A0A077ZE52_TRITR Loading...

Trypsin domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZE52, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 844 aa.

						>A0A077ZE52_TRITR|A0A077ZE52
MLQDSKPLKPGKLPCPKPTRPAQPAPPVQRPVYCGNTDTFERTVESYVTGNNAQDMFPWNVILTSRIKGSTKCIGSLVHRGGYQQTANTSDLIITAADCFKKYTPASAKSELLIFANSPRFSRQKRRGIKVKIADVNLYGLPWGNNETLRGIAILKLERPLSRVDNVVPVCLAERDSVPPPSASCYVTYYDKREHRMDEEIIMITRKPRCLAANSKAPQYRGVCAMEEKKRQYIQLGAPMVCLVNSRVYLYGVYLNQLSLKINNNVKQNLGFYGEINVAHDVFSGKKVQTLSENVDRQPGVKPHKPIHASSSSSSSSSASREKRRRRTRIISEIYIPISTKLPTISRPEQKRSKSSSSSSSSSSSSDSSSKRVTISRESKDNSKSAEEADDSTRVIRLNVKLVKTRLAALLRFNKTKRPHHSGSSSSSLGEEIIPHPLPDRPKGPVICPTPGQRPVKPTPDSSNGVLICPTHDNAIHIVPLPTPLPTAEYPSSSLEAVNMVILPSLPKYDMSDQTIADHEHILVQDNIVGESAIAKGRTASCDIIGIGNSMHSLLPGKSSGEKIGNEIDSRIPDVTEALKTVPCTRGNSTEHHQYDHLPGASGVHIFLVSGSSIEPLCTGTLYAKRGQEYSDEVVTASRCVPPTGNNKYQVYIGSLLPRKMAADQLNRTLIEVGNVYARPFYEGYDELKDIGMTMLKLKHRVKVINGVQPFPLPYSGTGASSRMQCFISGVCQHGMPVRVQYQLLTPTECKQHLGKKFLPSVMYCGVGQKSVLQYPIGSPLVCQSSGNWVQFGIYDHSFPTRRSYAAGESENEIIPDDVALFVKLEGDKVGQVQNVDTISNDIV
					

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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	38	Very low	39.6	Very low	235 Å²	235	159.2 Å²	159.2	100%	1.158	87%	0.866	S	S	*	*				0	157.2	0	-77.9	-177.3	162.9	0	0	108.6
2	L	39.2	Very low	39.9	Very low	154 Å²	154	164 Å²	164	81%	0.806	87%	0.873	S	S	*	*			trans	59.5	80.5	170.7	-62.3	146	0	0	0	113.8
3	Q	39	Very low	40.2	Very low	184 Å²	184	163.8 Å²	163.8	86%	0.86	87%	0.871	S	S	*	*				82.5	117.9	81.2	-81	-173.1	-39	0	0	114.7
4	D	36.2	Very low	40.7	Very low	163 Å²	163	160.4 Å²	160.4	87%	0.872	86%	0.862	S	S	*	*			trans	-73.2	148.7	177.2	-71	-87.2	0	0	0	114.3
5	S	41.9	Very low	40.8	Very low	120 Å²	120	157.5 Å²	157.5	84%	0.839	86%	0.858	S	S	*	*			trans	-157.7	121.3	157	-80.7	0	0	0	0	110.6
6	K	39.4	Very low	41.3	Very low	206 Å²	206	155.3 Å²	155.3	90%	0.896	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-75.9	134.1	178.6	-83.4	175.5	174.6	168.8	0	111.3
7	P	42.8	Very low	41.7	Very low	127 Å²	127	157.2 Å²	157.2	83%	0.825	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-75.4	149.5	176.5	30.8	-34.8	0	0	0	112.7
8	L	36.7	Very low	41.9	Very low	170 Å²	170	155.7 Å²	155.7	89%	0.89	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-77.2	152.5	179.1	-134.8	74.5	0	0	0	112	P10	L8-P10 WeakPolarHBondContact O-CD 3.43Å
9	K	37.5	Very low	42	Very low	196 Å²	196	154.6 Å²	154.6	85%	0.852	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-74.9	122.4	171.4	-73.2	179.2	177.1	175.7	0	110.5
10	P	44.3	Very low	42.2	Very low	128 Å²	128	156.8 Å²	156.8	83%	0.831	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-74.2	144	171.9	30.4	-33.6	0	0	0	111.5	L8	L8-P10 WeakPolarHBondContact O-CD 3.43Å
11	G	40.6	Very low	42.4	Very low	68 Å²	68	154.6 Å²	154.6	70%	0.701	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-74.5	159.7	178.2	0	0	0	0	0	113.6	L13	G11-L13 PolarHBondContact O-N 3.11Å; G11-L13 VanDerWaalsContact O-N 3.11Å
12	K	43.3	Very low	43	Very low	217 Å²	217	148 Å²	148	94%	0.943	82%	0.822	S	S	*	*			trans	-69.6	104.3	176.2	-70.7	-178.8	176.9	179.5	0	111
13	L	43.6	Very low	43.6	Very low	162 Å²	162	148 Å²	148	85%	0.848	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-66.7	135	162.1	-79.6	158	0	0	0	109.7	G11	G11-L13 PolarHBondContact O-N 3.11Å; G11-L13 VanDerWaalsContact O-N 3.11Å
14	P	47.9	Very low	44	Very low	115 Å²	115	145.1 Å²	145.1	75%	0.747	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-72.9	133.1	174.6	29.9	-33.1	0	0	0	110.3
15	C	41.8	Very low	44.5	Very low	118 Å²	118	141.4 Å²	141.4	80%	0.797	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-59.2	134.4	177.9	-58.6	0	0	0	0	110.9	K17	C15-K17 PolarHBondContact O-N 3.33Å
16	P	49.1	Very low	44.7	Very low	121 Å²	121	141 Å²	141	79%	0.786	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-62.8	129.8	174.1	26.7	-33.3	0	0	0	109.5
17	K	47.8	Very low	45.3	Very low	189 Å²	189	136.8 Å²	136.8	82%	0.822	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-59.9	138.5	172.2	-68.7	179.6	179.5	177	0	108.6	C15 T19	C15-K17 PolarHBondContact O-N 3.33Å; K17-T19 PolarHBondContact O-N 2.99Å
18	P	44.7	Very low	45.9	Very low	129 Å²	129	137.2 Å²	137.2	84%	0.838	80%	0.795	S	S	*	*			trans	-59.2	113.7	-178.8	24	-33.6	0	0	0	109.7	R20	P18-R20 PolarHBondContact O-N 3.1Å; P18-R20 VanDerWaalsContact O-N 3.1Å
19	T	45.4	Very low	47.3	Very low	136 Å²	136	137.8 Å²	137.8	83%	0.834	79%	0.793	S	S	*	*			trans	-63.2	114.7	177.2	-47	0	0	0	0	107.9	K17	K17-T19 PolarHBondContact O-N 2.99Å
20	R	45.6	Very low	49.1	Very low	197 Å²	197	137.3 Å²	137.3	74%	0.743	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-50.5	125.9	174.3	-172.9	-176.1	-166.6	-175	5.4	107.6	P18 A22	P18-R20 PolarHBondContact O-N 3.1Å; P18-R20 VanDerWaalsContact O-N 3.1Å; R20-A22 PolarHBondContact O-N 3.11Å
21	P	46.2	Very low	51.1	Low	111 Å²	111	134.3 Å²	134.3	72%	0.721	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-55.5	129.9	-178.2	22.2	-32.9	0	0	0	108.6	Q23	P21-Q23 PolarHBondContact O-N 3.2Å; P21-Q23 VanDerWaalsContact O-N 3.11Å
22	A	49.6	Very low	53.5	Low	97 Å²	97	131.5 Å²	131.5	80%	0.802	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-55.2	121.9	-179.9	0	0	0	0	0	108.2	R20	R20-A22 PolarHBondContact O-N 3.11Å
23	Q	51.5	Low	55.9	Low	153 Å²	153	124.3 Å²	124.3	72%	0.715	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-58.8	132.7	176.6	-70.9	-176.5	-49.1	0	0	107.7	P21 A25	P21-Q23 PolarHBondContact O-N 3.2Å; P21-Q23 VanDerWaalsContact O-N 3.11Å; Q23-A25 PolarHBondContact O-N 3.12Å; Q23-A25 VanDerWaalsContact O-N 3.12Å
24	P	47.5	Very low	58.4	Low	124 Å²	124	116.6 Å²	116.6	81%	0.805	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-52.1	125.2	175.6	-26.1	34.3	0	0	0	109
25	A	47.1	Very low	60.6	Low	85 Å²	85	111.1 Å²	111.1	70%	0.702	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-53.7	131.8	176.5	0	0	0	0	0	108.2	Q23	Q23-A25 PolarHBondContact O-N 3.12Å; Q23-A25 VanDerWaalsContact O-N 3.12Å
