1 4.31Å; I315-F324 HydrophobicContact CG2-CZ 4.14Å
316	L	67.8	Low	65.8	Low	43 Å²	43	76.3 Å²	76.3	23%	0.225	42%	0.418	C	S	.	.			trans	-98	125.1	172.3	-60.9	177.8	0	0	0	109.6	A191 L193 M357	A191-L316 HydrophobicContact CB-CD2 4.13Å; L193-L316 HydrophobicContact CB-CD1 3.66Å; L193-L316 HydrophobicContact CD1-CD1 3.91Å; L193-L316 HydrophobicContact CD2-CD1 3.84Å; L193-L316 HydrophobicContact CG-CD1 4.01Å; L316-M357 HydrophobicContact CD1-CE 3.75Å; L316-M357 HydrophobicContact CD1-SD 4.09Å; L316-M357 HydrophobicContact CD2-CE 4Å; L316-M357 HydrophobicContact CD2-SD 3.32Å; L316-M357 WeakPolarHBondContact CD2-SD 3.15Å; L316-M357 HydrophobicContact CG-CE 4.45Å; L316-M357 HydrophobicContact CG-SD 4.33Å
317	S	56.8	Low	66.6	Low	56 Å²	56	82 Å²	82	39%	0.392	44%	0.442	S	S	.	.			trans	-128.2	95	169.5	-77.1	0	0	0	0	109	G319 F324	S317-G319 PolarHBondContact O-N 2.04Å; S317-G319 VanDerWaalsContact O-N 3.1Å; S317-F324 VanDerWaalsContact OG-CE2 3.31Å; S317-F324 WeakPolarHBondContact OG-CE2 3.46Å
318	P	44.9	Very low	67.7	Low	131 Å²	131	81.5 Å²	81.5	85%	0.851	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	111.4	170.9	-12.9	27.3	0	0	0	108.8	R320	P318-R320 PolarHBondContact O-N 3.48Å
319	G	43.6	Very low	68.4	Low	81 Å²	81	76.5 Å²	76.5	84%	0.835	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.6	15.8	162.2	0	0	0	0	0	118.4	S317	S317-G319 PolarHBondContact O-N 2.04Å; S317-G319 VanDerWaalsContact O-N 3.1Å
320	R	42	Very low	68.8	Low	201 Å²	201	74 Å²	74	76%	0.758	41%	0.408	S	S	*	.			trans	-118.3	107.1	166.8	-80.5	-174.7	176.5	177.8	0.5	111.1	P318 R322	P318-R320 PolarHBondContact O-N 3.48Å; R320-R322 PolarHBondContact O-N 2.92Å
321	S	31.7	Very low	69.1	Low	135 Å²	135	73.9 Å²	73.9	94%	0.944	41%	0.408	S	S	*	.			trans	-68.7	59	167	-47.8	0	0	0	0	111.4
322	R	38.6	Very low	69.2	Low	202 Å²	202	73.6 Å²	73.6	76%	0.762	41%	0.406	S	S	*	.			trans	-89.3	120.5	153.4	-94.6	-178.4	168.6	174.8	-3.8	105.4	R320 F324	R320-R322 PolarHBondContact O-N 2.92Å; R322-F324 PolarHBondContact O-N 3.07Å
323	A	35.5	Very low	69.3	Low	99 Å²	99	73.6 Å²	73.6	82%	0.818	41%	0.406	S	S	*	.			trans	-57.4	94.9	166.8	0	0	0	0	0	107.5	T325	A323-T325 PolarHBondContact O-N 3.26Å; A323-T325 VanDerWaalsContact O-N 3.12Å
324	F	51	Low	69.5	Low	108 Å²	108	73.6 Å²	73.6	47%	0.474	41%	0.406	S	S	.	.			trans	-63.4	114.8	168.3	-93.7	-91.6	0	0	0	105.8	I315 S317 R322 R326	I315-F324 HydrophobicContact CD1-CD1 4.17Å; I315-F324 HydrophobicContact CD1-CE1 3.78Å; I315-F324 HydrophobicContact CG2-CE1 4.31Å; I315-F324 HydrophobicContact CG2-CZ 4.14Å; S317-F324 VanDerWaalsContact OG-CE2 3.31Å; S317-F324 WeakPolarHBondContact OG-CE2 3.46Å; R322-F324 PolarHBondContact O-N 3.07Å; F324-R326 PolarHBondContact O-N 3.44Å
325	T	56	Low	69.8	Low	140 Å²	140	74.8 Å²	74.8	86%	0.859	41%	0.412	S	S	*	.			trans	-69	-13.4	175.5	41.2	0	0	0	0	112.3	A323	A323-T325 PolarHBondContact O-N 3.26Å; A323-T325 VanDerWaalsContact O-N 3.12Å
326	R	73.6	Confident	70.4	Confident	98 Å²	98	73.2 Å²	73.2	37%	0.37	40%	0.404	S	S	.	.	S	Bend	trans	-86.8	135.5	-178	-57.8	-170.7	-175.9	-161.4	5.5	111.1	I220 E235 F324	I220-R326 HydrophobicContact CD1-CB 3.76Å; I220-R326 HydrophobicContact CG1-CB 4.39Å; E235-R326 WeakPolarHBondContact OE2-CD 3.28Å; E235-R326 IonicContact OE2-CZ 3.39Å; E235-R326 IonicContact OE2-NE 3.68Å; E235-R326 IonicContact OE2-NH1 3.29Å; E235-R326 PolarHBondContact OE2-NH1 2.91Å; F324-R326 PolarHBondContact O-N 3.44Å
327	K	85.1	Confident	71.7	Confident	135 Å²	135	75 Å²	75	59%	0.587	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-84	144.3	-179.2	-62.9	-178.5	179.6	179.9	0	110.6	G219 I220	G219-K327 WeakPolarHBondContact CA-O 3.32Å; I220-K327 PolarHBondContact N-O 3.12Å; I220-K327 VanDerWaalsContact N-O 3.1Å
328	S	92	Very high	73.4	Confident	38 Å²	38	72.5 Å²	72.5	27%	0.266	39%	0.39	S	S	.	.	B	Isolated β-bridge	trans	-69.4	158.4	168.1	-65.1	0	0	0	0	110.7	G188 G313	G188-S328 VanDerWaalsContact O-CB 3.29Å; G188-S328 WeakPolarHBondContact O-CB 3.5Å; G313-S328 WeakPolarHBondContact O-CB 3.1Å
329	F	94.8	Very high	75.5	Confident	1 Å²	1	69.3 Å²	69.3	0%	0.004	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-74.7	131.7	-177.2	178.2	-110.1	0	0	0	111.8	F186 G188 F212 A214 I220 L221 G313 L333	F186-F329 HydrophobicContact CB-CD1 4.28Å; F186-F329 VanDerWaalsContact CB-O 3.3Å; F186-F329 WeakPolarHBondContact CB-O 3.34Å; F186-F329 HydrophobicContact CD2-CD1 4.1Å; F186-F329 HydrophobicContact CD2-CE1 4.46Å; F186-F329 HydrophobicContact CG-CD1 4.44Å; G188-F329 WeakPolarHBondContact CA-O 3.23Å; G188-F329 PolarHBondContact N-O 3.4Å; F212-F329 HydrophobicContact CB-CZ 4.15Å; F212-F329 HydrophobicContact CD2-CE2 4.2Å; F212-F329 HydrophobicContact CD2-CZ 4.12Å; A214-F329 HydrophobicContact CB-CE2 4.03Å; I220-F329 WeakPolarHBondContact O-CB 3.28Å; L221-F329 HydrophobicContact CD1-CD2 3.55Å; L221-F329 HydrophobicContact CD1-CE2 3.78Å; L221-F329 HydrophobicContact CD1-CG 4.27Å; L221-F329 HydrophobicContact CG-CD2 3.97Å; L221-F329 HydrophobicContact CG-CE2 4.04Å; L221-F329 HydrophobicContact CG-CG 4.33Å; L221-F329 HydrophobicContact CG-CZ 4.46Å; G313-F329 PolarHBondContact O-N 3.25Å; F329-L333 HydrophobicContact CD1-CD2 4.37Å; F329-L333 HydrophobicContact CE1-CD2 3.72Å; F329-L333 HydrophobicContact CE1-CG 4.19Å; F329-L333 HydrophobicContact CZ-CD2 4.21Å
330	H	94.9	Very high	77.6	Confident	43 Å²	43	68.6 Å²	68.6	20%	0.199	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	107	172.2	-177.2	176.9	0	0	0	108.3	Y185 F186 M215 Q216	Y185-H330 PolarHBondContact OH-NE2 3.45Å; Y185-H330 VanDerWaalsContact OH-NE2 3.11Å; F186-H330 WeakPolarHBondContact O-CA 3.36Å; F186-H330 PolarHBondContact O-CD2 3.33Å; M215-H330 PolarHBondContact N-O 3.01Å; Q216-H330 HydrophobicContact CB-CB 4.45Å; Q216-H330 HydrophobicContact CG-CB 4.01Å; Q216-H330 PolarHBondContact NE2-ND1 3.04Å; Q216-H330 VanDerWaalsContact NE2-ND1 3.15Å
331	G	95	Very high	80	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.4	-166.7	-171.8	0	0	0	0	0	112.9	Y185 F186 K213	Y185-G331 WeakPolarHBondContact CD2-O 3.32Å; F186-G331 PolarHBondContact N-O 3.13Å; F186-G331 PolarHBondContact O-N 2.85Å; K213-G331 CarbonylContact O-C 3.56Å; K213-G331 WeakPolarHBondContact O-CA 3.49Å
332	C	95.7	Very high	82.9	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	142.3	179.7	-51.5	0	0	0	0	110	V183 V184 F212 K213 W272 C364	V183-C332 HydrophobicContact CG1-CB 3.91Å; V184-C332 CarbonylContact O-C 3.58Å; V184-C332 VanDerWaalsContact O-CA 3.27Å; V184-C332 WeakPolarHBondContact O-CA 3.29Å; F212-C332 CarbonylContact C-O 3.5Å; F212-C332 VanDerWaalsContact CA-O 3.27Å; F212-C332 WeakPolarHBondContact CA-O 3.24Å; K213-C332 HydrophobicContact CB-CB 4.44Å; K213-C332 PolarHBondContact N-O 3.26Å; K213-C332 PolarHBondContact O-N 3.34Å; W272-C332 HydrophobicContact CH2-CB 3.45Å; W272-C332 VanDerWaalsContact CH2-CB 3.45Å; W272-C332 HydrophobicContact CZ2-CB 4.18Å; W272-C332 HydrophobicContact CZ3-CB 4.06Å; W272-C332 WeakPolarHBondContact CZ3-O 3.34Å; C332-C364 HydrophobicContact CB-CB 3.84Å; C332-C364 WeakPolarHBondContact CB-SG 3.49Å; C332-C364 WeakPolarHBondContact SG-CA 3.01Å; C332-C364 WeakPolarHBondContact SG-CB 3.47Å; C332-C364 CovalentContact SG-SG 2.03Å; C332-C364 PolarHBondContact SG-SG 2.87Å
333	L	96.5	Very high	85.5	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	138.6	165.6	-55.5	-177.5	0	0	0	109.2	V183 V184 F186 L210 K211 F212 F312 F329	V183-L333 CarbonylContact C-O 3.58Å; V183-L333 WeakPolarHBondContact CA-O 3.38Å; V183-L333 WeakPolarHBondContact CG1-O 3.37Å; V184-L333 HydrophobicContact CG1-CB 3.86Å; V184-L333 PolarHBondContact N-O 2.9Å; V184-L333 PolarHBondContact O-N 3.35Å; F186-L333 HydrophobicContact CD2-CD1 4.37Å; F186-L333 HydrophobicContact CD2-CG 4.1Å; F186-L333 HydrophobicContact CE2-CB 4.12Å; F186-L333 HydrophobicContact CE2-CD1 3.52Å; F186-L333 HydrophobicContact CE2-CG 3.58Å; F186-L333 HydrophobicContact CZ-CD1 4.07Å; L210-L333 HydrophobicContact CD1-CD2 4.29Å; K211-L333 CarbonylContact O-C 3.53Å; K211-L333 VanDerWaalsContact O-CA 3.31Å; K211-L333 WeakPolarHBondContact O-CA 3.48Å; F212-L333 HydrophobicContact CB-CD2 3.46Å; F212-L333 VanDerWaalsContact CB-CD2 3.46Å; F312-L333 HydrophobicContact CB-CD1 4.27Å; F329-L333 HydrophobicContact CD1-CD2 4.37Å; F329-L333 HydrophobicContact CE1-CD2 3.72Å; F329-L333 HydrophobicContact CE1-CG 4.19Å; F329-L333 HydrophobicContact CZ-CD2 4.21Å
334	E	94.7	Very high	88.3	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	140.1	179.5	161.3	172	-106.2	0	0	109.7	R88 Y179 S181 E182 V183 K211 W272 L336	R88-E334 IonicContact CZ-OE1 2.97Å; R88-E334 IonicContact CZ-OE2 3.85Å; R88-E334 IonicContact NH1-OE1 3.96Å; R88-E334 PolarHBondContact NH1-OE1 3.36Å; R88-E334 IonicContact NH1-OE2 3.71Å; R88-E334 PolarHBondContact NH1-OE2 3.43Å; R88-E334 IonicContact NH2-OE2 2.82Å; R88-E334 PolarHBondContact NH2-OE2 3.29Å; Y179-E334 WeakPolarHBondContact CE1-OE1 3.49Å; Y179-E334 PolarHBondContact OH-OE2 3.19Å; S181-E334 WeakPolarHBondContact CB-OE1 3.08Å; S181-E334 PolarHBondContact OG-OE1 3.33Å; E182-E334 WeakPolarHBondContact O-CA 3.02Å; V183-E334 HydrophobicContact CG2-CB 4.21Å; K211-E334 HydrophobicContact CB-CB 3.98Å; K211-E334 HydrophobicContact CB-CG 4.23Å; K211-E334 HydrophobicContact CD-CG 4.49Å; K211-E334 WeakPolarHBondContact CD-OE2 3.09Å; K211-E334 PolarHBondContact N-O 3.44Å; K211-E334 PolarHBondContact O-N 2.82Å; W272-E334 HydrophobicContact CE3-CB 3.96Å; W272-E334 HydrophobicContact CH2-CB 3.57Å; W272-E334 HydrophobicContact CZ2-CB 4.28Å; W272-E334 HydrophobicContact CZ3-CB 3.4Å; E334-L336 VanDerWaalsContact C-N 3.34Å; E334-L336 PolarHBondContact O-N 2.73Å
335	N	93.1	Very high	90.3	Very high	26 Å²	26	40.2 Å²	40.2	14%	0.139	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	50.4	54.7	170.8	-67.9	-4.5	0	0	0	111.2	Y179 E182 Y337	Y179-N335 PolarHBondContact OH-ND2 2.88Å; Y179-N335 VanDerWaalsContact OH-ND2 3.08Å; E182-N335 PolarHBondContact N-OD1 3.01Å; E182-N335 PolarHBondContact O-N 3.48Å; N335-Y337 HydrophobicContact CB-CD2 4.44Å; N335-Y337 HydrophobicContact CB-CE2 3.88Å; N335-Y337 WeakPolarHBondContact O-CD2 3.47Å; N335-Y337 PolarHBondContact O-N 3.36Å
336	L	95.4	Very high	92.1	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	108.1	-177.5	175.6	61.3	0	0	0	110.3	L210 F312 E334 V343 T344	L210-L336 HydrophobicContact CB-CD1 3.72Å; L210-L336 HydrophobicContact CD2-CD1 3.65Å; L210-L336 HydrophobicContact CG-CD1 4.33Å; F312-L336 HydrophobicContact CB-CD2 4.28Å; F312-L336 HydrophobicContact CD1-CD1 3.91Å; F312-L336 HydrophobicContact CD1-CD2 3.75Å; F312-L336 HydrophobicContact CD1-CG 4.46Å; F312-L336 HydrophobicContact CD2-CD2 3.75Å; F312-L336 HydrophobicContact CE1-CD1 3.54Å; F312-L336 HydrophobicContact CE1-CD2 3.96Å; F312-L336 HydrophobicContact CE1-CG 4.26Å; F312-L336 HydrophobicContact CE2-CD2 3.92Å; F312-L336 HydrophobicContact CG-CD2 3.65Å; F312-L336 HydrophobicContact CZ-CD1 3.96Å; F312-L336 HydrophobicContact CZ-CD2 4.02Å; F312-L336 HydrophobicContact CZ-CG 4.31Å; E334-L336 VanDerWaalsContact C-N 3.34Å; E334-L336 PolarHBondContact O-N 2.73Å; L336-V343 HydrophobicContact CB-CB 4.43Å; L336-V343 HydrophobicContact CD2-CB 3.83Å; L336-V343 HydrophobicContact CD2-CG1 3.78Å; L336-V343 HydrophobicContact CG-CB 3.87Å; L336-V343 HydrophobicContact CG-CG1 4.37Å; L336-V343 HydrophobicContact CG-CG2 4.29Å; L336-V343 PolarHBondContact O-N 3.18Å; L336-T344 WeakPolarHBondContact CB-OG1 3.26Å; L336-T344 PolarHBondContact N-OG1 3.4Å
337	Y	94.4	Very high	93	Very high	82 Å²	82	30.1 Å²	30.1	32%	0.322	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	132.7	177.8	-67.5	-79.8	0	0	0	111.8	I208 S209 N335 V341 D342	I208-Y337 WeakPolarHBondContact CA-O 3.49Å; S209-Y337 PolarHBondContact N-O 3.49Å; S209-Y337 PolarHBondContact O-N 2.93Å; N335-Y337 HydrophobicContact CB-CD2 4.44Å; N335-Y337 HydrophobicContact CB-CE2 3.88Å; N335-Y337 WeakPolarHBondContact O-CD2 3.47Å; N335-Y337 PolarHBondContact O-N 3.36Å; Y337-V341 WeakPolarHBondContact CA-O 3.47Å; Y337-D342 HydrophobicContact CD1-CB 4.06Å; Y337-D342 HydrophobicContact CE1-CB 3.49Å; Y337-D342 VanDerWaalsContact CE1-CB 3.49Å; Y337-D342 WeakPolarHBondContact CE1-OD2 3.26Å; Y337-D342 VanDerWaalsContact CZ-OD2 3.3Å; Y337-D342 PolarHBondContact OH-OD2 2.82Å
338	Y	91.8	Very high	93.4	Very high	2 Å²	2	26.6 Å²	26.6	1%	0.008	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	117	168.1	-175	-79.8	0	0	0	108.9	Y194 L196 D206 I208 R224 I310 G340 V341	Y194-Y338 HydrophobicContact CE1-CD1 4.16Å; Y194-Y338 HydrophobicContact CE1-CG 4.43Å; L196-Y338 HydrophobicContact CD2-CD1 3.66Å; L196-Y338 HydrophobicContact CD2-CE1 3.24Å; L196-Y338 HydrophobicContact CG-CE1 4.49Å; D206-Y338 PolarHBondContact OD1-OH 2.85Å; D206-Y338 PolarHBondContact OD2-OH 3.42Å; I208-Y338 HydrophobicContact CD1-CD2 4.22Å; I208-Y338 HydrophobicContact CD1-CE2 4.06Å; I208-Y338 HydrophobicContact CG1-CD2 3.79Å; I208-Y338 HydrophobicContact CG1-CE2 3.92Å; R224-Y338 PolarHBondContact NH1-OH 3.39Å; I310-Y338 HydrophobicContact CD1-CD2 3.94Å; I310-Y338 HydrophobicContact CD1-CE2 3.88Å; Y338-G340 PolarHBondContact O-N 2.82Å; Y338-G340 VanDerWaalsContact O-N 3.11Å; Y338-V341 PolarHBondContact N-O 3.44Å; Y338-V341 WeakPolarHBondContact O-CB 3.33Å; Y338-V341 PolarHBondContact O-N 2.99Å
339	N	89.3	Confident	93.4	Very high	64 Å²	64	30.7 Å²	30.7	34%	0.342	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.3	39.1	-177.5	-68.5	-12.3	0	0	0	113.4	D206 V207 V341	D206-N339 WeakPolarHBondContact CA-OD1 3.45Å; D206-N339 PolarHBondContact OD1-ND2 2.94Å; V207-N339 PolarHBondContact N-OD1 3.36Å; V207-N339 PolarHBondContact O-N 3.25Å; V207-N339 PolarHBondContact O-OD1 3.03Å; N339-V341 VanDerWaalsContact C-N 3.3Å; N339-V341 PolarHBondContact O-N 2.85Å
340	G	88.7	Confident	93.3	Very high	67 Å²	67	37 Å²	37	69%	0.691	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.3	-3.3	-178.9	0	0	0	0	0	115.5	Y338	Y338-G340 PolarHBondContact O-N 2.82Å; Y338-G340 VanDerWaalsContact O-N 3.11Å
341	V	91.5	Very high	93.3	Very high	52 Å²	52	39.6 Å²	39.6	32%	0.315	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	125.7	174.4	-178.6	0	0	0	0	110	Y337 Y338 N339 V343 L346	Y337-V341 WeakPolarHBondContact CA-O 3.47Å; Y338-V341 PolarHBondContact N-O 3.44Å; Y338-V341 WeakPolarHBondContact O-CB 3.33Å; Y338-V341 PolarHBondContact O-N 2.99Å; N339-V341 VanDerWaalsContact C-N 3.3Å; N339-V341 PolarHBondContact O-N 2.85Å; V341-V343 PolarHBondContact O-N 2.64Å; V341-V343 VanDerWaalsContact O-N 3.17Å; V341-L346 HydrophobicContact CG1-CD1 3.55Å; V341-L346 HydrophobicContact CG1-CG 4.31Å
342	D	93.2	Very high	93.1	Very high	21 Å²	21	45.7 Å²	45.7	11%	0.112	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	94.6	174.8	-163	-41	0	0	0	110.9	Y337 T344 E345 L346	Y337-D342 HydrophobicContact CD1-CB 4.06Å; Y337-D342 HydrophobicContact CE1-CB 3.49Å; Y337-D342 VanDerWaalsContact CE1-CB 3.49Å; Y337-D342 WeakPolarHBondContact CE1-OD2 3.26Å; Y337-D342 VanDerWaalsContact CZ-OD2 3.3Å; Y337-D342 PolarHBondContact OH-OD2 2.82Å; D342-T344 VanDerWaalsContact C-N 3.26Å; D342-T344 PolarHBondContact O-N 2.75Å; D342-T344 WeakPolarHBondContact OD1-CB 3.49Å; D342-T344 PolarHBondContact OD1-N 3.33Å; D342-T344 VanDerWaalsContact OD1-N 3.16Å; D342-E345 HydrophobicContact CB-CB 3.83Å; D342-E345 PolarHBondContact O-N 2.02Å; D342-E345 PolarHBondContact OD1-N 2.88Å; D342-L346 WeakPolarHBondContact O-CG 3.36Å; D342-L346 PolarHBondContact O-N 3.27Å; D342-L346 VanDerWaalsContact O-N 3.14Å
343	V	94.3	Very high	92.8	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-66.3	-33.2	-178.3	-179.3	0	0	0	0	110.7	Y194 F312 L336 V341 L346 A347 I354	Y194-V343 HydrophobicContact CD1-CG2 4.2Å; Y194-V343 HydrophobicContact CG-CG2 4.44Å; F312-V343 HydrophobicContact CD2-CG1 4.35Å; F312-V343 HydrophobicContact CE2-CG1 4.13Å; L336-V343 HydrophobicContact CB-CB 4.43Å; L336-V343 HydrophobicContact CD2-CB 3.83Å; L336-V343 HydrophobicContact CD2-CG1 3.78Å; L336-V343 HydrophobicContact CG-CB 3.87Å; L336-V343 HydrophobicContact CG-CG1 4.37Å; L336-V343 HydrophobicContact CG-CG2 4.29Å; L336-V343 PolarHBondContact O-N 3.18Å; V341-V343 PolarHBondContact O-N 2.64Å; V341-V343 VanDerWaalsContact O-N 3.17Å; V343-L346 PolarHBondContact O-N 3.1Å; V343-A347 PolarHBondContact O-N 2.04Å; V343-I354 HydrophobicContact CG1-CD1 3.65Å
344	T	93.1	Very high	92.7	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-66.3	-43.4	178	-54.9	0	0	0	0	111.1	E182 V184 L336 D342 A347 K348	E182-T344 HydrophobicContact CB-CG2 3.82Å; V184-T344 HydrophobicContact CB-CG2 4.43Å; L336-T344 WeakPolarHBondContact CB-OG1 3.26Å; L336-T344 PolarHBondContact N-OG1 3.4Å; D342-T344 VanDerWaalsContact C-N 3.26Å; D342-T344 PolarHBondContact O-N 2.75Å; D342-T344 WeakPolarHBondContact OD1-CB 3.49Å; D342-T344 PolarHBondContact OD1-N 3.33Å; D342-T344 VanDerWaalsContact OD1-N 3.16Å; T344-A347 PolarHBondContact O-N 2.97Å; T344-K348 WeakPolarHBondContact O-CG 3Å; T344-K348 PolarHBondContact O-N 2.73Å
345	E	93	Very high	92.5	Very high	75 Å²	75	53.6 Å²	53.6	35%	0.35	28%	0.283	S	S	.	.	H	α-helix	trans	-63.4	-42.2	175.7	-169.7	-173.2	165.1	0	0	111.7	D342 A347 K348 K349	D342-E345 HydrophobicContact CB-CB 3.83Å; D342-E345 PolarHBondContact O-N 2.02Å; D342-E345 PolarHBondContact OD1-N 2.88Å; E345-A347 VanDerWaalsContact C-N 3.31Å; E345-A347 PolarHBondContact O-N 2.78Å; E345-K348 PolarHBondContact O-N 3.03Å; E345-K349 HydrophobicContact CG-CD 4.1Å; E345-K349 WeakPolarHBondContact O-CB 3.24Å; E345-K349 WeakPolarHBondContact O-CG 3.47Å; E345-K349 PolarHBondContact O-N 3.43Å; E345-K349 VanDerWaalsContact OE1-CE 3.28Å; E345-K349 WeakPolarHBondContact OE1-CE 3.37Å; E345-K349 IonicContact OE1-NZ 2.96Å; E345-K349 PolarHBondContact OE1-NZ 2.88Å
346	L	93.6	Very high	92.4	Very high	27 Å²	27	55.1 Å²	55.1	14%	0.141	29%	0.289	C	S	.	.	H	α-helix	trans	-59.8	-42.1	175.9	-67.8	-178.7	0	0	0	111.7	Y194 V341 D342 V343 K349 H350 K351 I354	Y194-L346 HydrophobicContact CD2-CD1 4.35Å; Y194-L346 HydrophobicContact CE2-CD1 3.82Å; V341-L346 HydrophobicContact CG1-CD1 3.55Å; V341-L346 HydrophobicContact CG1-CG 4.31Å; D342-L346 WeakPolarHBondContact O-CG 3.36Å; D342-L346 PolarHBondContact O-N 3.27Å; D342-L346 VanDerWaalsContact O-N 3.14Å; V343-L346 PolarHBondContact O-N 3.1Å; L346-K349 PolarHBondContact O-N 2.04Å; L346-H350 PolarHBondContact O-N 3.3Å; L346-H350 VanDerWaalsContact O-N 3.14Å; L346-K351 HydrophobicContact CB-CB 4.28Å; L346-K351 HydrophobicContact CB-CG 4.42Å; L346-K351 HydrophobicContact CD2-CB 3.98Å; L346-K351 HydrophobicContact CD2-CG 3.71Å; L346-K351 PolarHBondContact O-N 2.98Å; L346-I354 HydrophobicContact CB-CD1 4.28Å; L346-I354 HydrophobicContact CB-CG1 3.54Å; L346-I354 HydrophobicContact CD1-CG1 4.3Å
347	A	93.4	Very high	92	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-64	-49.2	176.2	0	0	0	0	0	111.5	L192 V343 T344 E345 K349 H350 I354 M356 F362	L192-A347 HydrophobicContact CD1-CB 4.13Å; L192-A347 HydrophobicContact CD2-CB 4.27Å; V343-A347 PolarHBondContact O-N 2.04Å; T344-A347 PolarHBondContact O-N 2.97Å; E345-A347 VanDerWaalsContact C-N 3.31Å; E345-A347 PolarHBondContact O-N 2.78Å; A347-K349 VanDerWaalsContact C-N 3.27Å; A347-K349 PolarHBondContact O-N 2.87Å; A347-H350 PolarHBondContact O-N 2.88Å; A347-I354 HydrophobicContact CB-CG2 4.02Å; A347-M356 HydrophobicContact CB-SD 4.32Å; A347-F362 HydrophobicContact CB-CE1 4Å; A347-F362 HydrophobicContact CB-CZ 4.14Å
348	K	92.3	Very high	91.6	Very high	61 Å²	61	57.7 Å²	57.7	27%	0.265	32%	0.323	S	S	.	.	H	α-helix	trans	-56.1	-41.9	177.1	-75.8	-175.6	-176.6	-157.4	0	112.3	E182 V183 T344 E345 H350 F362	E182-K348 WeakPolarHBondContact OE2-CD 3.47Å; E182-K348 WeakPolarHBondContact OE2-CE 3.49Å; E182-K348 IonicContact OE2-NZ 3.58Å; E182-K348 PolarHBondContact OE2-NZ 3.49Å; V183-K348 WeakPolarHBondContact O-CE 3.15Å; T344-K348 WeakPolarHBondContact O-CG 3Å; T344-K348 PolarHBondContact O-N 2.73Å; E345-K348 PolarHBondContact O-N 3.03Å; K348-H350 VanDerWaalsContact C-N 3.28Å; K348-H350 PolarHBondContact O-N 3.23Å; K348-H350 PolarHBondContact O-ND1 3.19Å; K348-F362 HydrophobicContact CB-CD1 4.49Å; K348-F362 HydrophobicContact CB-CE1 4.25Å; K348-F362 HydrophobicContact CB-CZ 4.34Å; K348-F362 HydrophobicContact CD-CD1 4.02Å; K348-F362 HydrophobicContact CD-CG 4.28Å; K348-F362 HydrophobicContact CG-CB 4.38Å; K348-F362 HydrophobicContact CG-CD1 3.25Å; K348-F362 HydrophobicContact CG-CD2 4.11Å; K348-F362 HydrophobicContact CG-CE1 3.36Å; K348-F362 HydrophobicContact CG-CE2 4.2Å; K348-F362 HydrophobicContact CG-CG 3.64Å; K348-F362 HydrophobicContact CG-CZ 3.85Å
349	K	93.7	Very high	91.2	Very high	123 Å²	123	63.5 Å²	63.5	54%	0.535	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	4.8	-179.9	-67.4	-177.8	177.3	177.2	0	114.2	E345 L346 A347 K351	E345-K349 HydrophobicContact CG-CD 4.1Å; E345-K349 WeakPolarHBondContact O-CB 3.24Å; E345-K349 WeakPolarHBondContact O-CG 3.47Å; E345-K349 PolarHBondContact O-N 3.43Å; E345-K349 VanDerWaalsContact OE1-CE 3.28Å; E345-K349 WeakPolarHBondContact OE1-CE 3.37Å; E345-K349 IonicContact OE1-NZ 2.96Å; E345-K349 PolarHBondContact OE1-NZ 2.88Å; L346-K349 PolarHBondContact O-N 2.04Å; A347-K349 VanDerWaalsContact C-N 3.27Å; A347-K349 PolarHBondContact O-N 2.87Å; K349-K351 VanDerWaalsContact C-N 3.29Å; K349-K351 HydrophobicContact CB-CD 4.46Å; K349-K351 HydrophobicContact CB-CG 4.11Å; K349-K351 PolarHBondContact O-N 3.19Å
350	H	91.8	Very high	90.9	Very high	134 Å²	134	61.4 Å²	61.4	62%	0.62	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	45.5	178.5	-62	65	0	0	0	112.8	L346 A347 K348 M356	L346-H350 PolarHBondContact O-N 3.3Å; L346-H350 VanDerWaalsContact O-N 3.14Å; A347-H350 PolarHBondContact O-N 2.88Å; K348-H350 VanDerWaalsContact C-N 3.28Å; K348-H350 PolarHBondContact O-N 3.23Å; K348-H350 PolarHBondContact O-ND1 3.19Å; H350-M356 WeakPolarHBondContact CD2-CE 3.48Å; H350-M356 WeakPolarHBondContact NE2-CE 3.25Å
351	K	94.5	Very high	91.1	Very high	97 Å²	97	60 Å²	60	42%	0.422	32%	0.323	S	S	.	.			trans	-72.6	148	-179.5	-65.6	-64.1	-170.7	179.2	0	111.1	L346 K349 Q353 I354	L346-K351 HydrophobicContact CB-CB 4.28Å; L346-K351 HydrophobicContact CB-CG 4.42Å; L346-K351 HydrophobicContact CD2-CB 3.98Å; L346-K351 HydrophobicContact CD2-CG 3.71Å; L346-K351 PolarHBondContact O-N 2.98Å; K349-K351 VanDerWaalsContact C-N 3.29Å; K349-K351 HydrophobicContact CB-CD 4.46Å; K349-K351 HydrophobicContact CB-CG 4.11Å; K349-K351 PolarHBondContact O-N 3.19Å; K351-Q353 PolarHBondContact O-N 2.86Å; K351-Q353 VanDerWaalsContact O-N 3.1Å; K351-I354 PolarHBondContact O-N 2.94Å
352	P	90.7	Very high	91.2	Very high	128 Å²	128	60.6 Å²	60.6	83%	0.831	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-16.3	-174.1	27	-36.3	0	0	0	114.7	I354	P352-I354 PolarHBondContact O-N 3.38Å
353	Q	90.4	Very high	91.1	Very high	59 Å²	59	63.1 Å²	63.1	28%	0.276	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-10.6	175.6	-67.8	165.8	-25.4	0	0	113	Y194 T195 D197 K351	Y194-Q353 HydrophobicContact CD2-CB 4.34Å; Y194-Q353 HydrophobicContact CE2-CB 4.07Å; T195-Q353 PolarHBondContact N-O 2.82Å; D197-Q353 PolarHBondContact OD1-NE2 2.85Å; K351-Q353 PolarHBondContact O-N 2.86Å; K351-Q353 VanDerWaalsContact O-N 3.1Å
354	I	93.2	Very high	90.9	Very high	19 Å²	19	64.9 Å²	64.9	10%	0.097	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	128.4	-179.3	-62.9	-70.4	0	0	0	109.9	L192 L193 Y194 V343 L346 A347 K351 P352 M356	L192-I354 HydrophobicContact CD2-CG2 4.29Å; L193-I354 WeakPolarHBondContact O-CA 3.35Å; Y194-I354 HydrophobicContact CD2-CD1 3.47Å; Y194-I354 VanDerWaalsContact CD2-CD1 3.47Å; Y194-I354 HydrophobicContact CD2-CG1 4.34Å; Y194-I354 HydrophobicContact CE2-CD1 4.48Å; Y194-I354 HydrophobicContact CG-CD1 3.91Å; V343-I354 HydrophobicContact CG1-CD1 3.65Å; L346-I354 HydrophobicContact CB-CD1 4.28Å; L346-I354 HydrophobicContact CB-CG1 3.54Å; L346-I354 HydrophobicContact CD1-CG1 4.3Å; A347-I354 HydrophobicContact CB-CG2 4.02Å; K351-I354 PolarHBondContact O-N 2.94Å; P352-I354 PolarHBondContact O-N 3.38Å; I354-M356 HydrophobicContact CG2-CG 4.06Å
355	L	92	Very high	90.7	Very high	89 Å²	89	67.5 Å²	67.5	47%	0.466	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	121.7	166.9	176.5	66.2	0	0	0	109.3	L193 M357	L193-L355 HydrophobicContact CB-CB 4.21Å; L193-L355 HydrophobicContact CD2-CD2 4.3Å; L193-L355 PolarHBondContact N-O 3.12Å; L193-L355 PolarHBondContact O-N 2.95Å; L355-M357 HydrophobicContact CD2-CE 3.46Å; L355-M357 VanDerWaalsContact CD2-CE 3.46Å; L355-M357 HydrophobicContact CG-CE 4.18Å; L355-M357 HydrophobicContact CG-CG 4.44Å
356	M	90.9	Very high	90.1	Very high	57 Å²	57	69.7 Å²	69.7	28%	0.281	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	130.3	175.1	-58.8	-168.8	-79.1	0	0	109.7	L192 A347 H350 I354 V360 F362	L192-M356 HydrophobicContact CD2-CB 4.16Å; L192-M356 HydrophobicContact CD2-CG 3.56Å; L192-M356 HydrophobicContact CD2-SD 4.32Å; A347-M356 HydrophobicContact CB-SD 4.32Å; H350-M356 WeakPolarHBondContact CD2-CE 3.48Å; H350-M356 WeakPolarHBondContact NE2-CE 3.25Å; I354-M356 HydrophobicContact CG2-CG 4.06Å; M356-V360 HydrophobicContact CB-CG2 4.33Å; M356-V360 HydrophobicContact SD-CB 4.49Å; M356-F362 HydrophobicContact SD-CZ 3.99Å
357	M	87.3	Confident	89.1	Confident	71 Å²	71	69.7 Å²	69.7	35%	0.35	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	138.7	176	-62.7	-163.3	-173.9	0	0	110.8	S190 A191 L316 L355	S190-M357 CarbonylContact C-O 3.55Å; S190-M357 WeakPolarHBondContact CA-O 3.38Å; S190-M357 WeakPolarHBondContact CB-O 3.38Å; A191-M357 PolarHBondContact N-O 2.91Å; A191-M357 PolarHBondContact O-N 2.97Å; L316-M357 HydrophobicContact CD1-CE 3.75Å; L316-M357 HydrophobicContact CD1-SD 4.09Å; L316-M357 HydrophobicContact CD2-CE 4Å; L316-M357 HydrophobicContact CD2-SD 3.32Å; L316-M357 WeakPolarHBondContact CD2-SD 3.15Å; L316-M357 HydrophobicContact CG-CE 4.45Å; L316-M357 HydrophobicContact CG-SD 4.33Å; L355-M357 HydrophobicContact CD2-CE 3.46Å; L355-M357 VanDerWaalsContact CD2-CE 3.46Å; L355-M357 HydrophobicContact CG-CE 4.18Å; L355-M357 HydrophobicContact CG-CG 4.44Å
358	G	85.1	Confident	88.3	Confident	65 Å²	65	78.6 Å²	78.6	67%	0.67	42%	0.423	S	S	*	.	S	Bend	trans	71.5	-162.1	-173.8	0	0	0	0	0	112.4	V360	G358-V360 PolarHBondContact O-N 2.55Å
359	N	82.8	Confident	87.9	Confident	125 Å²	125	77.1 Å²	77.1	67%	0.668	42%	0.419	S	S	*	.			trans	-96	83.4	-177.7	-170.5	21.3	0	0	0	111
360	V	84.4	Confident	87.9	Confident	19 Å²	19	72 Å²	72	12%	0.115	40%	0.398	C	S	.	.			trans	-76.7	126.5	176.4	-179.2	0	0	0	0	109.7	V184 L192 M356 G358 F362	V184-V360 HydrophobicContact CG2-CG1 3.22Å; L192-V360 HydrophobicContact CD2-CG1 4.29Å; L192-V360 HydrophobicContact CD2-CG2 4.09Å; M356-V360 HydrophobicContact CB-CG2 4.33Å; M356-V360 HydrophobicContact SD-CB 4.49Å; G358-V360 PolarHBondContact O-N 2.55Å; V360-F362 HydrophobicContact CG1-CE1 4.48Å
361	S	91.6	Very high	88	Confident	38 Å²	38	65.8 Å²	65.8	27%	0.266	37%	0.37	S	S	.	.	B	Isolated β-bridge	trans	-109.5	152	175	176	0	0	0	0	111.1	V184 Y185 S363	V184-S361 CarbonylContact C-O 3.59Å; V184-S361 WeakPolarHBondContact CA-O 3.05Å; Y185-S361 PolarHBondContact N-O 3Å; S361-S363 PolarHBondContact OG-N 3.05Å; S361-S363 PolarHBondContact OG-OG 3.12Å; S361-S363 VanDerWaalsContact OG-OG 3.12Å
362	F	93.1	Very high	88.1	Confident	65 Å²	65	61.2 Å²	61.2	29%	0.285	35%	0.35	S	S	.	.	S	Bend	trans	-104.4	18.3	179	-63.2	-66.5	0	0	0	113.4	V183 V184 A347 K348 M356 V360	V183-F362 CarbonylContact O-C 3.6Å; V183-F362 VanDerWaalsContact O-CA 3.32Å; V183-F362 WeakPolarHBondContact O-CA 3.46Å; V184-F362 HydrophobicContact CB-CD1 4.42Å; V184-F362 HydrophobicContact CG2-CE1 4.46Å; A347-F362 HydrophobicContact CB-CE1 4Å; A347-F362 HydrophobicContact CB-CZ 4.14Å; K348-F362 HydrophobicContact CB-CD1 4.49Å; K348-F362 HydrophobicContact CB-CE1 4.25Å; K348-F362 HydrophobicContact CB-CZ 4.34Å; K348-F362 HydrophobicContact CD-CD1 4.02Å; K348-F362 HydrophobicContact CD-CG 4.28Å; K348-F362 HydrophobicContact CG-CB 4.38Å; K348-F362 HydrophobicContact CG-CD1 3.25Å; K348-F362 HydrophobicContact CG-CD2 4.11Å; K348-F362 HydrophobicContact CG-CE1 3.36Å; K348-F362 HydrophobicContact CG-CE2 4.2Å; K348-F362 HydrophobicContact CG-CG 3.64Å; K348-F362 HydrophobicContact CG-CZ 3.85Å; M356-F362 HydrophobicContact SD-CZ 3.99Å; V360-F362 HydrophobicContact CG1-CE1 4.48Å