26	P	47.5	Very low	63.1	Low	112 Å²	112	106.6 Å²	106.6	73%	0.727	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-56	130.3	-174.5	22.4	-33.1	0	0	0	108.9	V28	P26-V28 PolarHBondContact O-N 2.89Å
27	P	51.9	Low	65.2	Low	117 Å²	117	101 Å²	101	76%	0.76	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-57.5	119.1	-168.3	21.4	-33.2	0	0	0	109.6	Q29	P27-Q29 PolarHBondContact O-N 3.05Å
28	V	55.2	Low	67.2	Low	137 Å²	137	96.7 Å²	96.7	83%	0.83	54%	0.544	S	S	*	.			trans	-57.7	105.6	-171.3	-179.6	0	0	0	0	108.8	P26 R30	P26-V28 PolarHBondContact O-N 2.89Å; V28-R30 PolarHBondContact O-N 2.93Å
29	Q	64.8	Low	69.3	Low	181 Å²	181	91.2 Å²	91.2	85%	0.846	51%	0.509	S	S	*	.			trans	-68.1	103.5	-174	-64.9	-170.9	12.1	0	0	108.7	P27	P27-Q29 PolarHBondContact O-N 3.05Å
30	R	76.9	Confident	71.4	Confident	187 Å²	187	86.9 Å²	86.9	71%	0.706	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-54.1	129.9	179.1	-67.9	-176	179.7	170.5	1	109.3	V28 V32	V28-R30 PolarHBondContact O-N 2.93Å; R30-V32 PolarHBondContact O-N 3.45Å
31	P	85.2	Confident	73.5	Confident	65 Å²	65	85.8 Å²	85.8	42%	0.422	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-58	131.2	-177.4	20.8	-31.6	0	0	0	111	Y33 T86	P31-Y33 HydrophobicContact CB-CE2 3.93Å; P31-Y33 HydrophobicContact CG-CE2 3.86Å; P31-Y33 WeakPolarHBondContact O-CD2 3.47Å; P31-Y33 WeakPolarHBondContact O-CE2 3.48Å; P31-T86 HydrophobicContact CB-CG2 3.8Å
32	V	91.2	Very high	75.5	Confident	8 Å²	8	83 Å²	83	5%	0.048	46%	0.457	C	S	.	.	P	Polyproline II helix	trans	-84.8	134	176.2	178	0	0	0	0	108.2	R30 T39 T86 A87 R163 V168	R30-V32 PolarHBondContact O-N 3.45Å; V32-T39 HydrophobicContact CG2-CG2 4.42Å; V32-T86 CarbonylContact O-C 3.54Å; V32-T86 VanDerWaalsContact O-CA 3.31Å; V32-T86 WeakPolarHBondContact O-CA 3.25Å; V32-A87 PolarHBondContact O-N 3.25Å; V32-R163 HydrophobicContact CG2-CB 4.19Å; V32-V168 HydrophobicContact CG1-CG1 4.15Å; V32-V168 HydrophobicContact CG1-CG2 3.81Å
33	Y	94.6	Very high	77.5	Confident	67 Å²	67	82 Å²	82	26%	0.263	44%	0.441	S	S	.	.	B	Isolated β-bridge	trans	-119.2	153	174.4	-62.4	-82.7	0	0	0	109.9	P31 Q84 Q85 T86 V168	P31-Y33 HydrophobicContact CB-CE2 3.93Å; P31-Y33 HydrophobicContact CG-CE2 3.86Å; P31-Y33 WeakPolarHBondContact O-CD2 3.47Å; P31-Y33 WeakPolarHBondContact O-CE2 3.48Å; Y33-Q84 WeakPolarHBondContact CE1-O 3.41Å; Y33-Q85 WeakPolarHBondContact CD1-O 3.47Å; Y33-T86 HydrophobicContact CE1-CG2 4.35Å; Y33-V168 WeakPolarHBondContact O-CG1 3.46Å
34	C	95.5	Very high	79.4	Confident	0 Å²	0	75.1 Å²	75.1	0%	0	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	150.2	176	64.4	0	0	0	0	111.4	N36 H79 A87 P169 C171 R247	C34-N36 PolarHBondContact O-N 3.21Å; C34-H79 HydrophobicContact CB-CB 3.55Å; C34-A87 HydrophobicContact CB-CB 4.17Å; C34-P169 CarbonylContact C-O 3.58Å; C34-P169 WeakPolarHBondContact CA-O 3.28Å; C34-P169 WeakPolarHBondContact CB-O 3.46Å; C34-C171 HydrophobicContact CB-CB 4Å; C34-C171 WeakPolarHBondContact CB-SG 3.33Å; C34-C171 PolarHBondContact O-SG 3.35Å; C34-C171 WeakPolarHBondContact SG-CA 3.38Å; C34-C171 WeakPolarHBondContact SG-CB 3.44Å; C34-C171 CovalentContact SG-SG 2.04Å; C34-C171 PolarHBondContact SG-SG 2.96Å; C34-R247 WeakPolarHBondContact O-CD 3.09Å
35	G	94.7	Very high	81.3	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.7	17.6	174.3	0	0	0	0	0	115.3	P169 V248	G35-P169 PolarHBondContact N-O 3.19Å; G35-V248 WeakPolarHBondContact CA-O 3.04Å; G35-V248 PolarHBondContact O-N 2.83Å
36	N	93.4	Very high	83.3	Confident	22 Å²	22	68 Å²	68	12%	0.118	35%	0.353	C	S	.	.			trans	-112.6	118.1	-180	-173.6	-12	0	0	0	110.9	C34 D38	C34-N36 PolarHBondContact O-N 3.21Å; N36-D38 WeakPolarHBondContact OD1-CB 3.38Å; N36-D38 PolarHBondContact OD1-N 2.86Å; N36-D38 PolarHBondContact OD1-OD2 3.01Å; N36-D38 VanDerWaalsContact OD1-OD2 3.13Å
37	T	92.6	Very high	85.4	Confident	3 Å²	3	63.4 Å²	63.4	2%	0.018	32%	0.321	C	S	.	.			trans	-91.6	-10.6	178.9	54.5	0	0	0	0	114.1	T39 F40 R42 V44 Y47 P58 W59	T37-T39 PolarHBondContact O-N 3.39Å; T37-T39 VanDerWaalsContact O-N 3.07Å; T37-F40 PolarHBondContact O-N 3.43Å; T37-R42 CarbonylContact C-O 3.4Å; T37-R42 WeakPolarHBondContact CB-O 3.5Å; T37-R42 PolarHBondContact OG1-O 2.95Å; T37-V44 HydrophobicContact CG2-CG2 4.08Å; T37-V44 PolarHBondContact OG1-N 3.07Å; T37-Y47 HydrophobicContact CG2-CE2 3.89Å; T37-P58 HydrophobicContact CG2-CG 4.1Å; T37-W59 HydrophobicContact CG2-CH2 3.97Å; T37-W59 HydrophobicContact CG2-CZ3 4.04Å
38	D	90.3	Very high	87.2	Confident	100 Å²	100	58.2 Å²	58.2	54%	0.535	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-60.2	-22	177.6	-53.3	-26.5	0	0	0	112.3	N36 F40 E41	N36-D38 WeakPolarHBondContact OD1-CB 3.38Å; N36-D38 PolarHBondContact OD1-N 2.86Å; N36-D38 PolarHBondContact OD1-OD2 3.01Å; N36-D38 VanDerWaalsContact OD1-OD2 3.13Å; D38-F40 PolarHBondContact O-N 3.14Å; D38-E41 PolarHBondContact O-N 3.18Å
39	T	88.1	Confident	88.6	Confident	14 Å²	14	53.1 Å²	53.1	9%	0.086	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-58.6	-20.9	169.9	-94.8	0	0	0	0	113.3	V32 T37 R163 V168	V32-T39 HydrophobicContact CG2-CG2 4.42Å; T37-T39 PolarHBondContact O-N 3.39Å; T37-T39 VanDerWaalsContact O-N 3.07Å; T39-R163 HydrophobicContact CG2-CG 3.88Å; T39-R163 VanDerWaalsContact O-CZ 3.22Å; T39-R163 PolarHBondContact O-NH2 2.68Å; T39-V168 HydrophobicContact CG2-CG2 3.67Å
40	F	90.3	Very high	89.3	Confident	45 Å²	45	46.9 Å²	46.9	20%	0.197	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-113.2	17.7	172.7	-54.7	-64.8	0	0	0	112.6	T37 D38 R42 P58 R163 N166 V168	T37-F40 PolarHBondContact O-N 3.43Å; D38-F40 PolarHBondContact O-N 3.14Å; F40-R42 WeakPolarHBondContact O-CG 3.41Å; F40-R42 PolarHBondContact O-N 3.37Å; F40-P58 HydrophobicContact CD2-CB 4.17Å; F40-P58 HydrophobicContact CD2-CG 4.3Å; F40-P58 HydrophobicContact CE2-CB 3.59Å; F40-P58 HydrophobicContact CE2-CG 4.05Å; F40-P58 HydrophobicContact CZ-CB 4.46Å; F40-R163 HydrophobicContact CE1-CG 4.16Å; F40-N166 HydrophobicContact CE1-CB 4.35Å; F40-V168 HydrophobicContact CD2-CG2 4.5Å; F40-V168 HydrophobicContact CE2-CB 4.15Å; F40-V168 HydrophobicContact CE2-CG2 3.51Å; F40-V168 HydrophobicContact CZ-CG2 3.79Å
41	E	90.1	Very high	89.2	Confident	174 Å²	174	45.6 Å²	45.6	81%	0.813	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.7	32.5	179.4	-61.7	174.8	-170.7	0	0	113.1	D38	D38-E41 PolarHBondContact O-N 3.18Å
42	R	88.6	Confident	88.7	Confident	52 Å²	52	46.5 Å²	46.5	20%	0.196	25%	0.249	C	C	.	.			trans	-132.6	139.9	-175.2	-77.4	174.9	73.4	149.1	-8.5	112	T37 F40 S46 Y47 N52 D55	T37-R42 CarbonylContact C-O 3.4Å; T37-R42 WeakPolarHBondContact CB-O 3.5Å; T37-R42 PolarHBondContact OG1-O 2.95Å; F40-R42 WeakPolarHBondContact O-CG 3.41Å; F40-R42 PolarHBondContact O-N 3.37Å; R42-S46 PolarHBondContact NE-OG 2.92Å; R42-Y47 HydrophobicContact CB-CE2 3.96Å; R42-N52 PolarHBondContact NH2-O 3.13Å; R42-D55 IonicContact CZ-OD2 3.25Å; R42-D55 IonicContact NH1-OD2 3.96Å; R42-D55 PolarHBondContact NH1-OD2 3.13Å; R42-D55 IonicContact NH2-OD2 3.7Å; R42-D55 PolarHBondContact NH2-OD2 2.84Å
43	T	90.3	Very high	88	Confident	77 Å²	77	47.3 Å²	47.3	47%	0.472	26%	0.257	S	S	.	.			trans	-77.1	158.4	167.4	65.1	0	0	0	0	110.9	E45 S46 Y47	T43-E45 VanDerWaalsContact C-N 3.29Å; T43-E45 WeakPolarHBondContact CB-OE2 3.46Å; T43-E45 PolarHBondContact O-N 2.66Å; T43-S46 WeakPolarHBondContact O-CB 3.49Å; T43-S46 PolarHBondContact O-N 3.02Å; T43-S46 PolarHBondContact O-OG 3.45Å; T43-S46 PolarHBondContact OG1-N 2.87Å; T43-Y47 WeakPolarHBondContact O-CD2 3.2Å
44	V	90.8	Very high	87.3	Confident	7 Å²	7	47.6 Å²	47.6	4%	0.042	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-62.6	-39.5	178.6	-177.9	0	0	0	0	110.7	T37 S46 Y47 F57 Y186 L243 V248	T37-V44 HydrophobicContact CG2-CG2 4.08Å; T37-V44 PolarHBondContact OG1-N 3.07Å; V44-S46 PolarHBondContact O-N 2.77Å; V44-Y47 PolarHBondContact O-N 3.48Å; V44-F57 HydrophobicContact CG1-CE1 3.76Å; V44-F57 HydrophobicContact CG1-CZ 4.28Å; V44-Y186 HydrophobicContact CG1-CE2 4.14Å; V44-L243 HydrophobicContact CB-CD2 4.36Å; V44-L243 HydrophobicContact CG2-CD1 4.17Å; V44-V248 HydrophobicContact CB-CG2 4.29Å; V44-V248 HydrophobicContact CG1-CG2 3.87Å; V44-V248 HydrophobicContact CG2-CG2 3.42Å; V44-V248 VanDerWaalsContact CG2-CG2 3.42Å
45	E	88	Confident	86.9	Confident	44 Å²	44	50.4 Å²	50.4	21%	0.206	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-62.4	-26	178.1	-60.4	90.5	154.9	0	0	112.9	T43 Y47 V48 T49	T43-E45 VanDerWaalsContact C-N 3.29Å; T43-E45 WeakPolarHBondContact CB-OE2 3.46Å; T43-E45 PolarHBondContact O-N 2.66Å; E45-Y47 PolarHBondContact O-N 2.93Å; E45-V48 PolarHBondContact O-N 2.71Å; E45-T49 PolarHBondContact O-N 2.79Å; E45-T49 PolarHBondContact O-OG1 3.26Å
46	S	90.2	Very high	86.8	Confident	17 Å²	17	50.8 Å²	50.8	12%	0.119	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-69.2	-14.8	179.2	77.8	0	0	0	0	114.3	R42 T43 V44 N52 A53	R42-S46 PolarHBondContact NE-OG 2.92Å; T43-S46 WeakPolarHBondContact O-CB 3.49Å; T43-S46 PolarHBondContact O-N 3.02Å; T43-S46 PolarHBondContact O-OG 3.45Å; T43-S46 PolarHBondContact OG1-N 2.87Å; V44-S46 PolarHBondContact O-N 2.77Å; S46-N52 CarbonylContact O-C 3.5Å; S46-N52 WeakPolarHBondContact O-CB 3.22Å; S46-A53 PolarHBondContact O-N 3.16Å
47	Y	91.4	Very high	86.9	Confident	14 Å²	14	49.8 Å²	49.8	6%	0.055	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-86.6	-10.6	172.2	-64	-92.9	0	0	0	112.3	T37 R42 T43 V44 E45 D55 M56 F57	T37-Y47 HydrophobicContact CG2-CE2 3.89Å; R42-Y47 HydrophobicContact CB-CE2 3.96Å; T43-Y47 WeakPolarHBondContact O-CD2 3.2Å; V44-Y47 PolarHBondContact O-N 3.48Å; E45-Y47 PolarHBondContact O-N 2.93Å; Y47-D55 HydrophobicContact CD1-CB 4.03Å; Y47-D55 HydrophobicContact CE1-CB 4.23Å; Y47-M56 VanDerWaalsContact CD1-O 3.24Å; Y47-M56 WeakPolarHBondContact CD1-O 3.31Å; Y47-M56 WeakPolarHBondContact CE1-O 3.32Å; Y47-F57 HydrophobicContact CD2-CD1 4.23Å; Y47-F57 AromaticContact CG-CD1 3.94Å; Y47-F57 HydrophobicContact CG-CD1 3.94Å; Y47-F57 HydrophobicContact CG-CE1 4.38Å
48	V	89.6	Confident	87	Confident	9 Å²	9	50 Å²	50	6%	0.055	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.4	-20.9	-170.4	-164.6	0	0	0	0	112	E45 F57 Y186 E199 I201	E45-V48 PolarHBondContact O-N 2.71Å; V48-F57 HydrophobicContact CG2-CE1 3.85Å; V48-F57 HydrophobicContact CG2-CZ 3.68Å; V48-Y186 HydrophobicContact CB-CD1 4.38Å; V48-Y186 HydrophobicContact CB-CE1 4.27Å; V48-Y186 HydrophobicContact CG1-CD1 4.03Å; V48-Y186 HydrophobicContact CG1-CE1 4.18Å; V48-Y186 HydrophobicContact CG2-CD1 3.72Å; V48-Y186 HydrophobicContact CG2-CE1 3.81Å; V48-E199 HydrophobicContact CB-CB 4.49Å; V48-E199 HydrophobicContact CG1-CB 4.34Å; V48-E199 HydrophobicContact CG2-CB 3.95Å; V48-I201 HydrophobicContact CG1-CG1 4.13Å
49	T	83.5	Confident	87.3	Confident	29 Å²	29	45.3 Å²	45.3	18%	0.178	25%	0.248	C	C	.	.	S	Bend	trans	-138.9	147.5	-174.6	58.2	0	0	0	0	112.3	E45 T748 Q752	E45-T49 PolarHBondContact O-N 2.79Å; E45-T49 PolarHBondContact O-OG1 3.26Å; T49-T748 HydrophobicContact CG2-CG2 4.14Å; T49-Q752 HydrophobicContact CG2-CG 3.6Å
50	G	79.5	Confident	87.8	Confident	51 Å²	51	44.6 Å²	44.6	53%	0.526	24%	0.244	S	C	.	.	S	Bend	trans	72.6	-172.9	-177.9	0	0	0	0	0	114.3	N52 A53	G50-N52 PolarHBondContact O-N 3.07Å; G50-A53 VanDerWaalsContact O-CB 3.28Å; G50-A53 WeakPolarHBondContact O-CB 2.77Å; G50-A53 PolarHBondContact O-N 2.92Å
51	N	74.5	Confident	88.1	Confident	160 Å²	160	42.5 Å²	42.5	86%	0.856	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-24.6	-173	-60.3	-4.6	0	0	0	114	A53	N51-A53 VanDerWaalsContact C-N 3.33Å
52	N	75.1	Confident	88.3	Confident	83 Å²	83	34.2 Å²	34.2	44%	0.444	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-6.3	-178.4	-74.6	0.3	0	0	0	113.6	R42 S46 G50 Q54 D55	R42-N52 PolarHBondContact NH2-O 3.13Å; S46-N52 CarbonylContact O-C 3.5Å; S46-N52 WeakPolarHBondContact O-CB 3.22Å; G50-N52 PolarHBondContact O-N 3.07Å; N52-Q54 PolarHBondContact O-N 2.84Å; N52-D55 PolarHBondContact O-N 2.68Å