363	S	91.4	Very high	88.4	Confident	74 Å²	74	55.1 Å²	55.1	52%	0.517	31%	0.311	S	S	.	.	S	Bend	trans	-127.1	133.6	173.8	63	0	0	0	0	109.7	Y185 S361 P365	Y185-S363 WeakPolarHBondContact CB-O 3.01Å; S361-S363 PolarHBondContact OG-N 3.05Å; S361-S363 PolarHBondContact OG-OG 3.12Å; S361-S363 VanDerWaalsContact OG-OG 3.12Å; S363-P365 WeakPolarHBondContact O-CD 3.36Å
364	C	90.8	Very high	88.7	Confident	36 Å²	36	52.3 Å²	52.3	24%	0.243	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-85.6	122.4	176.2	-168.9	0	0	0	0	111	V183 W272 C332	V183-C364 HydrophobicContact CG1-CB 3.87Å; W272-C364 HydrophobicContact CZ2-CB 4.45Å; C332-C364 HydrophobicContact CB-CB 3.84Å; C332-C364 WeakPolarHBondContact CB-SG 3.49Å; C332-C364 WeakPolarHBondContact SG-CA 3.01Å; C332-C364 WeakPolarHBondContact SG-CB 3.47Å; C332-C364 CovalentContact SG-SG 2.03Å; C332-C364 PolarHBondContact SG-SG 2.87Å
365	P	88.9	Confident	88.6	Confident	56 Å²	56	55 Å²	55	36%	0.364	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-60.7	140.2	174.9	-22.6	34	0	0	0	111.9	Y185 M215 S363	Y185-P365 HydrophobicContact CD1-CG 4.41Å; Y185-P365 HydrophobicContact CD2-CG 3.9Å; Y185-P365 HydrophobicContact CE1-CG 4.27Å; Y185-P365 HydrophobicContact CE2-CG 3.73Å; Y185-P365 HydrophobicContact CG-CG 4.21Å; M215-P365 WeakPolarHBondContact CE-O 3.48Å; S363-P365 WeakPolarHBondContact O-CD 3.36Å
366	Q	80.7	Confident	88.6	Confident	120 Å²	120	52 Å²	52	56%	0.561	30%	0.298	S	S	*	.	P	Polyproline II helix	trans	-85.1	124.3	173.2	-70.4	-176.5	-8.2	0	0	110
367	P	72.4	Confident	88.5	Confident	28 Å²	28	52 Å²	52	18%	0.182	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-66.5	138.4	176.6	-12.4	24.4	0	0	0	111.4	M215 Q270	M215-P367 HydrophobicContact CE-CG 4.1Å; M215-P367 HydrophobicContact SD-CG 4.02Å; Q270-P367 HydrophobicContact CB-CG 3.96Å; Q270-P367 HydrophobicContact CG-CG 4.27Å
368	Q	75.8	Confident	88.5	Confident	186 Å²	186	56.5 Å²	56.5	87%	0.869	32%	0.317	S	S	*	.			trans	-94.8	0.9	176.6	-64.8	-169.9	-6.1	0	0	113.6	V370	Q368-V370 PolarHBondContact O-N 3.16Å
369	T	84.9	Confident	88.9	Confident	30 Å²	30	53.4 Å²	53.4	18%	0.184	29%	0.285	C	S	.	.			trans	-76.1	124.4	-178.3	52.7	0	0	0	0	111.1	Q270 P371 L516	Q270-T369 PolarHBondContact NE2-OG1 3.47Å; Q270-T369 PolarHBondContact OE1-OG1 2.71Å; T369-P371 VanDerWaalsContact O-CD 3.24Å; T369-P371 WeakPolarHBondContact O-CD 3.24Å; T369-L516 HydrophobicContact CG2-CD2 3.95Å; T369-L516 HydrophobicContact CG2-CG 4.38Å
370	V	92.6	Very high	89.4	Confident	16 Å²	16	49.4 Å²	49.4	10%	0.097	26%	0.261	C	S	.	.			trans	-103.4	100.2	176.4	-179.5	0	0	0	0	108.7	Q368 P526 I527 I542 D543	Q368-V370 PolarHBondContact O-N 3.16Å; V370-P526 HydrophobicContact CB-CG 4.23Å; V370-P526 HydrophobicContact CG1-CB 3.88Å; V370-P526 HydrophobicContact CG1-CG 4.09Å; V370-I527 HydrophobicContact CG1-CD1 3.57Å; V370-I527 HydrophobicContact CG1-CG1 3.98Å; V370-I527 HydrophobicContact CG2-CD1 4.14Å; V370-I527 HydrophobicContact CG2-CG1 3.92Å; V370-I542 HydrophobicContact CG1-CG2 4.22Å; V370-D543 HydrophobicContact CG1-CB 3.89Å
371	P	95.1	Very high	89.9	Confident	4 Å²	4	48.6 Å²	48.6	3%	0.026	26%	0.256	C	S	.	.			trans	-77.3	155.3	176.7	29.9	-32.7	0	0	0	111.9	N119 T369 W453 L514 R515 D543 S544 C545	N119-P371 WeakPolarHBondContact OD1-CG 3.08Å; T369-P371 VanDerWaalsContact O-CD 3.24Å; T369-P371 WeakPolarHBondContact O-CD 3.24Å; P371-W453 HydrophobicContact CB-CH2 4.43Å; P371-L514 CarbonylContact C-O 3.52Å; P371-L514 WeakPolarHBondContact CA-O 2.99Å; P371-R515 HydrophobicContact CB-CB 4.46Å; P371-D543 VanDerWaalsContact O-CA 3.32Å; P371-D543 WeakPolarHBondContact O-CA 3.27Å; P371-D543 PolarHBondContact O-N 2.78Å; P371-S544 PolarHBondContact O-N 3.38Å; P371-S544 VanDerWaalsContact O-N 3.16Å; P371-C545 HydrophobicContact CB-CB 3.97Å; P371-C545 HydrophobicContact CG-CB 4.2Å
372	V	96.8	Very high	90.1	Very high	1 Å²	1	47 Å²	47	1%	0.006	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	124.2	177.1	-176.6	0	0	0	0	109.1	F374 C513 L514 P526 L540 I542	V372-F374 HydrophobicContact CG1-CE2 4.13Å; V372-C513 CarbonylContact O-C 3.46Å; V372-C513 VanDerWaalsContact O-CA 3.24Å; V372-C513 WeakPolarHBondContact O-CA 3.27Å; V372-L514 PolarHBondContact N-O 2.96Å; V372-L514 PolarHBondContact O-N 3.29Å; V372-P526 HydrophobicContact CG2-CB 3.6Å; V372-P526 HydrophobicContact CG2-CG 3.85Å; V372-L540 HydrophobicContact CG1-CB 4.17Å; V372-L540 HydrophobicContact CG1-CD1 3.81Å; V372-L540 HydrophobicContact CG1-CD2 4.44Å; V372-L540 HydrophobicContact CG1-CG 4.37Å; V372-I542 HydrophobicContact CG1-CG1 4.2Å; V372-I542 HydrophobicContact CG2-CG1 4.47Å
373	T	96.6	Very high	90.2	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	130.7	176.4	-54.8	0	0	0	0	111.3	L375 G512 L540 Q541 S544 C545 G546 W566	T373-L375 HydrophobicContact CG2-CD2 3.89Å; T373-G512 WeakPolarHBondContact CA-O 3.4Å; T373-L540 WeakPolarHBondContact O-CA 3.41Å; T373-Q541 PolarHBondContact N-O 2.96Å; T373-Q541 PolarHBondContact O-N 2.83Å; T373-S544 PolarHBondContact N-O 3.46Å; T373-S544 PolarHBondContact OG1-O 2.96Å; T373-C545 VanDerWaalsContact OG1-CA 3.24Å; T373-C545 WeakPolarHBondContact OG1-CA 3.49Å; T373-G546 PolarHBondContact OG1-N 3.32Å; T373-W566 HydrophobicContact CG2-CH2 3.52Å; T373-W566 HydrophobicContact CG2-CZ2 3.88Å
374	F	96.2	Very high	90.3	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	105.4	171.3	-68.8	-104.8	0	0	0	108.6	V372 L381 F491 F510 Q511 G512 L514 L540	V372-F374 HydrophobicContact CG1-CE2 4.13Å; F374-L381 HydrophobicContact CE1-CB 4.19Å; F374-L381 HydrophobicContact CZ-CB 3.93Å; F374-F491 HydrophobicContact CE1-CB 4.49Å; F374-F491 WeakPolarHBondContact CE1-O 3.45Å; F374-F491 HydrophobicContact CZ-CB 4.08Å; F374-F510 HydrophobicContact CB-CD1 4.03Å; F374-F510 WeakPolarHBondContact CB-O 3.33Å; F374-F510 HydrophobicContact CD1-CD1 4.49Å; F374-F510 AromaticContact CD2-CD1 3.88Å; F374-F510 HydrophobicContact CD2-CD1 3.88Å; F374-F510 HydrophobicContact CD2-CE1 4.04Å; F374-F510 AromaticContact CG-CD1 3.87Å; F374-F510 HydrophobicContact CG-CD1 3.87Å; F374-F510 HydrophobicContact CG-CE1 4.43Å; F374-Q511 WeakPolarHBondContact O-CA 3.34Å; F374-G512 PolarHBondContact N-O 3.09Å; F374-G512 PolarHBondContact O-N 2.94Å; F374-L514 HydrophobicContact CD2-CD1 4.46Å; F374-L514 HydrophobicContact CD2-CG 4.22Å; F374-L514 HydrophobicContact CE2-CB 4.07Å; F374-L514 HydrophobicContact CE2-CD1 3.47Å; F374-L514 VanDerWaalsContact CE2-CD1 3.47Å; F374-L514 HydrophobicContact CE2-CG 3.56Å; F374-L514 HydrophobicContact CZ-CD1 3.69Å; F374-L514 HydrophobicContact CZ-CG 4.3Å; F374-L540 HydrophobicContact CB-CD2 4.33Å; F374-L540 HydrophobicContact CD1-CD2 3.4Å; F374-L540 HydrophobicContact CD2-CD2 4.21Å; F374-L540 HydrophobicContact CE1-CD2 3.55Å; F374-L540 HydrophobicContact CE2-CD2 4.33Å; F374-L540 HydrophobicContact CG-CD2 3.74Å; F374-L540 HydrophobicContact CZ-CD2 4.03Å
375	L	91.6	Very high	90.1	Very high	74 Å²	74	42.9 Å²	42.9	39%	0.387	23%	0.226	S	C	.	.			trans	-77.9	-23.5	-167.6	-62.2	171.3	0	0	0	113.7	T373 S379 D539 Q541 W566	T373-L375 HydrophobicContact CG2-CD2 3.89Å; L375-S379 PolarHBondContact N-OG 2.8Å; L375-D539 WeakPolarHBondContact CB-O 2.95Å; L375-D539 PolarHBondContact N-O 3.24Å; L375-Q541 HydrophobicContact CD1-CB 4.34Å; L375-Q541 HydrophobicContact CD2-CB 4.24Å; L375-Q541 HydrophobicContact CG-CB 4.45Å; L375-W566 PolarHBondContact O-NE1 3.12Å
376	S	90.9	Very high	89.7	Confident	27 Å²	27	42.2 Å²	42.2	19%	0.189	22%	0.219	C	C	.	.	S	Bend	trans	-147.6	163.9	-175.4	76	0	0	0	0	111.6	R378 S379 Q511	S376-R378 PolarHBondContact O-N 2.9Å; S376-R378 PolarHBondContact OG-N 2.75Å; S376-S379 PolarHBondContact N-OG 2.8Å; S376-S379 WeakPolarHBondContact O-CB 3.23Å; S376-S379 PolarHBondContact O-N 2.89Å; S376-S379 PolarHBondContact O-OG 3.5Å; S376-S379 VanDerWaalsContact O-OG 3.09Å; S376-S379 PolarHBondContact OG-N 2.87Å; S376-S379 PolarHBondContact OG-OG 2.92Å; S376-Q511 VanDerWaalsContact C-CG 3.42Å
377	S	89.1	Confident	89.6	Confident	58 Å²	58	40 Å²	40	41%	0.406	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-4	173.5	61.2	0	0	0	0	114.9	G509	S377-G509 WeakPolarHBondContact O-CA 3.44Å; S377-G509 PolarHBondContact O-N 3.08Å
378	R	88.7	Confident	89.6	Confident	165 Å²	165	40.7 Å²	40.7	62%	0.623	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.8	-2.7	173.5	-59.7	-175.8	-62.1	-162.8	-2.8	113	S376	S376-R378 PolarHBondContact O-N 2.9Å; S376-R378 PolarHBondContact OG-N 2.75Å
379	S	92.5	Very high	89.9	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.2	C	C	.	.			trans	-67.2	139.7	-179.9	-64.6	0	0	0	0	110.1	L375 S376 G492 R538 D539	L375-S379 PolarHBondContact N-OG 2.8Å; S376-S379 PolarHBondContact N-OG 2.8Å; S376-S379 WeakPolarHBondContact O-CB 3.23Å; S376-S379 PolarHBondContact O-N 2.89Å; S376-S379 PolarHBondContact O-OG 3.5Å; S376-S379 VanDerWaalsContact O-OG 3.09Å; S376-S379 PolarHBondContact OG-N 2.87Å; S376-S379 PolarHBondContact OG-OG 2.92Å; S379-G492 CarbonylContact O-C 3.48Å; S379-R538 VanDerWaalsContact CA-O 3.3Å; S379-R538 WeakPolarHBondContact CA-O 3.33Å; S379-D539 WeakPolarHBondContact CB-O 3.21Å; S379-D539 VanDerWaalsContact OG-CB 3.3Å; S379-D539 WeakPolarHBondContact OG-CB 3.41Å; S379-D539 PolarHBondContact OG-O 3.3Å
380	Y	93.6	Very high	89.8	Confident	41 Å²	41	38.3 Å²	38.3	16%	0.161	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	155.1	173.7	72.4	-97.1	0	0	0	111.5	A382 Y490 F491 L495 F537 R538	Y380-A382 HydrophobicContact CD2-CB 4.2Å; Y380-A382 HydrophobicContact CE2-CB 4.18Å; Y380-Y490 HydrophobicContact CD2-CD1 4.31Å; Y380-F491 CarbonylContact C-O 3.51Å; Y380-F491 VanDerWaalsContact CA-O 3.27Å; Y380-F491 WeakPolarHBondContact CA-O 3.43Å; Y380-L495 HydrophobicContact CE1-CD2 4.07Å; Y380-F537 VanDerWaalsContact O-CA 3.29Å; Y380-F537 WeakPolarHBondContact O-CA 3.49Å; Y380-F537 WeakPolarHBondContact O-CB 3.01Å; Y380-R538 HydrophobicContact CD1-CB 3.6Å; Y380-R538 HydrophobicContact CD1-CG 4.5Å; Y380-R538 HydrophobicContact CE1-CB 3.29Å; Y380-R538 HydrophobicContact CE1-CG 4.19Å; Y380-R538 HydrophobicContact CG-CB 4.36Å; Y380-R538 PolarHBondContact N-O 2.8Å; Y380-R538 PolarHBondContact O-N 2.88Å
381	L	95.8	Very high	89.5	Confident	2 Å²	2	40.3 Å²	40.3	1%	0.01	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	114.9	168.8	172.8	57.4	0	0	0	108.3	F374 L383 Y490 F491 I517 V529 F537 L540	F374-L381 HydrophobicContact CE1-CB 4.19Å; F374-L381 HydrophobicContact CZ-CB 3.93Å; L381-L383 HydrophobicContact CD1-CD2 4.07Å; L381-L383 HydrophobicContact CD1-CG 4.1Å; L381-L383 HydrophobicContact CD2-CD1 3.88Å; L381-L383 HydrophobicContact CD2-CG 4.3Å; L381-L383 HydrophobicContact CG-CD1 3.98Å; L381-L383 HydrophobicContact CG-CD2 4.36Å; L381-L383 HydrophobicContact CG-CG 3.89Å; L381-Y490 CarbonylContact O-C 3.55Å; L381-Y490 WeakPolarHBondContact O-CA 3.35Å; L381-F491 HydrophobicContact CB-CB 4.18Å; L381-F491 PolarHBondContact N-O 3.15Å; L381-F491 PolarHBondContact O-N 2.94Å; L381-I517 HydrophobicContact CD2-CD1 3.96Å; L381-V529 HydrophobicContact CD1-CG1 3.63Å; L381-V529 HydrophobicContact CD1-CG2 4.24Å; L381-F537 HydrophobicContact CD1-CB 4.25Å; L381-L540 HydrophobicContact CB-CD1 3.72Å; L381-L540 HydrophobicContact CD1-CD1 4.22Å; L381-L540 HydrophobicContact CG-CD1 4.41Å
382	A	94.9	Very high	89.2	Confident	5 Å²	5	40.2 Å²	40.2	4%	0.041	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	120.7	176.9	0	0	0	0	0	109.5	Y380 T488 Y489 Y490 G535 S536	Y380-A382 HydrophobicContact CD2-CB 4.2Å; Y380-A382 HydrophobicContact CE2-CB 4.18Å; A382-T488 HydrophobicContact CB-CG2 4.21Å; A382-Y489 WeakPolarHBondContact CA-O 3.27Å; A382-Y490 HydrophobicContact CB-CD1 3.76Å; A382-Y490 HydrophobicContact CB-CE1 3.63Å; A382-G535 CarbonylContact O-C 3.52Å; A382-G535 WeakPolarHBondContact O-CA 3.02Å; A382-S536 PolarHBondContact N-O 3.03Å; A382-S536 PolarHBondContact O-N 2.77Å
383	L	95.4	Very high	89.1	Confident	2 Å²	2	41.5 Å²	41.5	1%	0.01	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	143.1	-177.4	-68.6	167.9	0	0	0	110.9	L381 T488 Y489 F491 I517 I519 V524 V529 L534	L381-L383 HydrophobicContact CD1-CD2 4.07Å; L381-L383 HydrophobicContact CD1-CG 4.1Å; L381-L383 HydrophobicContact CD2-CD1 3.88Å; L381-L383 HydrophobicContact CD2-CG 4.3Å; L381-L383 HydrophobicContact CG-CD1 3.98Å; L381-L383 HydrophobicContact CG-CD2 4.36Å; L381-L383 HydrophobicContact CG-CG 3.89Å; L383-T488 WeakPolarHBondContact O-CA 3.05Å; L383-Y489 PolarHBondContact N-O 2.83Å; L383-Y489 PolarHBondContact O-N 3.11Å; L383-F491 HydrophobicContact CD1-CD2 4Å; L383-F491 HydrophobicContact CD1-CE2 3.73Å; L383-I517 HydrophobicContact CD1-CG2 4.2Å; L383-I519 HydrophobicContact CB-CD1 3.75Å; L383-I519 HydrophobicContact CD1-CD1 4.12Å; L383-V524 HydrophobicContact CD1-CG1 3.88Å; L383-V524 HydrophobicContact CD1-CG2 4.09Å; L383-V524 HydrophobicContact CD2-CG1 3.88Å; L383-V529 HydrophobicContact CD2-CG2 3.83Å; L383-L534 HydrophobicContact CD2-CD2 4.22Å; L383-L534 HydrophobicContact CD2-CG 4.15Å
384	P	93	Very high	89	Confident	68 Å²	68	41.5 Å²	41.5	44%	0.442	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	141.1	177.3	29	-34	0	0	0	111.4	L534	P384-L534 HydrophobicContact CG-CD1 3.57Å
385	G	86.4	Confident	89	Confident	18 Å²	18	43.5 Å²	43.5	19%	0.186	25%	0.248	C	C	.	.			trans	-94.4	169.3	173	0	0	0	0	0	113.6	D487 Y489	G385-D487 PolarHBondContact N-O 2.94Å; G385-Y489 VanDerWaalsContact CA-CE2 3.5Å
386	N	81.9	Confident	89.3	Confident	41 Å²	41	40.1 Å²	40.1	22%	0.219	23%	0.23	C	C	.	.			trans	-90.7	107.5	160.6	-69.2	-13.1	0	0	0	107.5	E389 S485 K522	N386-E389 HydrophobicContact CB-CG 4.31Å; N386-E389 VanDerWaalsContact CB-OE1 3.25Å; N386-E389 WeakPolarHBondContact CB-OE1 3.35Å; N386-E389 PolarHBondContact ND2-OE1 3.11Å; N386-S485 WeakPolarHBondContact O-CB 3.43Å; N386-S485 PolarHBondContact O-OG 3.27Å; N386-K522 PolarHBondContact OD1-NZ 3.48Å
387	S	78.4	Confident	89.6	Confident	73 Å²	73	40.7 Å²	40.7	51%	0.51	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	133.2	-177.5	59.9	0	0	0	0	112.5	S485 D487	S387-S485 WeakPolarHBondContact CA-O 3.5Å; S387-D487 WeakPolarHBondContact CB-OD1 3.05Å
388	G	71.5	Confident	90.1	Very high	44 Å²	44	38 Å²	38	45%	0.454	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.5	11.3	168.1	0	0	0	0	0	116.2	S485	G388-S485 PolarHBondContact N-O 2.92Å; G388-S485 PolarHBondContact N-OG 3.19Å
389	E	82	Confident	90.5	Very high	53 Å²	53	30.3 Å²	30.3	25%	0.248	18%	0.182	C	C	.	.			trans	-71.6	142.7	162.1	-61	-177.7	-165.7	0	0	110.2	N386 K391 S485	N386-E389 HydrophobicContact CB-CG 4.31Å; N386-E389 VanDerWaalsContact CB-OE1 3.25Å; N386-E389 WeakPolarHBondContact CB-OE1 3.35Å; N386-E389 PolarHBondContact ND2-OE1 3.11Å; E389-K391 PolarHBondContact O-N 3.47Å; E389-K391 VanDerWaalsContact O-N 3.12Å; E389-S485 WeakPolarHBondContact CA-OG 3.31Å; E389-S485 WeakPolarHBondContact CB-OG 3.19Å; E389-S485 PolarHBondContact N-OG 2.83Å; E389-S485 PolarHBondContact O-N 2.78Å; E389-S485 PolarHBondContact O-OG 2.86Å
390	D	82.5	Confident	90.7	Very high	112 Å²	112	30.4 Å²	30.4	60%	0.599	18%	0.182	S	C	*	.	S	Bend	trans	-74.4	8	178.7	70.8	-27	0	0	0	114	I483	D390-I483 CarbonylContact C-O 3.47Å
391	K	86.7	Confident	90.8	Very high	59 Å²	59	29.3 Å²	29.3	26%	0.257	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	147	177.1	69.1	178.2	-176.5	174.6	0	109.8	E389 A460 K461	E389-K391 PolarHBondContact O-N 3.47Å; E389-K391 VanDerWaalsContact O-N 3.12Å; K391-A460 CarbonylContact C-O 3.5Å; K391-A460 VanDerWaalsContact CA-O 3.32Å; K391-A460 WeakPolarHBondContact CA-O 3.16Å; K391-K461 HydrophobicContact CB-CG 4.02Å
392	V	89.8	Confident	90.8	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.006	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	130.2	161	178	0	0	0	0	107.4	V394 L412 F419 F458 S459 A460 I483 Y489	V392-V394 HydrophobicContact CG1-CG2 4.34Å; V392-L412 HydrophobicContact CG2-CD2 4.16Å; V392-F419 HydrophobicContact CG1-CE1 4.2Å; V392-F419 HydrophobicContact CG1-CZ 4.12Å; V392-F458 HydrophobicContact CB-CE1 4.24Å; V392-F458 HydrophobicContact CB-CZ 4.31Å; V392-F458 HydrophobicContact CG1-CD1 4.38Å; V392-F458 HydrophobicContact CG1-CE1 3.49Å; V392-F458 VanDerWaalsContact CG1-CE1 3.49Å; V392-F458 HydrophobicContact CG1-CZ 4.03Å; V392-S459 CarbonylContact O-C 3.12Å; V392-S459 WeakPolarHBondContact O-CA 3.45Å; V392-A460 HydrophobicContact CB-CB 4.42Å; V392-A460 PolarHBondContact N-O 2.73Å; V392-A460 PolarHBondContact O-N 3.4Å; V392-I483 HydrophobicContact CG2-CG2 3.99Å; V392-Y489 HydrophobicContact CG1-CE1 3.79Å
393	S	92.9	Very high	90.8	Very high	28 Å²	28	37.7 Å²	37.7	20%	0.196	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	121.9	176	-176.6	0	0	0	0	109.2	F458 G520	S393-F458 WeakPolarHBondContact CA-O 3.32Å; S393-G520 PolarHBondContact O-N 2.86Å
394	V	95.4	Very high	90.7	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	130	178	-176.4	0	0	0	0	108.9	V392 F396 L408 F458 Y489 F491 T518 I519	V392-V394 HydrophobicContact CG1-CG2 4.34Å; V394-F396 HydrophobicContact CG1-CD1 4.11Å; V394-F396 HydrophobicContact CG1-CE1 4.47Å; V394-L408 HydrophobicContact CB-CD2 4.02Å; V394-L408 HydrophobicContact CG1-CD2 3.89Å; V394-L408 HydrophobicContact CG2-CD2 4.14Å; V394-F458 HydrophobicContact CB-CD1 4.38Å; V394-F458 PolarHBondContact N-O 2.96Å; V394-F458 PolarHBondContact O-N 2.96Å; V394-Y489 HydrophobicContact CG2-CD1 3.98Å; V394-Y489 HydrophobicContact CG2-CE1 3.81Å; V394-F491 HydrophobicContact CG1-CE1 4.01Å; V394-F491 HydrophobicContact CG1-CZ 3.77Å; V394-T518 WeakPolarHBondContact CA-O 3.45Å; V394-I519 HydrophobicContact CG1-CG1 4.48Å
395	T	97.1	Very high	90.6	Very high	43 Å²	43	36.1 Å²	36.1	26%	0.264	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	144.9	173.7	72.2	0	0	0	0	110.8	V456 S457 I517 T518	T395-V456 CarbonylContact C-O 3.51Å; T395-V456 VanDerWaalsContact CA-O 3.24Å; T395-V456 WeakPolarHBondContact CA-O 3.38Å; T395-S457 WeakPolarHBondContact CG2-OG 3.24Å; T395-I517 CarbonylContact O-C 3.51Å; T395-I517 WeakPolarHBondContact O-CA 3.48Å; T395-T518 PolarHBondContact N-O 3.29Å; T395-T518 PolarHBondContact O-N 3.18Å; T395-T518 WeakPolarHBondContact OG1-CB 3.47Å; T395-T518 PolarHBondContact OG1-OG1 2.03Å
396	F	97.6	Very high	90.9	Very high	3 Å²	3	35.6 Å²	35.6	1%	0.013	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.2	165.3	173.9	57.7	-88.8	0	0	0	110	V394 F398 L407 L421 V456 F491 L514 L516 I517	V394-F396 HydrophobicContact CG1-CD1 4.11Å; V394-F396 HydrophobicContact CG1-CE1 4.47Å; F396-F398 HydrophobicContact CD2-CB 4.25Å; F396-F398 HydrophobicContact CE2-CB 4.15Å; F396-F398 HydrophobicContact CE2-CD1 4.06Å; F396-F398 HydrophobicContact CE2-CG 4.41Å; F396-L407 HydrophobicContact CE2-CD2 4.39Å; F396-L421 HydrophobicContact CE1-CD2 4.2Å; F396-L421 HydrophobicContact CZ-CD2 3.84Å; F396-V456 HydrophobicContact CD2-CB 4.44Å; F396-V456 HydrophobicContact CE1-CB 4.39Å; F396-V456 HydrophobicContact CE1-CG1 4.31Å; F396-V456 HydrophobicContact CE2-CB 4.1Å; F396-V456 HydrophobicContact CE2-CG2 4.15Å; F396-V456 HydrophobicContact CZ-CB 4.07Å; F396-V456 HydrophobicContact CZ-CG1 4.09Å; F396-V456 HydrophobicContact CZ-CG2 4.43Å; F396-V456 PolarHBondContact N-O 2.64Å; F396-V456 PolarHBondContact O-N 2.48Å; F396-F491 AromaticContact CD1-CE1 3.86Å; F396-F491 HydrophobicContact CD1-CE1 3.86Å; F396-F491 HydrophobicContact CE1-CE1 4.21Å; F396-F491 HydrophobicContact CG-CE1 4.42Å; F396-L514 HydrophobicContact CD2-CD2 3.75Å; F396-L514 HydrophobicContact CE2-CD2 4.02Å; F396-L516 WeakPolarHBondContact CA-O 3.27Å; F396-I517 HydrophobicContact CB-CG1 4.07Å
397	Q	97.4	Very high	91.5	Very high	39 Å²	39	33.6 Å²	33.6	18%	0.182	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	142.8	164.9	-64.8	-172.1	-19.7	0	0	110.5	W453 H454 L514 R515 L516	Q397-W453 HydrophobicContact CB-CE3 3.93Å; Q397-W453 HydrophobicContact CB-CZ3 4.41Å; Q397-H454 CarbonylContact C-O 3.54Å; Q397-H454 WeakPolarHBondContact CA-O 3.26Å; Q397-L514 CarbonylContact O-C 3.46Å; Q397-L514 VanDerWaalsContact O-CA 3.27Å; Q397-L514 WeakPolarHBondContact O-CA 3.24Å; Q397-R515 HydrophobicContact CB-CG 3.9Å; Q397-R515 PolarHBondContact N-O 3.33Å; Q397-R515 PolarHBondContact O-N 2.74Å; Q397-R515 VanDerWaalsContact OE1-CZ 3.31Å; Q397-L516 HydrophobicContact CG-CD1 4.29Å
398	F	97.8	Very high	92.2	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	156.1	174.1	80.6	-77.9	0	0	0	112.3	F396 T400 L407 L423 L428 L448 W453 H454 V456 F510 C513 L514	F396-F398 HydrophobicContact CD2-CB 4.25Å; F396-F398 HydrophobicContact CE2-CB 4.15Å; F396-F398 HydrophobicContact CE2-CD1 4.06Å; F396-F398 HydrophobicContact CE2-CG 4.41Å; F398-T400 HydrophobicContact CD2-CG2 4.32Å; F398-T400 HydrophobicContact CE2-CG2 4.18Å; F398-L407 HydrophobicContact CB-CD2 4.37Å; F398-L407 HydrophobicContact CD2-CD2 4.27Å; F398-L407 HydrophobicContact CE2-CD1 4.42Å; F398-L407 HydrophobicContact CG-CD2 4.27Å; F398-L407 HydrophobicContact CZ-CD1 4.44Å; F398-L423 HydrophobicContact CE2-CD2 4.45Å; F398-L428 HydrophobicContact CE1-CD1 3.89Å; F398-L428 HydrophobicContact CE1-CD2 4.42Å; F398-L428 HydrophobicContact CE1-CG 4.49Å; F398-L428 HydrophobicContact CZ-CD1 4.24Å; F398-L428 HydrophobicContact CZ-CD2 4.2Å; F398-L428 HydrophobicContact CZ-CG 4.37Å; F398-L448 HydrophobicContact CE2-CB 4.48Å; F398-L448 HydrophobicContact CZ-CB 3.93Å; F398-L448 HydrophobicContact CZ-CD1 4.3Å; F398-W453 WeakPolarHBondContact O-CA 3.38Å; F398-H454 HydrophobicContact CD1-CB 4.19Å; F398-H454 HydrophobicContact CE1-CB 3.8Å; F398-H454 HydrophobicContact CZ-CB 4.28Å; F398-H454 PolarHBondContact N-O 3.08Å; F398-H454 PolarHBondContact O-N 3.12Å; F398-V456 HydrophobicContact CD1-CG2 3.48Å; F398-V456 VanDerWaalsContact CD1-CG2 3.48Å; F398-V456 HydrophobicContact CE1-CG2 3.36Å; F398-F510 HydrophobicContact CB-CZ 4.16Å; F398-F510 AromaticContact CD2-CE2 3.96Å; F398-F510 HydrophobicContact CD2-CE2 3.96Å; F398-F510 HydrophobicContact CD2-CZ 4.14Å; F398-C513 WeakPolarHBondContact CA-O 3.23Å; F398-L514 HydrophobicContact CB-CD2 3.33Å
399	R	97.3	Very high	93.2	Very high	5 Å²	5	28.1 Å²	28.1	2%	0.019	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	142.3	164.9	66.5	177.5	-179.9	176.5	7.9	111.3	D268 G451 Q452 W453 G512 C513 C545 I547	D268-R399 IonicContact OD1-NH1 3.35Å; D268-R399 PolarHBondContact OD1-NH1 3.23Å; R399-G451 WeakPolarHBondContact CD-O 3.47Å; R399-Q452 WeakPolarHBondContact CA-O 3.12Å; R399-Q452 WeakPolarHBondContact CB-O 3.17Å; R399-W453 HydrophobicContact CB-CD2 4.21Å; R399-W453 HydrophobicContact CB-CE3 4.11Å; R399-W453 HydrophobicContact CG-CD2 3.94Å; R399-W453 HydrophobicContact CG-CE3 3.96Å; R399-W453 HydrophobicContact CG-CH2 4.14Å; R399-W453 HydrophobicContact CG-CZ2 4.09Å; R399-W453 HydrophobicContact CG-CZ3 4.06Å; R399-G512 WeakPolarHBondContact O-CA 3.47Å; R399-C513 HydrophobicContact CG-CB 4.12Å; R399-C513 PolarHBondContact N-O 2.95Å; R399-C513 PolarHBondContact O-N 3.18Å; R399-C545 PolarHBondContact NE-SG 3.37Å; R399-C545 PolarHBondContact NH2-SG 2.96Å; R399-I547 HydrophobicContact CG-CD1 4.2Å
400	T	97.1	Very high	93.5	Very high	1 Å²	1	25.6 Å²	25.6	1%	0.006	13%	0.127	C	C	.	.			trans	-158.2	161.4	-180	-172.1	0	0	0	0	111.5	F398 N402 L423 N449 G451 F510 Q511	F398-T400 HydrophobicContact CD2-CG2 4.32Å; F398-T400 HydrophobicContact CE2-CG2 4.18Å; T400-N402 PolarHBondContact OG1-N 2.79Å; T400-L423 HydrophobicContact CG2-CD2 3.7Å; T400-N449 CarbonylContact O-C 3.57Å; T400-N449 VanDerWaalsContact O-CA 3.27Å; T400-N449 WeakPolarHBondContact O-CA 3.4Å; T400-G451 PolarHBondContact O-N 3.16Å; T400-F510 HydrophobicContact CG2-CE2 3.87Å; T400-Q511 WeakPolarHBondContact CB-O 3.38Å; T400-Q511 PolarHBondContact OG1-O 2.89Å
401	W	96	Very high	93.7	Very high	19 Å²	19	24.8 Å²	24.8	7%	0.072	12%	0.12	C	C	.	.	S	Bend	trans	-98.1	-13.7	165.5	-64	123.5	0	0	0	112.7	L266 D450 I547 T548 D549 Q564	L266-W401 HydrophobicContact CD1-CZ2 4.47Å; L266-W401 HydrophobicContact CD2-CZ2 4.21Å; W401-D450 WeakPolarHBondContact CH2-O 3.48Å; W401-D450 WeakPolarHBondContact CZ3-O 3.24Å; W401-I547 HydrophobicContact CG-CD1 4.35Å; W401-T548 VanDerWaalsContact CD1-O 3.31Å; W401-T548 PolarHBondContact NE1-O 3.31Å; W401-D549 HydrophobicContact CZ2-CB 3.84Å; W401-Q564 HydrophobicContact CB-CG 4.21Å; W401-Q564 HydrophobicContact CD2-CG 3.94Å; W401-Q564 HydrophobicContact CE3-CG 4.01Å; W401-Q564 HydrophobicContact CG-CG 4.03Å
402	N	95.5	Very high	93.6	Very high	21 Å²	21	22.2 Å²	22.2	11%	0.112	11%	0.109	C	C	.	.			trans	-74.6	132.1	-177.9	-75.8	-0.9	0	0	0	110.5	T400 A404 L423 N449 Q511 S565 W566	T400-N402 PolarHBondContact OG1-N 2.79Å; N402-A404 PolarHBondContact O-N 2.89Å; N402-L423 WeakPolarHBondContact O-CD2 3.41Å; N402-N449 VanDerWaalsContact O-CB 3.24Å; N402-N449 WeakPolarHBondContact O-CB 3.3Å; N402-Q511 PolarHBondContact ND2-OE1 3.33Å; N402-Q511 VanDerWaalsContact ND2-OE1 3.11Å; N402-S565 WeakPolarHBondContact OD1-CB 3.37Å; N402-W566 WeakPolarHBondContact OD1-CB 3.24Å; N402-W566 PolarHBondContact OD1-N 3.49Å
403	R	94.5	Very high	93.2	Very high	162 Å²	162	24.4 Å²	24.4	61%	0.611	12%	0.119	S	C	*	.	S	Bend	trans	-71.4	-16.3	175.8	-66.8	-177.7	-178.4	-176.8	1.2	113.6	K424 D425 G426	R403-K424 CarbonylContact O-C 3.48Å; R403-D425 PolarHBondContact O-N 2.94Å; R403-G426 PolarHBondContact O-N 3.48Å
404	A	93.3	Very high	92.1	Very high	36 Å²	36	33.9 Å²	33.9	30%	0.298	15%	0.151	S	C	.	.			trans	-144.5	151.7	178.6	0	0	0	0	0	112.5	N402 L423 L507	N402-A404 PolarHBondContact O-N 2.89Å; A404-L423 CarbonylContact C-O 3.58Å; A404-L423 WeakPolarHBondContact CA-O 3.2Å; A404-L423 WeakPolarHBondContact CB-O 3.37Å; A404-L507 HydrophobicContact CB-CD2 3.98Å
405	G	92.4	Very high	90.8	Very high	1 Å²	1	37 Å²	37	1%	0.01	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.1	148	177.2	0	0	0	0	0	113	L407 F422 L423	G405-L407 PolarHBondContact O-N 2.85Å; G405-F422 WeakPolarHBondContact O-CA 3.49Å; G405-L423 PolarHBondContact N-O 2.8Å; G405-L423 PolarHBondContact O-N 3.46Å
406	H	91.7	Very high	89.8	Confident	6 Å²	6	37 Å²	37	3%	0.028	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	114.7	179.9	-176.2	-74.7	0	0	0	111.8	L408 F409 V420 G492 G508 F510	H406-L408 VanDerWaalsContact CE1-C 3.48Å; H406-F409 WeakPolarHBondContact CE1-CB 3.39Å; H406-V420 VanDerWaalsContact CD2-CG1 3.43Å; H406-V420 WeakPolarHBondContact CD2-CG1 3.2Å; H406-V420 WeakPolarHBondContact NE2-CG1 3.48Å; H406-G492 CarbonylContact O-C 3.58Å; H406-G492 WeakPolarHBondContact O-CA 3.34Å; H406-G508 PolarHBondContact N-O 3.47Å; H406-G508 VanDerWaalsContact N-O 3.16Å; H406-F510 VanDerWaalsContact O-CB 3.23Å; H406-F510 WeakPolarHBondContact O-CB 3.16Å; H406-F510 PolarHBondContact O-N 3.29Å
407	L	93.9	Very high	89.1	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	-45.2	-172.1	-81.8	163	0	0	0	114	F396 F398 G405 L421 L423 L428 F491 G492 F510 L514	F396-L407 HydrophobicContact CE2-CD2 4.39Å; F398-L407 HydrophobicContact CB-CD2 4.37Å; F398-L407 HydrophobicContact CD2-CD2 4.27Å; F398-L407 HydrophobicContact CE2-CD1 4.42Å; F398-L407 HydrophobicContact CG-CD2 4.27Å; F398-L407 HydrophobicContact CZ-CD1 4.44Å; G405-L407 PolarHBondContact O-N 2.85Å; L407-L421 HydrophobicContact CB-CG 4.47Å; L407-L421 WeakPolarHBondContact CB-O 3.19Å; L407-L421 PolarHBondContact N-O 2.81Å; L407-L423 HydrophobicContact CD1-CB 4.3Å; L407-L428 HydrophobicContact CD1-CD2 3.21Å; L407-F491 CarbonylContact O-C 3.53Å; L407-F491 VanDerWaalsContact O-CA 3.24Å; L407-F491 WeakPolarHBondContact O-CA 3.02Å; L407-G492 PolarHBondContact O-N 2.86Å; L407-F510 HydrophobicContact CD2-CB 4.4Å; L407-F510 HydrophobicContact CD2-CD1 4.14Å; L407-F510 HydrophobicContact CD2-CD2 3.41Å; L407-F510 VanDerWaalsContact CD2-CD2 3.41Å; L407-F510 HydrophobicContact CD2-CE1 4.22Å; L407-F510 HydrophobicContact CD2-CE2 3.51Å; L407-F510 HydrophobicContact CD2-CG 3.75Å; L407-F510 HydrophobicContact CD2-CZ 3.93Å; L407-F510 HydrophobicContact CG-CD2 4.08Å; L407-F510 HydrophobicContact CG-CE2 4.47Å; L407-L514 HydrophobicContact CD2-CD2 4.36Å