53	A	77	Confident	88.7	Confident	26 Å²	26	31.9 Å²	31.9	22%	0.215	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	35.2	174.9	0	0	0	0	0	113.8	S46 G50 N51	S46-A53 PolarHBondContact O-N 3.16Å; G50-A53 VanDerWaalsContact O-CB 3.28Å; G50-A53 WeakPolarHBondContact O-CB 2.77Å; G50-A53 PolarHBondContact O-N 2.92Å; N51-A53 VanDerWaalsContact C-N 3.33Å
54	Q	80	Confident	88.9	Confident	73 Å²	73	28.2 Å²	28.2	34%	0.341	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111	-6.1	168.6	-67.8	-63.7	-56.2	0	0	111.7	N52 P119	N52-Q54 PolarHBondContact O-N 2.84Å; Q54-P119 WeakPolarHBondContact O-CB 3.12Å
55	D	87.4	Confident	89	Confident	58 Å²	58	28.3 Å²	28.3	31%	0.31	17%	0.166	S	C	.	.	S	Bend	trans	-101.1	138.4	176.7	-61.2	-56.3	0	0	0	111.1	R42 Y47 N52	R42-D55 IonicContact CZ-OD2 3.25Å; R42-D55 IonicContact NH1-OD2 3.96Å; R42-D55 PolarHBondContact NH1-OD2 3.13Å; R42-D55 IonicContact NH2-OD2 3.7Å; R42-D55 PolarHBondContact NH2-OD2 2.84Å; Y47-D55 HydrophobicContact CD1-CB 4.03Å; Y47-D55 HydrophobicContact CE1-CB 4.23Å; N52-D55 PolarHBondContact O-N 2.68Å
56	M	91.8	Very high	89	Confident	9 Å²	9	31.6 Å²	31.6	4%	0.044	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-70	155	172.4	54.2	162	44.2	0	0	111.8	Y47 N60 I62 S118 P119 M197	Y47-M56 VanDerWaalsContact CD1-O 3.24Å; Y47-M56 WeakPolarHBondContact CD1-O 3.31Å; Y47-M56 WeakPolarHBondContact CE1-O 3.32Å; M56-N60 HydrophobicContact CB-CB 4.39Å; M56-N60 HydrophobicContact CE-CB 4.36Å; M56-N60 HydrophobicContact SD-CB 4.33Å; M56-I62 HydrophobicContact CE-CD1 4Å; M56-I62 HydrophobicContact CE-CG1 4.14Å; M56-S118 PolarHBondContact SD-N 3.2Å; M56-P119 HydrophobicContact CG-CB 4.35Å; M56-M197 HydrophobicContact CB-CB 4.13Å; M56-M197 HydrophobicContact CB-CG 4.48Å; M56-M197 HydrophobicContact CE-CB 4.42Å; M56-M197 HydrophobicContact CE-CE 4.01Å; M56-M197 HydrophobicContact CE-CG 3.62Å; M56-M197 HydrophobicContact CE-SD 4.49Å
57	F	95.5	Very high	88.8	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-56.7	144.5	166.9	-66.8	-50.6	0	0	0	112.1	V44 Y47 V48 W59 N60 Y186 E199 V241	V44-F57 HydrophobicContact CG1-CE1 3.76Å; V44-F57 HydrophobicContact CG1-CZ 4.28Å; Y47-F57 HydrophobicContact CD2-CD1 4.23Å; Y47-F57 AromaticContact CG-CD1 3.94Å; Y47-F57 HydrophobicContact CG-CD1 3.94Å; Y47-F57 HydrophobicContact CG-CE1 4.38Å; V48-F57 HydrophobicContact CG2-CE1 3.85Å; V48-F57 HydrophobicContact CG2-CZ 3.68Å; F57-W59 HydrophobicContact CB-CD2 4.18Å; F57-W59 VanDerWaalsContact CB-CE2 3.48Å; F57-W59 HydrophobicContact CB-CG 4.45Å; F57-W59 HydrophobicContact CB-CZ2 3.67Å; F57-W59 HydrophobicContact CD1-CH2 4.4Å; F57-W59 AromaticContact CD1-CZ2 3.78Å; F57-W59 HydrophobicContact CD1-CZ2 3.78Å; F57-W59 HydrophobicContact CD2-CZ2 4.05Å; F57-W59 AromaticContact CD2-NE1 3.71Å; F57-W59 HydrophobicContact CE1-CZ2 4.37Å; F57-W59 AromaticContact CG-CE2 3.83Å; F57-W59 AromaticContact CG-CZ2 3.6Å; F57-W59 HydrophobicContact CG-CZ2 3.6Å; F57-W59 AromaticContact CG-NE1 3.76Å; F57-W59 PolarHBondContact O-N 3.01Å; F57-W59 VanDerWaalsContact O-N 3.07Å; F57-N60 WeakPolarHBondContact O-CB 3.2Å; F57-N60 PolarHBondContact O-N 3.04Å; F57-Y186 HydrophobicContact CE2-CG 4.42Å; F57-Y186 HydrophobicContact CZ-CD1 4.24Å; F57-Y186 HydrophobicContact CZ-CD2 4.36Å; F57-Y186 AromaticContact CZ-CG 3.91Å; F57-Y186 HydrophobicContact CZ-CG 3.91Å; F57-E199 HydrophobicContact CD1-CG 4.38Å; F57-E199 HydrophobicContact CD2-CG 3.48Å; F57-E199 VanDerWaalsContact CD2-CG 3.48Å; F57-E199 HydrophobicContact CE1-CG 4.28Å; F57-E199 HydrophobicContact CE2-CB 4.24Å; F57-E199 HydrophobicContact CE2-CG 3.36Å; F57-E199 HydrophobicContact CG-CG 4Å; F57-E199 HydrophobicContact CZ-CB 4.36Å; F57-E199 HydrophobicContact CZ-CG 3.79Å; F57-E199 PolarHBondContact N-OE1 3.34Å; F57-V241 HydrophobicContact CD2-CG2 4.34Å; F57-V241 HydrophobicContact CE2-CG2 3.87Å; F57-V241 HydrophobicContact CZ-CG2 4.41Å
58	P	95.6	Very high	88.5	Confident	9 Å²	9	42.2 Å²	42.2	6%	0.058	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-3.3	-171.2	29.6	-36.5	0	0	0	115.3	T37 F40 V167 V168	T37-P58 HydrophobicContact CG2-CG 4.1Å; F40-P58 HydrophobicContact CD2-CB 4.17Å; F40-P58 HydrophobicContact CD2-CG 4.3Å; F40-P58 HydrophobicContact CE2-CB 3.59Å; F40-P58 HydrophobicContact CE2-CG 4.05Å; F40-P58 HydrophobicContact CZ-CB 4.46Å; P58-V167 WeakPolarHBondContact O-CA 3.42Å; P58-V167 WeakPolarHBondContact O-CB 3.26Å; P58-V167 WeakPolarHBondContact O-CG1 3.48Å; P58-V168 CarbonylContact C-O 3.58Å; P58-V168 PolarHBondContact O-N 2.84Å; P58-V168 VanDerWaalsContact O-N 3.13Å
59	W	96.7	Very high	88.3	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-10.2	169.1	40.6	78.8	0	0	0	113.1	T37 F57 S76 L77 V168 V170 V241 V248	T37-W59 HydrophobicContact CG2-CH2 3.97Å; T37-W59 HydrophobicContact CG2-CZ3 4.04Å; F57-W59 HydrophobicContact CB-CD2 4.18Å; F57-W59 VanDerWaalsContact CB-CE2 3.48Å; F57-W59 HydrophobicContact CB-CG 4.45Å; F57-W59 HydrophobicContact CB-CZ2 3.67Å; F57-W59 HydrophobicContact CD1-CH2 4.4Å; F57-W59 AromaticContact CD1-CZ2 3.78Å; F57-W59 HydrophobicContact CD1-CZ2 3.78Å; F57-W59 HydrophobicContact CD2-CZ2 4.05Å; F57-W59 AromaticContact CD2-NE1 3.71Å; F57-W59 HydrophobicContact CE1-CZ2 4.37Å; F57-W59 AromaticContact CG-CE2 3.83Å; F57-W59 AromaticContact CG-CZ2 3.6Å; F57-W59 HydrophobicContact CG-CZ2 3.6Å; F57-W59 AromaticContact CG-NE1 3.76Å; F57-W59 PolarHBondContact O-N 3.01Å; F57-W59 VanDerWaalsContact O-N 3.07Å; W59-S76 CarbonylContact O-C 3.53Å; W59-S76 WeakPolarHBondContact O-CA 3.47Å; W59-L77 PolarHBondContact O-N 3.27Å; W59-V168 WeakPolarHBondContact CA-O 3.47Å; W59-V168 WeakPolarHBondContact CB-O 3.49Å; W59-V168 PolarHBondContact N-O 2.88Å; W59-V170 HydrophobicContact CB-CB 4.04Å; W59-V170 HydrophobicContact CB-CG1 4.44Å; W59-V170 HydrophobicContact CD2-CB 3.8Å; W59-V170 HydrophobicContact CD2-CG2 4.2Å; W59-V170 HydrophobicContact CE3-CB 4.1Å; W59-V170 HydrophobicContact CE3-CG2 4.47Å; W59-V170 HydrophobicContact CG-CB 3.76Å; W59-V170 HydrophobicContact CG-CG1 4.39Å; W59-V241 HydrophobicContact CZ2-CG2 4.33Å; W59-V248 HydrophobicContact CH2-CB 3.76Å; W59-V248 HydrophobicContact CH2-CG1 3.76Å; W59-V248 HydrophobicContact CH2-CG2 3.8Å; W59-V248 HydrophobicContact CZ2-CB 4.19Å; W59-V248 HydrophobicContact CZ2-CG1 3.65Å; W59-V248 HydrophobicContact CZ2-CG2 4.38Å; W59-V248 HydrophobicContact CZ3-CB 4.33Å