408	L	93.9	Very high	88.6	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	136	-175.9	175.5	67.4	0	0	0	110.9	V394 H406 F419 V420 L421 F458 Y489 Y490 F491	V394-L408 HydrophobicContact CB-CD2 4.02Å; V394-L408 HydrophobicContact CG1-CD2 3.89Å; V394-L408 HydrophobicContact CG2-CD2 4.14Å; H406-L408 VanDerWaalsContact CE1-C 3.48Å; L408-F419 HydrophobicContact CD2-CE2 3.97Å; L408-F419 HydrophobicContact CG-CE2 4.06Å; L408-V420 CarbonylContact O-C 3.5Å; L408-V420 WeakPolarHBondContact O-CA 2.93Å; L408-L421 HydrophobicContact CB-CB 4.08Å; L408-L421 PolarHBondContact N-O 2.78Å; L408-L421 VanDerWaalsContact N-O 3.08Å; L408-L421 PolarHBondContact O-N 2.8Å; L408-F458 HydrophobicContact CD2-CD1 4.45Å; L408-Y489 HydrophobicContact CD1-CD1 4.26Å; L408-Y490 CarbonylContact C-O 3.53Å; L408-Y490 VanDerWaalsContact CA-O 3.3Å; L408-Y490 WeakPolarHBondContact CA-O 3.48Å; L408-F491 HydrophobicContact CD1-CD1 3.95Å; L408-F491 HydrophobicContact CD1-CD2 4.05Å; L408-F491 HydrophobicContact CD1-CE1 3.78Å; L408-F491 HydrophobicContact CD1-CE2 3.84Å; L408-F491 HydrophobicContact CD1-CG 4.09Å; L408-F491 HydrophobicContact CD1-CZ 3.71Å
409	F	91.6	Very high	88.2	Confident	1 Å²	1	36.2 Å²	36.2	0%	0.004	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	142.1	170.9	166.6	-105.4	0	0	0	110.2	H406 E411 F419 V420 Y490 C494 C503	H406-F409 WeakPolarHBondContact CE1-CB 3.39Å; F409-E411 HydrophobicContact CE1-CG 3.99Å; F409-E411 HydrophobicContact CZ-CG 3.64Å; F409-F419 WeakPolarHBondContact CA-O 3.26Å; F409-F419 WeakPolarHBondContact CD2-O 3.45Å; F409-V420 HydrophobicContact CD2-CG2 3.75Å; F409-V420 HydrophobicContact CE2-CG2 4.39Å; F409-Y490 AromaticContact CD1-CD2 3.79Å; F409-Y490 HydrophobicContact CD1-CD2 3.79Å; F409-Y490 HydrophobicContact CD1-CG 4.39Å; F409-Y490 HydrophobicContact CE1-CD2 4.3Å; F409-Y490 PolarHBondContact N-O 3.36Å; F409-Y490 PolarHBondContact O-N 3.02Å; F409-C494 HydrophobicContact CB-CB 4.46Å; F409-C494 HydrophobicContact CD1-CB 4.08Å; F409-C494 HydrophobicContact CG-CB 4.37Å; F409-C503 HydrophobicContact CE2-CB 4.19Å; F409-C503 HydrophobicContact CZ-CB 4.22Å
410	G	89.1	Confident	87.9	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	144.7	168.8	0	0	0	0	0	110.9	S418 F419	G410-S418 WeakPolarHBondContact O-CA 3.14Å; G410-F419 PolarHBondContact N-O 2.95Å; G410-F419 VanDerWaalsContact N-O 3.16Å; G410-F419 WeakPolarHBondContact O-CD1 3.33Å; G410-F419 PolarHBondContact O-N 2.82Å
411	E	86.8	Confident	87.7	Confident	95 Å²	95	36 Å²	36	44%	0.444	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	146	168.8	-64.1	-173.4	163.5	0	0	109.1	F409 G486	F409-E411 HydrophobicContact CE1-CG 3.99Å; F409-E411 HydrophobicContact CZ-CG 3.64Å; E411-G486 VanDerWaalsContact O-CA 3.24Å; E411-G486 WeakPolarHBondContact O-CA 3.05Å
412	L	85.3	Confident	87.5	Confident	5 Å²	5	36.2 Å²	36.2	3%	0.026	19%	0.186	C	C	.	.	P	Polyproline II helix	trans	-86.3	154.3	170.8	-61.5	178	0	0	0	109.3	V392 G415 S416 G417 F419 L432 I483 D484	V392-L412 HydrophobicContact CG2-CD2 4.16Å; L412-G415 PolarHBondContact O-N 3.31Å; L412-S416 VanDerWaalsContact CB-OG 3.29Å; L412-S416 WeakPolarHBondContact CB-OG 3.43Å; L412-G417 PolarHBondContact N-O 2.97Å; L412-F419 HydrophobicContact CD2-CD1 4.07Å; L412-F419 HydrophobicContact CD2-CE1 4.35Å; L412-L432 HydrophobicContact CD1-CD1 3.99Å; L412-I483 HydrophobicContact CD2-CG2 3.95Å; L412-D484 WeakPolarHBondContact CA-O 3.4Å
413	Q	80.1	Confident	87.5	Confident	47 Å²	47	35.2 Å²	35.2	22%	0.22	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-56.2	152.7	179.6	-72.3	-121.1	-46.5	0	0	112.4	G415 S416 D484 S485 D487	Q413-G415 PolarHBondContact O-N 3.23Å; Q413-G415 VanDerWaalsContact O-N 3.14Å; Q413-S416 WeakPolarHBondContact O-CB 3.49Å; Q413-S416 PolarHBondContact O-N 3.31Å; Q413-S416 PolarHBondContact O-OG 3.13Å; Q413-D484 HydrophobicContact CB-CB 3.7Å; Q413-D484 HydrophobicContact CG-CB 4.02Å; Q413-D484 PolarHBondContact N-O 2.03Å; Q413-S485 WeakPolarHBondContact CG-O 3.46Å; Q413-D487 PolarHBondContact NE2-OD1 3.42Å
414	R	70.5	Confident	87.4	Confident	228 Å²	228	32.2 Å²	32.2	86%	0.86	17%	0.172	S	C	*	.	G	3₁₀ helix	trans	59.2	20	176.7	-55.8	175.6	-179.6	169.7	1.2	114.4	S416	R414-S416 PolarHBondContact O-N 2.97Å
415	G	67	Low	87.4	Confident	66 Å²	66	36.2 Å²	36.2	68%	0.68	19%	0.189	S	C	*	.	G	3₁₀ helix	trans	66.6	21.6	-178.2	0	0	0	0	0	113.5	L412 Q413 G417	L412-G415 PolarHBondContact O-N 3.31Å; Q413-G415 PolarHBondContact O-N 3.23Å; Q413-G415 VanDerWaalsContact O-N 3.14Å; G415-G417 PolarHBondContact O-N 2.89Å
416	S	76.4	Confident	87.5	Confident	42 Å²	42	36.2 Å²	36.2	29%	0.294	19%	0.189	S	C	.	.	S	Bend	trans	-67.5	-14.2	-178.7	57.6	0	0	0	0	113.7	L412 Q413 R414	L412-S416 VanDerWaalsContact CB-OG 3.29Å; L412-S416 WeakPolarHBondContact CB-OG 3.43Å; Q413-S416 WeakPolarHBondContact O-CB 3.49Å; Q413-S416 PolarHBondContact O-N 3.31Å; Q413-S416 PolarHBondContact O-OG 3.13Å; R414-S416 PolarHBondContact O-N 2.97Å
417	G	84.4	Confident	87.7	Confident	14 Å²	14	40.8 Å²	40.8	14%	0.144	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	161.3	-170.1	177.3	0	0	0	0	0	112.6	L412 G415 F433	L412-G417 PolarHBondContact N-O 2.97Å; G415-G417 PolarHBondContact O-N 2.89Å; G417-F433 CarbonylContact C-O 3.59Å; G417-F433 WeakPolarHBondContact CA-O 3.26Å
418	S	86.9	Confident	87.8	Confident	7 Å²	7	40.9 Å²	40.9	5%	0.049	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	154.2	174.3	62.4	0	0	0	0	109.9	G410 F433	G410-S418 WeakPolarHBondContact O-CA 3.14Å; S418-F433 PolarHBondContact N-O 2.76Å; S418-F433 PolarHBondContact O-N 3.15Å
419	F	88.8	Confident	87.7	Confident	4 Å²	4	43.6 Å²	43.6	2%	0.018	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	149.8	171.4	66.2	-87.1	0	0	0	110.8	V392 L408 F409 G410 L412 L430 S431 L432 F458 Y489	V392-F419 HydrophobicContact CG1-CE1 4.2Å; V392-F419 HydrophobicContact CG1-CZ 4.12Å; L408-F419 HydrophobicContact CD2-CE2 3.97Å; L408-F419 HydrophobicContact CG-CE2 4.06Å; F409-F419 WeakPolarHBondContact CA-O 3.26Å; F409-F419 WeakPolarHBondContact CD2-O 3.45Å; G410-F419 PolarHBondContact N-O 2.95Å; G410-F419 VanDerWaalsContact N-O 3.16Å; G410-F419 WeakPolarHBondContact O-CD1 3.33Å; G410-F419 PolarHBondContact O-N 2.82Å; L412-F419 HydrophobicContact CD2-CD1 4.07Å; L412-F419 HydrophobicContact CD2-CE1 4.35Å; F419-L430 HydrophobicContact CB-CD1 4.39Å; F419-L430 HydrophobicContact CD2-CD1 4.29Å; F419-S431 CarbonylContact C-O 3.54Å; F419-S431 VanDerWaalsContact CA-O 3.28Å; F419-S431 WeakPolarHBondContact CA-O 3.43Å; F419-L432 HydrophobicContact CB-CD1 4.14Å; F419-F458 AromaticContact CD2-CE1 3.83Å; F419-F458 HydrophobicContact CD2-CE1 3.83Å; F419-F458 HydrophobicContact CD2-CZ 4.14Å; F419-F458 HydrophobicContact CE2-CD1 4.47Å; F419-F458 AromaticContact CE2-CE1 3.73Å; F419-F458 HydrophobicContact CE2-CE1 3.73Å; F419-F458 HydrophobicContact CE2-CZ 4.45Å; F419-F458 HydrophobicContact CG-CE1 4.41Å; F419-F458 HydrophobicContact CG-CZ 4.35Å; F419-F458 HydrophobicContact CZ-CE1 4.23Å; F419-Y489 HydrophobicContact CE1-CE1 4.16Å; F419-Y489 HydrophobicContact CE2-CE1 4.49Å; F419-Y489 AromaticContact CZ-CD1 3.76Å; F419-Y489 HydrophobicContact CZ-CD1 3.76Å; F419-Y489 AromaticContact CZ-CE1 3.5Å; F419-Y489 HydrophobicContact CZ-CE1 3.5Å; F419-Y489 VanDerWaalsContact CZ-CE1 3.5Å
420	V	90.1	Very high	87.7	Confident	3 Å²	3	43.5 Å²	43.5	2%	0.018	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	123.2	-178.1	178.7	0	0	0	0	108.4	H406 L408 F409 F422 L430 S431 F433 G502	H406-V420 VanDerWaalsContact CD2-CG1 3.43Å; H406-V420 WeakPolarHBondContact CD2-CG1 3.2Å; H406-V420 WeakPolarHBondContact NE2-CG1 3.48Å; L408-V420 CarbonylContact O-C 3.5Å; L408-V420 WeakPolarHBondContact O-CA 2.93Å; F409-V420 HydrophobicContact CD2-CG2 3.75Å; F409-V420 HydrophobicContact CE2-CG2 4.39Å; V420-F422 HydrophobicContact CG1-CD1 3.84Å; V420-L430 CarbonylContact O-C 3.6Å; V420-L430 WeakPolarHBondContact O-CA 3.48Å; V420-S431 PolarHBondContact N-O 3.29Å; V420-S431 PolarHBondContact O-N 2.9Å; V420-F433 HydrophobicContact CB-CE2 4.19Å; V420-F433 HydrophobicContact CG2-CD2 4.29Å; V420-F433 HydrophobicContact CG2-CE2 3.88Å; V420-G502 WeakPolarHBondContact CG2-O 3.44Å
421	L	93.3	Very high	87.7	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	123.6	168.9	-178.3	68.8	0	0	0	108.5	F396 L407 L408 L428 L430 V456	F396-L421 HydrophobicContact CE1-CD2 4.2Å; F396-L421 HydrophobicContact CZ-CD2 3.84Å; L407-L421 HydrophobicContact CB-CG 4.47Å; L407-L421 WeakPolarHBondContact CB-O 3.19Å; L407-L421 PolarHBondContact N-O 2.81Å; L408-L421 HydrophobicContact CB-CB 4.08Å; L408-L421 PolarHBondContact N-O 2.78Å; L408-L421 VanDerWaalsContact N-O 3.08Å; L408-L421 PolarHBondContact O-N 2.8Å; L421-L428 HydrophobicContact CD1-CB 4.3Å; L421-L428 HydrophobicContact CD1-CD2 4.36Å; L421-L428 HydrophobicContact CG-CD2 4.41Å; L421-L430 HydrophobicContact CB-CD1 4.18Å; L421-L430 HydrophobicContact CD1-CB 3.94Å; L421-L430 HydrophobicContact CD1-CD1 4.48Å; L421-V456 HydrophobicContact CD2-CG1 4.09Å
422	F	92.3	Very high	87.8	Confident	22 Å²	22	39.4 Å²	39.4	10%	0.096	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	150.6	178.8	58.8	-82.7	0	0	0	111.2	G405 V420 K424 K429 L507	G405-F422 WeakPolarHBondContact O-CA 3.49Å; V420-F422 HydrophobicContact CG1-CD1 3.84Å; F422-K424 HydrophobicContact CD2-CB 3.9Å; F422-K424 HydrophobicContact CE2-CB 3.88Å; F422-K424 HydrophobicContact CE2-CD 4.17Å; F422-K429 VanDerWaalsContact CD1-O 3.28Å; F422-K429 WeakPolarHBondContact CD1-O 3.37Å; F422-K429 HydrophobicContact CD2-CB 4.28Å; F422-K429 HydrophobicContact CE1-CB 4.17Å; F422-K429 HydrophobicContact CE1-CD 4.31Å; F422-K429 HydrophobicContact CE1-CG 3.98Å; F422-K429 HydrophobicContact CE2-CB 3.82Å; F422-K429 HydrophobicContact CE2-CD 3.89Å; F422-K429 HydrophobicContact CE2-CG 4.1Å; F422-K429 HydrophobicContact CZ-CB 3.8Å; F422-K429 HydrophobicContact CZ-CD 3.47Å; F422-K429 VanDerWaalsContact CZ-CD 3.47Å; F422-K429 HydrophobicContact CZ-CG 3.6Å; F422-K429 PolarHBondContact N-O 3.07Å; F422-K429 PolarHBondContact O-N 3.07Å; F422-L507 HydrophobicContact CD2-CD1 3.57Å; F422-L507 HydrophobicContact CE2-CD1 4.04Å; F422-L507 HydrophobicContact CG-CD1 4.32Å
423	L	94.6	Very high	87.8	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.005	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	132.2	167.9	-170.4	67.9	0	0	0	108.2	F398 T400 N402 A404 G405 L407 K427 L428 L448 N449	F398-L423 HydrophobicContact CE2-CD2 4.45Å; T400-L423 HydrophobicContact CG2-CD2 3.7Å; N402-L423 WeakPolarHBondContact O-CD2 3.41Å; A404-L423 CarbonylContact C-O 3.58Å; A404-L423 WeakPolarHBondContact CA-O 3.2Å; A404-L423 WeakPolarHBondContact CB-O 3.37Å; G405-L423 PolarHBondContact N-O 2.8Å; G405-L423 PolarHBondContact O-N 3.46Å; L407-L423 HydrophobicContact CD1-CB 4.3Å; L423-K427 WeakPolarHBondContact CA-O 3.44Å; L423-L428 HydrophobicContact CB-CD2 4.43Å; L423-L428 HydrophobicContact CD1-CD2 4.14Å; L423-L428 HydrophobicContact CD1-CG 4.46Å; L423-L448 HydrophobicContact CD1-CB 4.05Å; L423-L448 HydrophobicContact CD1-CD1 4.32Å; L423-N449 HydrophobicContact CD2-CB 4.5Å
424	K	93.5	Very high	87.9	Confident	98 Å²	98	40.5 Å²	40.5	43%	0.426	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	125.8	173.6	179.8	175.9	178.9	-179.8	0	109.6	R403 F422 G426 K427	R403-K424 CarbonylContact O-C 3.48Å; F422-K424 HydrophobicContact CD2-CB 3.9Å; F422-K424 HydrophobicContact CE2-CB 3.88Å; F422-K424 HydrophobicContact CE2-CD 4.17Å; K424-G426 PolarHBondContact O-N 3.3Å; K424-K427 PolarHBondContact N-O 2.99Å; K424-K427 PolarHBondContact O-N 2.92Å
425	D	93.7	Very high	88.2	Confident	121 Å²	121	33.9 Å²	33.9	65%	0.647	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.8	37.5	-178.5	-52.4	-44.7	0	0	0	112.3	R403 K427	R403-D425 PolarHBondContact O-N 2.94Å; D425-K427 VanDerWaalsContact C-N 3.29Å; D425-K427 PolarHBondContact O-N 2.78Å
426	G	94.4	Very high	88.6	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.5	11.4	-178.2	0	0	0	0	0	115.4	R403 K424 A446 G447 L448 N449	R403-G426 PolarHBondContact O-N 3.48Å; K424-G426 PolarHBondContact O-N 3.3Å; G426-A446 CarbonylContact O-C 3.56Å; G426-G447 PolarHBondContact O-N 3.24Å; G426-L448 WeakPolarHBondContact O-CG 3.19Å; G426-L448 PolarHBondContact O-N 3.02Å; G426-N449 WeakPolarHBondContact CA-OD1 3.46Å
427	K	95.6	Very high	88.8	Confident	103 Å²	103	37.6 Å²	37.6	45%	0.448	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	145.2	177.3	-54.3	-172.8	177.6	178.8	0	110.9	L423 K424 D425 T443 G445 A446	L423-K427 WeakPolarHBondContact CA-O 3.44Å; K424-K427 PolarHBondContact N-O 2.99Å; K424-K427 PolarHBondContact O-N 2.92Å; D425-K427 VanDerWaalsContact C-N 3.29Å; D425-K427 PolarHBondContact O-N 2.78Å; K427-T443 HydrophobicContact CB-CG2 3.91Å; K427-T443 HydrophobicContact CD-CG2 4.24Å; K427-G445 WeakPolarHBondContact CG-O 3.31Å; K427-A446 HydrophobicContact CG-CB 4.47Å
428	L	95.1	Very high	88.7	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.005	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	127.2	173.8	-76.3	176.3	0	0	0	110	F398 L407 L421 L423 T443 A444 L448 V456 V469	F398-L428 HydrophobicContact CE1-CD1 3.89Å; F398-L428 HydrophobicContact CE1-CD2 4.42Å; F398-L428 HydrophobicContact CE1-CG 4.49Å; F398-L428 HydrophobicContact CZ-CD1 4.24Å; F398-L428 HydrophobicContact CZ-CD2 4.2Å; F398-L428 HydrophobicContact CZ-CG 4.37Å; L407-L428 HydrophobicContact CD1-CD2 3.21Å; L421-L428 HydrophobicContact CD1-CB 4.3Å; L421-L428 HydrophobicContact CD1-CD2 4.36Å; L421-L428 HydrophobicContact CG-CD2 4.41Å; L423-L428 HydrophobicContact CB-CD2 4.43Å; L423-L428 HydrophobicContact CD1-CD2 4.14Å; L423-L428 HydrophobicContact CD1-CG 4.46Å; L428-T443 CarbonylContact O-C 3.58Å; L428-T443 WeakPolarHBondContact O-CA 3.47Å; L428-T443 WeakPolarHBondContact O-CG2 3.43Å; L428-A444 PolarHBondContact N-O 3.03Å; L428-A444 PolarHBondContact O-N 3.36Å; L428-L448 HydrophobicContact CB-CD1 4.25Å; L428-L448 HydrophobicContact CD1-CD1 3.98Å; L428-L448 HydrophobicContact CG-CD1 3.6Å; L428-V456 HydrophobicContact CD1-CB 4.46Å; L428-V456 HydrophobicContact CD1-CG1 4.01Å; L428-V456 HydrophobicContact CD1-CG2 3.54Å; L428-V469 HydrophobicContact CB-CG2 4.45Å; L428-V469 HydrophobicContact CD1-CG1 4.27Å; L428-V469 HydrophobicContact CD1-CG2 3.62Å
429	K	92.7	Very high	88.6	Confident	57 Å²	57	44.1 Å²	44.1	25%	0.248	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	121.9	174.9	-177.5	168.1	171.8	-177.4	0	109.8	F422 N441 V442	F422-K429 VanDerWaalsContact CD1-O 3.28Å; F422-K429 WeakPolarHBondContact CD1-O 3.37Å; F422-K429 HydrophobicContact CD2-CB 4.28Å; F422-K429 HydrophobicContact CE1-CB 4.17Å; F422-K429 HydrophobicContact CE1-CD 4.31Å; F422-K429 HydrophobicContact CE1-CG 3.98Å; F422-K429 HydrophobicContact CE2-CB 3.82Å; F422-K429 HydrophobicContact CE2-CD 3.89Å; F422-K429 HydrophobicContact CE2-CG 4.1Å; F422-K429 HydrophobicContact CZ-CB 3.8Å; F422-K429 HydrophobicContact CZ-CD 3.47Å; F422-K429 VanDerWaalsContact CZ-CD 3.47Å; F422-K429 HydrophobicContact CZ-CG 3.6Å; F422-K429 PolarHBondContact N-O 3.07Å; F422-K429 PolarHBondContact O-N 3.07Å; K429-N441 WeakPolarHBondContact CE-OD1 3.2Å; K429-V442 CarbonylContact C-O 3.59Å; K429-V442 WeakPolarHBondContact CA-O 3.48Å
430	L	91.8	Very high	88.5	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	125.9	173.4	176.4	64.4	0	0	0	108.9	F419 V420 L421 N441 V442 F458 M465 V467	F419-L430 HydrophobicContact CB-CD1 4.39Å; F419-L430 HydrophobicContact CD2-CD1 4.29Å; V420-L430 CarbonylContact O-C 3.6Å; V420-L430 WeakPolarHBondContact O-CA 3.48Å; L421-L430 HydrophobicContact CB-CD1 4.18Å; L421-L430 HydrophobicContact CD1-CB 3.94Å; L421-L430 HydrophobicContact CD1-CD1 4.48Å; L430-N441 CarbonylContact O-C 3.44Å; L430-N441 VanDerWaalsContact O-CA 3.23Å; L430-N441 WeakPolarHBondContact O-CA 3.39Å; L430-V442 HydrophobicContact CB-CB 4.37Å; L430-V442 PolarHBondContact N-O 3.46Å; L430-V442 PolarHBondContact O-N 3.36Å; L430-F458 HydrophobicContact CD1-CD2 4.42Å; L430-F458 HydrophobicContact CD1-CE2 4.3Å; L430-F458 HydrophobicContact CD2-CD2 3.25Å; L430-F458 HydrophobicContact CD2-CE2 3.34Å; L430-F458 HydrophobicContact CD2-CG 4.18Å; L430-F458 HydrophobicContact CD2-CZ 4.29Å; L430-F458 HydrophobicContact CG-CD2 4.48Å; L430-F458 HydrophobicContact CG-CE2 4.43Å; L430-M465 HydrophobicContact CB-CE 4.33Å; L430-M465 HydrophobicContact CD2-CE 3.75Å; L430-M465 HydrophobicContact CD2-CG 3.43Å; L430-M465 VanDerWaalsContact CD2-CG 3.43Å; L430-M465 HydrophobicContact CD2-SD 3.28Å; L430-M465 WeakPolarHBondContact CD2-SD 3.21Å; L430-M465 HydrophobicContact CG-CE 3.78Å; L430-M465 HydrophobicContact CG-CG 4.41Å; L430-M465 HydrophobicContact CG-SD 3.64Å; L430-V467 HydrophobicContact CB-CG2 3.78Å; L430-V467 HydrophobicContact CD2-CG2 3.46Å; L430-V467 VanDerWaalsContact CD2-CG2 3.46Å; L430-V467 HydrophobicContact CG-CG2 4.31Å
431	S	89.6	Confident	88.5	Confident	4 Å²	4	49 Å²	49	3%	0.028	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	123.7	179.2	-68.6	0	0	0	0	110.2	F419 V420 F433 R440 N441	F419-S431 CarbonylContact C-O 3.54Å; F419-S431 VanDerWaalsContact CA-O 3.28Å; F419-S431 WeakPolarHBondContact CA-O 3.43Å; V420-S431 PolarHBondContact N-O 3.29Å; V420-S431 PolarHBondContact O-N 2.9Å; S431-F433 VanDerWaalsContact CB-CE2 3.49Å; S431-R440 CarbonylContact C-O 3.51Å; S431-R440 WeakPolarHBondContact CA-O 3.35Å; S431-N441 WeakPolarHBondContact CB-OD1 3.17Å; S431-N441 PolarHBondContact OG-OD1 3.45Å
432	L	88.4	Confident	88.4	Confident	5 Å²	5	49.3 Å²	49.3	3%	0.026	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	123.9	171.8	179.8	66.6	0	0	0	109.3	L412 F419 Q434 P439 R440 M465 L478	L412-L432 HydrophobicContact CD1-CD1 3.99Å; F419-L432 HydrophobicContact CB-CD1 4.14Å; L432-Q434 HydrophobicContact CG-CG 4.24Å; L432-P439 WeakPolarHBondContact O-CA 3.29Å; L432-R440 HydrophobicContact CB-CB 4.46Å; L432-R440 PolarHBondContact N-O 3.05Å; L432-R440 PolarHBondContact O-N 2.84Å; L432-M465 HydrophobicContact CB-SD 4.19Å; L432-L478 HydrophobicContact CD2-CD1 4.44Å; L432-L478 HydrophobicContact CD2-CD2 4.37Å
433	F	85.8	Confident	88.5	Confident	44 Å²	44	51.8 Å²	51.8	19%	0.193	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	128.9	179.5	-60.6	-90.6	0	0	0	109.8	G417 S418 V420 S431 P439	G417-F433 CarbonylContact C-O 3.59Å; G417-F433 WeakPolarHBondContact CA-O 3.26Å; S418-F433 PolarHBondContact N-O 2.76Å; S418-F433 PolarHBondContact O-N 3.15Å; V420-F433 HydrophobicContact CB-CE2 4.19Å; V420-F433 HydrophobicContact CG2-CD2 4.29Å; V420-F433 HydrophobicContact CG2-CE2 3.88Å; S431-F433 VanDerWaalsContact CB-CE2 3.49Å; F433-P439 HydrophobicContact CD1-CB 3.82Å; F433-P439 HydrophobicContact CD1-CG 3.64Å; F433-P439 HydrophobicContact CE1-CB 3.67Å; F433-P439 HydrophobicContact CE1-CG 3.5Å; F433-P439 VanDerWaalsContact CE1-CG 3.5Å; F433-P439 HydrophobicContact CZ-CB 4.33Å
434	Q	81.3	Confident	88.5	Confident	30 Å²	30	51.9 Å²	51.9	14%	0.14	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	151.9	177.3	-57.8	-166.4	-78.2	0	0	110.2	L432 G436 Q437 V481	L432-Q434 HydrophobicContact CG-CG 4.24Å; Q434-G436 PolarHBondContact O-N 2.84Å; Q434-Q437 PolarHBondContact O-N 3.05Å; Q434-V481 VanDerWaalsContact CD-CG1 3.43Å
435	A	76.8	Confident	88.5	Confident	90 Å²	90	48.1 Å²	48.1	74%	0.744	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	128.4	-179.1	0	0	0	0	0	111.1	Q437	A435-Q437 VanDerWaalsContact C-N 3.28Å; A435-Q437 PolarHBondContact O-N 2.88Å
436	G	75.9	Confident	88.5	Confident	93 Å²	93	45.6 Å²	45.6	96%	0.959	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.6	6.1	176.4	0	0	0	0	0	116.1	Q434	Q434-G436 PolarHBondContact O-N 2.84Å
437	Q	79.9	Confident	88.6	Confident	93 Å²	93	47.6 Å²	47.6	44%	0.435	31%	0.31	S	S	.	.	S	Bend	trans	-119.9	153.5	177.9	-62.3	-172.5	36.7	0	0	112	Q434 A435	Q434-Q437 PolarHBondContact O-N 3.05Å; A435-Q437 VanDerWaalsContact C-N 3.28Å; A435-Q437 PolarHBondContact O-N 2.88Å
438	S	81.6	Confident	88.6	Confident	98 Å²	98	42.9 Å²	42.9	69%	0.685	29%	0.29	S	S	*	.	P	Polyproline II helix	trans	-68	146.8	169.1	57.5	0	0	0	0	110.6	R440	S438-R440 PolarHBondContact O-N 3.11Å
439	P	84.7	Confident	88.6	Confident	60 Å²	60	44.4 Å²	44.4	39%	0.39	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-61.4	128.2	179	-21.6	32.3	0	0	0	111.5	L432 F433	L432-P439 WeakPolarHBondContact O-CA 3.29Å; F433-P439 HydrophobicContact CD1-CB 3.82Å; F433-P439 HydrophobicContact CD1-CG 3.64Å; F433-P439 HydrophobicContact CE1-CB 3.67Å; F433-P439 HydrophobicContact CE1-CG 3.5Å; F433-P439 VanDerWaalsContact CE1-CG 3.5Å; F433-P439 HydrophobicContact CZ-CB 4.33Å
440	R	87.9	Confident	88.7	Confident	49 Å²	49	44.2 Å²	44.2	19%	0.185	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	130.6	176.5	-59.1	-177.8	-174.7	-163.7	4.1	109.1	S431 L432 S438	S431-R440 CarbonylContact C-O 3.51Å; S431-R440 WeakPolarHBondContact CA-O 3.35Å; L432-R440 HydrophobicContact CB-CB 4.46Å; L432-R440 PolarHBondContact N-O 3.05Å; L432-R440 PolarHBondContact O-N 2.84Å; S438-R440 PolarHBondContact O-N 3.11Å
441	N	89.9	Confident	88.8	Confident	60 Å²	60	44.3 Å²	44.3	32%	0.321	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	138.3	-170.3	-61.8	-45.4	0	0	0	112.1	K429 L430 S431	K429-N441 WeakPolarHBondContact CE-OD1 3.2Å; L430-N441 CarbonylContact O-C 3.44Å; L430-N441 VanDerWaalsContact O-CA 3.23Å; L430-N441 WeakPolarHBondContact O-CA 3.39Å; S431-N441 WeakPolarHBondContact CB-OD1 3.17Å; S431-N441 PolarHBondContact OG-OD1 3.45Å
442	V	91.8	Very high	89.1	Confident	7 Å²	7	45.6 Å²	45.6	4%	0.042	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	139.1	164.1	173.7	0	0	0	0	107.6	K429 L430 M465 V467 A474 Q476	K429-V442 CarbonylContact C-O 3.59Å; K429-V442 WeakPolarHBondContact CA-O 3.48Å; L430-V442 HydrophobicContact CB-CB 4.37Å; L430-V442 PolarHBondContact N-O 3.46Å; L430-V442 PolarHBondContact O-N 3.36Å; V442-M465 HydrophobicContact CB-CE 3.9Å; V442-M465 HydrophobicContact CG2-CB 4.44Å; V442-M465 HydrophobicContact CG2-CE 3.3Å; V442-M465 HydrophobicContact CG2-CG 4.3Å; V442-V467 HydrophobicContact CB-CG2 4.3Å; V442-V467 HydrophobicContact CG1-CB 4.1Å; V442-V467 HydrophobicContact CG1-CG2 3.87Å; V442-A474 HydrophobicContact CG1-CB 3.64Å; V442-Q476 HydrophobicContact CG2-CB 3.12Å; V442-Q476 HydrophobicContact CG2-CG 4.13Å
443	T	93.5	Very high	89.4	Confident	73 Å²	73	46.9 Å²	46.9	45%	0.448	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	136	171.8	-53.4	0	0	0	0	109.4	K427 L428 A474	K427-T443 HydrophobicContact CB-CG2 3.91Å; K427-T443 HydrophobicContact CD-CG2 4.24Å; L428-T443 CarbonylContact O-C 3.58Å; L428-T443 WeakPolarHBondContact O-CA 3.47Å; L428-T443 WeakPolarHBondContact O-CG2 3.43Å; T443-A474 WeakPolarHBondContact O-CB 3.47Å
444	A	94.7	Very high	89.9	Confident	4 Å²	4	45.4 Å²	45.4	3%	0.033	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	150.9	-177.6	0	0	0	0	0	111.6	L428 V467 V469 A474	L428-A444 PolarHBondContact N-O 3.03Å; L428-A444 PolarHBondContact O-N 3.36Å; A444-V467 HydrophobicContact CB-CB 4.12Å; A444-V467 HydrophobicContact CB-CG1 3.93Å; A444-V469 HydrophobicContact CB-CG2 3.66Å; A444-A474 HydrophobicContact CB-CB 3.76Å
445	G	93.5	Very high	90.6	Very high	18 Å²	18	46.3 Å²	46.3	19%	0.186	31%	0.314	C	S	.	.			trans	68.4	174.7	178.9	0	0	0	0	0	115.1	K427 D472	K427-G445 WeakPolarHBondContact CG-O 3.31Å; G445-D472 PolarHBondContact N-OD2 3.01Å
446	A	94.8	Very high	91.6	Very high	69 Å²	69	42 Å²	42	57%	0.57	28%	0.278	S	S	*	.	S	Bend	trans	-157.2	145.9	175.4	0	0	0	0	0	111.4	G426 K427 L448	G426-A446 CarbonylContact O-C 3.56Å; K427-A446 HydrophobicContact CG-CB 4.47Å; A446-L448 VanDerWaalsContact C-N 3.3Å; A446-L448 PolarHBondContact O-N 2.61Å
447	G	94.6	Very high	92.5	Very high	41 Å²	41	39.4 Å²	39.4	42%	0.423	25%	0.246	S	C	.	.			trans	67.5	26.5	177.8	0	0	0	0	0	114.3	G426 N449	G426-G447 PolarHBondContact O-N 3.24Å; G447-N449 PolarHBondContact O-N 2.87Å
448	L	96.4	Very high	93	Very high	5 Å²	5	35 Å²	35	3%	0.026	23%	0.225	C	C	.	.			trans	-73.9	11.1	-173.5	-54	169.7	0	0	0	114.4	F398 L423 G426 L428 A446 H454 V469	F398-L448 HydrophobicContact CE2-CB 4.48Å; F398-L448 HydrophobicContact CZ-CB 3.93Å; F398-L448 HydrophobicContact CZ-CD1 4.3Å; L423-L448 HydrophobicContact CD1-CB 4.05Å; L423-L448 HydrophobicContact CD1-CD1 4.32Å; G426-L448 WeakPolarHBondContact O-CG 3.19Å; G426-L448 PolarHBondContact O-N 3.02Å; L428-L448 HydrophobicContact CB-CD1 4.25Å; L428-L448 HydrophobicContact CD1-CD1 3.98Å; L428-L448 HydrophobicContact CG-CD1 3.6Å; A446-L448 VanDerWaalsContact C-N 3.3Å; A446-L448 PolarHBondContact O-N 2.61Å; L448-H454 HydrophobicContact CD2-CB 4.47Å; L448-V469 HydrophobicContact CD1-CG1 3.92Å; L448-V469 HydrophobicContact CD2-CG1 3.68Å; L448-V469 HydrophobicContact CG-CG1 4.47Å
449	N	95.8	Very high	93.4	Very high	33 Å²	33	31.3 Å²	31.3	18%	0.176	20%	0.199	C	C	.	.			trans	-110.4	37.6	178.8	63.2	-88.6	0	0	0	110.9	T400 N402 L423 G426 G447	T400-N449 CarbonylContact O-C 3.57Å; T400-N449 VanDerWaalsContact O-CA 3.27Å; T400-N449 WeakPolarHBondContact O-CA 3.4Å; N402-N449 VanDerWaalsContact O-CB 3.24Å; N402-N449 WeakPolarHBondContact O-CB 3.3Å; L423-N449 HydrophobicContact CD2-CB 4.5Å; G426-N449 WeakPolarHBondContact CA-OD1 3.46Å; G447-N449 PolarHBondContact O-N 2.87Å
450	D	94.1	Very high	93.6	Very high	52 Å²	52	28.6 Å²	28.6	28%	0.278	18%	0.182	S	C	.	.	S	Bend	trans	-101	10.3	-173.8	67.8	0	0	0	0	113.3	W401 Q452 H454	W401-D450 WeakPolarHBondContact CH2-O 3.48Å; W401-D450 WeakPolarHBondContact CZ3-O 3.24Å; D450-Q452 PolarHBondContact O-N 3.43Å; D450-Q452 VanDerWaalsContact OD1-CB 3.26Å; D450-Q452 WeakPolarHBondContact OD1-CB 3.22Å; D450-Q452 PolarHBondContact OD1-N 2.92Å; D450-Q452 PolarHBondContact OD2-NE2 3.38Å; D450-H454 IonicContact OD1-CE1 3.85Å; D450-H454 IonicContact OD1-NE2 3.83Å; D450-H454 PolarHBondContact OD1-NE2 3.26Å; D450-H454 IonicContact OD2-CE1 3.76Å; D450-H454 IonicContact OD2-NE2 2.76Å
451	G	94.3	Very high	93.5	Very high	2 Å²	2	30.4 Å²	30.4	2%	0.021	19%	0.191	C	C	.	.	S	Bend	trans	75.6	-2.8	-178.3	0	0	0	0	0	114.8	L266 R399 T400	L266-G451 WeakPolarHBondContact CD2-O 3.35Å; R399-G451 WeakPolarHBondContact CD-O 3.47Å; T400-G451 PolarHBondContact O-N 3.16Å
452	Q	94.9	Very high	93	Very high	32 Å²	32	35.1 Å²	35.1	15%	0.15	21%	0.205	C	C	.	.	S	Bend	trans	-84.7	156.6	177.8	-59.6	-173.2	79.8	0	0	111.9	K238 R399 D450 H454	K238-Q452 HydrophobicContact CB-CG 4.31Å; K238-Q452 VanDerWaalsContact CG-OE1 3.29Å; R399-Q452 WeakPolarHBondContact CA-O 3.12Å; R399-Q452 WeakPolarHBondContact CB-O 3.17Å; D450-Q452 PolarHBondContact O-N 3.43Å; D450-Q452 VanDerWaalsContact OD1-CB 3.26Å; D450-Q452 WeakPolarHBondContact OD1-CB 3.22Å; D450-Q452 PolarHBondContact OD1-N 2.92Å; D450-Q452 PolarHBondContact OD2-NE2 3.38Å; Q452-H454 PolarHBondContact O-CD2 3.43Å; Q452-H454 PolarHBondContact O-N 3.05Å
453	W	95.2	Very high	92.5	Very high	31 Å²	31	36.6 Å²	36.6	12%	0.117	22%	0.215	C	C	.	.			trans	-73	119.3	170.4	-73.5	108	0	0	0	110.7	P371 Q397 F398 R399 C513 R515 C545	P371-W453 HydrophobicContact CB-CH2 4.43Å; Q397-W453 HydrophobicContact CB-CE3 3.93Å; Q397-W453 HydrophobicContact CB-CZ3 4.41Å; F398-W453 WeakPolarHBondContact O-CA 3.38Å; R399-W453 HydrophobicContact CB-CD2 4.21Å; R399-W453 HydrophobicContact CB-CE3 4.11Å; R399-W453 HydrophobicContact CG-CD2 3.94Å; R399-W453 HydrophobicContact CG-CE3 3.96Å; R399-W453 HydrophobicContact CG-CH2 4.14Å; R399-W453 HydrophobicContact CG-CZ2 4.09Å; R399-W453 HydrophobicContact CG-CZ3 4.06Å; W453-C513 HydrophobicContact CH2-CB 3.52Å; W453-C513 HydrophobicContact CZ2-CB 4.21Å; W453-C513 HydrophobicContact CZ3-CB 4.15Å; W453-R515 HydrophobicContact CE3-CG 4.07Å; W453-R515 HydrophobicContact CH2-CB 4.17Å; W453-R515 HydrophobicContact CH2-CG 3.8Å; W453-R515 HydrophobicContact CZ2-CG 4.34Å; W453-R515 HydrophobicContact CZ3-CB 4.31Å; W453-R515 HydrophobicContact CZ3-CG 3.67Å; W453-C545 HydrophobicContact CZ2-CB 4.41Å
454	H	96.6	Very high	92.1	Very high	13 Å²	13	35.8 Å²	35.8	6%	0.06	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	135.4	172.1	-65.2	-71.5	0	0	0	110.9	Q397 F398 L448 D450 Q452 D470	Q397-H454 CarbonylContact C-O 3.54Å; Q397-H454 WeakPolarHBondContact CA-O 3.26Å; F398-H454 HydrophobicContact CD1-CB 4.19Å; F398-H454 HydrophobicContact CE1-CB 3.8Å; F398-H454 HydrophobicContact CZ-CB 4.28Å; F398-H454 PolarHBondContact N-O 3.08Å; F398-H454 PolarHBondContact O-N 3.12Å; L448-H454 HydrophobicContact CD2-CB 4.47Å; D450-H454 IonicContact OD1-CE1 3.85Å; D450-H454 IonicContact OD1-NE2 3.83Å; D450-H454 PolarHBondContact OD1-NE2 3.26Å; D450-H454 IonicContact OD2-CE1 3.76Å; D450-H454 IonicContact OD2-NE2 2.76Å; Q452-H454 PolarHBondContact O-CD2 3.43Å; Q452-H454 PolarHBondContact O-N 3.05Å; H454-D470 VanDerWaalsContact CA-OD1 3.29Å; H454-D470 WeakPolarHBondContact CA-OD1 3.16Å; H454-D470 IonicContact CE1-OD2 2.63Å; H454-D470 IonicContact CG-OD2 3.72Å; H454-D470 IonicContact ND1-OD1 3.08Å; H454-D470 IonicContact ND1-OD2 2.66Å; H454-D470 PolarHBondContact ND1-OD2 2.63Å
455	S	96.7	Very high	91.8	Very high	49 Å²	49	35.6 Å²	35.6	34%	0.343	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	128.6	174.8	-170.2	0	0	0	0	110.4	V469 D470	S455-V469 CarbonylContact O-C 3.59Å; S455-V469 VanDerWaalsContact O-CA 3.3Å; S455-V469 WeakPolarHBondContact O-CA 3.19Å; S455-D470 PolarHBondContact N-OD1 2.88Å; S455-D470 PolarHBondContact O-N 3.24Å
456	V	97.1	Very high	91.7	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	128.4	179.5	-175.7	0	0	0	0	108.9	T395 F396 F398 L421 L428 V468	T395-V456 CarbonylContact C-O 3.51Å; T395-V456 VanDerWaalsContact CA-O 3.24Å; T395-V456 WeakPolarHBondContact CA-O 3.38Å; F396-V456 HydrophobicContact CD2-CB 4.44Å; F396-V456 HydrophobicContact CE1-CB 4.39Å; F396-V456 HydrophobicContact CE1-CG1 4.31Å; F396-V456 HydrophobicContact CE2-CB 4.1Å; F396-V456 HydrophobicContact CE2-CG2 4.15Å; F396-V456 HydrophobicContact CZ-CB 4.07Å; F396-V456 HydrophobicContact CZ-CG1 4.09Å; F396-V456 HydrophobicContact CZ-CG2 4.43Å; F396-V456 PolarHBondContact N-O 2.64Å; F396-V456 PolarHBondContact O-N 2.48Å; F398-V456 HydrophobicContact CD1-CG2 3.48Å; F398-V456 VanDerWaalsContact CD1-CG2 3.48Å; F398-V456 HydrophobicContact CE1-CG2 3.36Å; L421-V456 HydrophobicContact CD2-CG1 4.09Å; L428-V456 HydrophobicContact CD1-CB 4.46Å; L428-V456 HydrophobicContact CD1-CG1 4.01Å; L428-V456 HydrophobicContact CD1-CG2 3.54Å; V456-V468 WeakPolarHBondContact CA-O 3.25Å
457	S	95.3	Very high	91.6	Very high	39 Å²	39	33 Å²	33	27%	0.273	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	120.7	168.9	177.8	0	0	0	0	109	T395 V467 V468	T395-S457 WeakPolarHBondContact CG2-OG 3.24Å; S457-V467 WeakPolarHBondContact O-CA 3.24Å; S457-V468 PolarHBondContact N-O 3.27Å; S457-V468 PolarHBondContact O-N 3.11Å
458	F	90.4	Very high	91.7	Very high	1 Å²	1	32.6 Å²	32.6	0%	0.004	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	132.3	175.2	151.2	-117.4	0	0	0	108.7	V392 S393 V394 L408 F419 L430 A460 M465 N466	V392-F458 HydrophobicContact CB-CE1 4.24Å; V392-F458 HydrophobicContact CB-CZ 4.31Å; V392-F458 HydrophobicContact CG1-CD1 4.38Å; V392-F458 HydrophobicContact CG1-CE1 3.49Å; V392-F458 VanDerWaalsContact CG1-CE1 3.49Å; V392-F458 HydrophobicContact CG1-CZ 4.03Å; S393-F458 WeakPolarHBondContact CA-O 3.32Å; V394-F458 HydrophobicContact CB-CD1 4.38Å; V394-F458 PolarHBondContact N-O 2.96Å; V394-F458 PolarHBondContact O-N 2.96Å; L408-F458 HydrophobicContact CD2-CD1 4.45Å; F419-F458 AromaticContact CD2-CE1 3.83Å; F419-F458 HydrophobicContact CD2-CE1 3.83Å; F419-F458 HydrophobicContact CD2-CZ 4.14Å; F419-F458 HydrophobicContact CE2-CD1 4.47Å; F419-F458 AromaticContact CE2-CE1 3.73Å; F419-F458 HydrophobicContact CE2-CE1 3.73Å; F419-F458 HydrophobicContact CE2-CZ 4.45Å; F419-F458 HydrophobicContact CG-CE1 4.41Å; F419-F458 HydrophobicContact CG-CZ 4.35Å; F419-F458 HydrophobicContact CZ-CE1 4.23Å; L430-F458 HydrophobicContact CD1-CD2 4.42Å; L430-F458 HydrophobicContact CD1-CE2 4.3Å; L430-F458 HydrophobicContact CD2-CD2 3.25Å; L430-F458 HydrophobicContact CD2-CE2 3.34Å; L430-F458 HydrophobicContact CD2-CG 4.18Å; L430-F458 HydrophobicContact CD2-CZ 4.29Å; L430-F458 HydrophobicContact CG-CD2 4.48Å; L430-F458 HydrophobicContact CG-CE2 4.43Å; F458-A460 HydrophobicContact CE2-CB 3.61Å; F458-A460 HydrophobicContact CZ-CB 3.61Å; F458-M465 HydrophobicContact CE2-CG 4Å; F458-M465 HydrophobicContact CE2-SD 4.44Å; F458-N466 WeakPolarHBondContact CD2-O 3.36Å
459	S	90.1	Very high	91.6	Very high	19 Å²	19	32.6 Å²	32.6	13%	0.133	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	141.5	163.5	83.7	0	0	0	0	113	V392 N466	V392-S459 CarbonylContact O-C 3.12Å; V392-S459 WeakPolarHBondContact O-CA 3.45Å; S459-N466 WeakPolarHBondContact CA-OD1 3.44Å; S459-N466 WeakPolarHBondContact CB-OD1 3.4Å; S459-N466 PolarHBondContact N-O 2.96Å; S459-N466 VanDerWaalsContact N-O 3.12Å; S459-N466 PolarHBondContact N-OD1 3.31Å; S459-N466 PolarHBondContact O-N 3.24Å; S459-N466 PolarHBondContact O-OD1 3.37Å; S459-N466 PolarHBondContact OG-OD1 2.92Å
460	A	88.3	Confident	91.5	Very high	4 Å²	4	34.3 Å²	34.3	3%	0.033	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	128.3	172.8	0	0	0	0	0	109.6	K391 V392 F458 M465 I483	K391-A460 CarbonylContact C-O 3.5Å; K391-A460 VanDerWaalsContact CA-O 3.32Å; K391-A460 WeakPolarHBondContact CA-O 3.16Å; V392-A460 HydrophobicContact CB-CB 4.42Å; V392-A460 PolarHBondContact N-O 2.73Å; V392-A460 PolarHBondContact O-N 3.4Å; F458-A460 HydrophobicContact CE2-CB 3.61Å; F458-A460 HydrophobicContact CZ-CB 3.61Å; A460-M465 HydrophobicContact CB-CG 4.45Å; A460-I483 HydrophobicContact CB-CD1 3.82Å; A460-I483 HydrophobicContact CB-CG2 4.14Å
461	K	85.6	Confident	91.1	Very high	87 Å²	87	39.9 Å²	39.9	38%	0.378	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	170.4	174.1	-65.8	-176.6	179.6	-179.3	0	109.3	K391 S463 H464 L478 I483	K391-K461 HydrophobicContact CB-CG 4.02Å; K461-S463 PolarHBondContact O-N 3.34Å; K461-H464 PolarHBondContact N-O 3.44Å; K461-H464 PolarHBondContact O-N 3.4Å; K461-H464 VanDerWaalsContact O-O 3.05Å; K461-L478 WeakPolarHBondContact O-CD1 3.37Å; K461-I483 VanDerWaalsContact O-CD1 3.29Å; K461-I483 WeakPolarHBondContact O-CD1 3.34Å
462	W	79.3	Confident	90.7	Very high	159 Å²	159	43.9 Å²	43.9	60%	0.602	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55	-26.4	-177.7	68.8	-91.4	0	0	0	115.8	V481	W462-V481 WeakPolarHBondContact CA-O 3.27Å; W462-V481 WeakPolarHBondContact CB-O 3.48Å; W462-V481 PolarHBondContact O-N 2.95Å; W462-V481 VanDerWaalsContact O-N 3.15Å
463	S	80.9	Confident	90.4	Very high	37 Å²	37	46.1 Å²	46.1	26%	0.259	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.9	-22	-175.3	60.9	0	0	0	0	115	K461 L478	K461-S463 PolarHBondContact O-N 3.34Å; S463-L478 PolarHBondContact O-N 3.36Å
464	H	85.7	Confident	90	Very high	56 Å²	56	45.5 Å²	45.5	26%	0.259	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.4	158.8	-176.6	62.5	-76.8	0	0	0	112.2	K461 V475 Q476	K461-H464 PolarHBondContact N-O 3.44Å; K461-H464 PolarHBondContact O-N 3.4Å; K461-H464 VanDerWaalsContact O-O 3.05Å; H464-V475 HydrophobicContact CB-CG1 4.25Å; H464-Q476 WeakPolarHBondContact CA-O 3.4Å
465	M	89.2	Confident	89.5	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.005	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	132.2	171.8	-174.9	168.4	77.9	0	0	108.3	L430 L432 V442 F458 A460 V475 Q476 L478	L430-M465 HydrophobicContact CB-CE 4.33Å; L430-M465 HydrophobicContact CD2-CE 3.75Å; L430-M465 HydrophobicContact CD2-CG 3.43Å; L430-M465 VanDerWaalsContact CD2-CG 3.43Å; L430-M465 HydrophobicContact CD2-SD 3.28Å; L430-M465 WeakPolarHBondContact CD2-SD 3.21Å; L430-M465 HydrophobicContact CG-CE 3.78Å; L430-M465 HydrophobicContact CG-CG 4.41Å; L430-M465 HydrophobicContact CG-SD 3.64Å; L432-M465 HydrophobicContact CB-SD 4.19Å; V442-M465 HydrophobicContact CB-CE 3.9Å; V442-M465 HydrophobicContact CG2-CB 4.44Å; V442-M465 HydrophobicContact CG2-CE 3.3Å; V442-M465 HydrophobicContact CG2-CG 4.3Å; F458-M465 HydrophobicContact CE2-CG 4Å; F458-M465 HydrophobicContact CE2-SD 4.44Å; A460-M465 HydrophobicContact CB-CG 4.45Å; M465-V475 WeakPolarHBondContact O-CA 3.25Å; M465-Q476 PolarHBondContact N-O 3.12Å; M465-Q476 PolarHBondContact O-N 3.35Å; M465-L478 HydrophobicContact CB-CD1 4.31Å
466	N	90.3	Very high	88.8	Confident	30 Å²	30	50.1 Å²	50.1	16%	0.16	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	149.7	175.5	72.7	-11.5	0	0	0	112.1	F458 S459 A474 V475	F458-N466 WeakPolarHBondContact CD2-O 3.36Å; S459-N466 WeakPolarHBondContact CA-OD1 3.44Å; S459-N466 WeakPolarHBondContact CB-OD1 3.4Å; S459-N466 PolarHBondContact N-O 2.96Å; S459-N466 VanDerWaalsContact N-O 3.12Å; S459-N466 PolarHBondContact N-OD1 3.31Å; S459-N466 PolarHBondContact O-N 3.24Å; S459-N466 PolarHBondContact O-OD1 3.37Å; S459-N466 PolarHBondContact OG-OD1 2.92Å; N466-A474 CarbonylContact C-O 3.56Å; N466-A474 VanDerWaalsContact CA-O 3.24Å; N466-A474 WeakPolarHBondContact CA-O 3.42Å; N466-V475 HydrophobicContact CB-CG2 4.01Å
467	V	93.8	Very high	88.1	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.006	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	121.5	170.9	-177.5	0	0	0	0	106.8	L430 V442 A444 S457 V469 A474	L430-V467 HydrophobicContact CB-CG2 3.78Å; L430-V467 HydrophobicContact CD2-CG2 3.46Å; L430-V467 VanDerWaalsContact CD2-CG2 3.46Å; L430-V467 HydrophobicContact CG-CG2 4.31Å; V442-V467 HydrophobicContact CB-CG2 4.3Å; V442-V467 HydrophobicContact CG1-CB 4.1Å; V442-V467 HydrophobicContact CG1-CG2 3.87Å; A444-V467 HydrophobicContact CB-CB 4.12Å; A444-V467 HydrophobicContact CB-CG1 3.93Å; S457-V467 WeakPolarHBondContact O-CA 3.24Å; V467-V469 HydrophobicContact CG1-CG2 3.9Å; V467-A474 PolarHBondContact N-O 3.25Å; V467-A474 PolarHBondContact O-N 2.92Å
468	V	95	Very high	87.2	Confident	34 Å²	34	53.1 Å²	53.1	21%	0.206	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	126.6	173.1	-173.9	0	0	0	0	107.7	V456 S457 D472 T473	V456-V468 WeakPolarHBondContact CA-O 3.25Å; S457-V468 PolarHBondContact N-O 3.27Å; S457-V468 PolarHBondContact O-N 3.11Å; V468-D472 CarbonylContact C-O 3.59Å; V468-D472 VanDerWaalsContact CA-O 3.24Å; V468-D472 WeakPolarHBondContact CA-O 3.22Å; V468-D472 WeakPolarHBondContact CG1-O 3.29Å; V468-T473 HydrophobicContact CG2-CG2 4.05Å
469	V	95.7	Very high	86.1	Confident	4 Å²	4	58.8 Å²	58.8	2%	0.024	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	115.2	177.9	-171.8	0	0	0	0	108	L428 A444 L448 S455 V467 D471 D472	L428-V469 HydrophobicContact CB-CG2 4.45Å; L428-V469 HydrophobicContact CD1-CG1 4.27Å; L428-V469 HydrophobicContact CD1-CG2 3.62Å; A444-V469 HydrophobicContact CB-CG2 3.66Å; L448-V469 HydrophobicContact CD1-CG1 3.92Å; L448-V469 HydrophobicContact CD2-CG1 3.68Å; L448-V469 HydrophobicContact CG-CG1 4.47Å; S455-V469 CarbonylContact O-C 3.59Å; S455-V469 VanDerWaalsContact O-CA 3.3Å; S455-V469 WeakPolarHBondContact O-CA 3.19Å; V467-V469 HydrophobicContact CG1-CG2 3.9Å; V469-D471 PolarHBondContact O-N 3.41Å; V469-D472 PolarHBondContact N-O 2.63Å; V469-D472 PolarHBondContact O-N 3.23Å
470	D	92.6	Very high	84.8	Confident	69 Å²	69	61.8 Å²	61.8	37%	0.369	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.6	-108.3	-168.9	-56.2	-36.7	0	0	0	110.8	H454 S455	H454-D470 VanDerWaalsContact CA-OD1 3.29Å; H454-D470 WeakPolarHBondContact CA-OD1 3.16Å; H454-D470 IonicContact CE1-OD2 2.63Å; H454-D470 IonicContact CG-OD2 3.72Å; H454-D470 IonicContact ND1-OD1 3.08Å; H454-D470 IonicContact ND1-OD2 2.66Å; H454-D470 PolarHBondContact ND1-OD2 2.63Å; S455-D470 PolarHBondContact N-OD1 2.88Å; S455-D470 PolarHBondContact O-N 3.24Å
471	D	85.8	Confident	83.7	Confident	169 Å²	169	62 Å²	62	90%	0.904	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.1	-1.7	177.2	-61.5	-47.7	0	0	0	113.4	V469	V469-D471 PolarHBondContact O-N 3.41Å
472	D	86.1	Confident	82.9	Confident	86 Å²	86	64.2 Å²	64.2	46%	0.46	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	135.1	-179.1	-176	24.5	0	0	0	111.5	G445 V468 V469	G445-D472 PolarHBondContact N-OD2 3.01Å; V468-D472 CarbonylContact C-O 3.59Å; V468-D472 VanDerWaalsContact CA-O 3.24Å; V468-D472 WeakPolarHBondContact CA-O 3.22Å; V468-D472 WeakPolarHBondContact CG1-O 3.29Å; V469-D472 PolarHBondContact N-O 2.63Å; V469-D472 PolarHBondContact O-N 3.23Å
473	T	88.8	Confident	82.7	Confident	79 Å²	79	56.8 Å²	56.8	49%	0.485	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	118.6	-177.2	-62.5	0	0	0	0	111.1	V468 V475	V468-T473 HydrophobicContact CG2-CG2 4.05Å; T473-V475 HydrophobicContact CG2-CG2 3.98Å
474	A	86.4	Confident	82.7	Confident	19 Å²	19	56.6 Å²	56.6	16%	0.157	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	134.5	172	0	0	0	0	0	111	V442 T443 A444 N466 V467	V442-A474 HydrophobicContact CG1-CB 3.64Å; T443-A474 WeakPolarHBondContact O-CB 3.47Å; A444-A474 HydrophobicContact CB-CB 3.76Å; N466-A474 CarbonylContact C-O 3.56Å; N466-A474 VanDerWaalsContact CA-O 3.24Å; N466-A474 WeakPolarHBondContact CA-O 3.42Å; V467-A474 PolarHBondContact N-O 3.25Å; V467-A474 PolarHBondContact O-N 2.92Å
475	V	86	Confident	82.5	Confident	82 Å²	82	54 Å²	54	50%	0.497	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	134.9	-178	-176.4	0	0	0	0	110.5	H464 M465 N466 T473	H464-V475 HydrophobicContact CB-CG1 4.25Å; M465-V475 WeakPolarHBondContact O-CA 3.25Å; N466-V475 HydrophobicContact CB-CG2 4.01Å; T473-V475 HydrophobicContact CG2-CG2 3.98Å
476	Q	83.3	Confident	82.3	Confident	77 Å²	77	54.1 Å²	54.1	36%	0.36	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	115.1	170.7	176.8	63.4	55.8	0	0	109.8	V442 H464 M465	V442-Q476 HydrophobicContact CG2-CB 3.12Å; V442-Q476 HydrophobicContact CG2-CG 4.13Å; H464-Q476 WeakPolarHBondContact CA-O 3.4Å; M465-Q476 PolarHBondContact N-O 3.12Å; M465-Q476 PolarHBondContact O-N 3.35Å
477	P	80.8	Confident	82	Confident	89 Å²	89	57.2 Å²	57.2	58%	0.578	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.4	145.7	170.7	-21.4	32.7	0	0	0	111.7
478	L	76.5	Confident	81.9	Confident	13 Å²	13	59.7 Å²	59.7	7%	0.068	35%	0.349	C	S	.	.			trans	-118.4	133.9	176.9	-61.5	176.3	0	0	0	110.1	L432 K461 S463 M465 A480 V481 I483	L432-L478 HydrophobicContact CD2-CD1 4.44Å; L432-L478 HydrophobicContact CD2-CD2 4.37Å; K461-L478 WeakPolarHBondContact O-CD1 3.37Å; S463-L478 PolarHBondContact O-N 3.36Å; M465-L478 HydrophobicContact CB-CD1 4.31Å; L478-A480 PolarHBondContact O-N 2.77Å; L478-A480 VanDerWaalsContact O-N 3.14Å; L478-V481 HydrophobicContact CB-CG2 4.35Å; L478-I483 HydrophobicContact CD1-CD1 3.68Å
479	V	68.5	Low	81.8	Confident	120 Å²	120	58.3 Å²	58.3	73%	0.727	34%	0.34	S	S	*	.	S	Bend	trans	-73.2	101	166.4	-176	0	0	0	0	108.4	V481	V479-V481 WeakPolarHBondContact O-CG2 3.37Å; V479-V481 PolarHBondContact O-N 2.89Å
480	A	62.6	Low	81.6	Confident	82 Å²	82	60.3 Å²	60.3	68%	0.678	35%	0.348	S	S	*	.	S	Bend	trans	16.8	84.7	175.7	0	0	0	0	0	115.1	L478	L478-A480 PolarHBondContact O-N 2.77Å; L478-A480 VanDerWaalsContact O-N 3.14Å
481	V	66.1	Low	81.8	Confident	9 Å²	9	57 Å²	57	6%	0.055	33%	0.33	C	S	.	.			trans	-112	132.3	-179.2	179.6	0	0	0	0	109.4	Q434 W462 L478 V479 I483	Q434-V481 VanDerWaalsContact CD-CG1 3.43Å; W462-V481 WeakPolarHBondContact CA-O 3.27Å; W462-V481 WeakPolarHBondContact CB-O 3.48Å; W462-V481 PolarHBondContact O-N 2.95Å; W462-V481 VanDerWaalsContact O-N 3.15Å; L478-V481 HydrophobicContact CB-CG2 4.35Å; V479-V481 WeakPolarHBondContact O-CG2 3.37Å; V479-V481 PolarHBondContact O-N 2.89Å; V481-I483 HydrophobicContact CB-CG1 4.38Å; V481-I483 HydrophobicContact CG1-CG1 4.01Å; V481-I483 PolarHBondContact O-N 2.79Å
482	L	67.5	Low	82.1	Confident	132 Å²	132	49 Å²	49	69%	0.691	29%	0.287	S	S	*	.			trans	-68.9	117.1	166.5	-85.3	144.8	0	0	0	109
483	I	75.3	Confident	82	Confident	4 Å²	4	45.2 Å²	45.2	2%	0.021	27%	0.269	C	S	.	.			trans	-119.2	94.8	176.3	-57	-170.6	0	0	0	107	D390 V392 L412 A460 K461 L478 V481	D390-I483 CarbonylContact C-O 3.47Å; V392-I483 HydrophobicContact CG2-CG2 3.99Å; L412-I483 HydrophobicContact CD2-CG2 3.95Å; A460-I483 HydrophobicContact CB-CD1 3.82Å; A460-I483 HydrophobicContact CB-CG2 4.14Å; K461-I483 VanDerWaalsContact O-CD1 3.29Å; K461-I483 WeakPolarHBondContact O-CD1 3.34Å; L478-I483 HydrophobicContact CD1-CD1 3.68Å; V481-I483 HydrophobicContact CB-CG1 4.38Å; V481-I483 HydrophobicContact CG1-CG1 4.01Å; V481-I483 PolarHBondContact O-N 2.79Å
484	D	80.4	Confident	81.3	Confident	32 Å²	32	43.1 Å²	43.1	17%	0.171	26%	0.257	C	S	.	.			trans	-103.1	121.3	174.9	-67.2	-22.9	0	0	0	108.3	L412 Q413 G486	L412-D484 WeakPolarHBondContact CA-O 3.4Å; Q413-D484 HydrophobicContact CB-CB 3.7Å; Q413-D484 HydrophobicContact CG-CB 4.02Å; Q413-D484 PolarHBondContact N-O 2.03Å; D484-G486 PolarHBondContact O-N 2.88Å
485	S	82.6	Confident	80.5	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.014	27%	0.267	C	S	.	.			trans	-57.3	131.2	179.3	43.1	0	0	0	0	112.5	N386 S387 G388 E389 Q413	N386-S485 WeakPolarHBondContact O-CB 3.43Å; N386-S485 PolarHBondContact O-OG 3.27Å; S387-S485 WeakPolarHBondContact CA-O 3.5Å; G388-S485 PolarHBondContact N-O 2.92Å; G388-S485 PolarHBondContact N-OG 3.19Å; E389-S485 WeakPolarHBondContact CA-OG 3.31Å; E389-S485 WeakPolarHBondContact CB-OG 3.19Å; E389-S485 PolarHBondContact N-OG 2.83Å; E389-S485 PolarHBondContact O-N 2.78Å; E389-S485 PolarHBondContact O-OG 2.86Å; Q413-S485 WeakPolarHBondContact CG-O 3.46Å
486	G	83.5	Confident	79.1	Confident	3 Å²	3	44.8 Å²	44.8	3%	0.031	28%	0.276	C	S	.	.			trans	-82.6	179.1	179.7	0	0	0	0	0	114.9	E411 D484	E411-G486 VanDerWaalsContact O-CA 3.24Å; E411-G486 WeakPolarHBondContact O-CA 3.05Å; D484-G486 PolarHBondContact O-N 2.88Å
487	D	85.9	Confident	77.7	Confident	96 Å²	96	48.6 Å²	48.6	51%	0.513	30%	0.298	S	S	.	.	S	Bend	trans	-87	-20.3	-168.9	-54.5	-13.8	0	0	0	112.9	G385 S387 Q413	G385-D487 PolarHBondContact N-O 2.94Å; S387-D487 WeakPolarHBondContact CB-OD1 3.05Å; Q413-D487 PolarHBondContact NE2-OD1 3.42Å
488	T	89.8	Confident	76.4	Confident	53 Å²	53	45.5 Å²	45.5	33%	0.325	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	136.5	-175.4	-56.8	0	0	0	0	112.1	A382 L383 Y490	A382-T488 HydrophobicContact CB-CG2 4.21Å; L383-T488 WeakPolarHBondContact O-CA 3.05Å; T488-Y490 HydrophobicContact CG2-CD2 4.18Å; T488-Y490 HydrophobicContact CG2-CE1 4.42Å; T488-Y490 HydrophobicContact CG2-CE2 3.63Å
489	Y	92.9	Very high	74.9	Confident	5 Å²	5	50.9 Å²	50.9	2%	0.02	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	127.6	176.8	-66.1	-98.5	0	0	0	109.5	A382 L383 G385 V392 V394 L408 F419 I519	A382-Y489 WeakPolarHBondContact CA-O 3.27Å; L383-Y489 PolarHBondContact N-O 2.83Å; L383-Y489 PolarHBondContact O-N 3.11Å; G385-Y489 VanDerWaalsContact CA-CE2 3.5Å; V392-Y489 HydrophobicContact CG1-CE1 3.79Å; V394-Y489 HydrophobicContact CG2-CD1 3.98Å; V394-Y489 HydrophobicContact CG2-CE1 3.81Å; L408-Y489 HydrophobicContact CD1-CD1 4.26Å; F419-Y489 HydrophobicContact CE1-CE1 4.16Å; F419-Y489 HydrophobicContact CE2-CE1 4.49Å; F419-Y489 AromaticContact CZ-CD1 3.76Å; F419-Y489 HydrophobicContact CZ-CD1 3.76Å; F419-Y489 AromaticContact CZ-CE1 3.5Å; F419-Y489 HydrophobicContact CZ-CE1 3.5Å; F419-Y489 VanDerWaalsContact CZ-CE1 3.5Å; Y489-I519 HydrophobicContact CD2-CD1 4.35Å; Y489-I519 HydrophobicContact CD2-CG2 3.95Å; Y489-I519 HydrophobicContact CE2-CG2 3.81Å; Y489-I519 HydrophobicContact CG-CD1 4.43Å
490	Y	93.4	Very high	74.2	Confident	46 Å²	46	46.3 Å²	46.3	18%	0.18	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	117.6	178.7	-65.1	-93.7	0	0	0	110.2	Y380 L381 A382 L408 F409 T488 G493 L495	Y380-Y490 HydrophobicContact CD2-CD1 4.31Å; L381-Y490 CarbonylContact O-C 3.55Å; L381-Y490 WeakPolarHBondContact O-CA 3.35Å; A382-Y490 HydrophobicContact CB-CD1 3.76Å; A382-Y490 HydrophobicContact CB-CE1 3.63Å; L408-Y490 CarbonylContact C-O 3.53Å; L408-Y490 VanDerWaalsContact CA-O 3.3Å; L408-Y490 WeakPolarHBondContact CA-O 3.48Å; F409-Y490 AromaticContact CD1-CD2 3.79Å; F409-Y490 HydrophobicContact CD1-CD2 3.79Å; F409-Y490 HydrophobicContact CD1-CG 4.39Å; F409-Y490 HydrophobicContact CE1-CD2 4.3Å; F409-Y490 PolarHBondContact N-O 3.36Å; F409-Y490 PolarHBondContact O-N 3.02Å; T488-Y490 HydrophobicContact CG2-CD2 4.18Å; T488-Y490 HydrophobicContact CG2-CE1 4.42Å; T488-Y490 HydrophobicContact CG2-CE2 3.63Å; Y490-G493 VanDerWaalsContact CB-O 3.29Å; Y490-G493 WeakPolarHBondContact CB-O 3.25Å; Y490-L495 HydrophobicContact CD1-CG 4.49Å; Y490-L495 HydrophobicContact CE1-CD1 3.55Å; Y490-L495 HydrophobicContact CE1-CG 3.79Å; Y490-L495 WeakPolarHBondContact OH-CD1 3.24Å
491	F	95.6	Very high	73.8	Confident	0 Å²	0	47 Å²	47	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	143.5	173.5	-62.7	-104.3	0	0	0	110.3	F374 Y380 L381 L383 V394 F396 L407 L408 G493 L514 I517 I519	F374-F491 HydrophobicContact CE1-CB 4.49Å; F374-F491 WeakPolarHBondContact CE1-O 3.45Å; F374-F491 HydrophobicContact CZ-CB 4.08Å; Y380-F491 CarbonylContact C-O 3.51Å; Y380-F491 VanDerWaalsContact CA-O 3.27Å; Y380-F491 WeakPolarHBondContact CA-O 3.43Å; L381-F491 HydrophobicContact CB-CB 4.18Å; L381-F491 PolarHBondContact N-O 3.15Å; L381-F491 PolarHBondContact O-N 2.94Å; L383-F491 HydrophobicContact CD1-CD2 4Å; L383-F491 HydrophobicContact CD1-CE2 3.73Å; V394-F491 HydrophobicContact CG1-CE1 4.01Å; V394-F491 HydrophobicContact CG1-CZ 3.77Å; F396-F491 AromaticContact CD1-CE1 3.86Å; F396-F491 HydrophobicContact CD1-CE1 3.86Å; F396-F491 HydrophobicContact CE1-CE1 4.21Å; F396-F491 HydrophobicContact CG-CE1 4.42Å; L407-F491 CarbonylContact O-C 3.53Å; L407-F491 VanDerWaalsContact O-CA 3.24Å; L407-F491 WeakPolarHBondContact O-CA 3.02Å; L408-F491 HydrophobicContact CD1-CD1 3.95Å; L408-F491 HydrophobicContact CD1-CD2 4.05Å; L408-F491 HydrophobicContact CD1-CE1 3.78Å; L408-F491 HydrophobicContact CD1-CE2 3.84Å; L408-F491 HydrophobicContact CD1-CG 4.09Å; L408-F491 HydrophobicContact CD1-CZ 3.71Å; F491-G493 PolarHBondContact O-N 3.29Å; F491-G493 VanDerWaalsContact O-N 3.08Å; F491-L514 HydrophobicContact CB-CD1 3.9Å; F491-L514 HydrophobicContact CD1-CD1 3.82Å; F491-L514 HydrophobicContact CG-CD1 4.24Å; F491-I517 HydrophobicContact CE1-CG2 3.95Å; F491-I517 HydrophobicContact CE2-CG2 4.26Å; F491-I517 HydrophobicContact CZ-CG2 3.62Å; F491-I519 HydrophobicContact CE2-CD1 4.08Å; F491-I519 HydrophobicContact CZ-CD1 4.32Å; F491-I519 HydrophobicContact CZ-CG1 4.39Å
492	G	92.2	Very high	73.2	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	30%	0.295	C	S	.	.	S	Bend	trans	71.7	-10.5	173.7	0	0	0	0	0	117.3	S379 H406 L407 G509 F510	S379-G492 CarbonylContact O-C 3.48Å; H406-G492 CarbonylContact O-C 3.58Å; H406-G492 WeakPolarHBondContact O-CA 3.34Å; L407-G492 PolarHBondContact O-N 2.86Å; G492-G509 CarbonylContact O-C 3.53Å; G492-G509 WeakPolarHBondContact O-CA 3.27Å; G492-F510 PolarHBondContact O-N 2.81Å
493	G	84.6	Confident	73	Confident	7 Å²	7	41.2 Å²	41.2	7%	0.072	27%	0.266	C	S	.	.			trans	-174.3	-172.7	177.8	0	0	0	0	0	110.7	Y490 F491	Y490-G493 VanDerWaalsContact CB-O 3.29Å; Y490-G493 WeakPolarHBondContact CB-O 3.25Å; F491-G493 PolarHBondContact O-N 3.29Å; F491-G493 VanDerWaalsContact O-N 3.08Å
494	C	74	Confident	72.3	Confident	35 Å²	35	49.1 Å²	49.1	24%	0.236	30%	0.3	C	S	.	.			trans	-145.9	159.7	176.3	63.3	0	0	0	0	110.6	F409 C503	F409-C494 HydrophobicContact CB-CB 4.46Å; F409-C494 HydrophobicContact CD1-CB 4.08Å; F409-C494 HydrophobicContact CG-CB 4.37Å; C494-C503 HydrophobicContact CB-CB 3.83Å; C494-C503 WeakPolarHBondContact CB-SG 3.29Å; C494-C503 VanDerWaalsContact SG-CA 3.57Å; C494-C503 WeakPolarHBondContact SG-CB 3.35Å; C494-C503 PolarHBondContact SG-O 3.43Å; C494-C503 CovalentContact SG-SG 2.02Å; C494-C503 PolarHBondContact SG-SG 3.16Å
495	L	69.4	Low	71.3	Confident	70 Å²	70	49.4 Å²	49.4	37%	0.366	31%	0.305	S	S	.	.			trans	-80.7	123.6	179.4	-72	170.3	0	0	0	110	Y380 Y490 N497 S498	Y380-L495 HydrophobicContact CE1-CD2 4.07Å; Y490-L495 HydrophobicContact CD1-CG 4.49Å; Y490-L495 HydrophobicContact CE1-CD1 3.55Å; Y490-L495 HydrophobicContact CE1-CG 3.79Å; Y490-L495 WeakPolarHBondContact OH-CD1 3.24Å; L495-N497 PolarHBondContact O-N 3.38Å; L495-S498 PolarHBondContact O-N 2.9Å; L495-S498 PolarHBondContact O-OG 2.94Å
496	G	57.1	Low	70.3	Confident	66 Å²	66	55.7 Å²	55.7	68%	0.68	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-9.5	-175.9	0	0	0	0	0	116.6
497	N	52.7	Low	69.6	Low	157 Å²	157	57.9 Å²	57.9	84%	0.84	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-4.8	177.3	-74.8	0.1	0	0	0	114.1	L495 S499	L495-N497 PolarHBondContact O-N 3.38Å; N497-S499 PolarHBondContact O-N 2.91Å; N497-S499 VanDerWaalsContact O-N 3.13Å
498	S	53	Low	69.4	Low	23 Å²	23	55.4 Å²	55.4	16%	0.161	35%	0.354	C	S	.	.			trans	-74.8	103.6	173.4	55.2	0	0	0	0	109.3	L495 G500 C503	L495-S498 PolarHBondContact O-N 2.9Å; L495-S498 PolarHBondContact O-OG 2.94Å; S498-G500 PolarHBondContact O-N 3.18Å; S498-C503 PolarHBondContact OG-SG 3.39Å
499	S	46.7	Very low	69.4	Low	126 Å²	126	53.3 Å²	53.3	88%	0.881	34%	0.343	S	S	*	.			trans	-62	-0.3	-178.6	-44.1	0	0	0	0	114.8	N497	N497-S499 PolarHBondContact O-N 2.91Å; N497-S499 VanDerWaalsContact O-N 3.13Å
500	G	52.2	Low	69.5	Low	25 Å²	25	53.2 Å²	53.2	26%	0.258	34%	0.342	S	S	.	.	S	Bend	trans	-71.8	128.5	174.8	0	0	0	0	0	111.9	S498 G502 C503	S498-G500 PolarHBondContact O-N 3.18Å; G500-G502 PolarHBondContact O-N 2.7Å; G500-C503 PolarHBondContact O-N 2.98Å
501	S	54.3	Low	69.6	Low	97 Å²	97	51.9 Å²	51.9	68%	0.678	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-7.3	-176.5	49.5	0	0	0	0	115.8
502	G	54.8	Low	69.6	Low	5 Å²	5	51.9 Å²	51.9	5%	0.052	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-31.2	179.9	0	0	0	0	0	115.7	V420 G500	V420-G502 WeakPolarHBondContact CG2-O 3.44Å; G500-G502 PolarHBondContact O-N 2.7Å
503	C	62.6	Low	69.9	Low	14 Å²	14	51.9 Å²	51.9	10%	0.095	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-21.5	-176.9	162.4	0	0	0	0	113.1	F409 C494 S498 G500 S505	F409-C503 HydrophobicContact CE2-CB 4.19Å; F409-C503 HydrophobicContact CZ-CB 4.22Å; C494-C503 HydrophobicContact CB-CB 3.83Å; C494-C503 WeakPolarHBondContact CB-SG 3.29Å; C494-C503 VanDerWaalsContact SG-CA 3.57Å; C494-C503 WeakPolarHBondContact SG-CB 3.35Å; C494-C503 PolarHBondContact SG-O 3.43Å; C494-C503 CovalentContact SG-SG 2.02Å; C494-C503 PolarHBondContact SG-SG 3.16Å; S498-C503 PolarHBondContact OG-SG 3.39Å; G500-C503 PolarHBondContact O-N 2.98Å; C503-S505 PolarHBondContact O-N 3.28Å
504	K	59.9	Low	70.5	Confident	169 Å²	169	51.6 Å²	51.6	74%	0.735	33%	0.334	S	S	*	.			trans	-79.4	67.7	172.5	-68.1	-174.9	-179.3	179.2	0	110.8
505	S	60.6	Low	71.6	Confident	38 Å²	38	51.6 Å²	51.6	27%	0.266	33%	0.33	S	S	.	.			trans	-85.9	142.7	170.3	-173.6	0	0	0	0	110.3	C503 L507	C503-S505 PolarHBondContact O-N 3.28Å; S505-L507 PolarHBondContact O-N 3.25Å; S505-L507 WeakPolarHBondContact OG-CB 3.25Å; S505-L507 PolarHBondContact OG-N 3.29Å
506	P	62.2	Low	72.8	Confident	134 Å²	134	52.8 Å²	52.8	87%	0.87	34%	0.336	S	S	*	.	S	Bend	trans	-66.3	-13.3	167.6	28.2	-34.2	0	0	0	112.4
507	L	68.1	Low	74.7	Confident	50 Å²	50	49.8 Å²	49.8	26%	0.262	30%	0.304	S	S	.	.	S	Bend	trans	-80	132.7	176.2	-55.7	174.5	0	0	0	109.7	A404 F422 S505	A404-L507 HydrophobicContact CB-CD2 3.98Å; F422-L507 HydrophobicContact CD2-CD1 3.57Å; F422-L507 HydrophobicContact CE2-CD1 4.04Å; F422-L507 HydrophobicContact CG-CD1 4.32Å; S505-L507 PolarHBondContact O-N 3.25Å; S505-L507 WeakPolarHBondContact OG-CB 3.25Å; S505-L507 PolarHBondContact OG-N 3.29Å
508	G	81.4	Confident	76.7	Confident	44 Å²	44	44 Å²	44	45%	0.454	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-62.8	168.3	172.9	0	0	0	0	0	113	H406	H406-G508 PolarHBondContact N-O 3.47Å; H406-G508 VanDerWaalsContact N-O 3.16Å
509	G	89.5	Confident	78.7	Confident	9 Å²	9	43.4 Å²	43.4	9%	0.093	27%	0.269	C	S	.	.	B	Isolated β-bridge	trans	-61.6	160.4	171.2	0	0	0	0	0	112.7	S377 G492	S377-G509 WeakPolarHBondContact O-CA 3.44Å; S377-G509 PolarHBondContact O-N 3.08Å; G492-G509 CarbonylContact O-C 3.53Å; G492-G509 WeakPolarHBondContact O-CA 3.27Å
510	F	94.8	Very high	80.8	Confident	2 Å²	2	37.9 Å²	37.9	1%	0.009	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-64.5	136.4	176.4	178.1	-110.3	0	0	0	111.4	F374 F398 T400 H406 L407 G492 G512 L514	F374-F510 HydrophobicContact CB-CD1 4.03Å; F374-F510 WeakPolarHBondContact CB-O 3.33Å; F374-F510 HydrophobicContact CD1-CD1 4.49Å; F374-F510 AromaticContact CD2-CD1 3.88Å; F374-F510 HydrophobicContact CD2-CD1 3.88Å; F374-F510 HydrophobicContact CD2-CE1 4.04Å; F374-F510 AromaticContact CG-CD1 3.87Å; F374-F510 HydrophobicContact CG-CD1 3.87Å; F374-F510 HydrophobicContact CG-CE1 4.43Å; F398-F510 HydrophobicContact CB-CZ 4.16Å; F398-F510 AromaticContact CD2-CE2 3.96Å; F398-F510 HydrophobicContact CD2-CE2 3.96Å; F398-F510 HydrophobicContact CD2-CZ 4.14Å; T400-F510 HydrophobicContact CG2-CE2 3.87Å; H406-F510 VanDerWaalsContact O-CB 3.23Å; H406-F510 WeakPolarHBondContact O-CB 3.16Å; H406-F510 PolarHBondContact O-N 3.29Å; L407-F510 HydrophobicContact CD2-CB 4.4Å; L407-F510 HydrophobicContact CD2-CD1 4.14Å; L407-F510 HydrophobicContact CD2-CD2 3.41Å; L407-F510 VanDerWaalsContact CD2-CD2 3.41Å; L407-F510 HydrophobicContact CD2-CE1 4.22Å; L407-F510 HydrophobicContact CD2-CE2 3.51Å; L407-F510 HydrophobicContact CD2-CG 3.75Å; L407-F510 HydrophobicContact CD2-CZ 3.93Å; L407-F510 HydrophobicContact CG-CD2 4.08Å; L407-F510 HydrophobicContact CG-CE2 4.47Å; G492-F510 PolarHBondContact O-N 2.81Å; F510-G512 VanDerWaalsContact CE1-C 3.49Å; F510-L514 HydrophobicContact CE1-CD2 4.03Å; F510-L514 HydrophobicContact CE1-CG 4.16Å; F510-L514 HydrophobicContact CZ-CD2 4.36Å