60	N	97	Very high	88.5	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	135.6	-171.5	-77.1	-19.6	0	0	0	112.6	M56 F57 T188 M197 E199 P239	M56-N60 HydrophobicContact CB-CB 4.39Å; M56-N60 HydrophobicContact CE-CB 4.36Å; M56-N60 HydrophobicContact SD-CB 4.33Å; F57-N60 WeakPolarHBondContact O-CB 3.2Å; F57-N60 PolarHBondContact O-N 3.04Å; N60-T188 WeakPolarHBondContact ND2-CB 3.32Å; N60-T188 WeakPolarHBondContact ND2-CG2 3.13Å; N60-T188 PolarHBondContact ND2-OG1 3.12Å; N60-M197 HydrophobicContact CB-CE 4.22Å; N60-E199 PolarHBondContact ND2-OE1 3.37Å; N60-P239 WeakPolarHBondContact OD1-CG 3.43Å
61	V	97	Very high	89.2	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.006	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	146.9	177.4	-63.8	0	0	0	0	111.3	L63 I74 G75 I93 I114 F115 A116	V61-L63 HydrophobicContact CG2-CD1 4.29Å; V61-I74 CarbonylContact O-C 3.46Å; V61-I74 WeakPolarHBondContact O-CA 3.33Å; V61-G75 WeakPolarHBondContact CG2-O 3.34Å; V61-G75 PolarHBondContact N-O 3.11Å; V61-G75 PolarHBondContact O-N 3.06Å; V61-I93 HydrophobicContact CB-CD1 4.48Å; V61-I93 HydrophobicContact CG1-CD1 4.2Å; V61-I93 HydrophobicContact CG2-CD1 3.98Å; V61-I93 HydrophobicContact CG2-CG1 4.15Å; V61-I93 HydrophobicContact CG2-CG2 3.79Å; V61-I114 HydrophobicContact CB-CG2 3.87Å; V61-I114 HydrophobicContact CG1-CG2 4.2Å; V61-I114 HydrophobicContact CG2-CG2 4.39Å; V61-F115 CarbonylContact C-O 3.11Å; V61-F115 WeakPolarHBondContact CA-O 3.32Å; V61-A116 HydrophobicContact CG1-CB 3.87Å
62	I	96	Very high	90	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	119.3	-177.6	-53	178.9	0	0	0	108.5	M56 T64 T71 I114 F115 F121 M197	M56-I62 HydrophobicContact CE-CD1 4Å; M56-I62 HydrophobicContact CE-CG1 4.14Å; I62-T64 HydrophobicContact CG2-CG2 3.79Å; I62-T71 HydrophobicContact CG2-CG2 3.56Å; I62-I114 WeakPolarHBondContact O-CA 3.44Å; I62-F115 PolarHBondContact N-O 3.11Å; I62-F115 PolarHBondContact O-N 3.5Å; I62-F121 HydrophobicContact CD1-CB 3.53Å; I62-F121 HydrophobicContact CD1-CG 4.05Å; I62-M197 HydrophobicContact CD1-CE 4.45Å; I62-M197 HydrophobicContact CD1-CG 3.92Å; I62-M197 HydrophobicContact CD1-SD 3.79Å; I62-M197 HydrophobicContact CG1-CE 3.99Å; I62-M197 HydrophobicContact CG1-CG 4.46Å; I62-M197 HydrophobicContact CG1-SD 3.86Å
63	L	95.8	Very high	91	Very high	3 Å²	3	31.4 Å²	31.4	2%	0.016	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	122.4	175.1	-78.5	72.9	0	0	0	109.2	V61 K72 C73 T95 F100 I114 L155	V61-L63 HydrophobicContact CG2-CD1 4.29Å; L63-K72 PolarHBondContact O-N 3.03Å; L63-C73 HydrophobicContact CB-CB 4.06Å; L63-C73 HydrophobicContact CD2-CB 4.29Å; L63-C73 PolarHBondContact N-O 2.69Å; L63-C73 PolarHBondContact O-N 2.84Å; L63-T95 HydrophobicContact CD2-CG2 3.99Å; L63-F100 HydrophobicContact CD2-CE2 4.35Å; L63-F100 HydrophobicContact CD2-CZ 3.99Å; L63-I114 HydrophobicContact CG-CG1 4.34Å; L63-L155 HydrophobicContact CD2-CD1 4.12Å
64	T	94.4	Very high	91.9	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	149.7	-172.7	68.4	0	0	0	0	111.5	I62 L112 L113 F115 F121	I62-T64 HydrophobicContact CG2-CG2 3.79Å; T64-L112 CarbonylContact O-C 3.19Å; T64-L112 WeakPolarHBondContact O-CA 3.09Å; T64-L112 WeakPolarHBondContact O-CD2 3.5Å; T64-L113 PolarHBondContact N-O 2.83Å; T64-L113 PolarHBondContact O-N 3.32Å; T64-L113 PolarHBondContact OG1-O 2.86Å; T64-F115 HydrophobicContact CG2-CD2 3.9Å; T64-F115 HydrophobicContact CG2-CE2 4.29Å; T64-F115 WeakPolarHBondContact OG1-CE2 3.33Å; T64-F121 HydrophobicContact CG2-CE1 3.75Å; T64-F121 HydrophobicContact CG2-CE2 4.22Å; T64-F121 HydrophobicContact CG2-CZ 3.6Å
65	S	92.4	Very high	92.8	Very high	8 Å²	8	26.7 Å²	26.7	6%	0.056	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	127.5	168.1	50.6	0	0	0	0	110.5	I67 K68 G69 S70	S65-I67 PolarHBondContact O-N 3.26Å; S65-K68 WeakPolarHBondContact OG-CB 3.16Å; S65-G69 WeakPolarHBondContact O-CA 3.4Å; S65-G69 PolarHBondContact O-N 3.43Å; S65-G69 PolarHBondContact OG-N 2.93Å; S65-S70 PolarHBondContact N-O 2.82Å; S65-S70 PolarHBondContact OG-N 3.09Å; S65-S70 VanDerWaalsContact OG-N 3.16Å; S65-S70 PolarHBondContact OG-O 3.19Å; S65-S70 PolarHBondContact OG-OG 3.05Å
66	R	88.2	Confident	93.3	Very high	113 Å²	113	24 Å²	24	43%	0.426	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-49	-174.9	-179.1	175.5	-174.4	157.1	-2.5	112.8	S110 E111 L113 R126	R66-S110 WeakPolarHBondContact CD-O 3.15Å; R66-S110 PolarHBondContact NH1-O 2.87Å; R66-E111 WeakPolarHBondContact CB-O 3.12Å; R66-E111 PolarHBondContact N-O 3.44Å; R66-L113 HydrophobicContact CB-CD1 4.22Å; R66-L113 HydrophobicContact CB-CG 4.09Å; R66-L113 HydrophobicContact CG-CD1 3.88Å; R66-L113 HydrophobicContact CG-CG 4.04Å; R66-R126 PolarHBondContact O-NH1 2.84Å
67	I	85.7	Confident	93.5	Very high	147 Å²	147	23.5 Å²	23.5	75%	0.754	11%	0.111	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-71.2	-179.1	-59.1	169.1	0	0	0	109.3	S65 G69 R126	S65-I67 PolarHBondContact O-N 3.26Å; I67-G69 VanDerWaalsContact C-N 3.31Å; I67-G69 PolarHBondContact O-N 2.98Å; I67-R126 PolarHBondContact O-NH2 3.2Å; I67-R126 VanDerWaalsContact O-NH2 3.11Å
68	K	86.3	Confident	93.6	Very high	108 Å²	108	23.5 Å²	23.5	47%	0.47	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-40.2	-176.7	-81	-178.2	172.7	-178.9	0	112.3	S65 S70 R123 E388	S65-K68 WeakPolarHBondContact OG-CB 3.16Å; K68-S70 VanDerWaalsContact C-N 3.27Å; K68-R123 PolarHBondContact O-NE 2.88Å; K68-R123 PolarHBondContact O-NH2 2.77Å; K68-E388 IonicContact NZ-OE1 3.36Å; K68-E388 PolarHBondContact NZ-OE1 2.86Å
69	G	84.8	Confident	93.6	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	11%	0.113	C	C	.	.			trans	77	12.3	-174.2	0	0	0	0	0	113.6	S65 I67	S65-G69 WeakPolarHBondContact O-CA 3.4Å; S65-G69 PolarHBondContact O-N 3.43Å; S65-G69 PolarHBondContact OG-N 2.93Å; I67-G69 VanDerWaalsContact C-N 3.31Å; I67-G69 PolarHBondContact O-N 2.98Å
70	S	88.7	Confident	93.2	Very high	29 Å²	29	31.6 Å²	31.6	20%	0.203	14%	0.142	C	C	.	.			trans	-82.1	133.1	171.5	49.4	0	0	0	0	110.4	S65 K68 K72	S65-S70 PolarHBondContact N-O 2.82Å; S65-S70 PolarHBondContact OG-N 3.09Å; S65-S70 VanDerWaalsContact OG-N 3.16Å; S65-S70 PolarHBondContact OG-O 3.19Å; S65-S70 PolarHBondContact OG-OG 3.05Å; K68-S70 VanDerWaalsContact C-N 3.27Å; S70-K72 WeakPolarHBondContact OG-CE 3.21Å; S70-K72 PolarHBondContact OG-NZ 2.86Å
71	T	92.4	Very high	92.7	Very high	11 Å²	11	32.7 Å²	32.7	7%	0.067	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.5	137.1	168.7	-52.1	0	0	0	0	110.2	I62 Y190 I234	I62-T71 HydrophobicContact CG2-CG2 3.56Å; T71-Y190 HydrophobicContact CG2-CD1 3.9Å; T71-Y190 HydrophobicContact CG2-CE1 4.2Å; T71-Y190 HydrophobicContact CG2-CG 4.08Å; T71-I234 HydrophobicContact CG2-CD1 3.86Å
72	K	92.6	Very high	92	Very high	64 Å²	64	34.6 Å²	34.6	28%	0.278	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	-42	179.2	-61.5	-57.7	175.3	-168.1	0	112	L63 S70 E388	L63-K72 PolarHBondContact O-N 3.03Å; S70-K72 WeakPolarHBondContact OG-CE 3.21Å; S70-K72 PolarHBondContact OG-NZ 2.86Å; K72-E388 IonicContact NZ-OE2 3.8Å; K72-E388 PolarHBondContact NZ-OE2 2.9Å; K72-E388 VanDerWaalsContact NZ-OE2 3.15Å
73	C	95.8	Very high	91.4	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.007	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	168.2	179.3	-79.5	0	0	0	0	112.1	L63 C99 L236	L63-C73 HydrophobicContact CB-CB 4.06Å; L63-C73 HydrophobicContact CD2-CB 4.29Å; L63-C73 PolarHBondContact N-O 2.69Å; L63-C73 PolarHBondContact O-N 2.84Å; C73-C99 HydrophobicContact CB-CB 3.86Å; C73-C99 WeakPolarHBondContact CB-SG 3.49Å; C73-C99 WeakPolarHBondContact SG-CA 3.48Å; C73-C99 WeakPolarHBondContact SG-CB 3.24Å; C73-C99 CovalentContact SG-SG 2.02Å; C73-C99 PolarHBondContact SG-SG 2.95Å; C73-L236 VanDerWaalsContact CA-O 3.32Å; C73-L236 WeakPolarHBondContact CA-O 3.35Å; C73-L236 WeakPolarHBondContact CB-O 3.25Å; C73-L236 VanDerWaalsContact SG-CG 3.58Å; C73-L236 PolarHBondContact SG-O 3.3Å; C73-L236 VanDerWaalsContact SG-O 3.4Å
74	I	96.5	Very high	90.8	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	160.4	163.1	-60.6	170.6	0	0	0	107.6	V61 T95 T188 M197 I234 L236 G237 A238	V61-I74 CarbonylContact O-C 3.46Å; V61-I74 WeakPolarHBondContact O-CA 3.33Å; I74-T95 PolarHBondContact O-OG1 3.11Å; I74-T188 HydrophobicContact CD1-CG2 4.43Å; I74-T188 WeakPolarHBondContact CD1-O 3.48Å; I74-M197 HydrophobicContact CD1-CE 3.95Å; I74-M197 HydrophobicContact CD1-SD 4.22Å; I74-M197 HydrophobicContact CG1-CE 3.96Å; I74-M197 HydrophobicContact CG1-SD 4.35Å; I74-M197 HydrophobicContact CG2-CE 3.93Å; I74-I234 WeakPolarHBondContact CD1-O 3.39Å; I74-L236 PolarHBondContact N-O 3.14Å; I74-G237 CarbonylContact C-O 3.6Å; I74-G237 CarbonylContact O-C 3.53Å; I74-G237 WeakPolarHBondContact O-CA 3.43Å; I74-A238 HydrophobicContact CB-CB 4.07Å; I74-A238 HydrophobicContact CD1-CB 4.17Å; I74-A238 HydrophobicContact CG2-CB 4.13Å
75	G	97.3	Very high	90.5	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	178.8	165.9	0	0	0	0	0	110.7	V61 I94	V61-G75 WeakPolarHBondContact CG2-O 3.34Å; V61-G75 PolarHBondContact N-O 3.11Å; V61-G75 PolarHBondContact O-N 3.06Å; G75-I94 CarbonylContact C-O 3.54Å; G75-I94 WeakPolarHBondContact CA-O 3.45Å
76	S	98.1	Very high	90.3	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	134.7	174.8	51.7	0	0	0	0	111.3	W59 I93 I94	W59-S76 CarbonylContact O-C 3.53Å; W59-S76 WeakPolarHBondContact O-CA 3.47Å; S76-I93 CarbonylContact O-C 3.56Å; S76-I93 VanDerWaalsContact O-CA 3.23Å; S76-I93 WeakPolarHBondContact O-CA 3.35Å; S76-I94 PolarHBondContact N-O 3.44Å; S76-I94 PolarHBondContact O-N 2.84Å; S76-I94 PolarHBondContact OG-O 3.45Å
77	L	97.9	Very high	90.3	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	124.6	165.5	-170.5	76.6	0	0	0	108.4	W59 L92 I93 L157 L161 V167 P169 V170	W59-L77 PolarHBondContact O-N 3.27Å; L77-L92 WeakPolarHBondContact CA-O 3.41Å; L77-I93 HydrophobicContact CD1-CG1 3.94Å; L77-L157 HydrophobicContact CD1-CD1 4.34Å; L77-L161 HydrophobicContact CD1-CD1 4.46Å; L77-L161 HydrophobicContact CD2-CB 4.22Å; L77-V167 HydrophobicContact CD2-CB 4.21Å; L77-V167 HydrophobicContact CD2-CG2 3.73Å; L77-P169 HydrophobicContact CD2-CB 4.27Å; L77-P169 HydrophobicContact CG-CB 4.16Å; L77-P169 CarbonylContact O-C 3.49Å; L77-P169 VanDerWaalsContact O-CA 3.24Å; L77-P169 WeakPolarHBondContact O-CA 3.34Å; L77-V170 PolarHBondContact O-N 3.35Å
78	V	97.2	Very high	90.5	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-118.4	157.5	-172.1	-61.2	0	0	0	0	112.6	S90 L92 I94 P169 V170 L172 L250 F283	V78-S90 WeakPolarHBondContact O-CB 3.39Å; V78-S90 PolarHBondContact O-OG 3.31Å; V78-L92 HydrophobicContact CG2-CB 3.9Å; V78-L92 PolarHBondContact N-O 3.09Å; V78-I94 HydrophobicContact CB-CD1 4.45Å; V78-I94 HydrophobicContact CB-CG1 4.5Å; V78-I94 HydrophobicContact CG1-CB 4.18Å; V78-I94 HydrophobicContact CG1-CD1 3.98Å; V78-I94 HydrophobicContact CG1-CG1 3.9Å; V78-I94 HydrophobicContact CG2-CD1 3.9Å; V78-I94 HydrophobicContact CG2-CG1 3.8Å; V78-P169 VanDerWaalsContact C-CB 3.46Å; V78-V170 HydrophobicContact CG1-CG1 3.96Å; V78-L172 HydrophobicContact CB-CD2 4.04Å; V78-L172 HydrophobicContact CG1-CD2 4.09Å; V78-L250 HydrophobicContact CG1-CD2 3.73Å; V78-F283 HydrophobicContact CG2-CZ 4.49Å
79	H	94.2	Very high	90.8	Very high	21 Å²	21	45.6 Å²	45.6	10%	0.097	24%	0.237	C	C	.	.			trans	-103.8	132.3	169.8	-173.2	63.9	0	0	0	110.3	C34 G81 A87 P169 V170	C34-H79 HydrophobicContact CB-CB 3.55Å; H79-G81 PolarHBondContact CD2-N 2.99Å; H79-G81 VanDerWaalsContact CD2-N 3.35Å; H79-G81 PolarHBondContact CD2-O 3.24Å; H79-G81 VanDerWaalsContact CD2-O 3.25Å; H79-G81 VanDerWaalsContact NE2-CA 3.35Å; H79-G81 WeakPolarHBondContact NE2-CA 2.91Å; H79-G81 PolarHBondContact NE2-N 2.77Å; H79-A87 HydrophobicContact CB-CB 4.33Å; H79-A87 WeakPolarHBondContact ND1-CB 3.13Å; H79-P169 HydrophobicContact CB-CB 4.16Å; H79-P169 HydrophobicContact CB-CG 4.09Å; H79-V170 PolarHBondContact N-O 2.84Å