511	Q	95.9	Very high	82.5	Confident	19 Å²	19	43 Å²	43	9%	0.089	25%	0.254	C	S	.	.			trans	-120.1	131.2	163	-67.1	161.7	-71.8	0	0	107.4	F374 S376 T400 N402 W566 D567	F374-Q511 WeakPolarHBondContact O-CA 3.34Å; S376-Q511 VanDerWaalsContact C-CG 3.42Å; T400-Q511 WeakPolarHBondContact CB-O 3.38Å; T400-Q511 PolarHBondContact OG1-O 2.89Å; N402-Q511 PolarHBondContact ND2-OE1 3.33Å; N402-Q511 VanDerWaalsContact ND2-OE1 3.11Å; Q511-W566 HydrophobicContact CB-CB 3.89Å; Q511-W566 HydrophobicContact CB-CD2 3.78Å; Q511-W566 HydrophobicContact CB-CE3 4.36Å; Q511-W566 HydrophobicContact CB-CG 3.52Å; Q511-W566 HydrophobicContact CG-CG 4.23Å; Q511-D567 PolarHBondContact NE2-OD2 3.32Å
512	G	96.8	Very high	84.4	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	149.9	-165	-170.2	0	0	0	0	0	111.3	T373 F374 R399 F510	T373-G512 WeakPolarHBondContact CA-O 3.4Å; F374-G512 PolarHBondContact N-O 3.09Å; F374-G512 PolarHBondContact O-N 2.94Å; R399-G512 WeakPolarHBondContact O-CA 3.47Å; F510-G512 VanDerWaalsContact CE1-C 3.49Å
513	C	97.5	Very high	86.2	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	145.6	179.8	-55.8	0	0	0	0	111.9	V372 F398 R399 W453 C545	V372-C513 CarbonylContact O-C 3.46Å; V372-C513 VanDerWaalsContact O-CA 3.24Å; V372-C513 WeakPolarHBondContact O-CA 3.27Å; F398-C513 WeakPolarHBondContact CA-O 3.23Å; R399-C513 HydrophobicContact CG-CB 4.12Å; R399-C513 PolarHBondContact N-O 2.95Å; R399-C513 PolarHBondContact O-N 3.18Å; W453-C513 HydrophobicContact CH2-CB 3.52Å; W453-C513 HydrophobicContact CZ2-CB 4.21Å; W453-C513 HydrophobicContact CZ3-CB 4.15Å; C513-C545 HydrophobicContact CB-CB 3.87Å; C513-C545 WeakPolarHBondContact CB-SG 3.48Å; C513-C545 WeakPolarHBondContact SG-CA 3.46Å; C513-C545 WeakPolarHBondContact SG-CB 3.17Å; C513-C545 CovalentContact SG-SG 2.03Å; C513-C545 PolarHBondContact SG-SG 3.49Å
514	L	97.6	Very high	87.8	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	150.4	168.1	-62.4	-174.5	0	0	0	111.2	P371 V372 F374 F396 Q397 F398 L407 F491 F510 I517	P371-L514 CarbonylContact C-O 3.52Å; P371-L514 WeakPolarHBondContact CA-O 2.99Å; V372-L514 PolarHBondContact N-O 2.96Å; V372-L514 PolarHBondContact O-N 3.29Å; F374-L514 HydrophobicContact CD2-CD1 4.46Å; F374-L514 HydrophobicContact CD2-CG 4.22Å; F374-L514 HydrophobicContact CE2-CB 4.07Å; F374-L514 HydrophobicContact CE2-CD1 3.47Å; F374-L514 VanDerWaalsContact CE2-CD1 3.47Å; F374-L514 HydrophobicContact CE2-CG 3.56Å; F374-L514 HydrophobicContact CZ-CD1 3.69Å; F374-L514 HydrophobicContact CZ-CG 4.3Å; F396-L514 HydrophobicContact CD2-CD2 3.75Å; F396-L514 HydrophobicContact CE2-CD2 4.02Å; Q397-L514 CarbonylContact O-C 3.46Å; Q397-L514 VanDerWaalsContact O-CA 3.27Å; Q397-L514 WeakPolarHBondContact O-CA 3.24Å; F398-L514 HydrophobicContact CB-CD2 3.33Å; L407-L514 HydrophobicContact CD2-CD2 4.36Å; F491-L514 HydrophobicContact CB-CD1 3.9Å; F491-L514 HydrophobicContact CD1-CD1 3.82Å; F491-L514 HydrophobicContact CG-CD1 4.24Å; F510-L514 HydrophobicContact CE1-CD2 4.03Å; F510-L514 HydrophobicContact CE1-CG 4.16Å; F510-L514 HydrophobicContact CZ-CD2 4.36Å; L514-I517 HydrophobicContact CB-CD1 4.32Å; L514-I517 HydrophobicContact CD1-CD1 4.49Å
515	R	95.8	Very high	89.4	Confident	36 Å²	36	43.9 Å²	43.9	14%	0.136	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	171.8	167.4	69.3	-178.8	-174.4	-170.5	-3.5	111.3	P371 Q397 W453 I517	P371-R515 HydrophobicContact CB-CB 4.46Å; Q397-R515 HydrophobicContact CB-CG 3.9Å; Q397-R515 PolarHBondContact N-O 3.33Å; Q397-R515 PolarHBondContact O-N 2.74Å; Q397-R515 VanDerWaalsContact OE1-CZ 3.31Å; W453-R515 HydrophobicContact CE3-CG 4.07Å; W453-R515 HydrophobicContact CH2-CB 4.17Å; W453-R515 HydrophobicContact CH2-CG 3.8Å; W453-R515 HydrophobicContact CZ2-CG 4.34Å; W453-R515 HydrophobicContact CZ3-CB 4.31Å; W453-R515 HydrophobicContact CZ3-CG 3.67Å; R515-I517 VanDerWaalsContact C-N 3.31Å; R515-I517 PolarHBondContact O-N 2.81Å
516	L	95.1	Very high	91	Very high	95 Å²	95	42.6 Å²	42.6	50%	0.497	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	54.1	44.2	176.1	-62.1	176.5	0	0	0	113.1	T369 F396 Q397	T369-L516 HydrophobicContact CG2-CD2 3.95Å; T369-L516 HydrophobicContact CG2-CG 4.38Å; F396-L516 WeakPolarHBondContact CA-O 3.27Å; Q397-L516 HydrophobicContact CG-CD1 4.29Å
517	I	96.6	Very high	92.5	Very high	3 Å²	3	36.7 Å²	36.7	2%	0.015	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	127.9	-177.6	-53.9	171.3	0	0	0	109.3	L381 L383 T395 F396 F491 L514 R515 I519 V524	L381-I517 HydrophobicContact CD2-CD1 3.96Å; L383-I517 HydrophobicContact CD1-CG2 4.2Å; T395-I517 CarbonylContact O-C 3.51Å; T395-I517 WeakPolarHBondContact O-CA 3.48Å; F396-I517 HydrophobicContact CB-CG1 4.07Å; F491-I517 HydrophobicContact CE1-CG2 3.95Å; F491-I517 HydrophobicContact CE2-CG2 4.26Å; F491-I517 HydrophobicContact CZ-CG2 3.62Å; L514-I517 HydrophobicContact CB-CD1 4.32Å; L514-I517 HydrophobicContact CD1-CD1 4.49Å; R515-I517 VanDerWaalsContact C-N 3.31Å; R515-I517 PolarHBondContact O-N 2.81Å; I517-I519 HydrophobicContact CG2-CG1 4.5Å; I517-V524 HydrophobicContact CB-CB 4.15Å; I517-V524 HydrophobicContact CB-CG2 4.47Å; I517-V524 HydrophobicContact CG2-CB 4.31Å; I517-V524 HydrophobicContact CG2-CG2 4.1Å; I517-V524 WeakPolarHBondContact O-CB 3.42Å; I517-V524 PolarHBondContact O-N 2.75Å
518	T	95.9	Very high	93.7	Very high	36 Å²	36	37.7 Å²	37.7	22%	0.221	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	132.3	174.6	-44.9	0	0	0	0	109.1	V394 T395 K522	V394-T518 WeakPolarHBondContact CA-O 3.45Å; T395-T518 PolarHBondContact N-O 3.29Å; T395-T518 PolarHBondContact O-N 3.18Å; T395-T518 WeakPolarHBondContact OG1-CB 3.47Å; T395-T518 PolarHBondContact OG1-OG1 2.03Å; T518-K522 WeakPolarHBondContact CA-O 3.45Å; T518-K522 WeakPolarHBondContact CG2-O 3.39Å
519	I	94.5	Very high	94.3	Very high	9 Å²	9	35.7 Å²	35.7	5%	0.046	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	120.5	176.7	-58.6	172.2	0	0	0	107.5	L383 V394 Y489 F491 I517 D521 K522 V524	L383-I519 HydrophobicContact CB-CD1 3.75Å; L383-I519 HydrophobicContact CD1-CD1 4.12Å; V394-I519 HydrophobicContact CG1-CG1 4.48Å; Y489-I519 HydrophobicContact CD2-CD1 4.35Å; Y489-I519 HydrophobicContact CD2-CG2 3.95Å; Y489-I519 HydrophobicContact CE2-CG2 3.81Å; Y489-I519 HydrophobicContact CG-CD1 4.43Å; F491-I519 HydrophobicContact CE2-CD1 4.08Å; F491-I519 HydrophobicContact CZ-CD1 4.32Å; F491-I519 HydrophobicContact CZ-CG1 4.39Å; I517-I519 HydrophobicContact CG2-CG1 4.5Å; I519-D521 PolarHBondContact O-N 2.98Å; I519-K522 PolarHBondContact N-O 2.93Å; I519-K522 PolarHBondContact O-N 3Å; I519-K522 VanDerWaalsContact O-N 3.07Å; I519-V524 HydrophobicContact CD1-CG2 4.29Å; I519-V524 HydrophobicContact CG1-CG2 4.42Å
520	G	90.9	Very high	94.3	Very high	11 Å²	11	37.7 Å²	37.7	11%	0.113	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.5	-122.9	-165.5	0	0	0	0	0	109.8	S393	S393-G520 PolarHBondContact O-N 2.86Å
521	D	88.4	Confident	94	Very high	133 Å²	133	44.1 Å²	44.1	71%	0.711	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.6	8.8	177.5	-56.4	-41	0	0	0	112.8	I519	I519-D521 PolarHBondContact O-N 2.98Å
522	K	92.6	Very high	93.7	Very high	127 Å²	127	46.1 Å²	46.1	55%	0.552	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.6	118.8	-176.8	-68	176.3	-178.3	164.5	0	111.6	N386 T518 I519	N386-K522 PolarHBondContact OD1-NZ 3.48Å; T518-K522 WeakPolarHBondContact CA-O 3.45Å; T518-K522 WeakPolarHBondContact CG2-O 3.39Å; I519-K522 PolarHBondContact N-O 2.93Å; I519-K522 PolarHBondContact O-N 3Å; I519-K522 VanDerWaalsContact O-N 3.07Å
523	A	94.3	Very high	93.5	Very high	85 Å²	85	49.9 Å²	49.9	70%	0.702	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.5	135.7	169.2	0	0	0	0	0	110.4
524	V	95.1	Very high	93.4	Very high	25 Å²	25	51.8 Å²	51.8	15%	0.152	30%	0.304	C	S	.	.			trans	-92.6	128.6	179.4	174.8	0	0	0	0	108.9	L383 I517 I519 P526 L534	L383-V524 HydrophobicContact CD1-CG1 3.88Å; L383-V524 HydrophobicContact CD1-CG2 4.09Å; L383-V524 HydrophobicContact CD2-CG1 3.88Å; I517-V524 HydrophobicContact CB-CB 4.15Å; I517-V524 HydrophobicContact CB-CG2 4.47Å; I517-V524 HydrophobicContact CG2-CB 4.31Å; I517-V524 HydrophobicContact CG2-CG2 4.1Å; I517-V524 WeakPolarHBondContact O-CB 3.42Å; I517-V524 PolarHBondContact O-N 2.75Å; I519-V524 HydrophobicContact CD1-CG2 4.29Å; I519-V524 HydrophobicContact CG1-CG2 4.42Å; V524-P526 WeakPolarHBondContact O-CD 3.13Å; V524-L534 HydrophobicContact CG1-CD2 3.97Å
525	D	94.2	Very high	93.2	Very high	66 Å²	66	53.8 Å²	53.8	35%	0.353	32%	0.324	S	S	.	.			trans	-94.8	108.4	167.5	-177	-1.6	0	0	0	109.8	I527 L528	D525-I527 PolarHBondContact O-N 3.16Å; D525-I527 VanDerWaalsContact O-N 3.12Å; D525-I527 VanDerWaalsContact OD1-CB 3.26Å; D525-I527 WeakPolarHBondContact OD1-CB 3.48Å; D525-I527 VanDerWaalsContact OD1-CG1 3.32Å; D525-I527 WeakPolarHBondContact OD1-CG1 3.31Å; D525-I527 PolarHBondContact OD1-N 2.85Å; D525-L528 HydrophobicContact CB-CD1 4.23Å; D525-L528 HydrophobicContact CB-CG 4.18Å; D525-L528 PolarHBondContact O-N 2.8Å
526	P	94.8	Very high	93.1	Very high	11 Å²	11	54.9 Å²	54.9	7%	0.071	34%	0.337	C	S	.	.	H	α-helix	trans	-62.5	-17.3	178.4	-22.1	35	0	0	0	114	V370 V372 V524 L528 V529 Q530 I542	V370-P526 HydrophobicContact CB-CG 4.23Å; V370-P526 HydrophobicContact CG1-CB 3.88Å; V370-P526 HydrophobicContact CG1-CG 4.09Å; V372-P526 HydrophobicContact CG2-CB 3.6Å; V372-P526 HydrophobicContact CG2-CG 3.85Å; V524-P526 WeakPolarHBondContact O-CD 3.13Å; P526-L528 VanDerWaalsContact C-N 3.34Å; P526-V529 VanDerWaalsContact O-CB 3.3Å; P526-V529 WeakPolarHBondContact O-CB 3.36Å; P526-V529 PolarHBondContact O-N 3.42Å; P526-Q530 PolarHBondContact O-N 3.33Å; P526-I542 HydrophobicContact CB-CG2 3.9Å; P526-I542 WeakPolarHBondContact O-CG2 3.22Å
527	I	92.3	Very high	93	Very high	10 Å²	10	52.7 Å²	52.7	5%	0.051	32%	0.324	C	S	.	.	H	α-helix	trans	-68.9	-36.2	177.5	-57.6	-60.1	0	0	0	111.1	V370 D525 V529 Q530 Q531 I542 D543	V370-I527 HydrophobicContact CG1-CD1 3.57Å; V370-I527 HydrophobicContact CG1-CG1 3.98Å; V370-I527 HydrophobicContact CG2-CD1 4.14Å; V370-I527 HydrophobicContact CG2-CG1 3.92Å; D525-I527 PolarHBondContact O-N 3.16Å; D525-I527 VanDerWaalsContact O-N 3.12Å; D525-I527 VanDerWaalsContact OD1-CB 3.26Å; D525-I527 WeakPolarHBondContact OD1-CB 3.48Å; D525-I527 VanDerWaalsContact OD1-CG1 3.32Å; D525-I527 WeakPolarHBondContact OD1-CG1 3.31Å; D525-I527 PolarHBondContact OD1-N 2.85Å; I527-V529 PolarHBondContact O-N 2.63Å; I527-Q530 WeakPolarHBondContact O-CB 3.44Å; I527-Q530 PolarHBondContact O-N 3.3Å; I527-Q531 WeakPolarHBondContact O-CG 3.46Å; I527-Q531 PolarHBondContact O-N 2.85Å; I527-I542 HydrophobicContact CD1-CG2 4.38Å; I527-D543 HydrophobicContact CD1-CB 3.99Å
528	L	93.9	Very high	92.7	Very high	70 Å²	70	57.5 Å²	57.5	37%	0.366	34%	0.342	S	S	.	.	H	α-helix	trans	-64.4	-31.5	172.8	-62.3	179.9	0	0	0	111.4	D525 P526 Q531 G532 A533 L534	D525-L528 HydrophobicContact CB-CD1 4.23Å; D525-L528 HydrophobicContact CB-CG 4.18Å; D525-L528 PolarHBondContact O-N 2.8Å; P526-L528 VanDerWaalsContact C-N 3.34Å; L528-Q531 PolarHBondContact O-N 2.77Å; L528-G532 PolarHBondContact O-N 2.97Å; L528-A533 HydrophobicContact CB-CB 4.45Å; L528-A533 PolarHBondContact O-N 2.82Å; L528-L534 HydrophobicContact CB-CB 3.8Å; L528-L534 HydrophobicContact CB-CD2 4.42Å; L528-L534 PolarHBondContact O-N 2.79Å
529	V	93.4	Very high	92.5	Very high	2 Å²	2	56.8 Å²	56.8	1%	0.012	34%	0.337	C	S	.	.	H	α-helix	trans	-66.8	-46	172.8	-177.3	0	0	0	0	110.8	L381 L383 P526 I527 Q531 G532 L534 F537 I542	L381-V529 HydrophobicContact CD1-CG1 3.63Å; L381-V529 HydrophobicContact CD1-CG2 4.24Å; L383-V529 HydrophobicContact CD2-CG2 3.83Å; P526-V529 VanDerWaalsContact O-CB 3.3Å; P526-V529 WeakPolarHBondContact O-CB 3.36Å; P526-V529 PolarHBondContact O-N 3.42Å; I527-V529 PolarHBondContact O-N 2.63Å; V529-Q531 PolarHBondContact O-N 2.66Å; V529-G532 PolarHBondContact O-N 2.83Å; V529-L534 VanDerWaalsContact CA-O 3.27Å; V529-L534 WeakPolarHBondContact CA-O 3.3Å; V529-L534 HydrophobicContact CG2-CB 4.2Å; V529-L534 HydrophobicContact CG2-CD2 4.17Å; V529-L534 HydrophobicContact CG2-CG 4.23Å; V529-L534 WeakPolarHBondContact CG2-O 3.32Å; V529-F537 HydrophobicContact CG1-CB 4.44Å; V529-F537 HydrophobicContact CG1-CD1 3.65Å; V529-F537 HydrophobicContact CG1-CE1 4.32Å; V529-F537 HydrophobicContact CG1-CG 4.37Å; V529-I542 HydrophobicContact CB-CD1 4.26Å; V529-I542 HydrophobicContact CG1-CD1 4.09Å
530	Q	90	Very high	92.4	Very high	52 Å²	52	56.7 Å²	56.7	24%	0.243	34%	0.336	C	S	.	.	H	α-helix	trans	-60.5	-33.2	177.2	-169.1	178.2	2.8	0	0	112.3	P526 I527 G532 I542	P526-Q530 PolarHBondContact O-N 3.33Å; I527-Q530 WeakPolarHBondContact O-CB 3.44Å; I527-Q530 PolarHBondContact O-N 3.3Å; Q530-G532 VanDerWaalsContact C-N 3.28Å; Q530-I542 HydrophobicContact CB-CB 4.3Å; Q530-I542 HydrophobicContact CB-CD1 3.75Å; Q530-I542 HydrophobicContact CB-CG2 4.09Å; Q530-I542 HydrophobicContact CG-CB 4.48Å; Q530-I542 HydrophobicContact CG-CD1 4.36Å
531	Q	88.9	Confident	92.5	Very high	136 Å²	136	57.9 Å²	57.9	64%	0.636	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-6	176.7	-68.4	171.7	-4.4	0	0	113.6	I527 L528 V529 A533	I527-Q531 WeakPolarHBondContact O-CG 3.46Å; I527-Q531 PolarHBondContact O-N 2.85Å; L528-Q531 PolarHBondContact O-N 2.77Å; V529-Q531 PolarHBondContact O-N 2.66Å; Q531-A533 PolarHBondContact O-N 2.98Å
532	G	88.7	Confident	92.8	Very high	62 Å²	62	52.2 Å²	52.2	64%	0.639	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.4	11.8	-176.5	0	0	0	0	0	114.3	L528 V529 Q530	L528-G532 PolarHBondContact O-N 2.97Å; V529-G532 PolarHBondContact O-N 2.83Å; Q530-G532 VanDerWaalsContact C-N 3.28Å
533	A	93.3	Very high	92.8	Very high	79 Å²	79	46.1 Å²	46.1	65%	0.653	28%	0.282	S	S	*	.	S	Bend	trans	-84.6	-19	177.6	0	0	0	0	0	112.8	L528 Q531	L528-A533 HydrophobicContact CB-CB 4.45Å; L528-A533 PolarHBondContact O-N 2.82Å; Q531-A533 PolarHBondContact O-N 2.98Å
534	L	94.5	Very high	92.8	Very high	40 Å²	40	42.2 Å²	42.2	21%	0.209	25%	0.25	C	C	.	.	S	Bend	trans	-136.1	123.7	-178.7	-178.1	64.9	0	0	0	111.5	L383 P384 V524 L528 V529	L383-L534 HydrophobicContact CD2-CD2 4.22Å; L383-L534 HydrophobicContact CD2-CG 4.15Å; P384-L534 HydrophobicContact CG-CD1 3.57Å; V524-L534 HydrophobicContact CG1-CD2 3.97Å; L528-L534 HydrophobicContact CB-CB 3.8Å; L528-L534 HydrophobicContact CB-CD2 4.42Å; L528-L534 PolarHBondContact O-N 2.79Å; V529-L534 VanDerWaalsContact CA-O 3.27Å; V529-L534 WeakPolarHBondContact CA-O 3.3Å; V529-L534 HydrophobicContact CG2-CB 4.2Å; V529-L534 HydrophobicContact CG2-CD2 4.17Å; V529-L534 HydrophobicContact CG2-CG 4.23Å; V529-L534 WeakPolarHBondContact CG2-O 3.32Å
535	G	93.6	Very high	92.7	Very high	41 Å²	41	42.2 Å²	42.2	42%	0.423	25%	0.25	S	S	.	.			trans	62.6	-161	172.4	0	0	0	0	0	114.3	A382	A382-G535 CarbonylContact O-C 3.52Å; A382-G535 WeakPolarHBondContact O-CA 3.02Å
536	S	93	Very high	92.4	Very high	60 Å²	60	39.8 Å²	39.8	42%	0.42	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	159.9	175	66.9	0	0	0	0	110.9	A382	A382-S536 PolarHBondContact N-O 3.03Å; A382-S536 PolarHBondContact O-N 2.77Å
537	F	93.9	Very high	92.3	Very high	48 Å²	48	39.9 Å²	39.9	21%	0.211	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	163.3	-177.8	69.5	-85.6	0	0	0	113.2	Y78 Y380 L381 V529 L540 I542	Y78-F537 AromaticContact CD1-CE2 3.84Å; Y78-F537 HydrophobicContact CD1-CE2 3.84Å; Y78-F537 HydrophobicContact CD1-CZ 4.21Å; Y78-F537 HydrophobicContact CE1-CD2 4.45Å; Y78-F537 AromaticContact CE1-CE2 3.56Å; Y78-F537 HydrophobicContact CE1-CE2 3.56Å; Y78-F537 HydrophobicContact CE1-CZ 4.33Å; Y78-F537 HydrophobicContact CG-CE2 4.42Å; Y78-F537 HydrophobicContact CG-CZ 4.42Å; Y78-F537 AromaticContact CZ-CE2 3.91Å; Y380-F537 VanDerWaalsContact O-CA 3.29Å; Y380-F537 WeakPolarHBondContact O-CA 3.49Å; Y380-F537 WeakPolarHBondContact O-CB 3.01Å; L381-F537 HydrophobicContact CD1-CB 4.25Å; V529-F537 HydrophobicContact CG1-CB 4.44Å; V529-F537 HydrophobicContact CG1-CD1 3.65Å; V529-F537 HydrophobicContact CG1-CE1 4.32Å; V529-F537 HydrophobicContact CG1-CG 4.37Å; F537-L540 HydrophobicContact CB-CD1 3.47Å; F537-L540 VanDerWaalsContact CB-CD1 3.47Å; F537-L540 HydrophobicContact CB-CG 4.01Å; F537-L540 HydrophobicContact CD2-CB 3.87Å; F537-L540 HydrophobicContact CD2-CD1 4.18Å; F537-L540 HydrophobicContact CD2-CG 4.03Å; F537-L540 HydrophobicContact CE2-CB 4.5Å; F537-L540 HydrophobicContact CG-CD1 4.11Å; F537-L540 HydrophobicContact CG-CG 4.43Å; F537-I542 HydrophobicContact CD1-CD1 4.41Å; F537-I542 HydrophobicContact CE1-CD1 4.25Å; F537-I542 HydrophobicContact CZ-CD1 4.35Å
538	R	91.4	Very high	92.2	Very high	104 Å²	104	41.6 Å²	41.6	39%	0.392	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	137.3	172.2	178.9	179.9	176.5	165.5	6.7	110.3	S379 Y380 L540	S379-R538 VanDerWaalsContact CA-O 3.3Å; S379-R538 WeakPolarHBondContact CA-O 3.33Å; Y380-R538 HydrophobicContact CD1-CB 3.6Å; Y380-R538 HydrophobicContact CD1-CG 4.5Å; Y380-R538 HydrophobicContact CE1-CB 3.29Å; Y380-R538 HydrophobicContact CE1-CG 4.19Å; Y380-R538 HydrophobicContact CG-CB 4.36Å; Y380-R538 PolarHBondContact N-O 2.8Å; Y380-R538 PolarHBondContact O-N 2.88Å; R538-L540 VanDerWaalsContact C-N 3.26Å; R538-L540 PolarHBondContact O-N 3.01Å
539	D	90.3	Very high	92.1	Very high	21 Å²	21	38.9 Å²	38.9	11%	0.112	24%	0.238	C	C	.	.	S	Bend	trans	51.1	42.6	171.8	-59.8	-31.4	0	0	0	113.6	K77 Y78 L375 S379	K77-D539 IonicContact NZ-OD1 2.64Å; K77-D539 PolarHBondContact NZ-OD1 2.98Å; Y78-D539 PolarHBondContact OH-N 3.13Å; L375-D539 WeakPolarHBondContact CB-O 2.95Å; L375-D539 PolarHBondContact N-O 3.24Å; S379-D539 WeakPolarHBondContact CB-O 3.21Å; S379-D539 VanDerWaalsContact OG-CB 3.3Å; S379-D539 WeakPolarHBondContact OG-CB 3.41Å; S379-D539 PolarHBondContact OG-O 3.3Å
540	L	93.6	Very high	92	Very high	8 Å²	8	41.7 Å²	41.7	4%	0.042	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	149.9	174.6	-55.2	-175.4	0	0	0	111.7	V372 T373 F374 L381 F537 R538 I542	V372-L540 HydrophobicContact CG1-CB 4.17Å; V372-L540 HydrophobicContact CG1-CD1 3.81Å; V372-L540 HydrophobicContact CG1-CD2 4.44Å; V372-L540 HydrophobicContact CG1-CG 4.37Å; T373-L540 WeakPolarHBondContact O-CA 3.41Å; F374-L540 HydrophobicContact CB-CD2 4.33Å; F374-L540 HydrophobicContact CD1-CD2 3.4Å; F374-L540 HydrophobicContact CD2-CD2 4.21Å; F374-L540 HydrophobicContact CE1-CD2 3.55Å; F374-L540 HydrophobicContact CE2-CD2 4.33Å; F374-L540 HydrophobicContact CG-CD2 3.74Å; F374-L540 HydrophobicContact CZ-CD2 4.03Å; L381-L540 HydrophobicContact CB-CD1 3.72Å; L381-L540 HydrophobicContact CD1-CD1 4.22Å; L381-L540 HydrophobicContact CG-CD1 4.41Å; F537-L540 HydrophobicContact CB-CD1 3.47Å; F537-L540 VanDerWaalsContact CB-CD1 3.47Å; F537-L540 HydrophobicContact CB-CG 4.01Å; F537-L540 HydrophobicContact CD2-CB 3.87Å; F537-L540 HydrophobicContact CD2-CD1 4.18Å; F537-L540 HydrophobicContact CD2-CG 4.03Å; F537-L540 HydrophobicContact CE2-CB 4.5Å; F537-L540 HydrophobicContact CG-CD1 4.11Å; F537-L540 HydrophobicContact CG-CG 4.43Å; R538-L540 VanDerWaalsContact C-N 3.26Å; R538-L540 PolarHBondContact O-N 3.01Å; L540-I542 HydrophobicContact CB-CG1 4.45Å
541	Q	93	Very high	92.1	Very high	35 Å²	35	40 Å²	40	16%	0.164	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	107.4	163.8	-162.7	-177.3	-27.6	0	0	108.6	T373 L375 S544	T373-Q541 PolarHBondContact N-O 2.96Å; T373-Q541 PolarHBondContact O-N 2.83Å; L375-Q541 HydrophobicContact CD1-CB 4.34Å; L375-Q541 HydrophobicContact CD2-CB 4.24Å; L375-Q541 HydrophobicContact CG-CB 4.45Å; Q541-S544 WeakPolarHBondContact CG-OG 3.47Å; Q541-S544 PolarHBondContact NE2-OG 3.42Å
542	I	93.5	Very high	92	Very high	14 Å²	14	35.7 Å²	35.7	7%	0.072	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	148.1	-177.8	-62.6	170	0	0	0	109.7	V370 V372 P526 I527 V529 Q530 F537 L540 S544	V370-I542 HydrophobicContact CG1-CG2 4.22Å; V372-I542 HydrophobicContact CG1-CG1 4.2Å; V372-I542 HydrophobicContact CG2-CG1 4.47Å; P526-I542 HydrophobicContact CB-CG2 3.9Å; P526-I542 WeakPolarHBondContact O-CG2 3.22Å; I527-I542 HydrophobicContact CD1-CG2 4.38Å; V529-I542 HydrophobicContact CB-CD1 4.26Å; V529-I542 HydrophobicContact CG1-CD1 4.09Å; Q530-I542 HydrophobicContact CB-CB 4.3Å; Q530-I542 HydrophobicContact CB-CD1 3.75Å; Q530-I542 HydrophobicContact CB-CG2 4.09Å; Q530-I542 HydrophobicContact CG-CB 4.48Å; Q530-I542 HydrophobicContact CG-CD1 4.36Å; F537-I542 HydrophobicContact CD1-CD1 4.41Å; F537-I542 HydrophobicContact CE1-CD1 4.25Å; F537-I542 HydrophobicContact CZ-CD1 4.35Å; L540-I542 HydrophobicContact CB-CG1 4.45Å; I542-S544 VanDerWaalsContact C-N 3.3Å; I542-S544 PolarHBondContact O-N 2.8Å
543	D	93.4	Very high	91.8	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.7	31.6	179.4	-157	17.1	0	0	0	112.6	R118 N119 W120 V370 P371 I527	R118-D543 IonicContact NH1-OD2 3.85Å; N119-D543 CarbonylContact C-O 3.55Å; N119-D543 WeakPolarHBondContact CA-O 3.39Å; N119-D543 PolarHBondContact N-OD1 2.93Å; W120-D543 PolarHBondContact N-O 3.3Å; W120-D543 PolarHBondContact NE1-OD2 3.46Å; V370-D543 HydrophobicContact CG1-CB 3.89Å; P371-D543 VanDerWaalsContact O-CA 3.32Å; P371-D543 WeakPolarHBondContact O-CA 3.27Å; P371-D543 PolarHBondContact O-N 2.78Å; I527-D543 HydrophobicContact CD1-CB 3.99Å
544	S	93.1	Very high	91.5	Very high	3 Å²	3	34.8 Å²	34.8	2%	0.021	20%	0.2	C	C	.	.			trans	-161.5	150.5	173.4	60.3	0	0	0	0	110.5	W120 P371 T373 Q541 I542	W120-S544 WeakPolarHBondContact O-CB 3.35Å; P371-S544 PolarHBondContact O-N 3.38Å; P371-S544 VanDerWaalsContact O-N 3.16Å; T373-S544 PolarHBondContact N-O 3.46Å; T373-S544 PolarHBondContact OG1-O 2.96Å; Q541-S544 WeakPolarHBondContact CG-OG 3.47Å; Q541-S544 PolarHBondContact NE2-OG 3.42Å; I542-S544 VanDerWaalsContact C-N 3.3Å; I542-S544 PolarHBondContact O-N 2.8Å
545	C	93.8	Very high	91.3	Very high	24 Å²	24	37.4 Å²	37.4	16%	0.162	21%	0.208	C	C	.	.			trans	-116.7	102.4	169.5	178.2	0	0	0	0	110.4	P371 T373 R399 W453 C513 I547	P371-C545 HydrophobicContact CB-CB 3.97Å; P371-C545 HydrophobicContact CG-CB 4.2Å; T373-C545 VanDerWaalsContact OG1-CA 3.24Å; T373-C545 WeakPolarHBondContact OG1-CA 3.49Å; R399-C545 PolarHBondContact NE-SG 3.37Å; R399-C545 PolarHBondContact NH2-SG 2.96Å; W453-C545 HydrophobicContact CZ2-CB 4.41Å; C513-C545 HydrophobicContact CB-CB 3.87Å; C513-C545 WeakPolarHBondContact CB-SG 3.48Å; C513-C545 WeakPolarHBondContact SG-CA 3.46Å; C513-C545 WeakPolarHBondContact SG-CB 3.17Å; C513-C545 CovalentContact SG-SG 2.03Å; C513-C545 PolarHBondContact SG-SG 3.49Å; C545-I547 VanDerWaalsContact C-N 3.31Å; C545-I547 PolarHBondContact O-N 2.89Å; C545-I547 VanDerWaalsContact SG-CG2 3.57Å
546	G	89	Confident	91.2	Very high	16 Å²	16	36 Å²	36	17%	0.165	19%	0.191	C	C	.	.			trans	-85.5	15.2	-173.5	0	0	0	0	0	116.1	R124 T373 T548	R124-G546 PolarHBondContact NH2-O 2.71Å; T373-G546 PolarHBondContact OG1-N 3.32Å; G546-T548 PolarHBondContact O-OG1 3.01Å
547	I	91.9	Very high	91.1	Very high	13 Å²	13	36.4 Å²	36.4	7%	0.067	19%	0.187	C	C	.	.			trans	-62.1	143.2	178.4	-165.8	170.5	0	0	0	110.6	L266 R399 W401 C545 W566	L266-I547 HydrophobicContact CD1-CG2 3.96Å; L266-I547 HydrophobicContact CD2-CG2 4.29Å; R399-I547 HydrophobicContact CG-CD1 4.2Å; W401-I547 HydrophobicContact CG-CD1 4.35Å; C545-I547 VanDerWaalsContact C-N 3.31Å; C545-I547 PolarHBondContact O-N 2.89Å; C545-I547 VanDerWaalsContact SG-CG2 3.57Å; I547-W566 HydrophobicContact CB-CZ3 3.9Å; I547-W566 HydrophobicContact CG1-CE3 4.45Å; I547-W566 HydrophobicContact CG1-CZ3 4Å
548	T	90.9	Very high	90.9	Very high	46 Å²	46	36.5 Å²	36.5	28%	0.282	19%	0.188	S	C	.	.			trans	-135.4	135.6	-177	-53.8	0	0	0	0	108.7	R124 W401 G546	R124-T548 PolarHBondContact NH1-OG1 2.89Å; W401-T548 VanDerWaalsContact CD1-O 3.31Å; W401-T548 PolarHBondContact NE1-O 3.31Å; G546-T548 PolarHBondContact O-OG1 3.01Å
549	D	91.6	Very high	90.8	Very high	12 Å²	12	35.1 Å²	35.1	6%	0.064	21%	0.206	C	C	.	.			trans	-87.8	116.7	171.6	-166.7	-24.7	0	0	0	108.1	S265 L266 W401 C551 L552 Q564	S265-D549 VanDerWaalsContact CB-OD2 3.31Å; S265-D549 WeakPolarHBondContact CB-OD2 3.42Å; S265-D549 WeakPolarHBondContact OG-CB 3.08Å; L266-D549 HydrophobicContact CD1-CB 4.02Å; L266-D549 HydrophobicContact CG-CB 4.4Å; W401-D549 HydrophobicContact CZ2-CB 3.84Å; D549-C551 PolarHBondContact OD1-N 3.2Å; D549-L552 PolarHBondContact OD1-N 3.47Å; D549-Q564 PolarHBondContact OD1-NE2 2.97Å
550	R	90.8	Very high	90.9	Very high	61 Å²	61	34.6 Å²	34.6	23%	0.23	21%	0.205	C	C	.	.	S	Bend	trans	-94.1	-4.9	178.9	-66.4	176.6	174.2	78.6	-8.7	112.8	W566 D567 F569	R550-W566 PolarHBondContact NH1-O 3.28Å; R550-W566 PolarHBondContact NH2-O 3.34Å; R550-D567 PolarHBondContact NH2-O 3.43Å; R550-F569 HydrophobicContact CB-CB 3.91Å; R550-F569 HydrophobicContact CB-CD1 4.1Å; R550-F569 HydrophobicContact CB-CG 4.3Å
551	C	91.5	Very high	90.9	Very high	17 Å²	17	41 Å²	41	12%	0.115	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-1.6	177.3	-71.4	0	0	0	0	112.8	D549 P553 S554 C562	D549-C551 PolarHBondContact OD1-N 3.2Å; C551-P553 CarbonylContact C-O 3.5Å; C551-P553 CarbonylContact O-C 3.51Å; C551-S554 WeakPolarHBondContact O-CA 3.1Å; C551-S554 WeakPolarHBondContact O-CB 3.38Å; C551-S554 PolarHBondContact O-N 3.5Å; C551-S554 VanDerWaalsContact O-N 3.15Å; C551-C562 WeakPolarHBondContact CA-SG 3.21Å; C551-C562 HydrophobicContact CB-CB 3.66Å; C551-C562 WeakPolarHBondContact CB-SG 3.39Å; C551-C562 VanDerWaalsContact SG-C 3.52Å; C551-C562 WeakPolarHBondContact SG-CB 3.46Å; C551-C562 CovalentContact SG-SG 2.04Å; C551-C562 PolarHBondContact SG-SG 3.14Å
552	L	87.6	Confident	91	Very high	46 Å²	46	40.8 Å²	40.8	24%	0.241	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-137.1	110.9	177.9	-72.7	175.6	0	0	0	111.4	K240 D549	K240-L552 HydrophobicContact CD-CD1 3.62Å; K240-L552 VanDerWaalsContact CE-CD1 3.47Å; K240-L552 HydrophobicContact CG-CD1 4.29Å; D549-L552 PolarHBondContact OD1-N 3.47Å
553	P	84.4	Confident	91.1	Very high	65 Å²	65	42.3 Å²	42.3	42%	0.422	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	cis	-62.5	147.2	-6.3	29.1	-34.9	0	0	0	111.5	C551 Y555	C551-P553 CarbonylContact C-O 3.5Å; C551-P553 CarbonylContact O-C 3.51Å; P553-Y555 PolarHBondContact O-N 2.95Å
554	S	86.6	Confident	91.1	Very high	56 Å²	56	43.8 Å²	43.8	39%	0.392	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	127.2	-179.8	179.4	0	0	0	0	109.8	C551 C556	C551-S554 WeakPolarHBondContact O-CA 3.1Å; C551-S554 WeakPolarHBondContact O-CB 3.38Å; C551-S554 PolarHBondContact O-N 3.5Å; C551-S554 VanDerWaalsContact O-N 3.15Å; S554-C556 VanDerWaalsContact C-N 3.26Å; S554-C556 WeakPolarHBondContact OG-CB 3.41Å; S554-C556 PolarHBondContact OG-N 2.82Å; S554-C556 VanDerWaalsContact OG-N 3.1Å; S554-C556 PolarHBondContact OG-O 2.96Å
555	Y	89.4	Confident	91.2	Very high	95 Å²	95	45.1 Å²	45.1	37%	0.373	27%	0.265	S	S	.	.			trans	-80.9	-8.2	167.9	-60.1	-82.7	0	0	0	112.5	E127 P553 E557 F569 T582	E127-Y555 PolarHBondContact OE1-OH 3.41Å; E127-Y555 VanDerWaalsContact OE1-OH 3.11Å; P553-Y555 PolarHBondContact O-N 2.95Å; Y555-E557 PolarHBondContact O-N 3.13Å; Y555-F569 HydrophobicContact CD2-CE1 4Å; Y555-F569 HydrophobicContact CD2-CE2 4.37Å; Y555-F569 AromaticContact CD2-CZ 3.88Å; Y555-F569 HydrophobicContact CD2-CZ 3.88Å; Y555-F569 HydrophobicContact CG-CE1 4.48Å; Y555-F569 HydrophobicContact CG-CE2 4.46Å; Y555-F569 AromaticContact CG-CZ 3.97Å; Y555-F569 HydrophobicContact CG-CZ 3.97Å; Y555-T582 WeakPolarHBondContact O-CB 3.43Å
556	C	93.1	Very high	91.1	Very high	11 Å²	11	45.2 Å²	45.2	7%	0.074	26%	0.262	C	S	.	.			trans	-75.9	111.3	174	-50.2	0	0	0	0	109.1	S554 G560 C562 C571	S554-C556 VanDerWaalsContact C-N 3.26Å; S554-C556 WeakPolarHBondContact OG-CB 3.41Å; S554-C556 PolarHBondContact OG-N 2.82Å; S554-C556 VanDerWaalsContact OG-N 3.1Å; S554-C556 PolarHBondContact OG-O 2.96Å; C556-G560 WeakPolarHBondContact CB-O 3.32Å; C556-C562 HydrophobicContact CB-CB 4.48Å; C556-C562 WeakPolarHBondContact SG-CB 3.37Å; C556-C571 WeakPolarHBondContact CA-SG 3.36Å; C556-C571 HydrophobicContact CB-CB 3.7Å; C556-C571 WeakPolarHBondContact CB-SG 3.34Å; C556-C571 WeakPolarHBondContact SG-CA 3.44Å; C556-C571 WeakPolarHBondContact SG-CB 3.41Å; C556-C571 CovalentContact SG-SG 2.02Å; C556-C571 PolarHBondContact SG-SG 2.86Å
557	E	91.4	Very high	91.1	Very high	70 Å²	70	49.3 Å²	49.3	33%	0.327	28%	0.28	S	S	.	.			trans	-80.4	169.5	179.7	-62.5	179	-159.8	0	0	111.4	Y555 G559 G560 T582 H584	Y555-E557 PolarHBondContact O-N 3.13Å; E557-G559 PolarHBondContact O-N 2.86Å; E557-G560 PolarHBondContact O-N 3.17Å; E557-T582 PolarHBondContact N-O 3.37Å; E557-H584 VanDerWaalsContact CD-ND1 3.34Å; E557-H584 IonicContact OE1-CG 3.52Å; E557-H584 IonicContact OE1-ND1 3.91Å; E557-H584 PolarHBondContact OE1-ND1 2.78Å; E557-H584 IonicContact OE2-CE1 3.84Å; E557-H584 IonicContact OE2-CG 3.36Å; E557-H584 IonicContact OE2-ND1 3.89Å; E557-H584 PolarHBondContact OE2-ND1 2.8Å
558	H	89.6	Confident	91.1	Very high	50 Å²	50	52.8 Å²	52.8	23%	0.231	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.2	30.5	172.6	-47.1	101.9	0	0	0	115.4	Y578 C583 G613	H558-Y578 HydrophobicContact CB-CD2 3.39Å; H558-Y578 HydrophobicContact CB-CE2 3.54Å; H558-Y578 HydrophobicContact CB-CG 3.98Å; H558-Y578 AromaticContact CD2-CE1 3.83Å; H558-Y578 AromaticContact CD2-CE2 3.73Å; H558-Y578 AromaticContact CD2-CZ 3.51Å; H558-Y578 AromaticContact CE1-CD1 3.76Å; H558-Y578 AromaticContact CE1-CE1 3.68Å; H558-Y578 AromaticContact CG-CD1 3.88Å; H558-Y578 AromaticContact CG-CD2 3.53Å; H558-Y578 AromaticContact CG-CE1 3.82Å; H558-Y578 AromaticContact CG-CE2 3.47Å; H558-Y578 VanDerWaalsContact CG-CE2 3.47Å; H558-Y578 AromaticContact CG-CG 3.77Å; H558-Y578 AromaticContact CG-CZ 3.63Å; H558-Y578 AromaticContact ND1-CD1 3.47Å; H558-Y578 WeakPolarHBondContact ND1-CD1 3.3Å; H558-Y578 AromaticContact ND1-CD2 3.89Å; H558-Y578 AromaticContact ND1-CE1 3.71Å; H558-Y578 AromaticContact ND1-CG 3.6Å; H558-Y578 AromaticContact NE2-CE1 3.78Å; H558-Y578 AromaticContact NE2-CZ 3.91Å; H558-C583 PolarHBondContact ND1-O 2.59Å; H558-G613 PolarHBondContact NE2-O 3.38Å
559	G	88	Confident	91.2	Very high	75 Å²	75	53.3 Å²	53.3	77%	0.773	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	79	15.2	177.5	0	0	0	0	0	115.1	E557	E557-G559 PolarHBondContact O-N 2.86Å
560	G	92.3	Very high	91.4	Very high	9 Å²	9	55.5 Å²	55.5	9%	0.093	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-60	142.7	173.9	0	0	0	0	0	112.9	C556 E557 C562 D572	C556-G560 WeakPolarHBondContact CB-O 3.32Å; E557-G560 PolarHBondContact O-N 3.17Å; G560-C562 PolarHBondContact O-N 3.42Å; G560-D572 CarbonylContact C-O 3.51Å; G560-D572 VanDerWaalsContact CA-O 3.25Å; G560-D572 WeakPolarHBondContact CA-O 3.5Å
561	E	95.1	Very high	91.7	Very high	144 Å²	144	53.8 Å²	53.8	67%	0.673	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.6	118.5	-178.9	-171.3	178.7	166.6	0	0	110.5	D572	E561-D572 HydrophobicContact CB-CB 4.24Å; E561-D572 PolarHBondContact N-O 3.17Å; E561-D572 PolarHBondContact O-N 3.01Å
562	C	95.1	Very high	92	Very high	30 Å²	30	56.4 Å²	56.4	20%	0.203	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	131.4	178.3	-171.3	0	0	0	0	111.9	C551 C556 G560	C551-C562 WeakPolarHBondContact CA-SG 3.21Å; C551-C562 HydrophobicContact CB-CB 3.66Å; C551-C562 WeakPolarHBondContact CB-SG 3.39Å; C551-C562 VanDerWaalsContact SG-C 3.52Å; C551-C562 WeakPolarHBondContact SG-CB 3.46Å; C551-C562 CovalentContact SG-SG 2.04Å; C551-C562 PolarHBondContact SG-SG 3.14Å; C556-C562 HydrophobicContact CB-CB 4.48Å; C556-C562 WeakPolarHBondContact SG-CB 3.37Å; G560-C562 PolarHBondContact O-N 3.42Å
563	S	94.4	Very high	92.4	Very high	45 Å²	45	55.2 Å²	55.2	32%	0.315	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	152.6	168.4	55.2	0	0	0	0	110.3	F569 S570	S563-F569 CarbonylContact O-C 3.54Å; S563-F569 VanDerWaalsContact O-CA 3.25Å; S563-F569 WeakPolarHBondContact O-CA 3.19Å; S563-F569 WeakPolarHBondContact O-CB 3.35Å; S563-S570 PolarHBondContact N-O 3.02Å; S563-S570 PolarHBondContact O-N 3.43Å; S563-S570 PolarHBondContact OG-O 3.11Å; S563-S570 PolarHBondContact OG-OG 3.43Å
564	Q	94.5	Very high	92.9	Very high	32 Å²	32	59.1 Å²	59.1	15%	0.15	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	166.2	-175.4	68.6	-178.8	-48.2	0	0	114.4	W401 D549 F569	W401-Q564 HydrophobicContact CB-CG 4.21Å; W401-Q564 HydrophobicContact CD2-CG 3.94Å; W401-Q564 HydrophobicContact CE3-CG 4.01Å; W401-Q564 HydrophobicContact CG-CG 4.03Å; D549-Q564 PolarHBondContact OD1-NE2 2.97Å; Q564-F569 HydrophobicContact CB-CB 4.06Å
565	S	93.4	Very high	93	Very high	31 Å²	31	60.7 Å²	60.7	22%	0.217	36%	0.364	C	S	.	.			trans	-135.1	-178.1	173	64.3	0	0	0	0	109.5	N402 D567 T568	N402-S565 WeakPolarHBondContact OD1-CB 3.37Å; S565-D567 VanDerWaalsContact C-N 3.26Å; S565-D567 PolarHBondContact O-N 2.97Å; S565-T568 PolarHBondContact N-O 3.42Å; S565-T568 WeakPolarHBondContact OG-CG2 3.46Å; S565-T568 PolarHBondContact OG-N 3.02Å; S565-T568 VanDerWaalsContact OG-N 3.13Å; S565-T568 PolarHBondContact OG-O 2.98Å
566	W	91.8	Very high	93.2	Very high	25 Å²	25	57.4 Å²	57.4	10%	0.095	35%	0.354	C	S	.	.	S	Bend	trans	-59.3	-36.1	175.7	-178.9	-95	0	0	0	113.1	T373 L375 N402 Q511 I547 R550	T373-W566 HydrophobicContact CG2-CH2 3.52Å; T373-W566 HydrophobicContact CG2-CZ2 3.88Å; L375-W566 PolarHBondContact O-NE1 3.12Å; N402-W566 WeakPolarHBondContact OD1-CB 3.24Å; N402-W566 PolarHBondContact OD1-N 3.49Å; Q511-W566 HydrophobicContact CB-CB 3.89Å; Q511-W566 HydrophobicContact CB-CD2 3.78Å; Q511-W566 HydrophobicContact CB-CE3 4.36Å; Q511-W566 HydrophobicContact CB-CG 3.52Å; Q511-W566 HydrophobicContact CG-CG 4.23Å; I547-W566 HydrophobicContact CB-CZ3 3.9Å; I547-W566 HydrophobicContact CG1-CE3 4.45Å; I547-W566 HydrophobicContact CG1-CZ3 4Å; R550-W566 PolarHBondContact NH1-O 3.28Å; R550-W566 PolarHBondContact NH2-O 3.34Å
567	D	89.5	Confident	93.1	Very high	103 Å²	103	57.3 Å²	57.3	55%	0.551	36%	0.355	S	S	*	.	S	Bend	trans	-101.4	-35	-171.5	-67	-53.7	0	0	0	113	Q511 R550 S565	Q511-D567 PolarHBondContact NE2-OD2 3.32Å; R550-D567 PolarHBondContact NH2-O 3.43Å; S565-D567 VanDerWaalsContact C-N 3.26Å; S565-D567 PolarHBondContact O-N 2.97Å
568	T	92.1	Very high	93.3	Very high	85 Å²	85	54.2 Å²	54.2	52%	0.521	34%	0.34	S	S	.	.			trans	-142.4	164.9	-173.3	-164.4	0	0	0	0	113.5	S565	S565-T568 PolarHBondContact N-O 3.42Å; S565-T568 WeakPolarHBondContact OG-CG2 3.46Å; S565-T568 PolarHBondContact OG-N 3.02Å; S565-T568 VanDerWaalsContact OG-N 3.13Å; S565-T568 PolarHBondContact OG-O 2.98Å
569	F	94.1	Very high	93.6	Very high	57 Å²	57	55.3 Å²	55.3	25%	0.25	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	167.7	163.5	74	-82.8	0	0	0	110.8	R550 Y555 S563 Q564 T582	R550-F569 HydrophobicContact CB-CB 3.91Å; R550-F569 HydrophobicContact CB-CD1 4.1Å; R550-F569 HydrophobicContact CB-CG 4.3Å; Y555-F569 HydrophobicContact CD2-CE1 4Å; Y555-F569 HydrophobicContact CD2-CE2 4.37Å; Y555-F569 AromaticContact CD2-CZ 3.88Å; Y555-F569 HydrophobicContact CD2-CZ 3.88Å; Y555-F569 HydrophobicContact CG-CE1 4.48Å; Y555-F569 HydrophobicContact CG-CE2 4.46Å; Y555-F569 AromaticContact CG-CZ 3.97Å; Y555-F569 HydrophobicContact CG-CZ 3.97Å; S563-F569 CarbonylContact O-C 3.54Å; S563-F569 VanDerWaalsContact O-CA 3.25Å; S563-F569 WeakPolarHBondContact O-CA 3.19Å; S563-F569 WeakPolarHBondContact O-CB 3.35Å; Q564-F569 HydrophobicContact CB-CB 4.06Å; F569-T582 HydrophobicContact CZ-CG2 4.47Å
570	S	95.4	Very high	93.8	Very high	59 Å²	59	53.5 Å²	53.5	41%	0.413	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	142.9	175.8	46.6	0	0	0	0	110.3	S563	S563-S570 PolarHBondContact N-O 3.02Å; S563-S570 PolarHBondContact O-N 3.43Å; S563-S570 PolarHBondContact OG-O 3.11Å; S563-S570 PolarHBondContact OG-OG 3.43Å
571	C	96.8	Very high	93.9	Very high	24 Å²	24	61 Å²	61	16%	0.162	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	130.7	178.1	-58.4	0	0	0	0	111	C556 E581	C556-C571 WeakPolarHBondContact CA-SG 3.36Å; C556-C571 HydrophobicContact CB-CB 3.7Å; C556-C571 WeakPolarHBondContact CB-SG 3.34Å; C556-C571 WeakPolarHBondContact SG-CA 3.44Å; C556-C571 WeakPolarHBondContact SG-CB 3.41Å; C556-C571 CovalentContact SG-SG 2.02Å; C556-C571 PolarHBondContact SG-SG 2.86Å; C571-E581 WeakPolarHBondContact CB-O 3.42Å; C571-E581 PolarHBondContact SG-O 2.82Å; C571-E581 VanDerWaalsContact SG-O 3.4Å
572	D	96.9	Very high	93.9	Very high	72 Å²	72	56.3 Å²	56.3	39%	0.385	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	110.1	165	-169.7	-7.9	0	0	0	109.3	G560 E561 L574	G560-D572 CarbonylContact C-O 3.51Å; G560-D572 VanDerWaalsContact CA-O 3.25Å; G560-D572 WeakPolarHBondContact CA-O 3.5Å; E561-D572 HydrophobicContact CB-CB 4.24Å; E561-D572 PolarHBondContact N-O 3.17Å; E561-D572 PolarHBondContact O-N 3.01Å; D572-L574 VanDerWaalsContact OD1-CB 3.22Å; D572-L574 WeakPolarHBondContact OD1-CB 3.38Å; D572-L574 WeakPolarHBondContact OD1-CG 3.17Å; D572-L574 PolarHBondContact OD1-N 2.89Å
573	C	95.8	Very high	93.9	Very high	21 Å²	21	54.9 Å²	54.9	14%	0.142	34%	0.336	C	S	.	.			trans	-94.4	5.5	179.4	-47.5	0	0	0	0	112.9	G575 T576 Y578 G580 C583	C573-G575 PolarHBondContact O-N 3.47Å; C573-T576 PolarHBondContact O-N 2.88Å; C573-T576 PolarHBondContact O-OG1 2.77Å; C573-Y578 WeakPolarHBondContact CB-O 3.18Å; C573-G580 PolarHBondContact SG-O 2.86Å; C573-C583 WeakPolarHBondContact CA-SG 3.43Å; C573-C583 HydrophobicContact CB-CB 3.83Å; C573-C583 WeakPolarHBondContact CB-SG 3.37Å; C573-C583 WeakPolarHBondContact SG-CA 3.38Å; C573-C583 WeakPolarHBondContact SG-CB 3.36Å; C573-C583 PolarHBondContact SG-N 2.93Å; C573-C583 CovalentContact SG-SG 2.04Å; C573-C583 PolarHBondContact SG-SG 3.43Å
574	L	95.1	Very high	93.9	Very high	148 Å²	148	56.6 Å²	56.6	78%	0.775	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	129.6	-179.8	-68.2	173.5	0	0	0	110.8	D572 T576	D572-L574 VanDerWaalsContact OD1-CB 3.22Å; D572-L574 WeakPolarHBondContact OD1-CB 3.38Å; D572-L574 WeakPolarHBondContact OD1-CG 3.17Å; D572-L574 PolarHBondContact OD1-N 2.89Å; L574-T576 VanDerWaalsContact C-N 3.26Å; L574-T576 PolarHBondContact O-N 2.87Å
575	G	90.1	Very high	93.8	Very high	89 Å²	89	57.8 Å²	57.8	92%	0.918	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.8	1.5	179.2	0	0	0	0	0	115.3	C573	C573-G575 PolarHBondContact O-N 3.47Å
576	T	91.9	Very high	93.9	Very high	26 Å²	26	57.8 Å²	57.8	16%	0.16	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-24.8	175.9	69	0	0	0	0	112.8	C573 L574 Y578	C573-T576 PolarHBondContact O-N 2.88Å; C573-T576 PolarHBondContact O-OG1 2.77Å; L574-T576 VanDerWaalsContact C-N 3.26Å; L574-T576 PolarHBondContact O-N 2.87Å; T576-Y578 VanDerWaalsContact O-CD2 3.26Å; T576-Y578 WeakPolarHBondContact O-CD2 3.42Å; T576-Y578 PolarHBondContact OG1-N 3.38Å; T576-Y578 VanDerWaalsContact OG1-N 3.16Å
577	G	92.5	Very high	94	Very high	9 Å²	9	61.3 Å²	61.3	9%	0.093	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.6	7.3	-170.1	0	0	0	0	0	113.9	L587	G577-L587 VanDerWaalsContact O-CB 3.29Å; G577-L587 WeakPolarHBondContact O-CB 3.46Å; G577-L587 WeakPolarHBondContact O-CG 3.33Å; G577-L587 PolarHBondContact O-N 2.9Å
578	Y	95.3	Very high	94.2	Very high	5 Å²	5	60 Å²	60	2%	0.02	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	167	-178.1	-61.1	-97.7	0	0	0	112.1	H558 C573 T576 C583 S585 D608 G611 L615	H558-Y578 HydrophobicContact CB-CD2 3.39Å; H558-Y578 HydrophobicContact CB-CE2 3.54Å; H558-Y578 HydrophobicContact CB-CG 3.98Å; H558-Y578 AromaticContact CD2-CE1 3.83Å; H558-Y578 AromaticContact CD2-CE2 3.73Å; H558-Y578 AromaticContact CD2-CZ 3.51Å; H558-Y578 AromaticContact CE1-CD1 3.76Å; H558-Y578 AromaticContact CE1-CE1 3.68Å; H558-Y578 AromaticContact CG-CD1 3.88Å; H558-Y578 AromaticContact CG-CD2 3.53Å; H558-Y578 AromaticContact CG-CE1 3.82Å; H558-Y578 AromaticContact CG-CE2 3.47Å; H558-Y578 VanDerWaalsContact CG-CE2 3.47Å; H558-Y578 AromaticContact CG-CG 3.77Å; H558-Y578 AromaticContact CG-CZ 3.63Å; H558-Y578 AromaticContact ND1-CD1 3.47Å; H558-Y578 WeakPolarHBondContact ND1-CD1 3.3Å; H558-Y578 AromaticContact ND1-CD2 3.89Å; H558-Y578 AromaticContact ND1-CE1 3.71Å; H558-Y578 AromaticContact ND1-CG 3.6Å; H558-Y578 AromaticContact NE2-CE1 3.78Å; H558-Y578 AromaticContact NE2-CZ 3.91Å; C573-Y578 WeakPolarHBondContact CB-O 3.18Å; T576-Y578 VanDerWaalsContact O-CD2 3.26Å; T576-Y578 WeakPolarHBondContact O-CD2 3.42Å; T576-Y578 PolarHBondContact OG1-N 3.38Å; T576-Y578 VanDerWaalsContact OG1-N 3.16Å; Y578-C583 WeakPolarHBondContact CB-O 3.48Å; Y578-S585 CarbonylContact C-O 3.56Å; Y578-S585 VanDerWaalsContact CA-O 3.23Å; Y578-S585 WeakPolarHBondContact CA-O 3.37Å; Y578-S585 WeakPolarHBondContact CB-O 3.49Å; Y578-D608 WeakPolarHBondContact CE1-OD2 3.45Å; Y578-D608 PolarHBondContact OH-OD2 3.33Å; Y578-G611 WeakPolarHBondContact CE1-O 3.15Å; Y578-L615 PolarHBondContact OH-O 3.13Å
579	T	94.8	Very high	94.3	Very high	72 Å²	72	57.6 Å²	57.6	44%	0.442	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	-179.2	-178.9	-163.7	0	0	0	0	111.6	C583 H584 S585 L587	T579-C583 CarbonylContact O-C 3.59Å; T579-C583 WeakPolarHBondContact O-CA 3.28Å; T579-H584 PolarHBondContact O-N 2.85Å; T579-S585 PolarHBondContact N-O 2.86Å; T579-S585 PolarHBondContact O-N 2.81Å; T579-L587 HydrophobicContact CG2-CD2 3.83Å
580	G	93.9	Very high	94.3	Very high	38 Å²	38	60 Å²	60	39%	0.392	35%	0.353	S	S	.	.	S	Bend	trans	88.8	171.4	-170.7	0	0	0	0	0	112.6	C573 T582 C583	C573-G580 PolarHBondContact SG-O 2.86Å; G580-T582 PolarHBondContact O-N 2.87Å; G580-C583 PolarHBondContact O-N 3.46Å
581	E	93.8	Very high	94.3	Very high	166 Å²	166	58.6 Å²	58.6	78%	0.776	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-29.1	-174.5	-63.9	-62.6	143.9	0	0	113.8	C571	C571-E581 WeakPolarHBondContact CB-O 3.42Å; C571-E581 PolarHBondContact SG-O 2.82Å; C571-E581 VanDerWaalsContact SG-O 3.4Å
582	T	94.8	Very high	94.2	Very high	45 Å²	45	57.5 Å²	57.5	28%	0.276	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.5	11.7	-178.1	52.9	0	0	0	0	113.3	Y555 E557 F569 G580 H584	Y555-T582 WeakPolarHBondContact O-CB 3.43Å; E557-T582 PolarHBondContact N-O 3.37Å; F569-T582 HydrophobicContact CZ-CG2 4.47Å; G580-T582 PolarHBondContact O-N 2.87Å; T582-H584 PolarHBondContact O-N 3.23Å
583	C	95.1	Very high	94.1	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	34%	0.343	C	S	.	.	S	Bend	trans	57.8	29.9	-173.8	-42.5	0	0	0	0	113.8	H558 C573 Y578 T579 G580	H558-C583 PolarHBondContact ND1-O 2.59Å; C573-C583 WeakPolarHBondContact CA-SG 3.43Å; C573-C583 HydrophobicContact CB-CB 3.83Å; C573-C583 WeakPolarHBondContact CB-SG 3.37Å; C573-C583 WeakPolarHBondContact SG-CA 3.38Å; C573-C583 WeakPolarHBondContact SG-CB 3.36Å; C573-C583 PolarHBondContact SG-N 2.93Å; C573-C583 CovalentContact SG-SG 2.04Å; C573-C583 PolarHBondContact SG-SG 3.43Å; Y578-C583 WeakPolarHBondContact CB-O 3.48Å; T579-C583 CarbonylContact O-C 3.59Å; T579-C583 WeakPolarHBondContact O-CA 3.28Å; G580-C583 PolarHBondContact O-N 3.46Å
584	H	94.1	Very high	94	Very high	81 Å²	81	59.6 Å²	59.6	38%	0.375	35%	0.346	S	S	.	.			trans	-79.4	-33.3	-178	-179.1	71.2	0	0	0	113.1	E557 T579 T582 S612	E557-H584 VanDerWaalsContact CD-ND1 3.34Å; E557-H584 IonicContact OE1-CG 3.52Å; E557-H584 IonicContact OE1-ND1 3.91Å; E557-H584 PolarHBondContact OE1-ND1 2.78Å; E557-H584 IonicContact OE2-CE1 3.84Å; E557-H584 IonicContact OE2-CG 3.36Å; E557-H584 IonicContact OE2-ND1 3.89Å; E557-H584 PolarHBondContact OE2-ND1 2.8Å; T579-H584 PolarHBondContact O-N 2.85Å; T582-H584 PolarHBondContact O-N 3.23Å; H584-S612 WeakPolarHBondContact CE1-CB 3.32Å; H584-S612 WeakPolarHBondContact NE2-CB 3.37Å; H584-S612 PolarHBondContact NE2-OG 2.73Å; H584-S612 VanDerWaalsContact O-CB 3.25Å; H584-S612 WeakPolarHBondContact O-CB 3.38Å; H584-S612 PolarHBondContact O-OG 2.83Å
585	S	93.4	Very high	94	Very high	58 Å²	58	53.3 Å²	53.3	41%	0.406	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	125.2	-170.3	-60.6	0	0	0	0	111.4	Y578 T579	Y578-S585 CarbonylContact C-O 3.56Å; Y578-S585 VanDerWaalsContact CA-O 3.23Å; Y578-S585 WeakPolarHBondContact CA-O 3.37Å; Y578-S585 WeakPolarHBondContact CB-O 3.49Å; T579-S585 PolarHBondContact N-O 2.86Å; T579-S585 PolarHBondContact O-N 2.81Å
586	S	94.2	Very high	94.2	Very high	30 Å²	30	53.2 Å²	53.2	21%	0.21	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	143.3	177.5	-165.3	0	0	0	0	112.2	Y588 D608	S586-Y588 VanDerWaalsContact C-N 3.29Å; S586-Y588 PolarHBondContact OG-N 2.85Å; S586-Y588 PolarHBondContact OG-O 2.93Å; S586-D608 WeakPolarHBondContact CB-OD2 3.24Å; S586-D608 WeakPolarHBondContact OG-CB 3.42Å; S586-D608 PolarHBondContact OG-OD2 2.7Å
587	L	94.2	Very high	94.3	Very high	99 Å²	99	59.1 Å²	59.1	52%	0.518	31%	0.312	S	S	.	.	S	Bend	trans	-79.6	-15.5	169.3	-68.7	174.3	0	0	0	112.6	G577 T579	G577-L587 VanDerWaalsContact O-CB 3.29Å; G577-L587 WeakPolarHBondContact O-CB 3.46Å; G577-L587 WeakPolarHBondContact O-CG 3.33Å; G577-L587 PolarHBondContact O-N 2.9Å; T579-L587 HydrophobicContact CG2-CD2 3.83Å
588	Y	94.3	Very high	94.3	Very high	77 Å²	77	66.8 Å²	66.8	30%	0.302	34%	0.339	S	S	.	.	S	Bend	trans	-110.6	153.5	-171.7	-55.4	-66.8	0	0	0	111.2	S586 Y606 P617	S586-Y588 VanDerWaalsContact C-N 3.29Å; S586-Y588 PolarHBondContact OG-N 2.85Å; S586-Y588 PolarHBondContact OG-O 2.93Å; Y588-Y606 VanDerWaalsContact CD1-CB 3.42Å; Y588-Y606 HydrophobicContact CD1-CG 4.45Å; Y588-Y606 HydrophobicContact CE1-CD2 4.21Å; Y588-Y606 HydrophobicContact CE1-CG 4.08Å; Y588-Y606 HydrophobicContact CE2-CG 4.47Å; Y588-P617 HydrophobicContact CD2-CB 3.42Å; Y588-P617 VanDerWaalsContact CD2-CB 3.42Å; Y588-P617 HydrophobicContact CD2-CG 3.69Å; Y588-P617 HydrophobicContact CE2-CB 3.83Å; Y588-P617 HydrophobicContact CE2-CG 3.66Å; Y588-P617 HydrophobicContact CG-CB 4.32Å
589	E	94.9	Very high	94.2	Very high	34 Å²	34	69.6 Å²	69.6	16%	0.159	37%	0.369	C	S	.	.	B	Isolated β-bridge	trans	-75.9	157.6	176.7	-55.7	-56.2	125.5	0	0	111	S591 A594 H595 R598 I607 D608	E589-S591 VanDerWaalsContact C-N 3.27Å; E589-S591 PolarHBondContact O-N 3.1Å; E589-A594 HydrophobicContact CB-CB 3.77Å; E589-A594 HydrophobicContact CG-CB 4.24Å; E589-H595 WeakPolarHBondContact CG-CE1 3.3Å; E589-H595 WeakPolarHBondContact CG-ND1 3.22Å; E589-R598 IonicContact OE1-CZ 3.29Å; E589-R598 IonicContact OE1-NE 3.19Å; E589-R598 PolarHBondContact OE1-NE 2.77Å; E589-R598 VanDerWaalsContact OE1-NE 3.12Å; E589-R598 IonicContact OE1-NH1 2.75Å; E589-R598 PolarHBondContact OE1-NH1 3.31Å; E589-R598 VanDerWaalsContact OE1-NH1 3.08Å; E589-R598 IonicContact OE1-NH2 3.92Å; E589-R598 PolarHBondContact OE1-NH2 2.88Å; E589-R598 IonicContact OE2-CZ 3.61Å; E589-R598 VanDerWaalsContact OE2-CZ 3.24Å; E589-R598 IonicContact OE2-NE 3.82Å; E589-R598 PolarHBondContact OE2-NE 2.99Å; E589-R598 VanDerWaalsContact OE2-NE 3.09Å; E589-R598 IonicContact OE2-NH2 3.89Å; E589-R598 PolarHBondContact OE2-NH2 2.95Å; E589-I607 VanDerWaalsContact O-CA 3.25Å; E589-I607 WeakPolarHBondContact O-CA 3.35Å; E589-I607 WeakPolarHBondContact O-CB 3.49Å; E589-D608 PolarHBondContact O-N 2.88Å
590	Q	94.2	Very high	94.2	Very high	106 Å²	106	69 Å²	69	50%	0.495	36%	0.363	S	S	.	.	S	Bend	trans	-72.7	-19.9	-178.7	-60.1	-174.6	-57.7	0	0	114.1	D608	Q590-D608 VanDerWaalsContact CA-O 3.24Å; Q590-D608 WeakPolarHBondContact CA-O 3.33Å; Q590-D608 WeakPolarHBondContact CG-O 3.34Å
591	S	94.6	Very high	94.3	Very high	31 Å²	31	71.8 Å²	71.8	22%	0.217	38%	0.375	C	S	.	.	S	Bend	trans	-154.5	164.1	-177.8	74.4	0	0	0	0	112.8	E589 E593 A594 H595	E589-S591 VanDerWaalsContact C-N 3.27Å; E589-S591 PolarHBondContact O-N 3.1Å; S591-E593 PolarHBondContact O-N 3.21Å; S591-E593 PolarHBondContact OG-N 3.24Å; S591-A594 PolarHBondContact O-N 2.94Å; S591-A594 PolarHBondContact OG-N 3.02Å; S591-A594 VanDerWaalsContact OG-N 3.11Å; S591-H595 PolarHBondContact O-N 3.04Å
592	C	95.1	Very high	94.4	Very high	0 Å²	0	65.9 Å²	65.9	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-63.6	-30.8	170.7	-68.9	0	0	0	0	112.1	H595 K596 C622 T630	C592-H595 PolarHBondContact O-N 2.67Å; C592-K596 PolarHBondContact O-N 3.3Å; C592-C622 WeakPolarHBondContact CA-SG 3.5Å; C592-C622 HydrophobicContact CB-CB 3.52Å; C592-C622 WeakPolarHBondContact CB-SG 3.41Å; C592-C622 WeakPolarHBondContact SG-CA 3.48Å; C592-C622 WeakPolarHBondContact SG-CB 3.29Å; C592-C622 CovalentContact SG-SG 2.03Å; C592-C622 PolarHBondContact SG-SG 3.18Å; C592-T630 WeakPolarHBondContact CB-OG1 3.47Å; C592-T630 PolarHBondContact SG-OG1 3.39Å
593	E	94.7	Very high	94.5	Very high	112 Å²	112	64.5 Å²	64.5	52%	0.523	35%	0.346	S	S	.	.	H	α-helix	trans	-64.9	-41	174.9	-176.1	165	-136.9	0	0	111.9	S591 H595 K596 H597 A628	S591-E593 PolarHBondContact O-N 3.21Å; S591-E593 PolarHBondContact OG-N 3.24Å; E593-H595 VanDerWaalsContact C-N 3.34Å; E593-H595 PolarHBondContact O-N 2.83Å; E593-K596 WeakPolarHBondContact O-CB 3.48Å; E593-K596 PolarHBondContact O-N 3.28Å; E593-K596 VanDerWaalsContact O-N 3.11Å; E593-H597 PolarHBondContact O-CD2 2.98Å; E593-H597 PolarHBondContact O-N 3.38Å; E593-A628 HydrophobicContact CB-CB 3.86Å; E593-A628 HydrophobicContact CG-CB 4.43Å
594	A	94.1	Very high	94.5	Very high	26 Å²	26	69.7 Å²	69.7	22%	0.215	37%	0.373	C	S	.	.	H	α-helix	trans	-61.4	-41.6	174.3	0	0	0	0	0	112	E589 S591 K596 H597 R598	E589-A594 HydrophobicContact CB-CB 3.77Å; E589-A594 HydrophobicContact CG-CB 4.24Å; S591-A594 PolarHBondContact O-N 2.94Å; S591-A594 PolarHBondContact OG-N 3.02Å; S591-A594 VanDerWaalsContact OG-N 3.11Å; A594-K596 VanDerWaalsContact C-N 3.35Å; A594-K596 PolarHBondContact O-N 3.29Å; A594-H597 PolarHBondContact O-N 3.3Å; A594-R598 PolarHBondContact O-N 3.1Å
595	H	94.4	Very high	94.5	Very high	16 Å²	16	68.1 Å²	68.1	7%	0.074	37%	0.365	C	S	.	.	H	α-helix	trans	-61.6	-40.5	171.7	-78.5	-60.2	0	0	0	112.8	E589 S591 C592 E593 H597 R598 N600 Y606 M624	E589-H595 WeakPolarHBondContact CG-CE1 3.3Å; E589-H595 WeakPolarHBondContact CG-ND1 3.22Å; S591-H595 PolarHBondContact O-N 3.04Å; C592-H595 PolarHBondContact O-N 2.67Å; E593-H595 VanDerWaalsContact C-N 3.34Å; E593-H595 PolarHBondContact O-N 2.83Å; H595-H597 VanDerWaalsContact C-N 3.34Å; H595-H597 PolarHBondContact O-N 2.9Å; H595-R598 PolarHBondContact O-N 3.18Å; H595-N600 HydrophobicContact CB-CB 4.34Å; H595-N600 PolarHBondContact ND1-ND2 3.02Å; H595-N600 WeakPolarHBondContact O-CB 3.48Å; H595-N600 PolarHBondContact O-N 2.89Å; H595-Y606 PolarHBondContact NE2-O 3.04Å; H595-M624 HydrophobicContact CB-SD 4.12Å
596	K	94.3	Very high	94.6	Very high	86 Å²	86	70.6 Å²	70.6	37%	0.374	37%	0.366	S	S	.	.	H	α-helix	trans	-59.8	-44.2	175.8	-171.8	-176.6	173.8	-165.5	0	111.4	C592 E593 A594 R598 G599 M624 D626 A628	C592-K596 PolarHBondContact O-N 3.3Å; E593-K596 WeakPolarHBondContact O-CB 3.48Å; E593-K596 PolarHBondContact O-N 3.28Å; E593-K596 VanDerWaalsContact O-N 3.11Å; A594-K596 VanDerWaalsContact C-N 3.35Å; A594-K596 PolarHBondContact O-N 3.29Å; K596-R598 PolarHBondContact O-N 2.91Å; K596-G599 PolarHBondContact O-N 2.89Å; K596-M624 HydrophobicContact CB-CB 4.26Å; K596-M624 HydrophobicContact CB-CG 4.09Å; K596-M624 HydrophobicContact CB-SD 3.58Å; K596-M624 VanDerWaalsContact CB-SD 3.58Å; K596-M624 HydrophobicContact CD-CB 4.19Å; K596-M624 HydrophobicContact CG-CB 4.1Å; K596-M624 HydrophobicContact CG-CG 4.48Å; K596-M624 HydrophobicContact CG-SD 4.39Å; K596-M624 PolarHBondContact N-SD 3.43Å; K596-M624 VanDerWaalsContact N-SD 3.41Å; K596-D626 PolarHBondContact NZ-O 3.14Å; K596-A628 HydrophobicContact CD-CB 4.17Å
597	H	93.9	Very high	94.6	Very high	150 Å²	150	69.2 Å²	69.2	69%	0.694	36%	0.356	S	S	*	.	H	α-helix	trans	-63.8	-25	178.6	-76.9	-62	0	0	0	113.7	E593 A594 H595 G599	E593-H597 PolarHBondContact O-CD2 2.98Å; E593-H597 PolarHBondContact O-N 3.38Å; A594-H597 PolarHBondContact O-N 3.3Å; H595-H597 VanDerWaalsContact C-N 3.34Å; H595-H597 PolarHBondContact O-N 2.9Å; H597-G599 VanDerWaalsContact C-N 3.26Å; H597-G599 PolarHBondContact O-N 2.81Å
598	R	93.2	Very high	94.7	Very high	170 Å²	170	64.5 Å²	64.5	64%	0.642	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-3	171.5	-66.3	-169.1	-179.4	-155.2	5.5	114.1	E589 A594 H595 K596	E589-R598 IonicContact OE1-CZ 3.29Å; E589-R598 IonicContact OE1-NE 3.19Å; E589-R598 PolarHBondContact OE1-NE 2.77Å; E589-R598 VanDerWaalsContact OE1-NE 3.12Å; E589-R598 IonicContact OE1-NH1 2.75Å; E589-R598 PolarHBondContact OE1-NH1 3.31Å; E589-R598 VanDerWaalsContact OE1-NH1 3.08Å; E589-R598 IonicContact OE1-NH2 3.92Å; E589-R598 PolarHBondContact OE1-NH2 2.88Å; E589-R598 IonicContact OE2-CZ 3.61Å; E589-R598 VanDerWaalsContact OE2-CZ 3.24Å; E589-R598 IonicContact OE2-NE 3.82Å; E589-R598 PolarHBondContact OE2-NE 2.99Å; E589-R598 VanDerWaalsContact OE2-NE 3.09Å; E589-R598 IonicContact OE2-NH2 3.89Å; E589-R598 PolarHBondContact OE2-NH2 2.95Å; A594-R598 PolarHBondContact O-N 3.1Å; H595-R598 PolarHBondContact O-N 3.18Å; K596-R598 PolarHBondContact O-N 2.91Å
599	G	93.3	Very high	94.6	Very high	65 Å²	65	61 Å²	61	67%	0.67	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.7	17	179.8	0	0	0	0	0	114.6	K596 H597	K596-G599 PolarHBondContact O-N 2.89Å; H597-G599 VanDerWaalsContact C-N 3.26Å; H597-G599 PolarHBondContact O-N 2.81Å
600	N	94.6	Very high	94.5	Very high	59 Å²	59	61.5 Å²	61.5	32%	0.316	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-76.6	141.9	178.8	-68.8	-20.9	0	0	0	112	H595 Y605 M624	H595-N600 HydrophobicContact CB-CB 4.34Å; H595-N600 PolarHBondContact ND1-ND2 3.02Å; H595-N600 WeakPolarHBondContact O-CB 3.48Å; H595-N600 PolarHBondContact O-N 2.89Å; N600-Y605 HydrophobicContact CB-CE1 4.23Å; N600-M624 HydrophobicContact CB-CE 4.28Å; N600-M624 WeakPolarHBondContact O-CE 3.46Å
601	P	95.3	Very high	94.4	Very high	96 Å²	96	56.7 Å²	56.7	62%	0.623	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-79.7	160.6	177.3	33.3	-36.1	0	0	0	112.4	G603 Y605 M624	P601-G603 PolarHBondContact O-N 2.9Å; P601-Y605 VanDerWaalsContact O-CE2 3.27Å; P601-Y605 WeakPolarHBondContact O-CE2 3.4Å; P601-Y605 PolarHBondContact O-OH 2.79Å; P601-M624 WeakPolarHBondContact O-CE 3.46Å
602	S	96.6	Very high	94.1	Very high	42 Å²	42	57.6 Å²	57.6	29%	0.294	31%	0.308	S	S	.	.	S	Bend	trans	-52.4	138.8	174.1	-58.3	0	0	0	0	112.1	C622 M624	S602-C622 CarbonylContact C-O 3.58Å; S602-C622 WeakPolarHBondContact CA-O 3.44Å; S602-C622 WeakPolarHBondContact CB-O 3.45Å; S602-M624 PolarHBondContact OG-N 2.78Å
603	G	95.8	Very high	93.8	Very high	16 Å²	16	58.4 Å²	58.4	17%	0.165	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.1	-172.5	-172.4	0	0	0	0	0	113.8	P601 Y605 Y621 C622	P601-G603 PolarHBondContact O-N 2.9Å; G603-Y605 WeakPolarHBondContact O-CD2 3.45Å; G603-Y621 CarbonylContact O-C 3.5Å; G603-C622 PolarHBondContact N-O 3.48Å; G603-C622 PolarHBondContact O-N 3.12Å
604	L	95.3	Very high	93.3	Very high	109 Å²	109	59.1 Å²	59.1	57%	0.571	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86	127.7	172.7	-72.1	169.4	0	0	0	109.9	L619 V620 Y621	L604-L619 HydrophobicContact CB-CD1 4.31Å; L604-V620 WeakPolarHBondContact CA-O 3.35Å; L604-Y621 HydrophobicContact CD2-CD2 4.1Å; L604-Y621 HydrophobicContact CG-CD2 4.27Å
605	Y	95.1	Very high	93.1	Very high	49 Å²	49	60.2 Å²	60.2	19%	0.192	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	146	178.7	-65.7	-89	0	0	0	109.8	N600 P601 G603 V620 C622 M624	N600-Y605 HydrophobicContact CB-CE1 4.23Å; P601-Y605 VanDerWaalsContact O-CE2 3.27Å; P601-Y605 WeakPolarHBondContact O-CE2 3.4Å; P601-Y605 PolarHBondContact O-OH 2.79Å; G603-Y605 WeakPolarHBondContact O-CD2 3.45Å; Y605-V620 PolarHBondContact N-O 2.86Å; Y605-V620 WeakPolarHBondContact O-CG2 3.4Å; Y605-V620 PolarHBondContact O-N 2.77Å; Y605-V620 VanDerWaalsContact O-O 3.13Å; Y605-C622 HydrophobicContact CD2-CB 3.73Å; Y605-C622 HydrophobicContact CE2-CB 4.23Å; Y605-M624 HydrophobicContact CE2-CE 3.8Å