80	R	89.7	Confident	91.3	Very high	158 Å²	158	46 Å²	46	60%	0.596	24%	0.24	S	C	*	.			trans	-81.2	-24.7	178.3	177.9	173.4	174.3	-146.1	-0.5	113.2	L92 F283	R80-L92 HydrophobicContact CB-CD1 4.08Å; R80-F283 HydrophobicContact CG-CB 3.91Å; R80-F283 HydrophobicContact CG-CD1 4.14Å; R80-F283 HydrophobicContact CG-CD2 4.17Å; R80-F283 HydrophobicContact CG-CG 3.81Å; R80-F283 PolarHBondContact NE-O 2.89Å; R80-F283 PolarHBondContact NH2-O 3.19Å
81	G	85.9	Confident	91.6	Very high	22 Å²	22	46.6 Å²	46.6	23%	0.227	24%	0.241	C	C	.	.	S	Bend	trans	-77.6	168.5	-179.6	0	0	0	0	0	113.6	H79	H79-G81 PolarHBondContact CD2-N 2.99Å; H79-G81 VanDerWaalsContact CD2-N 3.35Å; H79-G81 PolarHBondContact CD2-O 3.24Å; H79-G81 VanDerWaalsContact CD2-O 3.25Å; H79-G81 VanDerWaalsContact NE2-CA 3.35Å; H79-G81 WeakPolarHBondContact NE2-CA 2.91Å; H79-G81 PolarHBondContact NE2-N 2.77Å
82	G	83.1	Confident	91.9	Very high	42 Å²	42	47.4 Å²	47.4	43%	0.433	24%	0.244	S	C	.	.			trans	-67.2	158.2	171.4	0	0	0	0	0	112	Q84 Q85	G82-Q84 PolarHBondContact O-N 2.04Å; G82-Q85 WeakPolarHBondContact O-CB 3.23Å; G82-Q85 PolarHBondContact O-N 3.42Å
83	Y	82.3	Confident	92.1	Very high	106 Å²	106	44.3 Å²	44.3	42%	0.416	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-21.6	-172.1	73.2	-89.4	0	0	0	115.2	R247	Y83-R247 PolarHBondContact O-NH1 3.29Å
84	Q	83	Confident	92.2	Very high	139 Å²	139	44.3 Å²	44.3	65%	0.65	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-10.3	176.5	-60	-176	-10.3	0	0	113.7	Y33 G82	Y33-Q84 WeakPolarHBondContact CE1-O 3.41Å; G82-Q84 PolarHBondContact O-N 2.04Å
85	Q	88.8	Confident	92.3	Very high	113 Å²	113	44.3 Å²	44.3	53%	0.528	23%	0.231	S	C	.	.	S	Bend	trans	-84	148.6	-178.6	-60.7	179.1	10.3	0	0	110.9	Y33 G82 A87	Y33-Q85 WeakPolarHBondContact CD1-O 3.47Å; G82-Q85 WeakPolarHBondContact O-CB 3.23Å; G82-Q85 PolarHBondContact O-N 3.42Å; Q85-A87 PolarHBondContact O-N 3.04Å
86	T	88.2	Confident	92.2	Very high	75 Å²	75	44.3 Å²	44.3	46%	0.46	23%	0.231	S	C	.	.	B	Isolated β-bridge	trans	-75.5	123.2	179.8	51.5	0	0	0	0	111.1	P31 V32 Y33 N88	P31-T86 HydrophobicContact CB-CG2 3.8Å; V32-T86 CarbonylContact O-C 3.54Å; V32-T86 VanDerWaalsContact O-CA 3.31Å; V32-T86 WeakPolarHBondContact O-CA 3.25Å; Y33-T86 HydrophobicContact CE1-CG2 4.35Å; T86-N88 PolarHBondContact O-N 3.35Å
87	A	88.7	Confident	92	Very high	2 Å²	2	44.3 Å²	44.3	2%	0.017	23%	0.231	C	C	.	.			trans	-102.3	44.4	-175.4	0	0	0	0	0	112.2	V32 C34 H79 Q85 T89 P169	V32-A87 PolarHBondContact O-N 3.25Å; C34-A87 HydrophobicContact CB-CB 4.17Å; H79-A87 HydrophobicContact CB-CB 4.33Å; H79-A87 WeakPolarHBondContact ND1-CB 3.13Å; Q85-A87 PolarHBondContact O-N 3.04Å; A87-T89 PolarHBondContact O-N 2.91Å; A87-T89 VanDerWaalsContact O-N 3.16Å; A87-P169 HydrophobicContact CB-CG 3.75Å
88	N	88.2	Confident	91.7	Very high	88 Å²	88	47 Å²	47	47%	0.471	25%	0.245	S	C	.	.	S	Bend	trans	-56.5	-32.5	-173.2	-64.5	-11.1	0	0	0	113.7	T86	T86-N88 PolarHBondContact O-N 3.35Å
89	T	92.5	Very high	91.6	Very high	86 Å²	86	47.6 Å²	47.6	53%	0.528	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	151.7	176	57.6	0	0	0	0	111	A87 L161	A87-T89 PolarHBondContact O-N 2.91Å; A87-T89 VanDerWaalsContact O-N 3.16Å; T89-L161 CarbonylContact C-O 3.53Å; T89-L161 WeakPolarHBondContact CA-O 3.36Å
90	S	95.9	Very high	91.6	Very high	8 Å²	8	46.7 Å²	46.7	6%	0.056	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	142.8	162.9	-178.2	0	0	0	0	111.9	V78 L92 P160 L161	V78-S90 WeakPolarHBondContact O-CB 3.39Å; V78-S90 PolarHBondContact O-OG 3.31Å; S90-L92 PolarHBondContact OG-N 3.11Å; S90-L92 VanDerWaalsContact OG-N 3.16Å; S90-P160 WeakPolarHBondContact O-CA 3.23Å; S90-L161 PolarHBondContact N-O 2.86Å; S90-L161 PolarHBondContact O-N 2.98Å
91	D	96.4	Very high	91.5	Very high	42 Å²	42	42.1 Å²	42.1	23%	0.225	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	4.8	170.7	64.5	-22.1	0	0	0	112.8	K156 L157 P160	D91-K156 CarbonylContact O-C 3.47Å; D91-K156 WeakPolarHBondContact O-CA 3.11Å; D91-K156 WeakPolarHBondContact OD2-CE 3.46Å; D91-K156 IonicContact OD2-NZ 3.07Å; D91-L157 HydrophobicContact CB-CB 4.24Å; D91-L157 PolarHBondContact O-N 3.05Å; D91-P160 HydrophobicContact CB-CB 4.24Å; D91-P160 HydrophobicContact CB-CG 4.17Å
92	L	97.2	Very high	91.6	Very high	28 Å²	28	47.8 Å²	47.8	15%	0.147	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	126.2	-174.2	-67.1	174.3	0	0	0	112.2	L77 V78 R80 S90 I154 L155 F283	L77-L92 WeakPolarHBondContact CA-O 3.41Å; V78-L92 HydrophobicContact CG2-CB 3.9Å; V78-L92 PolarHBondContact N-O 3.09Å; R80-L92 HydrophobicContact CB-CD1 4.08Å; S90-L92 PolarHBondContact OG-N 3.11Å; S90-L92 VanDerWaalsContact OG-N 3.16Å; L92-I154 HydrophobicContact CD2-CG2 4.4Å; L92-L155 WeakPolarHBondContact CA-O 3.44Å; L92-F283 HydrophobicContact CD1-CE1 3.86Å; L92-F283 HydrophobicContact CD1-CZ 4.02Å
93	I	98	Very high	91.8	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	138.9	174.7	-72.2	160.7	0	0	0	110.5	V61 S76 L77 I114 I154 L155 L157	V61-I93 HydrophobicContact CB-CD1 4.48Å; V61-I93 HydrophobicContact CG1-CD1 4.2Å; V61-I93 HydrophobicContact CG2-CD1 3.98Å; V61-I93 HydrophobicContact CG2-CG1 4.15Å; V61-I93 HydrophobicContact CG2-CG2 3.79Å; S76-I93 CarbonylContact O-C 3.56Å; S76-I93 VanDerWaalsContact O-CA 3.23Å; S76-I93 WeakPolarHBondContact O-CA 3.35Å; L77-I93 HydrophobicContact CD1-CG1 3.94Å; I93-I114 HydrophobicContact CD1-CD1 3.83Å; I93-I114 HydrophobicContact CD1-CG2 3.89Å; I93-I154 WeakPolarHBondContact O-CA 3.47Å; I93-L155 HydrophobicContact CB-CB 4.26Å; I93-L155 HydrophobicContact CB-CD1 4.45Å; I93-L155 HydrophobicContact CG2-CD1 4.01Å; I93-L155 HydrophobicContact CG2-CG 4.42Å; I93-L155 PolarHBondContact N-O 2.77Å; I93-L155 PolarHBondContact O-N 2.65Å; I93-L157 HydrophobicContact CD1-CD1 3.89Å; I93-L157 HydrophobicContact CD1-CD2 3.72Å; I93-L157 HydrophobicContact CD1-CG 3.92Å