606	Y	94.5	Very high	92.8	Very high	109 Å²	109	61 Å²	61	43%	0.427	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	134.4	160.3	-77	-87.3	0	0	0	107.9	Y588 H595 P617 F618 L619	Y588-Y606 VanDerWaalsContact CD1-CB 3.42Å; Y588-Y606 HydrophobicContact CD1-CG 4.45Å; Y588-Y606 HydrophobicContact CE1-CD2 4.21Å; Y588-Y606 HydrophobicContact CE1-CG 4.08Å; Y588-Y606 HydrophobicContact CE2-CG 4.47Å; H595-Y606 PolarHBondContact NE2-O 3.04Å; Y606-P617 HydrophobicContact CD1-CB 4.5Å; Y606-F618 WeakPolarHBondContact CA-O 3.36Å; Y606-L619 HydrophobicContact CD1-CB 4.26Å; Y606-L619 HydrophobicContact CD2-CD1 3.84Å; Y606-L619 HydrophobicContact CE1-CB 3.97Å; Y606-L619 HydrophobicContact CE1-CD1 4.42Å; Y606-L619 HydrophobicContact CE2-CD1 3.75Å; Y606-L619 HydrophobicContact CG-CD1 4.22Å
607	I	94.8	Very high	92.8	Very high	2 Å²	2	58.3 Å²	58.3	1%	0.01	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	153.9	169.4	63.6	167.2	0	0	0	109.4	E589 P617 F618 V620 T630	E589-I607 VanDerWaalsContact O-CA 3.25Å; E589-I607 WeakPolarHBondContact O-CA 3.35Å; E589-I607 WeakPolarHBondContact O-CB 3.49Å; I607-P617 VanDerWaalsContact O-CA 3.32Å; I607-P617 WeakPolarHBondContact O-CA 3.34Å; I607-F618 HydrophobicContact CD1-CE1 4.32Å; I607-F618 HydrophobicContact CD1-CE2 4.14Å; I607-F618 HydrophobicContact CD1-CZ 3.72Å; I607-F618 HydrophobicContact CG1-CE1 4.02Å; I607-F618 HydrophobicContact CG1-CE2 4.14Å; I607-F618 HydrophobicContact CG1-CZ 3.81Å; I607-F618 PolarHBondContact N-O 3.03Å; I607-F618 PolarHBondContact O-N 2.92Å; I607-V620 HydrophobicContact CB-CG2 4.38Å; I607-V620 HydrophobicContact CD1-CG1 3.91Å; I607-V620 HydrophobicContact CD1-CG2 3.91Å; I607-V620 HydrophobicContact CG1-CG1 3.91Å; I607-V620 HydrophobicContact CG1-CG2 3.8Å; I607-V620 HydrophobicContact CG2-CG2 3.77Å; I607-T630 HydrophobicContact CD1-CG2 3.68Å
608	D	95.1	Very high	92.7	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	30%	0.304	C	S	.	.			trans	-124.9	87	177.5	-172.2	-11.9	0	0	0	109.5	Y578 S586 E589 Q590 D610 G611 P617	Y578-D608 WeakPolarHBondContact CE1-OD2 3.45Å; Y578-D608 PolarHBondContact OH-OD2 3.33Å; S586-D608 WeakPolarHBondContact CB-OD2 3.24Å; S586-D608 WeakPolarHBondContact OG-CB 3.42Å; S586-D608 PolarHBondContact OG-OD2 2.7Å; E589-D608 PolarHBondContact O-N 2.88Å; Q590-D608 VanDerWaalsContact CA-O 3.24Å; Q590-D608 WeakPolarHBondContact CA-O 3.33Å; Q590-D608 WeakPolarHBondContact CG-O 3.34Å; D608-D610 VanDerWaalsContact C-N 3.34Å; D608-D610 PolarHBondContact O-N 3.24Å; D608-G611 PolarHBondContact O-N 2.9Å; D608-G611 VanDerWaalsContact O-N 3.07Å; D608-G611 PolarHBondContact OD1-N 3.03Å; D608-P617 HydrophobicContact CB-CB 4.27Å
609	A	93.9	Very high	92.7	Very high	4 Å²	4	47 Å²	47	3%	0.033	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-40.4	-167.9	0	0	0	0	0	112.6	F618 A667 A668 L671	A609-F618 HydrophobicContact CB-CE1 4.14Å; A609-A667 HydrophobicContact CB-CB 3.75Å; A609-A668 HydrophobicContact CB-CB 4.22Å; A609-L671 HydrophobicContact CB-CD1 4.01Å; A609-L671 WeakPolarHBondContact O-CD1 3.49Å
610	D	92.6	Very high	92.8	Very high	43 Å²	43	44.1 Å²	44.1	23%	0.23	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-5.2	177	57.8	-37.7	0	0	0	113.7	D608 S612 G613 P614 L615	D608-D610 VanDerWaalsContact C-N 3.34Å; D608-D610 PolarHBondContact O-N 3.24Å; D610-S612 PolarHBondContact O-N 2.76Å; D610-G613 PolarHBondContact O-N 3.02Å; D610-G613 WeakPolarHBondContact OD2-CA 3.36Å; D610-P614 WeakPolarHBondContact OD2-CD 3.32Å; D610-L615 WeakPolarHBondContact OD1-CB 3.37Å; D610-L615 VanDerWaalsContact OD2-CB 3.3Å; D610-L615 WeakPolarHBondContact OD2-CB 3.33Å; D610-L615 VanDerWaalsContact OD2-CG 3.31Å; D610-L615 WeakPolarHBondContact OD2-CG 3.23Å; D610-L615 PolarHBondContact OD2-N 2.86Å
611	G	90.8	Very high	92.8	Very high	5 Å²	5	45 Å²	45	5%	0.052	26%	0.261	C	S	.	.	S	Bend	trans	65.2	-116.5	178.9	0	0	0	0	0	110.4	Y578 D608 G613	Y578-G611 WeakPolarHBondContact CE1-O 3.15Å; D608-G611 PolarHBondContact O-N 2.9Å; D608-G611 VanDerWaalsContact O-N 3.07Å; D608-G611 PolarHBondContact OD1-N 3.03Å; G611-G613 PolarHBondContact O-N 3.08Å
612	S	88.6	Confident	92.8	Very high	51 Å²	51	40.4 Å²	40.4	36%	0.357	23%	0.231	S	C	.	.	S	Bend	trans	-78	23.9	176.6	-55.1	0	0	0	0	113.9	H584 D610	H584-S612 WeakPolarHBondContact CE1-CB 3.32Å; H584-S612 WeakPolarHBondContact NE2-CB 3.37Å; H584-S612 PolarHBondContact NE2-OG 2.73Å; H584-S612 VanDerWaalsContact O-CB 3.25Å; H584-S612 WeakPolarHBondContact O-CB 3.38Å; H584-S612 PolarHBondContact O-OG 2.83Å; D610-S612 PolarHBondContact O-N 2.76Å
613	G	88.3	Confident	92.7	Very high	16 Å²	16	41 Å²	41	17%	0.165	23%	0.231	C	C	.	.	S	Bend	trans	-84.2	176	176.2	0	0	0	0	0	112.2	H558 D610 G611 L615	H558-G613 PolarHBondContact NE2-O 3.38Å; D610-G613 PolarHBondContact O-N 3.02Å; D610-G613 WeakPolarHBondContact OD2-CA 3.36Å; G611-G613 PolarHBondContact O-N 3.08Å; G613-L615 PolarHBondContact O-N 3.23Å
614	P	86	Confident	92.6	Very high	127 Å²	127	40.8 Å²	40.8	83%	0.825	23%	0.226	S	C	*	.	S	Bend	trans	-72.2	-7	-173.4	31	-36.9	0	0	0	114.8	D610	D610-P614 WeakPolarHBondContact OD2-CD 3.32Å
615	L	88.4	Confident	92.3	Very high	50 Å²	50	40.3 Å²	40.3	26%	0.262	23%	0.227	S	C	.	.	S	Bend	trans	-94	136.5	-179	-46.7	166.2	0	0	0	109.8	Y578 D610 G613 G663 Q664 A667	Y578-L615 PolarHBondContact OH-O 3.13Å; D610-L615 WeakPolarHBondContact OD1-CB 3.37Å; D610-L615 VanDerWaalsContact OD2-CB 3.3Å; D610-L615 WeakPolarHBondContact OD2-CB 3.33Å; D610-L615 VanDerWaalsContact OD2-CG 3.31Å; D610-L615 WeakPolarHBondContact OD2-CG 3.23Å; D610-L615 PolarHBondContact OD2-N 2.86Å; G613-L615 PolarHBondContact O-N 3.23Å; L615-G663 VanDerWaalsContact CD1-C 3.45Å; L615-G663 WeakPolarHBondContact CD1-O 3.31Å; L615-Q664 HydrophobicContact CB-CG 4.15Å; L615-A667 HydrophobicContact CD1-CB 3.94Å
616	G	89.3	Confident	91.9	Very high	32 Å²	32	44.1 Å²	44.1	33%	0.33	25%	0.251	S	S	.	.	P	Polyproline II helix	trans	-74.4	167.9	175.9	0	0	0	0	0	113.2	Q664	G616-Q664 PolarHBondContact O-NE2 3.19Å
617	P	92.8	Very high	91.5	Very high	29 Å²	29	43 Å²	43	19%	0.188	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-67.4	154	174.9	28.3	-35.2	0	0	0	112.1	Y588 Y606 I607 D608	Y588-P617 HydrophobicContact CD2-CB 3.42Å; Y588-P617 VanDerWaalsContact CD2-CB 3.42Å; Y588-P617 HydrophobicContact CD2-CG 3.69Å; Y588-P617 HydrophobicContact CE2-CB 3.83Å; Y588-P617 HydrophobicContact CE2-CG 3.66Å; Y588-P617 HydrophobicContact CG-CB 4.32Å; Y606-P617 HydrophobicContact CD1-CB 4.5Å; I607-P617 VanDerWaalsContact O-CA 3.32Å; I607-P617 WeakPolarHBondContact O-CA 3.34Å; D608-P617 HydrophobicContact CB-CB 4.27Å
618	F	92.9	Very high	91.4	Very high	10 Å²	10	44.3 Å²	44.3	4%	0.044	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	152	178.6	62.9	-76.9	0	0	0	112.3	Y606 I607 A609 V620 V632 A660 Q664 A668	Y606-F618 WeakPolarHBondContact CA-O 3.36Å; I607-F618 HydrophobicContact CD1-CE1 4.32Å; I607-F618 HydrophobicContact CD1-CE2 4.14Å; I607-F618 HydrophobicContact CD1-CZ 3.72Å; I607-F618 HydrophobicContact CG1-CE1 4.02Å; I607-F618 HydrophobicContact CG1-CE2 4.14Å; I607-F618 HydrophobicContact CG1-CZ 3.81Å; I607-F618 PolarHBondContact N-O 3.03Å; I607-F618 PolarHBondContact O-N 2.92Å; A609-F618 HydrophobicContact CB-CE1 4.14Å; F618-V620 HydrophobicContact CD2-CG1 3.56Å; F618-V620 HydrophobicContact CE2-CG1 3.32Å; F618-V620 HydrophobicContact CZ-CG1 4.28Å; F618-V632 HydrophobicContact CE2-CG2 4.23Å; F618-A660 HydrophobicContact CB-CB 4.33Å; F618-A660 HydrophobicContact CD2-CB 3.46Å; F618-A660 VanDerWaalsContact CD2-CB 3.46Å; F618-A660 HydrophobicContact CE2-CB 3.9Å; F618-A660 HydrophobicContact CG-CB 3.98Å; F618-Q664 HydrophobicContact CD1-CB 3.66Å; F618-Q664 HydrophobicContact CD1-CG 3.72Å; F618-Q664 HydrophobicContact CE1-CB 3.72Å; F618-Q664 HydrophobicContact CE1-CG 4.17Å; F618-Q664 HydrophobicContact CG-CB 4.17Å; F618-Q664 HydrophobicContact CG-CG 4.34Å; F618-Q664 HydrophobicContact CZ-CB 4.25Å; F618-A668 HydrophobicContact CZ-CB 4.02Å
619	L	93.1	Very high	91.3	Very high	74 Å²	74	49.1 Å²	49.1	39%	0.387	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	129.9	-175.2	-170	71.9	0	0	0	111.2	L604 Y606	L604-L619 HydrophobicContact CB-CD1 4.31Å; Y606-L619 HydrophobicContact CD1-CB 4.26Å; Y606-L619 HydrophobicContact CD2-CD1 3.84Å; Y606-L619 HydrophobicContact CE1-CB 3.97Å; Y606-L619 HydrophobicContact CE1-CD1 4.42Å; Y606-L619 HydrophobicContact CE2-CD1 3.75Å; Y606-L619 HydrophobicContact CG-CD1 4.22Å
620	V	94.7	Very high	91.4	Very high	3 Å²	3	51.4 Å²	51.4	2%	0.018	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	160.3	177	-58.6	0	0	0	0	110.9	L604 Y605 I607 F618 T630 V632	L604-V620 WeakPolarHBondContact CA-O 3.35Å; Y605-V620 PolarHBondContact N-O 2.86Å; Y605-V620 WeakPolarHBondContact O-CG2 3.4Å; Y605-V620 PolarHBondContact O-N 2.77Å; Y605-V620 VanDerWaalsContact O-O 3.13Å; I607-V620 HydrophobicContact CB-CG2 4.38Å; I607-V620 HydrophobicContact CD1-CG1 3.91Å; I607-V620 HydrophobicContact CD1-CG2 3.91Å; I607-V620 HydrophobicContact CG1-CG1 3.91Å; I607-V620 HydrophobicContact CG1-CG2 3.8Å; I607-V620 HydrophobicContact CG2-CG2 3.77Å; F618-V620 HydrophobicContact CD2-CG1 3.56Å; F618-V620 HydrophobicContact CE2-CG1 3.32Å; F618-V620 HydrophobicContact CZ-CG1 4.28Å; V620-T630 HydrophobicContact CB-CG2 3.97Å; V620-T630 HydrophobicContact CG1-CG2 3.88Å; V620-T630 HydrophobicContact CG2-CG2 4.04Å; V620-V632 HydrophobicContact CG1-CG2 3.96Å
621	Y	94.8	Very high	91.4	Very high	78 Å²	78	52 Å²	52	31%	0.306	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	117.5	166.1	-177.5	-96.2	0	0	0	109.5	G603 L604 N623 V631	G603-Y621 CarbonylContact O-C 3.5Å; L604-Y621 HydrophobicContact CD2-CD2 4.1Å; L604-Y621 HydrophobicContact CG-CD2 4.27Å; Y621-N623 HydrophobicContact CD1-CB 4.39Å; Y621-N623 HydrophobicContact CE1-CB 3.98Å; Y621-V631 HydrophobicContact CD1-CB 4.34Å; Y621-V631 HydrophobicContact CD1-CG2 4.37Å; Y621-V631 PolarHBondContact N-O 2.94Å; Y621-V631 WeakPolarHBondContact O-CB 3.44Å; Y621-V631 PolarHBondContact O-N 2.78Å
622	C	95.6	Very high	91.3	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	110.3	175	-64	0	0	0	0	109.8	C592 S602 G603 Y605 M624 W629	C592-C622 WeakPolarHBondContact CA-SG 3.5Å; C592-C622 HydrophobicContact CB-CB 3.52Å; C592-C622 WeakPolarHBondContact CB-SG 3.41Å; C592-C622 WeakPolarHBondContact SG-CA 3.48Å; C592-C622 WeakPolarHBondContact SG-CB 3.29Å; C592-C622 CovalentContact SG-SG 2.03Å; C592-C622 PolarHBondContact SG-SG 3.18Å; S602-C622 CarbonylContact C-O 3.58Å; S602-C622 WeakPolarHBondContact CA-O 3.44Å; S602-C622 WeakPolarHBondContact CB-O 3.45Å; G603-C622 PolarHBondContact N-O 3.48Å; G603-C622 PolarHBondContact O-N 3.12Å; Y605-C622 HydrophobicContact CD2-CB 3.73Å; Y605-C622 HydrophobicContact CE2-CB 4.23Å; C622-M624 HydrophobicContact CB-CE 3.99Å; C622-M624 HydrophobicContact CB-CG 4.05Å; C622-M624 HydrophobicContact CB-SD 4.05Å; C622-W629 WeakPolarHBondContact CA-O 3.42Å
623	N	94.9	Very high	91.1	Very high	53 Å²	53	59 Å²	59	28%	0.283	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	107.3	168.4	-173.8	5.9	0	0	0	109.2	Y621 T625 A628 W629	Y621-N623 HydrophobicContact CD1-CB 4.39Å; Y621-N623 HydrophobicContact CE1-CB 3.98Å; N623-T625 PolarHBondContact OD1-OG1 3.12Å; N623-A628 CarbonylContact O-C 3.56Å; N623-A628 WeakPolarHBondContact O-CA 3.33Å; N623-W629 HydrophobicContact CB-CB 4.22Å; N623-W629 PolarHBondContact N-O 3.49Å; N623-W629 PolarHBondContact O-N 2.79Å
624	M	93.6	Very high	90.8	Very high	13 Å²	13	61.1 Å²	61.1	6%	0.064	33%	0.334	C	S	.	.			trans	-117.9	20.6	-171.1	-60	-179	-70.1	0	0	112.7	H595 K596 N600 P601 S602 Y605 C622 A628	H595-M624 HydrophobicContact CB-SD 4.12Å; K596-M624 HydrophobicContact CB-CB 4.26Å; K596-M624 HydrophobicContact CB-CG 4.09Å; K596-M624 HydrophobicContact CB-SD 3.58Å; K596-M624 VanDerWaalsContact CB-SD 3.58Å; K596-M624 HydrophobicContact CD-CB 4.19Å; K596-M624 HydrophobicContact CG-CB 4.1Å; K596-M624 HydrophobicContact CG-CG 4.48Å; K596-M624 HydrophobicContact CG-SD 4.39Å; K596-M624 PolarHBondContact N-SD 3.43Å; K596-M624 VanDerWaalsContact N-SD 3.41Å; N600-M624 HydrophobicContact CB-CE 4.28Å; N600-M624 WeakPolarHBondContact O-CE 3.46Å; P601-M624 WeakPolarHBondContact O-CE 3.46Å; S602-M624 PolarHBondContact OG-N 2.78Å; Y605-M624 HydrophobicContact CE2-CE 3.8Å; C622-M624 HydrophobicContact CB-CE 3.99Å; C622-M624 HydrophobicContact CB-CG 4.05Å; C622-M624 HydrophobicContact CB-SD 4.05Å; M624-A628 HydrophobicContact CG-CB 4.27Å
625	T	89.6	Confident	90.1	Very high	98 Å²	98	58.7 Å²	58.7	60%	0.601	33%	0.331	S	S	*	.	S	Bend	trans	-65.2	-42.9	-179.7	51.1	0	0	0	0	112.6	N623	N623-T625 PolarHBondContact OD1-OG1 3.12Å
626	D	85	Confident	89.3	Confident	129 Å²	129	57.5 Å²	57.5	69%	0.69	33%	0.332	S	S	*	.	S	Bend	trans	-122.3	-110	176	-59.6	-49.7	0	0	0	108.8	K596	K596-D626 PolarHBondContact NZ-O 3.14Å
627	S	87.5	Confident	88.4	Confident	87 Å²	87	60 Å²	60	61%	0.608	34%	0.342	S	S	*	.	S	Bend	trans	-66.7	142.4	165.9	-56.8	0	0	0	0	110.6	W629	S627-W629 PolarHBondContact O-N 2.93Å
628	A	92.1	Very high	87.3	Confident	29 Å²	29	66.2 Å²	66.2	24%	0.24	37%	0.374	C	S	.	.			trans	-75.5	116	-179.5	0	0	0	0	0	110.7	E593 K596 N623 M624	E593-A628 HydrophobicContact CB-CB 3.86Å; E593-A628 HydrophobicContact CG-CB 4.43Å; K596-A628 HydrophobicContact CD-CB 4.17Å; N623-A628 CarbonylContact O-C 3.56Å; N623-A628 WeakPolarHBondContact O-CA 3.33Å; M624-A628 HydrophobicContact CG-CB 4.27Å
629	W	93.9	Very high	86.4	Confident	101 Å²	101	69.6 Å²	69.6	38%	0.383	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	128.7	175.5	-71.2	88	0	0	0	111.1	C622 N623 S627 V631 E676	C622-W629 WeakPolarHBondContact CA-O 3.42Å; N623-W629 HydrophobicContact CB-CB 4.22Å; N623-W629 PolarHBondContact N-O 3.49Å; N623-W629 PolarHBondContact O-N 2.79Å; S627-W629 PolarHBondContact O-N 2.93Å; W629-V631 HydrophobicContact CB-CG2 4.24Å; W629-E676 HydrophobicContact CH2-CG 4.23Å; W629-E676 HydrophobicContact CZ3-CG 4Å
630	T	94.5	Very high	85.5	Confident	51 Å²	51	69.2 Å²	69.2	31%	0.313	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	105	166.8	-62.9	0	0	0	0	109.4	C592 I607 V620 V632	C592-T630 WeakPolarHBondContact CB-OG1 3.47Å; C592-T630 PolarHBondContact SG-OG1 3.39Å; I607-T630 HydrophobicContact CD1-CG2 3.68Å; V620-T630 HydrophobicContact CB-CG2 3.97Å; V620-T630 HydrophobicContact CG1-CG2 3.88Å; V620-T630 HydrophobicContact CG2-CG2 4.04Å; T630-V632 HydrophobicContact CG2-CG2 4.36Å
631	V	92.4	Very high	84.6	Confident	57 Å²	57	75 Å²	75	35%	0.345	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	110	-178.2	-175.1	0	0	0	0	109.8	Y621 W629	Y621-V631 HydrophobicContact CD1-CB 4.34Å; Y621-V631 HydrophobicContact CD1-CG2 4.37Å; Y621-V631 PolarHBondContact N-O 2.94Å; Y621-V631 WeakPolarHBondContact O-CB 3.44Å; Y621-V631 PolarHBondContact O-N 2.78Å; W629-V631 HydrophobicContact CB-CG2 4.24Å
632	V	90.5	Very high	83.4	Confident	33 Å²	33	75.8 Å²	75.8	20%	0.2	45%	0.448	C	S	.	.	P	Polyproline II helix	trans	-97.6	120.9	175.3	-166.9	0	0	0	0	109.7	F618 V620 T630 Y658 A660 L665	F618-V632 HydrophobicContact CE2-CG2 4.23Å; V620-V632 HydrophobicContact CG1-CG2 3.96Å; T630-V632 HydrophobicContact CG2-CG2 4.36Å; V632-Y658 HydrophobicContact CG1-CD1 4.18Å; V632-A660 HydrophobicContact CG1-CB 3.96Å; V632-L665 HydrophobicContact CB-CD2 4.16Å; V632-L665 HydrophobicContact CG1-CD2 3.88Å; V632-L665 HydrophobicContact CG2-CD2 4.11Å
633	R	83.6	Confident	81.9	Confident	170 Å²	170	86.2 Å²	86.2	64%	0.642	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-87.7	150.5	-179.8	-64.5	-174.8	178.1	-176.8	-0.7	111.7	A659	R633-A659 PolarHBondContact O-N 3.14Å
634	H	82.6	Confident	80.1	Confident	60 Å²	60	87.5 Å²	87.5	28%	0.278	51%	0.513	S	S	.	.	B	Isolated β-bridge	trans	-95.9	150.6	166.3	63	66	0	0	0	111.2	G636 F656 A657 Y658	H634-G636 VanDerWaalsContact C-N 3.31Å; H634-G636 PolarHBondContact CE1-O 3.14Å; H634-G636 VanDerWaalsContact CE1-O 3.25Å; H634-G636 PolarHBondContact ND1-N 3.1Å; H634-G636 PolarHBondContact ND1-O 3.02Å; H634-F656 HydrophobicContact CB-CB 4.43Å; H634-A657 CarbonylContact C-O 3.6Å; H634-A657 WeakPolarHBondContact CA-O 3.42Å; H634-A657 WeakPolarHBondContact CB-O 3.49Å; H634-Y658 HydrophobicContact CB-CD1 4.21Å; H634-Y658 HydrophobicContact CB-CE1 4.24Å
635	G	70.6	Confident	78.2	Confident	75 Å²	75	89.7 Å²	89.7	77%	0.773	53%	0.534	S	S	*	.	S	Bend	trans	-81.7	-4	178.6	0	0	0	0	0	114.6	A657	G635-A657 PolarHBondContact N-O 3.47Å
636	G	70.8	Confident	76.5	Confident	26 Å²	26	90.7 Å²	90.7	27%	0.268	54%	0.542	S	S	.	.	S	Bend	trans	-81.6	164.1	175.7	0	0	0	0	0	113.4	H634	H634-G636 VanDerWaalsContact C-N 3.31Å; H634-G636 PolarHBondContact CE1-O 3.14Å; H634-G636 VanDerWaalsContact CE1-O 3.25Å; H634-G636 PolarHBondContact ND1-N 3.1Å; H634-G636 PolarHBondContact ND1-O 3.02Å
637	P	71.2	Confident	74.9	Confident	85 Å²	85	90.9 Å²	90.9	55%	0.552	55%	0.553	S	S	*	*			trans	-65	150.2	172.2	29.8	-35	0	0	0	111.1	A639 V640	P637-A639 PolarHBondContact O-N 2.87Å; P637-A639 VanDerWaalsContact O-N 3.08Å; P637-V640 HydrophobicContact CG-CG2 3.74Å
638	D	70.4	Confident	73.3	Confident	159 Å²	159	89.8 Å²	89.8	85%	0.85	56%	0.556	S	S	*	*	S	Bend	trans	-60.6	-19.1	179.8	-63.1	-30.5	0	0	0	113.4
639	A	73.7	Confident	71.3	Confident	80 Å²	80	97 Å²	97	66%	0.661	58%	0.584	S	S	*	*			trans	-143.2	139.3	173.6	0	0	0	0	0	110.9	P637	P637-A639 PolarHBondContact O-N 2.87Å; P637-A639 VanDerWaalsContact O-N 3.08Å
640	V	73.9	Confident	69.4	Low	66 Å²	66	97 Å²	97	40%	0.4	60%	0.597	S	S	.	*			trans	-121.3	122.1	174.3	179.8	0	0	0	0	109.1	P637 V654	P637-V640 HydrophobicContact CG-CG2 3.74Å; V640-V654 HydrophobicContact CB-CG1 4.22Å; V640-V654 HydrophobicContact CB-CG2 4.17Å; V640-V654 HydrophobicContact CG1-CG1 4.29Å; V640-V654 HydrophobicContact CG1-CG2 3.67Å; V640-V654 HydrophobicContact CG2-CG1 3.88Å
641	T	75.3	Confident	67.8	Low	125 Å²	125	101 Å²	101	77%	0.767	62%	0.616	S	S	*	*			trans	-85	113.8	174.8	-51.5	0	0	0	0	110
642	L	69.6	Low	66.3	Low	95 Å²	95	101.3 Å²	101.3	50%	0.497	62%	0.621	S	S	.	*	P	Polyproline II helix	trans	-81.8	124.5	172.2	-65.6	177.4	0	0	0	110	V654	L642-V654 HydrophobicContact CD2-CG2 3.49Å; L642-V654 VanDerWaalsContact CD2-CG2 3.49Å; L642-V654 HydrophobicContact CG-CG2 4.28Å
643	R	64.3	Low	65.1	Low	219 Å²	219	104.3 Å²	104.3	83%	0.826	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-99.6	128.8	173.1	-65.2	-174.2	-177.7	-172.1	0.8	109.1
644	G	57.3	Low	64.3	Low	79 Å²	79	99 Å²	99	81%	0.814	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-58.8	137.9	179.4	0	0	0	0	0	112.6
645	A	53.9	Low	63.7	Low	60 Å²	60	101.6 Å²	101.6	50%	0.496	66%	0.66	S	S	.	*	P	Polyproline II helix	trans	-82.4	147.4	176.9	0	0	0	0	0	111.4
646	P	54.1	Low	63.8	Low	119 Å²	119	101.6 Å²	101.6	77%	0.773	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-59.8	149.3	167.8	-18.1	30.9	0	0	0	111.2	G648	P646-G648 PolarHBondContact O-N 2.96Å
647	S	50.2	Low	64	Low	132 Å²	132	103.5 Å²	103.5	92%	0.923	65%	0.652	S	S	*	*	S	Bend	trans	-49.4	120.7	-177.5	47.5	0	0	0	0	113.2
648	G	53.7	Low	64.4	Low	65 Å²	65	102.8 Å²	102.8	67%	0.67	64%	0.639	S	S	*	*	S	Bend	trans	132.6	9.5	167	0	0	0	0	0	119.4	P646	P646-G648 PolarHBondContact O-N 2.96Å
649	H	50.9	Low	64.7	Low	180 Å²	180	99.2 Å²	99.2	83%	0.833	63%	0.631	S	S	*	*	S	Bend	trans	126.8	154.9	165.8	-66.4	-52	0	0	0	113.7
650	P	54.5	Low	65.3	Low	100 Å²	100	95.7 Å²	95.7	65%	0.649	60%	0.602	S	S	*	*			cis	-124	169.3	-31.6	34.7	-17	0	0	0	113.2
651	L	59.6	Low	65.8	Low	136 Å²	136	94.2 Å²	94.2	71%	0.712	60%	0.601	S	S	*	*			trans	-13.9	124	168.2	-66.9	141.5	0	0	0	116.9	A653	L651-A653 PolarHBondContact O-N 2.91Å
652	S	61.4	Low	66.1	Low	64 Å²	64	91.8 Å²	91.8	45%	0.448	59%	0.593	S	S	.	*			trans	-77.1	115.5	166.4	-51.8	0	0	0	0	110
653	A	65.2	Low	66.9	Low	96 Å²	96	88.6 Å²	88.6	79%	0.793	58%	0.583	S	S	*	*			trans	-110.8	141.8	177.3	0	0	0	0	0	110.9	L651	L651-A653 PolarHBondContact O-N 2.91Å
654	V	67.8	Low	68.2	Low	59 Å²	59	79.8 Å²	79.8	36%	0.358	55%	0.551	S	S	.	*			trans	-117.9	131.9	173.2	-177.8	0	0	0	0	107.9	V640 L642 F656	V640-V654 HydrophobicContact CB-CG1 4.22Å; V640-V654 HydrophobicContact CB-CG2 4.17Å; V640-V654 HydrophobicContact CG1-CG1 4.29Å; V640-V654 HydrophobicContact CG1-CG2 3.67Å; V640-V654 HydrophobicContact CG2-CG1 3.88Å; L642-V654 HydrophobicContact CD2-CG2 3.49Å; L642-V654 VanDerWaalsContact CD2-CG2 3.49Å; L642-V654 HydrophobicContact CG-CG2 4.28Å; V654-F656 HydrophobicContact CG1-CE2 4.29Å; V654-F656 HydrophobicContact CG1-CZ 4.18Å
655	S	70.3	Confident	69.7	Low	114 Å²	114	78 Å²	78	80%	0.797	52%	0.523	S	S	*	.			trans	-112.6	128.8	173.1	-177.3	0	0	0	0	109.4
656	F	72.6	Confident	71.3	Confident	74 Å²	74	82.2 Å²	82.2	33%	0.325	53%	0.526	S	S	.	.			trans	-92.4	105.9	173.8	-64.4	-81.9	0	0	0	108.8	H634 V654 Y658	H634-F656 HydrophobicContact CB-CB 4.43Å; V654-F656 HydrophobicContact CG1-CE2 4.29Å; V654-F656 HydrophobicContact CG1-CZ 4.18Å; F656-Y658 HydrophobicContact CB-CE2 4.33Å; F656-Y658 PolarHBondContact O-N 3Å
657	A	73.3	Confident	73.1	Confident	66 Å²	66	77.3 Å²	77.3	55%	0.545	50%	0.496	S	S	.	.			trans	-78.8	116	173.3	0	0	0	0	0	109.5	H634 G635	H634-A657 CarbonylContact C-O 3.6Å; H634-A657 WeakPolarHBondContact CA-O 3.42Å; H634-A657 WeakPolarHBondContact CB-O 3.49Å; G635-A657 PolarHBondContact N-O 3.47Å
658	Y	80.3	Confident	75.1	Confident	70 Å²	70	72 Å²	72	28%	0.275	46%	0.46	S	S	.	.	B	Isolated β-bridge	trans	-80.6	152	171.2	-72.2	-90.9	0	0	0	110.9	V632 H634 F656 A660 L665 Q677	V632-Y658 HydrophobicContact CG1-CD1 4.18Å; H634-Y658 HydrophobicContact CB-CD1 4.21Å; H634-Y658 HydrophobicContact CB-CE1 4.24Å; F656-Y658 HydrophobicContact CB-CE2 4.33Å; F656-Y658 PolarHBondContact O-N 3Å; Y658-A660 WeakPolarHBondContact CB-O 3.14Å; Y658-A660 PolarHBondContact O-N 2.66Å; Y658-L665 HydrophobicContact CD1-CD1 4.5Å; Y658-L665 HydrophobicContact CD2-CD1 4.03Å; Y658-L665 HydrophobicContact CG-CD1 3.9Å; Y658-Q677 VanDerWaalsContact OH-CD 3.24Å; Y658-Q677 PolarHBondContact OH-NE2 2.96Å
659	A	77.3	Confident	76.9	Confident	84 Å²	84	71.2 Å²	71.2	69%	0.694	44%	0.441	S	S	*	.	S	Bend	trans	-64.4	-26	170.1	0	0	0	0	0	112.2	R633	R633-A659 PolarHBondContact O-N 3.14Å
660	A	85.8	Confident	78.8	Confident	6 Å²	6	68.1 Å²	68.1	5%	0.05	43%	0.431	C	S	.	.	S	Bend	trans	-97.2	144.2	174.8	0	0	0	0	0	111.4	F618 V632 Y658 Q664 L665	F618-A660 HydrophobicContact CB-CB 4.33Å; F618-A660 HydrophobicContact CD2-CB 3.46Å; F618-A660 VanDerWaalsContact CD2-CB 3.46Å; F618-A660 HydrophobicContact CE2-CB 3.9Å; F618-A660 HydrophobicContact CG-CB 3.98Å; V632-A660 HydrophobicContact CG1-CB 3.96Å; Y658-A660 WeakPolarHBondContact CB-O 3.14Å; Y658-A660 PolarHBondContact O-N 2.66Å; A660-Q664 HydrophobicContact CB-CB 4.18Å; A660-L665 HydrophobicContact CB-CD2 3.99Å; A660-L665 HydrophobicContact CB-CG 4.05Å
661	G	84.1	Confident	80.4	Confident	36 Å²	36	68.4 Å²	68.4	37%	0.371	43%	0.427	S	S	.	.			trans	-69.6	161	173.9	0	0	0	0	0	112.8	G663 Q664 L665	G661-G663 VanDerWaalsContact C-N 3.25Å; G661-G663 PolarHBondContact O-N 3.41Å; G661-Q664 WeakPolarHBondContact O-CB 3.41Å; G661-Q664 PolarHBondContact O-N 3.24Å; G661-Q664 VanDerWaalsContact O-N 3.13Å; G661-L665 WeakPolarHBondContact O-CG 3.17Å; G661-L665 PolarHBondContact O-N 2.73Å
662	A	82.4	Confident	81.9	Confident	73 Å²	73	64.1 Å²	64.1	60%	0.603	41%	0.411	S	S	*	.	H	α-helix	trans	-58	-34.6	-178.8	0	0	0	0	0	113.7	R666	A662-R666 WeakPolarHBondContact O-CB 3.28Å; A662-R666 PolarHBondContact O-N 2.99Å
663	G	85.8	Confident	83.3	Confident	28 Å²	28	70.9 Å²	70.9	29%	0.289	44%	0.436	S	S	.	.	H	α-helix	trans	-65.4	-47.8	174.7	0	0	0	0	0	112.5	L615 G661 L665 R666 A667	L615-G663 VanDerWaalsContact CD1-C 3.45Å; L615-G663 WeakPolarHBondContact CD1-O 3.31Å; G661-G663 VanDerWaalsContact C-N 3.25Å; G661-G663 PolarHBondContact O-N 3.41Å; G663-L665 PolarHBondContact O-N 3.1Å; G663-R666 PolarHBondContact O-N 2.64Å; G663-A667 PolarHBondContact O-N 3.11Å
664	Q	91	Very high	84.5	Confident	34 Å²	34	74.6 Å²	74.6	16%	0.159	43%	0.429	C	S	.	.	H	α-helix	trans	-60.9	-45	177.3	-71.7	168.6	-33.8	0	0	111.6	L615 G616 F618 A660 G661 R666 A667 A668	L615-Q664 HydrophobicContact CB-CG 4.15Å; G616-Q664 PolarHBondContact O-NE2 3.19Å; F618-Q664 HydrophobicContact CD1-CB 3.66Å; F618-Q664 HydrophobicContact CD1-CG 3.72Å; F618-Q664 HydrophobicContact CE1-CB 3.72Å; F618-Q664 HydrophobicContact CE1-CG 4.17Å; F618-Q664 HydrophobicContact CG-CB 4.17Å; F618-Q664 HydrophobicContact CG-CG 4.34Å; F618-Q664 HydrophobicContact CZ-CB 4.25Å; A660-Q664 HydrophobicContact CB-CB 4.18Å; G661-Q664 WeakPolarHBondContact O-CB 3.41Å; G661-Q664 PolarHBondContact O-N 3.24Å; G661-Q664 VanDerWaalsContact O-N 3.13Å; Q664-R666 VanDerWaalsContact C-N 3.35Å; Q664-R666 PolarHBondContact O-N 3.07Å; Q664-A667 PolarHBondContact O-N 3.08Å; Q664-A668 PolarHBondContact O-N 2.8Å
665	L	89.2	Confident	85.5	Confident	42 Å²	42	75.7 Å²	75.7	22%	0.22	44%	0.438	C	S	.	.	H	α-helix	trans	-59.1	-46.2	174.4	-70.9	174.1	0	0	0	111.3	V632 Y658 A660 G661 G663 A667 A668 V669	V632-L665 HydrophobicContact CB-CD2 4.16Å; V632-L665 HydrophobicContact CG1-CD2 3.88Å; V632-L665 HydrophobicContact CG2-CD2 4.11Å; Y658-L665 HydrophobicContact CD1-CD1 4.5Å; Y658-L665 HydrophobicContact CD2-CD1 4.03Å; Y658-L665 HydrophobicContact CG-CD1 3.9Å; A660-L665 HydrophobicContact CB-CD2 3.99Å; A660-L665 HydrophobicContact CB-CG 4.05Å; G661-L665 WeakPolarHBondContact O-CG 3.17Å; G661-L665 PolarHBondContact O-N 2.73Å; G663-L665 PolarHBondContact O-N 3.1Å; L665-A667 PolarHBondContact O-N 3.41Å; L665-A668 PolarHBondContact O-N 3.23Å; L665-V669 WeakPolarHBondContact O-CB 3.21Å; L665-V669 WeakPolarHBondContact O-CG2 3.42Å; L665-V669 PolarHBondContact O-N 3.46Å
666	R	88.6	Confident	86.3	Confident	149 Å²	149	75.7 Å²	75.7	56%	0.562	43%	0.426	S	S	*	.	H	α-helix	trans	-62.4	-43.1	178.3	-173.3	-178.8	-65.4	148.7	-1.5	111.7	A662 G663 Q664 V669 N670	A662-R666 WeakPolarHBondContact O-CB 3.28Å; A662-R666 PolarHBondContact O-N 2.99Å; G663-R666 PolarHBondContact O-N 2.64Å; Q664-R666 VanDerWaalsContact C-N 3.35Å; Q664-R666 PolarHBondContact O-N 3.07Å; R666-V669 PolarHBondContact O-N 2.77Å; R666-N670 WeakPolarHBondContact O-CB 3.45Å; R666-N670 PolarHBondContact O-N 3.29Å; R666-N670 PolarHBondContact O-ND2 2.59Å; R666-N670 PolarHBondContact O-OD1 3.41Å
667	A	91.4	Very high	86.6	Confident	16 Å²	16	77.8 Å²	77.8	13%	0.132	44%	0.437	C	S	.	.	H	α-helix	trans	-60.3	-48.3	176.8	0	0	0	0	0	111.2	A609 L615 G663 Q664 L665 V669 N670 L671	A609-A667 HydrophobicContact CB-CB 3.75Å; L615-A667 HydrophobicContact CD1-CB 3.94Å; G663-A667 PolarHBondContact O-N 3.11Å; Q664-A667 PolarHBondContact O-N 3.08Å; L665-A667 PolarHBondContact O-N 3.41Å; A667-V669 PolarHBondContact O-N 3.2Å; A667-N670 PolarHBondContact O-N 3.44Å; A667-L671 WeakPolarHBondContact O-CG 3.39Å; A667-L671 PolarHBondContact O-N 3.43Å
668	A	92.2	Very high	86.8	Confident	20 Å²	20	85.7 Å²	85.7	17%	0.165	45%	0.452	C	S	.	.	H	α-helix	trans	-63.4	-41.8	177.5	0	0	0	0	0	113.1	A609 F618 Q664 L665 N670 L671 A672	A609-A668 HydrophobicContact CB-CB 4.22Å; F618-A668 HydrophobicContact CZ-CB 4.02Å; Q664-A668 PolarHBondContact O-N 2.8Å; L665-A668 PolarHBondContact O-N 3.23Å; A668-N670 VanDerWaalsContact C-N 3.32Å; A668-N670 PolarHBondContact O-N 3.44Å; A668-L671 PolarHBondContact O-N 2.78Å; A668-A672 PolarHBondContact O-N 3.1Å; A668-A672 VanDerWaalsContact O-N 3.16Å
669	V	90.8	Very high	86.5	Confident	48 Å²	48	85.3 Å²	85.3	29%	0.291	46%	0.455	S	S	.	.	H	α-helix	trans	-64.4	-37.2	177.4	170.3	0	0	0	0	111.5	L665 R666 A667 L671 A672 C675	L665-V669 WeakPolarHBondContact O-CB 3.21Å; L665-V669 WeakPolarHBondContact O-CG2 3.42Å; L665-V669 PolarHBondContact O-N 3.46Å; R666-V669 PolarHBondContact O-N 2.77Å; A667-V669 PolarHBondContact O-N 3.2Å; V669-L671 PolarHBondContact O-N 3.21Å; V669-A672 PolarHBondContact O-N 3.08Å; V669-C675 HydrophobicContact CG1-CB 4.2Å; V669-C675 HydrophobicContact CG2-CB 4.44Å
670	N	90.6	Very high	86.3	Confident	116 Å²	116	85 Å²	85	62%	0.62	45%	0.453	S	S	*	.	H	α-helix	trans	-68.2	-24.6	178.3	-72.9	-13.3	0	0	0	113.1	R666 A667 A668	R666-N670 WeakPolarHBondContact O-CB 3.45Å; R666-N670 PolarHBondContact O-N 3.29Å; R666-N670 PolarHBondContact O-ND2 2.59Å; R666-N670 PolarHBondContact O-OD1 3.41Å; A667-N670 PolarHBondContact O-N 3.44Å; A668-N670 VanDerWaalsContact C-N 3.32Å; A668-N670 PolarHBondContact O-N 3.44Å
671	L	89.6	Confident	85.7	Confident	105 Å²	105	89.1 Å²	89.1	55%	0.55	47%	0.473	S	S	.	.	H	α-helix	trans	-87.3	-19.8	175.6	-65.9	167	0	0	0	113	A609 A667 A668 V669	A609-L671 HydrophobicContact CB-CD1 4.01Å; A609-L671 WeakPolarHBondContact O-CD1 3.49Å; A667-L671 WeakPolarHBondContact O-CG 3.39Å; A667-L671 PolarHBondContact O-N 3.43Å; A668-L671 PolarHBondContact O-N 2.78Å; V669-L671 PolarHBondContact O-N 3.21Å
672	A	91.4	Very high	85.3	Confident	47 Å²	47	97.2 Å²	97.2	39%	0.388	49%	0.492	S	S	.	.			trans	-78.4	133.2	-176.9	0	0	0	0	0	111.2	A668 V669 R674	A668-A672 PolarHBondContact O-N 3.1Å; A668-A672 VanDerWaalsContact O-N 3.16Å; V669-A672 PolarHBondContact O-N 3.08Å; A672-R674 VanDerWaalsContact C-N 3.26Å; A672-R674 PolarHBondContact O-N 3.25Å
673	E	90.6	Very high	84.6	Confident	205 Å²	205	94.4 Å²	94.4	96%	0.958	47%	0.468	S	S	*	.	S	Bend	trans	-61.1	-38.9	169.9	-174.5	-175.4	175.3	0	0	111.3
674	R	89.8	Confident	83.4	Confident	174 Å²	174	95.6 Å²	95.6	66%	0.657	48%	0.48	S	S	*	.			trans	-141.4	134.4	179.3	179	175.2	167.2	160.9	-4.5	110.6	A672 E676	A672-R674 VanDerWaalsContact C-N 3.26Å; A672-R674 PolarHBondContact O-N 3.25Å; R674-E676 IonicContact CZ-OE2 3.47Å; R674-E676 IonicContact NE-OE2 3.28Å; R674-E676 PolarHBondContact NE-OE2 2.99Å; R674-E676 IonicContact NH2-OE2 2.83Å; R674-E676 PolarHBondContact NH2-OE2 3.46Å
675	C	88.1	Confident	81.9	Confident	82 Å²	82	98.2 Å²	98.2	55%	0.554	50%	0.499	S	S	*	.			trans	-126.4	132.3	174.8	178	0	0	0	0	110.1	V669	V669-C675 HydrophobicContact CG1-CB 4.2Å; V669-C675 HydrophobicContact CG2-CB 4.44Å
676	E	86.8	Confident	80.1	Confident	115 Å²	115	99.4 Å²	99.4	54%	0.537	52%	0.515	S	S	.	.			trans	-134.9	141	177.8	58.2	-174.1	-144.8	0	0	112.1	W629 R674	W629-E676 HydrophobicContact CH2-CG 4.23Å; W629-E676 HydrophobicContact CZ3-CG 4Å; R674-E676 IonicContact CZ-OE2 3.47Å; R674-E676 IonicContact NE-OE2 3.28Å; R674-E676 PolarHBondContact NE-OE2 2.99Å; R674-E676 IonicContact NH2-OE2 2.83Å; R674-E676 PolarHBondContact NH2-OE2 3.46Å
677	Q	80.6	Confident	78.3	Confident	118 Å²	118	103.3 Å²	103.3	55%	0.551	53%	0.529	S	S	*	.			trans	-134.2	127.6	172.1	-178.3	-176.9	-3	0	0	108.5	Y658 L679	Y658-Q677 VanDerWaalsContact OH-CD 3.24Å; Y658-Q677 PolarHBondContact OH-NE2 2.96Å; Q677-L679 HydrophobicContact CG-CD1 3.94Å
678	R	77.4	Confident	76.1	Confident	232 Å²	232	109.6 Å²	109.6	88%	0.875	55%	0.55	S	S	*	.			trans	-96.3	119.8	177.6	-172.6	175.6	-179	172.8	1.1	110.2
679	L	72.8	Confident	73.8	Confident	61 Å²	61	113.9 Å²	113.9	32%	0.319	58%	0.576	S	S	.	*			trans	-110.8	133	165.8	-66.5	96.2	0	0	0	109.1	Q677 W711	Q677-L679 HydrophobicContact CG-CD1 3.94Å; L679-W711 HydrophobicContact CB-CZ3 4.29Å; L679-W711 HydrophobicContact CD2-CZ3 4.25Å
680	A	73.9	Confident	71.5	Confident	79 Å²	79	118 Å²	118	65%	0.653	60%	0.597	S	S	*	*			trans	-126.8	127.6	176.5	0	0	0	0	0	109.6
681	L	72.7	Confident	69.4	Low	91 Å²	91	114.8 Å²	114.8	48%	0.476	58%	0.583	S	S	.	*			trans	-101.6	124.5	172.3	179.7	64.9	0	0	0	108.4	W711	L681-W711 HydrophobicContact CB-CE3 4.46Å
682	R	74.8	Confident	67.4	Low	206 Å²	206	120.6 Å²	120.6	78%	0.777	60%	0.597	S	S	*	*			trans	-111.8	140.4	170.6	-64.3	-170.6	179.4	166.3	-1.2	109	W745	R682-W745 WeakPolarHBondContact CB-OXT 3.23Å; R682-W745 VanDerWaalsContact CG-OXT 3.28Å; R682-W745 WeakPolarHBondContact CG-OXT 3.5Å
683	C	69.2	Low	65.6	Low	14 Å²	14	125.4 Å²	125.4	10%	0.095	62%	0.616	C	S	.	*			trans	-142.3	108	-162.1	51	0	0	0	0	110.9	C738 W745	C683-C738 HydrophobicContact CB-CB 3.74Å; C683-C738 WeakPolarHBondContact CB-SG 2.96Å; C683-C738 WeakPolarHBondContact SG-CA 3.37Å; C683-C738 WeakPolarHBondContact SG-CB 3.46Å; C683-C738 CovalentContact SG-SG 2.03Å; C683-C738 PolarHBondContact SG-SG 3.45Å; C683-W745 CarbonylContact C-O 3.6Å; C683-W745 PolarHBondContact N-O 3.26Å
684	G	60.6	Low	63.8	Low	53 Å²	53	117.8 Å²	117.8	55%	0.546	59%	0.593	S	S	.	*	S	Bend	trans	-99.8	115.4	171.3	0	0	0	0	0	110.6	A686	G684-A686 VanDerWaalsContact C-N 3.34Å; G684-A686 PolarHBondContact O-N 2.82Å
685	T	58.7	Low	62.2	Low	90 Å²	90	114.4 Å²	114.4	55%	0.552	59%	0.592	S	S	*	*	S	Bend	trans	43.6	48.5	178	44.1	0	0	0	0	115.5	R687 G741 N743	T685-R687 VanDerWaalsContact C-N 3.32Å; T685-R687 PolarHBondContact O-N 2.79Å; T685-G741 VanDerWaalsContact CG2-O 3.23Å; T685-G741 WeakPolarHBondContact CG2-O 3.28Å; T685-N743 WeakPolarHBondContact CG2-OD1 3.23Å
686	A	50.9	Low	60.8	Low	66 Å²	66	113.8 Å²	113.8	55%	0.545	59%	0.587	S	S	.	*			trans	-77.8	77.8	169.9	0	0	0	0	0	110.8	G684	G684-A686 VanDerWaalsContact C-N 3.34Å; G684-A686 PolarHBondContact O-N 2.82Å
687	R	50.6	Low	59.5	Low	231 Å²	231	113.7 Å²	113.7	87%	0.872	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-75	131.7	169	-90.3	-177	176.1	178.1	-0.2	110.5	T685	T685-R687 VanDerWaalsContact C-N 3.32Å; T685-R687 PolarHBondContact O-N 2.79Å
688	R	46.8	Very low	58.8	Low	148 Å²	148	110.4 Å²	110.4	56%	0.558	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-46.3	153.8	167.6	-104.5	-173.3	-155.7	169.2	-2.9	113.3	S691 L697	R688-S691 VanDerWaalsContact NH1-CB 3.32Å; R688-S691 PolarHBondContact NH1-OG 3.47Å; R688-S691 PolarHBondContact NH2-OG 2.84Å; R688-S691 VanDerWaalsContact NH2-OG 3.14Å; R688-L697 HydrophobicContact CG-CD1 3.54Å
689	P	44.3	Very low	58.4	Low	110 Å²	110	105.4 Å²	105.4	71%	0.714	56%	0.56	S	S	*	*	S	Bend		-94.3	119	124.6	5.6	13.6	0	0	0	109.2
690	D	41.5	Very low	58.4	Low	136 Å²	136	106.5 Å²	106.5	73%	0.727	56%	0.561	S	S	*	*			trans	34	119.4	160.1	-132.9	-13.6	0	0	0	120.7
691	S	46.7	Very low	58.3	Low	47 Å²	47	105.5 Å²	105.5	33%	0.329	55%	0.546	S	S	.	.			trans	-117.3	103.7	159.6	94	0	0	0	0	109.5	R688	R688-S691 VanDerWaalsContact NH1-CB 3.32Å; R688-S691 PolarHBondContact NH1-OG 3.47Å; R688-S691 PolarHBondContact NH2-OG 2.84Å; R688-S691 VanDerWaalsContact NH2-OG 3.14Å
692	R	47.4	Very low	58	Low	228 Å²	228	102.1 Å²	102.1	86%	0.86	53%	0.533	S	S	*	.	S	Bend	trans	-107	-10.9	152.6	-70.2	-172.4	-179.9	-165.3	-0.4	112.8
693	D	53	Low	57.5	Low	147 Å²	147	101.8 Å²	101.8	79%	0.786	53%	0.532	S	S	*	.	S	Bend	trans	-111.3	0.3	-171.2	-63.4	-19.3	0	0	0	115.5	T695	D693-T695 VanDerWaalsContact C-N 3.31Å; D693-T695 PolarHBondContact O-N 3.22Å
694	G	53.9	Low	57.3	Low	45 Å²	45	104.5 Å²	104.5	46%	0.464	55%	0.548	S	S	.	.			trans	74.6	10.8	174.1	0	0	0	0	0	116.2
695	T	56.7	Low	57.7	Low	104 Å²	104	108.5 Å²	108.5	64%	0.638	56%	0.557	S	S	*	*			trans	-71	126.8	-178.9	-34.1	0	0	0	0	112	D693 L697	D693-T695 VanDerWaalsContact C-N 3.31Å; D693-T695 PolarHBondContact O-N 3.22Å; T695-L697 PolarHBondContact O-N 2.75Å
696	P	58.3	Low	58.3	Low	69 Å²	69	109.6 Å²	109.6	45%	0.448	56%	0.556	S	S	.	*			trans	-68.3	129.8	179.6	23.6	-29.6	0	0	0	111.8	T709	P696-T709 HydrophobicContact CB-CG2 3.64Å; P696-T709 HydrophobicContact CG-CG2 3.46Å; P696-T709 VanDerWaalsContact CG-CG2 3.46Å
697	L	60	Low	59.4	Low	113 Å²	113	110.7 Å²	110.7	59%	0.592	56%	0.556	S	S	*	*	S	Bend	trans	-84.2	-14.3	-174.1	-65.8	166.7	0	0	0	114	R688 T695	R688-L697 HydrophobicContact CG-CD1 3.54Å; T695-L697 PolarHBondContact O-N 2.75Å
698	S	65.8	Low	60.5	Low	48 Å²	48	102 Å²	102	34%	0.336	53%	0.525	S	S	.	.			trans	-144.9	148.3	175.6	63.1	0	0	0	0	109.3	W711	S698-W711 PolarHBondContact OG-NE1 2.94Å
699	W	69.1	Low	61.6	Low	127 Å²	127	97.7 Å²	97.7	48%	0.481	52%	0.515	S	S	.	.			trans	-152.5	159.5	179.2	55.6	-91.8	0	0	0	109.3	V701 T707 H708 T709	W699-V701 HydrophobicContact CE3-CG2 3.72Å; W699-V701 HydrophobicContact CZ3-CB 4.36Å; W699-V701 HydrophobicContact CZ3-CG2 3.38Å; W699-T707 HydrophobicContact CB-CG2 3.65Å; W699-T707 HydrophobicContact CD2-CG2 3.91Å; W699-T707 HydrophobicContact CE3-CG2 3.91Å; W699-T707 HydrophobicContact CG-CG2 3.83Å; W699-H708 CarbonylContact C-O 3.51Å; W699-H708 WeakPolarHBondContact CA-O 3.39Å; W699-H708 VanDerWaalsContact CB-O 3.31Å; W699-H708 WeakPolarHBondContact CB-O 3.16Å; W699-T709 HydrophobicContact CB-CG2 4.3Å
700	W	71.7	Confident	62.8	Low	85 Å²	85	93.5 Å²	93.5	32%	0.322	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	153.8	170.7	62.3	-83.1	0	0	0	108.7	G702 H708 S710 W711	W700-G702 VanDerWaalsContact CZ3-CA 3.48Å; W700-H708 HydrophobicContact CD2-CB 3.84Å; W700-H708 AromaticContact CE2-CG 3.9Å; W700-H708 HydrophobicContact CE3-CB 4.47Å; W700-H708 AromaticContact CE3-CD2 3.98Å; W700-H708 HydrophobicContact CG-CB 4.24Å; W700-H708 HydrophobicContact CH2-CB 4.26Å; W700-H708 AromaticContact CH2-CD2 3.58Å; W700-H708 AromaticContact CH2-CG 3.87Å; W700-H708 HydrophobicContact CZ2-CB 3.59Å; W700-H708 AromaticContact CZ2-CD2 3.84Å; W700-H708 AromaticContact CZ2-CG 3.65Å; W700-H708 AromaticContact CZ3-CD2 3.67Å; W700-H708 PolarHBondContact N-O 2.84Å; W700-H708 PolarHBondContact O-N 3.48Å; W700-S710 PolarHBondContact NE1-O 3.16Å; W700-W711 HydrophobicContact CB-CH2 4.36Å; W700-W711 HydrophobicContact CB-CZ2 4.48Å
701	V	71.3	Confident	64.1	Low	58 Å²	58	90.1 Å²	90.1	35%	0.352	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	128.2	177.7	167.1	0	0	0	0	109	W699 N705 E706	W699-V701 HydrophobicContact CE3-CG2 3.72Å; W699-V701 HydrophobicContact CZ3-CB 4.36Å; W699-V701 HydrophobicContact CZ3-CG2 3.38Å; V701-N705 WeakPolarHBondContact CG1-OD1 3.12Å; V701-E706 WeakPolarHBondContact CA-O 3.22Å
702	G	66.6	Low	64.6	Low	19 Å²	19	90.6 Å²	90.6	20%	0.196	48%	0.478	C	S	.	.			trans	-91.9	-169.1	-177.9	0	0	0	0	0	113.7	W700 T704 N705 E706	W700-G702 VanDerWaalsContact CZ3-CA 3.48Å; G702-T704 PolarHBondContact O-N 3.32Å; G702-T704 VanDerWaalsContact O-N 3.12Å; G702-N705 PolarHBondContact O-N 3.05Å; G702-N705 VanDerWaalsContact O-N 3.08Å; G702-E706 PolarHBondContact N-O 3.3Å
703	R	64.4	Low	65.4	Low	199 Å²	199	83.1 Å²	83.1	75%	0.751	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-25.6	-178	74.8	-179.9	-166.3	164.4	4.1	114.7	N705	R703-N705 VanDerWaalsContact C-N 3.33Å
704	T	65	Low	66.2	Low	72 Å²	72	77 Å²	77	44%	0.442	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	3.4	-177.9	43.3	0	0	0	0	113	G702 E706	G702-T704 PolarHBondContact O-N 3.32Å; G702-T704 VanDerWaalsContact O-N 3.12Å; T704-E706 WeakPolarHBondContact CB-OE2 3.08Å; T704-E706 PolarHBondContact O-N 3.46Å; T704-E706 VanDerWaalsContact OG1-CD 3.26Å; T704-E706 WeakPolarHBondContact OG1-CG 3.41Å; T704-E706 PolarHBondContact OG1-OE2 3.13Å
705	N	68.3	Low	66.9	Low	137 Å²	137	80.3 Å²	80.3	73%	0.733	45%	0.447	S	S	*	.	S	Bend	trans	59.6	19	-170.3	-153.8	40	0	0	0	113.3	V701 G702 R703	V701-N705 WeakPolarHBondContact CG1-OD1 3.12Å; G702-N705 PolarHBondContact O-N 3.05Å; G702-N705 VanDerWaalsContact O-N 3.08Å; R703-N705 VanDerWaalsContact C-N 3.33Å
706	E	72.1	Confident	67.4	Low	112 Å²	112	79.7 Å²	79.7	52%	0.523	45%	0.445	S	S	.	.			trans	-86	138.5	175.7	-69.2	167.6	162.7	0	0	109.7	V701 G702 T704 H708	V701-E706 WeakPolarHBondContact CA-O 3.22Å; G702-E706 PolarHBondContact N-O 3.3Å; T704-E706 WeakPolarHBondContact CB-OE2 3.08Å; T704-E706 PolarHBondContact O-N 3.46Å; T704-E706 VanDerWaalsContact OG1-CD 3.26Å; T704-E706 WeakPolarHBondContact OG1-CG 3.41Å; T704-E706 PolarHBondContact OG1-OE2 3.13Å; E706-H708 PolarHBondContact O-CD2 3.31Å; E706-H708 VanDerWaalsContact O-CD2 3.23Å; E706-H708 PolarHBondContact O-N 2.55Å
707	T	74.1	Confident	67.7	Low	90 Å²	90	83.2 Å²	83.2	55%	0.552	46%	0.46	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.3	117.7	175.6	-55.9	0	0	0	0	109.4	W699	W699-T707 HydrophobicContact CB-CG2 3.65Å; W699-T707 HydrophobicContact CD2-CG2 3.91Å; W699-T707 HydrophobicContact CE3-CG2 3.91Å; W699-T707 HydrophobicContact CG-CG2 3.83Å
708	H	72.9	Confident	68.2	Low	47 Å²	47	79.2 Å²	79.2	22%	0.218	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	133.9	173.8	-60.4	-80.5	0	0	0	110.1	W699 W700 E706	W699-H708 CarbonylContact C-O 3.51Å; W699-H708 WeakPolarHBondContact CA-O 3.39Å; W699-H708 VanDerWaalsContact CB-O 3.31Å; W699-H708 WeakPolarHBondContact CB-O 3.16Å; W700-H708 HydrophobicContact CD2-CB 3.84Å; W700-H708 AromaticContact CE2-CG 3.9Å; W700-H708 HydrophobicContact CE3-CB 4.47Å; W700-H708 AromaticContact CE3-CD2 3.98Å; W700-H708 HydrophobicContact CG-CB 4.24Å; W700-H708 HydrophobicContact CH2-CB 4.26Å; W700-H708 AromaticContact CH2-CD2 3.58Å; W700-H708 AromaticContact CH2-CG 3.87Å; W700-H708 HydrophobicContact CZ2-CB 3.59Å; W700-H708 AromaticContact CZ2-CD2 3.84Å; W700-H708 AromaticContact CZ2-CG 3.65Å; W700-H708 AromaticContact CZ3-CD2 3.67Å; W700-H708 PolarHBondContact N-O 2.84Å; W700-H708 PolarHBondContact O-N 3.48Å; E706-H708 PolarHBondContact O-CD2 3.31Å; E706-H708 VanDerWaalsContact O-CD2 3.23Å; E706-H708 PolarHBondContact O-N 2.55Å
709	T	71.3	Confident	68.4	Low	59 Å²	59	84.3 Å²	84.3	36%	0.362	46%	0.462	S	S	.	.			trans	-109.5	-5.9	-175.3	55.7	0	0	0	0	112.3	P696 W699	P696-T709 HydrophobicContact CB-CG2 3.64Å; P696-T709 HydrophobicContact CG-CG2 3.46Å; P696-T709 VanDerWaalsContact CG-CG2 3.46Å; W699-T709 HydrophobicContact CB-CG2 4.3Å
710	S	68.9	Low	68.5	Low	22 Å²	22	81.9 Å²	81.9	15%	0.154	45%	0.454	C	S	.	.			trans	-94.1	138.7	177.6	55.1	0	0	0	0	111.6	W700	W700-S710 PolarHBondContact NE1-O 3.16Å
711	W	69.1	Low	68.7	Low	65 Å²	65	79.6 Å²	79.6	25%	0.246	45%	0.451	C	S	.	.			trans	-112.8	151	177	-69.4	86	0	0	0	111.9	L679 L681 S698 W700 S714	L679-W711 HydrophobicContact CB-CZ3 4.29Å; L679-W711 HydrophobicContact CD2-CZ3 4.25Å; L681-W711 HydrophobicContact CB-CE3 4.46Å; S698-W711 PolarHBondContact OG-NE1 2.94Å; W700-W711 HydrophobicContact CB-CH2 4.36Å; W700-W711 HydrophobicContact CB-CZ2 4.48Å; W711-S714 WeakPolarHBondContact O-CB 3.35Å; W711-S714 PolarHBondContact O-N 3.45Å
712	G	58	Low	69	Low	57 Å²	57	78.7 Å²	78.7	59%	0.588	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	21.4	96.9	171.9	0	0	0	0	0	117.6	S714 T722	G712-S714 VanDerWaalsContact C-N 3.3Å; G712-S714 PolarHBondContact O-N 2.93Å; G712-T722 PolarHBondContact O-OG1 2.95Å
713	G	63.3	Low	69.5	Low	71 Å²	71	78.6 Å²	78.6	73%	0.732	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.2	-1.8	171.8	0	0	0	0	0	116.2	T722	G713-T722 WeakPolarHBondContact CA-OG1 3.45Å; G713-T722 PolarHBondContact O-OG1 3.28Å
714	S	69.2	Low	70.2	Confident	18 Å²	18	69.8 Å²	69.8	13%	0.126	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-85.2	151.9	175	-173.9	0	0	0	0	113.8	W711 G712 K720	W711-S714 WeakPolarHBondContact O-CB 3.35Å; W711-S714 PolarHBondContact O-N 3.45Å; G712-S714 VanDerWaalsContact C-N 3.3Å; G712-S714 PolarHBondContact O-N 2.93Å; S714-K720 WeakPolarHBondContact CB-O 3.31Å; S714-K720 PolarHBondContact OG-O 2.88Å
715	L	68.9	Low	70.9	Confident	115 Å²	115	70 Å²	70	60%	0.602	41%	0.411	S	S	*	.	P	Polyproline II helix	trans	-76.5	148.1	173.1	-68.5	168.7	0	0	0	111.1	D717 A718	L715-D717 PolarHBondContact O-N 3.15Å; L715-A718 HydrophobicContact CB-CB 4.21Å; L715-A718 WeakPolarHBondContact O-CB 3.2Å; L715-A718 PolarHBondContact O-N 3.14Å
716	P	66.5	Low	71.6	Confident	90 Å²	90	69.6 Å²	69.6	58%	0.584	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	140	167.8	-22.8	33.2	0	0	0	110.7	A718	P716-A718 PolarHBondContact O-N 3.23Å
717	D	64.9	Low	72.1	Confident	143 Å²	143	67.6 Å²	67.6	77%	0.765	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.3	-0.9	179	-51.2	-40.8	0	0	0	117.4	L715 Q719	L715-D717 PolarHBondContact O-N 3.15Å; D717-Q719 PolarHBondContact O-N 3.11Å; D717-Q719 VanDerWaalsContact O-N 3.13Å
718	A	70.1	Confident	72.7	Confident	29 Å²	29	67.7 Å²	67.7	24%	0.24	41%	0.411	C	S	.	.			trans	-64.1	-20.7	-179.8	0	0	0	0	0	113.8	L715 P716 K720 L725	L715-A718 HydrophobicContact CB-CB 4.21Å; L715-A718 WeakPolarHBondContact O-CB 3.2Å; L715-A718 PolarHBondContact O-N 3.14Å; P716-A718 PolarHBondContact O-N 3.23Å; A718-K720 WeakPolarHBondContact O-CG 3.14Å; A718-K720 PolarHBondContact O-N 2.86Å; A718-L725 HydrophobicContact CB-CD2 4.08Å
719	Q	70.2	Confident	73	Confident	156 Å²	156	66.2 Å²	66.2	73%	0.729	41%	0.406	S	S	*	.			trans	49.4	21.7	-171.8	-60.1	-163.3	-14.1	0	0	114.2	D717	D717-Q719 PolarHBondContact O-N 3.11Å; D717-Q719 VanDerWaalsContact O-N 3.13Å
720	K	72.3	Confident	73.3	Confident	75 Å²	75	67.9 Å²	67.9	33%	0.326	41%	0.412	S	S	.	.	S	Bend	trans	-126.7	154.3	179.9	-67.2	177.8	179.6	-166.1	0	109.3	S714 A718 L725 Y735	S714-K720 WeakPolarHBondContact CB-O 3.31Å; S714-K720 PolarHBondContact OG-O 2.88Å; A718-K720 WeakPolarHBondContact O-CG 3.14Å; A718-K720 PolarHBondContact O-N 2.86Å; K720-L725 HydrophobicContact CB-CD2 4.36Å; K720-L725 HydrophobicContact CB-CG 4.28Å; K720-L725 HydrophobicContact CD-CD2 4.31Å; K720-Y735 HydrophobicContact CD-CD1 4.13Å; K720-Y735 HydrophobicContact CG-CD1 3.92Å; K720-Y735 HydrophobicContact CG-CG 3.91Å
721	C	74.7	Confident	73.7	Confident	38 Å²	38	69.1 Å²	69.1	26%	0.257	42%	0.417	S	S	.	.			trans	-86.9	172.1	166.4	-64.8	0	0	0	0	109.6	C723 G724 L725 Y735 C736	C721-C723 PolarHBondContact O-N 2.94Å; C721-C723 VanDerWaalsContact O-N 3.14Å; C721-G724 WeakPolarHBondContact O-CA 3.46Å; C721-G724 PolarHBondContact O-N 2.71Å; C721-L725 PolarHBondContact O-N 3.12Å; C721-L725 VanDerWaalsContact O-N 3.11Å; C721-Y735 PolarHBondContact N-O 3.05Å; C721-C736 HydrophobicContact CB-CB 3.83Å; C721-C736 WeakPolarHBondContact CB-SG 3.28Å; C721-C736 PolarHBondContact N-SG 3.22Å; C721-C736 WeakPolarHBondContact SG-CB 3.18Å; C721-C736 CovalentContact SG-SG 2.04Å; C721-C736 PolarHBondContact SG-SG 3.25Å
722	T	78.1	Confident	74.1	Confident	38 Å²	38	71.5 Å²	71.5	23%	0.233	44%	0.444	C	S	.	.	H	α-helix	trans	-48.3	-43.5	176.4	-65.3	0	0	0	0	112.4	G712 G713 G724 L725 E726	G712-T722 PolarHBondContact O-OG1 2.95Å; G713-T722 WeakPolarHBondContact CA-OG1 3.45Å; G713-T722 PolarHBondContact O-OG1 3.28Å; T722-G724 PolarHBondContact O-N 2.82Å; T722-L725 PolarHBondContact O-N 2.06Å; T722-L725 VanDerWaalsContact O-N 3.15Å; T722-E726 HydrophobicContact CG2-CG 4.23Å; T722-E726 WeakPolarHBondContact CG2-OE1 3.25Å; T722-E726 WeakPolarHBondContact O-CG 3.43Å; T722-E726 PolarHBondContact O-N 2.04Å
723	C	77.6	Confident	75.1	Confident	17 Å²	17	76.2 Å²	76.2	12%	0.115	45%	0.45	C	S	.	.	H	α-helix	trans	-63.6	-30.1	179.1	75.5	0	0	0	0	114	C721 G727 N728 C729 N737	C721-C723 PolarHBondContact O-N 2.94Å; C721-C723 VanDerWaalsContact O-N 3.14Å; C723-G727 WeakPolarHBondContact O-CA 3.05Å; C723-G727 PolarHBondContact O-N 3.42Å; C723-N728 WeakPolarHBondContact CA-OD1 3.38Å; C723-N728 VanDerWaalsContact CB-OD1 3.25Å; C723-N728 WeakPolarHBondContact CB-OD1 3.49Å; C723-N728 PolarHBondContact O-N 3.28Å; C723-N728 PolarHBondContact O-OD1 3.43Å; C723-C729 HydrophobicContact CB-CB 3.95Å; C723-C729 WeakPolarHBondContact CB-SG 3Å; C723-C729 PolarHBondContact O-N 3.36Å; C723-C729 PolarHBondContact O-SG 3Å; C723-C729 VanDerWaalsContact SG-CA 3.57Å; C723-C729 WeakPolarHBondContact SG-CB 3.05Å; C723-C729 CovalentContact SG-SG 2.06Å; C723-C729 PolarHBondContact SG-SG 3.5Å; C723-N737 PolarHBondContact SG-OD1 3Å
724	G	78.5	Confident	75.6	Confident	14 Å²	14	77.2 Å²	77.2	14%	0.144	43%	0.433	C	S	.	.	H	α-helix	trans	-79.5	-26.5	179.8	0	0	0	0	0	112.2	C721 T722 C729	C721-G724 WeakPolarHBondContact O-CA 3.46Å; C721-G724 PolarHBondContact O-N 2.71Å; T722-G724 PolarHBondContact O-N 2.82Å; G724-C729 VanDerWaalsContact CA-SG 3.53Å; G724-C729 PolarHBondContact N-SG 2.03Å
725	L	79.6	Confident	76	Confident	76 Å²	76	83 Å²	83	40%	0.398	45%	0.453	S	S	.	.	H	α-helix	trans	-75.9	-41.5	170.8	-69.3	175	0	0	0	111.5	A718 K720 C721 T722 G727	A718-L725 HydrophobicContact CB-CD2 4.08Å; K720-L725 HydrophobicContact CB-CD2 4.36Å; K720-L725 HydrophobicContact CB-CG 4.28Å; K720-L725 HydrophobicContact CD-CD2 4.31Å; C721-L725 PolarHBondContact O-N 3.12Å; C721-L725 VanDerWaalsContact O-N 3.11Å; T722-L725 PolarHBondContact O-N 2.06Å; T722-L725 VanDerWaalsContact O-N 3.15Å; L725-G727 VanDerWaalsContact C-N 3.3Å
726	E	83.9	Confident	76.3	Confident	129 Å²	129	78.3 Å²	78.3	60%	0.603	43%	0.429	S	S	*	.	H	α-helix	trans	-79.9	-11.2	179.4	-67.1	179.3	175.8	0	0	113.2	T722 N728	T722-E726 HydrophobicContact CG2-CG 4.23Å; T722-E726 WeakPolarHBondContact CG2-OE1 3.25Å; T722-E726 WeakPolarHBondContact O-CG 3.43Å; T722-E726 PolarHBondContact O-N 2.04Å; E726-N728 VanDerWaalsContact C-N 3.28Å; E726-N728 PolarHBondContact O-N 3.14Å; E726-N728 PolarHBondContact OE2-ND2 3.16Å
727	G	82.9	Confident	76.8	Confident	70 Å²	70	75.7 Å²	75.7	72%	0.722	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.3	22.9	-179.3	0	0	0	0	0	113.9	C723 L725	C723-G727 WeakPolarHBondContact O-CA 3.05Å; C723-G727 PolarHBondContact O-N 3.42Å; L725-G727 VanDerWaalsContact C-N 3.3Å
728	N	85.6	Confident	77.3	Confident	92 Å²	92	70.5 Å²	70.5	49%	0.492	39%	0.385	S	S	.	.			trans	-118.2	18.8	-175.7	67	9.2	0	0	0	113.1	C723 E726	C723-N728 WeakPolarHBondContact CA-OD1 3.38Å; C723-N728 VanDerWaalsContact CB-OD1 3.25Å; C723-N728 WeakPolarHBondContact CB-OD1 3.49Å; C723-N728 PolarHBondContact O-N 3.28Å; C723-N728 PolarHBondContact O-OD1 3.43Å; E726-N728 VanDerWaalsContact C-N 3.28Å; E726-N728 PolarHBondContact O-N 3.14Å; E726-N728 PolarHBondContact OE2-ND2 3.16Å
729	C	79.8	Confident	77.3	Confident	17 Å²	17	72.8 Å²	72.8	12%	0.115	39%	0.393	C	S	.	.			trans	-59.6	145.5	167.8	-61.7	0	0	0	0	110	C723 G724 D731 N737	C723-C729 HydrophobicContact CB-CB 3.95Å; C723-C729 WeakPolarHBondContact CB-SG 3Å; C723-C729 PolarHBondContact O-N 3.36Å; C723-C729 PolarHBondContact O-SG 3Å; C723-C729 VanDerWaalsContact SG-CA 3.57Å; C723-C729 WeakPolarHBondContact SG-CB 3.05Å; C723-C729 CovalentContact SG-SG 2.06Å; C723-C729 PolarHBondContact SG-SG 3.5Å; G724-C729 VanDerWaalsContact CA-SG 3.53Å; G724-C729 PolarHBondContact N-SG 2.03Å; C729-D731 PolarHBondContact O-N 3.3Å; C729-N737 WeakPolarHBondContact CA-OD1 3.12Å; C729-N737 WeakPolarHBondContact CB-OD1 3.35Å
730	I	77.3	Confident	77.3	Confident	94 Å²	94	66.6 Å²	66.6	48%	0.482	37%	0.368	S	S	.	.	S	Bend	trans	-59.3	-40.3	-177.5	-76.1	161.5	0	0	0	111.5	N737 W745	I730-N737 PolarHBondContact N-OD1 2.82Å; I730-N737 VanDerWaalsContact N-OD1 3.16Å; I730-W745 VanDerWaalsContact CD1-CE2 3.43Å; I730-W745 HydrophobicContact CD1-CZ2 3.33Å; I730-W745 HydrophobicContact CG1-CZ2 4.45Å
731	D	77.9	Confident	76.9	Confident	47 Å²	47	64.2 Å²	64.2	25%	0.251	37%	0.365	S	S	.	.	S	Bend	trans	-112.3	107.2	172.8	-173	-17.5	0	0	0	109	C729 Q733 Y734 A740	C729-D731 PolarHBondContact O-N 3.3Å; D731-Q733 PolarHBondContact O-N 3.33Å; D731-Q733 VanDerWaalsContact OD1-CB 3.28Å; D731-Q733 WeakPolarHBondContact OD1-CB 3.43Å; D731-Q733 WeakPolarHBondContact OD1-CG 3.45Å; D731-Q733 PolarHBondContact OD1-N 3.48Å; D731-Y734 HydrophobicContact CB-CD2 3.79Å; D731-Y734 HydrophobicContact CB-CE2 4.3Å; D731-Y734 PolarHBondContact O-N 2.93Å; D731-Y734 VanDerWaalsContact OD2-CE2 3.23Å; D731-Y734 WeakPolarHBondContact OD2-CE2 3.45Å; D731-A740 HydrophobicContact CB-CB 4.46Å
732	S	77.9	Confident	76.5	Confident	116 Å²	116	66.2 Å²	66.2	81%	0.811	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-11.8	179.2	60.8	0	0	0	0	114.6	Y734	S732-Y734 VanDerWaalsContact C-N 3.3Å
733	Q	77.6	Confident	75.8	Confident	156 Å²	156	70.3 Å²	70.3	73%	0.729	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-15.7	175	-59.9	-173.7	2.3	0	0	113.1	D731	D731-Q733 PolarHBondContact O-N 3.33Å; D731-Q733 VanDerWaalsContact OD1-CB 3.28Å; D731-Q733 WeakPolarHBondContact OD1-CB 3.43Å; D731-Q733 WeakPolarHBondContact OD1-CG 3.45Å; D731-Q733 PolarHBondContact OD1-N 3.48Å
734	Y	74.9	Confident	75.2	Confident	92 Å²	92	76.3 Å²	76.3	36%	0.361	42%	0.418	S	S	.	.			trans	-112.6	152.8	-177.9	-61.2	-78.3	0	0	0	112.3	D731 S732 D739 A740	D731-Y734 HydrophobicContact CB-CD2 3.79Å; D731-Y734 HydrophobicContact CB-CE2 4.3Å; D731-Y734 PolarHBondContact O-N 2.93Å; D731-Y734 VanDerWaalsContact OD2-CE2 3.23Å; D731-Y734 WeakPolarHBondContact OD2-CE2 3.45Å; S732-Y734 VanDerWaalsContact C-N 3.3Å; Y734-D739 HydrophobicContact CD1-CB 3.59Å; Y734-D739 HydrophobicContact CE1-CB 4.39Å; Y734-D739 HydrophobicContact CG-CB 4.01Å; Y734-A740 HydrophobicContact CD2-CB 3.92Å; Y734-A740 HydrophobicContact CE2-CB 4.14Å
735	Y	76.8	Confident	74.2	Confident	139 Å²	139	82.4 Å²	82.4	55%	0.545	44%	0.436	S	S	.	.	S	Bend	trans	-90	-12.3	179.8	-68.8	-38.3	0	0	0	113.4	K720 C721	K720-Y735 HydrophobicContact CD-CD1 4.13Å; K720-Y735 HydrophobicContact CG-CD1 3.92Å; K720-Y735 HydrophobicContact CG-CG 3.91Å; C721-Y735 PolarHBondContact N-O 3.05Å
736	C	76	Confident	74	Confident	17 Å²	17	82.8 Å²	82.8	12%	0.115	44%	0.438	C	S	.	.	S	Bend	trans	-145.2	142.6	173.8	-69.5	0	0	0	0	110.6	C721 C738 D739	C721-C736 HydrophobicContact CB-CB 3.83Å; C721-C736 WeakPolarHBondContact CB-SG 3.28Å; C721-C736 PolarHBondContact N-SG 3.22Å; C721-C736 WeakPolarHBondContact SG-CB 3.18Å; C721-C736 CovalentContact SG-SG 2.04Å; C721-C736 PolarHBondContact SG-SG 3.25Å; C736-C738 PolarHBondContact O-N 3.18Å; C736-D739 WeakPolarHBondContact CB-OD2 3.07Å; C736-D739 PolarHBondContact N-OD2 3.06Å; C736-D739 WeakPolarHBondContact O-CB 3.27Å; C736-D739 PolarHBondContact O-N 2.7Å
737	N	77.1	Confident	73.4	Confident	34 Å²	34	80.3 Å²	80.3	18%	0.182	43%	0.43	C	S	.	.	G	3₁₀ helix	trans	-58.1	-31.2	176.9	-74.4	-20.3	0	0	0	113.2	C723 C729 I730 D739 A740	C723-N737 PolarHBondContact SG-OD1 3Å; C729-N737 WeakPolarHBondContact CA-OD1 3.12Å; C729-N737 WeakPolarHBondContact CB-OD1 3.35Å; I730-N737 PolarHBondContact N-OD1 2.82Å; I730-N737 VanDerWaalsContact N-OD1 3.16Å; N737-D739 PolarHBondContact O-N 3.14Å; N737-A740 WeakPolarHBondContact O-CB 3.38Å; N737-A740 PolarHBondContact O-N 3.29Å
738	C	73.8	Confident	72.9	Confident	34 Å²	34	80.9 Å²	80.9	23%	0.23	41%	0.413	C	S	.	.	G	3₁₀ helix	trans	-64.3	-22	176.6	-70.2	0	0	0	0	114.2	C683 C736 A740	C683-C738 HydrophobicContact CB-CB 3.74Å; C683-C738 WeakPolarHBondContact CB-SG 2.96Å; C683-C738 WeakPolarHBondContact SG-CA 3.37Å; C683-C738 WeakPolarHBondContact SG-CB 3.46Å; C683-C738 CovalentContact SG-SG 2.03Å; C683-C738 PolarHBondContact SG-SG 3.45Å; C736-C738 PolarHBondContact O-N 3.18Å; C738-A740 VanDerWaalsContact C-N 3.3Å
739	D	70.9	Confident	72.2	Confident	78 Å²	78	80.2 Å²	80.2	42%	0.417	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-77.6	-20.3	179.9	-57.4	-31.5	0	0	0	111.9	Y734 C736 N737 G741	Y734-D739 HydrophobicContact CD1-CB 3.59Å; Y734-D739 HydrophobicContact CE1-CB 4.39Å; Y734-D739 HydrophobicContact CG-CB 4.01Å; C736-D739 WeakPolarHBondContact CB-OD2 3.07Å; C736-D739 PolarHBondContact N-OD2 3.06Å; C736-D739 WeakPolarHBondContact O-CB 3.27Å; C736-D739 PolarHBondContact O-N 2.7Å; N737-D739 PolarHBondContact O-N 3.14Å; D739-G741 PolarHBondContact O-N 3Å
740	A	70.3	Confident	71.7	Confident	25 Å²	25	84.2 Å²	84.2	21%	0.207	43%	0.427	C	S	.	.	G	3₁₀ helix	trans	-74	-9.7	-178.4	0	0	0	0	0	113.4	D731 Y734 N737 C738 Q742	D731-A740 HydrophobicContact CB-CB 4.46Å; Y734-A740 HydrophobicContact CD2-CB 3.92Å; Y734-A740 HydrophobicContact CE2-CB 4.14Å; N737-A740 WeakPolarHBondContact O-CB 3.38Å; N737-A740 PolarHBondContact O-N 3.29Å; C738-A740 VanDerWaalsContact C-N 3.3Å; A740-Q742 HydrophobicContact CB-CG 4.37Å; A740-Q742 PolarHBondContact O-N 3.22Å
741	G	64.1	Low	71.3	Confident	25 Å²	25	83.5 Å²	83.5	26%	0.258	42%	0.424	S	S	.	.			trans	64.1	24	175.1	0	0	0	0	0	114.6	T685 D739	T685-G741 VanDerWaalsContact CG2-O 3.23Å; T685-G741 WeakPolarHBondContact CG2-O 3.28Å; D739-G741 PolarHBondContact O-N 3Å
742	Q	66.3	Low	70.8	Confident	80 Å²	80	86.1 Å²	86.1	37%	0.374	44%	0.436	S	S	.	.			trans	-89.8	152.6	176.3	-59.2	-163.6	8.7	0	0	111.2	A740 E744	A740-Q742 HydrophobicContact CB-CG 4.37Å; A740-Q742 PolarHBondContact O-N 3.22Å; Q742-E744 VanDerWaalsContact C-N 3.28Å; Q742-E744 PolarHBondContact O-N 3.21Å
743	N	63.1	Low	70.3	Confident	125 Å²	125	83.8 Å²	83.8	67%	0.668	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	10.8	-178.4	-75.5	-20.5	0	0	0	113.7	T685	T685-N743 WeakPolarHBondContact CG2-OD1 3.23Å
744	E	64.6	Low	69.7	Low	143 Å²	143	77.8 Å²	77.8	67%	0.668	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-4.4	-172.1	-63.4	-175.6	170.1	0	0	114.2	Q742	Q742-E744 VanDerWaalsContact C-N 3.28Å; Q742-E744 PolarHBondContact O-N 3.21Å
745	W	58.4	Low	69.2	Low	142 Å²	142	76.5 Å²	76.5	54%	0.538	38%	0.382	S	S	.	.			trans	-128.5	0	-165.4	-67.5	91.3	0	0	0	116.4	R682 C683 I730	R682-W745 WeakPolarHBondContact CB-OXT 3.23Å; R682-W745 VanDerWaalsContact CG-OXT 3.28Å; R682-W745 WeakPolarHBondContact CG-OXT 3.5Å; C683-W745 CarbonylContact C-O 3.6Å; C683-W745 PolarHBondContact N-O 3.26Å; I730-W745 VanDerWaalsContact CD1-CE2 3.43Å; I730-W745 HydrophobicContact CD1-CZ2 3.33Å; I730-W745 HydrophobicContact CG1-CZ2 4.45Å

Retrieved 745 of 745 residues in 296 ms (Link to these results)

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