94	I	97.7	Very high	92	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	135.3	170.9	-56.9	-173	0	0	0	110	G75 S76 V78 I152 A153 I154 L172 V253 I276 A279 F283	G75-I94 CarbonylContact C-O 3.54Å; G75-I94 WeakPolarHBondContact CA-O 3.45Å; S76-I94 PolarHBondContact N-O 3.44Å; S76-I94 PolarHBondContact O-N 2.84Å; S76-I94 PolarHBondContact OG-O 3.45Å; V78-I94 HydrophobicContact CB-CD1 4.45Å; V78-I94 HydrophobicContact CB-CG1 4.5Å; V78-I94 HydrophobicContact CG1-CB 4.18Å; V78-I94 HydrophobicContact CG1-CD1 3.98Å; V78-I94 HydrophobicContact CG1-CG1 3.9Å; V78-I94 HydrophobicContact CG2-CD1 3.9Å; V78-I94 HydrophobicContact CG2-CG1 3.8Å; I94-I152 HydrophobicContact CG2-CB 4.26Å; I94-I152 HydrophobicContact CG2-CD1 4.18Å; I94-A153 WeakPolarHBondContact CA-O 3.38Å; I94-I154 HydrophobicContact CG1-CG1 4.3Å; I94-L172 HydrophobicContact CD1-CD2 4.19Å; I94-V253 HydrophobicContact CG2-CG2 3.65Å; I94-I276 HydrophobicContact CD1-CD1 3.81Å; I94-I276 HydrophobicContact CG2-CD1 4.19Å; I94-A279 HydrophobicContact CD1-CB 3.64Å; I94-F283 HydrophobicContact CD1-CE2 4.33Å; I94-F283 HydrophobicContact CD1-CZ 4.4Å
95	T	97.3	Very high	92	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	-173	179.6	-174.2	0	0	0	0	109.7	L63 I74 C99 F100 I152 A153 L155 G237	L63-T95 HydrophobicContact CD2-CG2 3.99Å; I74-T95 PolarHBondContact O-OG1 3.11Å; T95-C99 PolarHBondContact OG1-SG 2.99Å; T95-F100 HydrophobicContact CG2-CE2 3.82Å; T95-F100 HydrophobicContact CG2-CZ 4.45Å; T95-I152 CarbonylContact O-C 3.51Å; T95-I152 WeakPolarHBondContact O-CA 3.19Å; T95-A153 HydrophobicContact CG2-CB 4.05Å; T95-A153 PolarHBondContact N-O 2.8Å; T95-A153 PolarHBondContact O-N 3.38Å; T95-L155 HydrophobicContact CG2-CD1 3.99Å; T95-L155 HydrophobicContact CG2-CD2 4.5Å; T95-L155 HydrophobicContact CG2-CG 4.28Å; T95-G237 WeakPolarHBondContact OG1-CA 3.48Å
96	A	95.6	Very high	91.9	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	141.6	177.9	0	0	0	0	0	111.8	D98 C99 L236 L255	A96-D98 PolarHBondContact O-N 2.91Å; A96-C99 WeakPolarHBondContact O-CB 3.44Å; A96-C99 PolarHBondContact O-N 3.47Å; A96-C99 VanDerWaalsContact O-N 3.17Å; A96-C99 PolarHBondContact O-SG 2.84Å; A96-L236 HydrophobicContact CB-CD1 3.76Å; A96-L236 HydrophobicContact CB-CG 4.11Å; A96-L255 HydrophobicContact CB-CD2 3.58Å
97	A	93.9	Very high	91.9	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-67.7	-24.5	176	0	0	0	0	0	112.9	C99 F100 L138 R150 G151 A153 L291	A97-C99 PolarHBondContact O-N 3.16Å; A97-F100 PolarHBondContact O-N 2.91Å; A97-L138 HydrophobicContact CB-CB 4.39Å; A97-L138 HydrophobicContact CB-CD2 4.31Å; A97-R150 HydrophobicContact CB-CB 3.97Å; A97-R150 WeakPolarHBondContact O-CD 3.09Å; A97-G151 WeakPolarHBondContact CB-O 3.45Å; A97-G151 PolarHBondContact N-O 3.23Å; A97-A153 HydrophobicContact CB-CB 4.39Å; A97-L291 HydrophobicContact CB-CD1 4.15Å
98	D	92.7	Very high	91.9	Very high	56 Å²	56	36.4 Å²	36.4	30%	0.299	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-71	-11.1	174.7	-116.4	9.5	0	0	0	113.6	A96 F100 K101 R150 L236	A96-D98 PolarHBondContact O-N 2.91Å; D98-F100 PolarHBondContact O-N 2.66Å; D98-K101 WeakPolarHBondContact O-CB 3.42Å; D98-K101 PolarHBondContact O-N 3.24Å; D98-R150 HydrophobicContact CB-CB 4.18Å; D98-R150 WeakPolarHBondContact OD1-CD 3.27Å; D98-R150 WeakPolarHBondContact OD1-CG 3.39Å; D98-R150 IonicContact OD1-CZ 3.42Å; D98-R150 IonicContact OD1-NE 2.7Å; D98-R150 IonicContact OD1-NH1 3.76Å; D98-R150 PolarHBondContact OD1-NH1 3.3Å; D98-L236 HydrophobicContact CB-CD2 4.41Å
99	C	94.2	Very high	92.1	Very high	13 Å²	13	35.6 Å²	35.6	9%	0.088	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-59.9	-27	164.5	-59.8	0	0	0	0	112.5	C73 T95 A96 A97	C73-C99 HydrophobicContact CB-CB 3.86Å; C73-C99 WeakPolarHBondContact CB-SG 3.49Å; C73-C99 WeakPolarHBondContact SG-CA 3.48Å; C73-C99 WeakPolarHBondContact SG-CB 3.24Å; C73-C99 CovalentContact SG-SG 2.02Å; C73-C99 PolarHBondContact SG-SG 2.95Å; T95-C99 PolarHBondContact OG1-SG 2.99Å; A96-C99 WeakPolarHBondContact O-CB 3.44Å; A96-C99 PolarHBondContact O-N 3.47Å; A96-C99 VanDerWaalsContact O-N 3.17Å; A96-C99 PolarHBondContact O-SG 2.84Å; A97-C99 PolarHBondContact O-N 3.16Å
100	F	93.8	Very high	91.9	Very high	3 Å²	3	34.7 Å²	34.7	1%	0.013	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-100.2	6.5	-177.9	-59.1	-88.1	0	0	0	112.9	L63 T95 A97 D98 K102 Y103 A108 L112 V136 L138 A153 L155	L63-F100 HydrophobicContact CD2-CE2 4.35Å; L63-F100 HydrophobicContact CD2-CZ 3.99Å; T95-F100 HydrophobicContact CG2-CE2 3.82Å; T95-F100 HydrophobicContact CG2-CZ 4.45Å; A97-F100 PolarHBondContact O-N 2.91Å; D98-F100 PolarHBondContact O-N 2.66Å; F100-K102 PolarHBondContact O-N 3.17Å; F100-Y103 PolarHBondContact O-N 2.78Å; F100-A108 HydrophobicContact CD1-CB 3.77Å; F100-A108 HydrophobicContact CE1-CB 3.92Å; F100-L112 HydrophobicContact CD1-CD1 3.97Å; F100-L112 HydrophobicContact CE1-CD1 3.53Å; F100-L112 HydrophobicContact CZ-CD1 4.37Å; F100-V136 HydrophobicContact CD1-CG1 3.88Å; F100-V136 HydrophobicContact CE1-CG1 3.87Å; F100-V136 HydrophobicContact CE1-CG2 4.2Å; F100-V136 HydrophobicContact CG-CG1 4.25Å; F100-V136 HydrophobicContact CZ-CG1 4.25Å; F100-L138 HydrophobicContact CB-CD1 3.98Å; F100-L138 HydrophobicContact CB-CD2 3.83Å; F100-L138 HydrophobicContact CD2-CD2 3.6Å; F100-L138 HydrophobicContact CE2-CD2 4.39Å; F100-L138 HydrophobicContact CG-CD2 3.75Å; F100-A153 HydrophobicContact CD2-CB 3.97Å; F100-A153 HydrophobicContact CE2-CB 3.79Å; F100-L155 HydrophobicContact CE1-CD2 4.23Å; F100-L155 HydrophobicContact CE2-CD2 3.77Å; F100-L155 HydrophobicContact CZ-CD1 3.89Å; F100-L155 HydrophobicContact CZ-CD2 3.4Å; F100-L155 VanDerWaalsContact CZ-CD2 3.4Å; F100-L155 HydrophobicContact CZ-CG 4.3Å
101	K	88.4	Confident	91.7	Very high	61 Å²	61	38 Å²	38	27%	0.265	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-15.6	-179.8	175	178.3	170.4	-151.8	0	115.9	D98 D391	D98-K101 WeakPolarHBondContact O-CB 3.42Å; D98-K101 PolarHBondContact O-N 3.24Å; K101-D391 IonicContact NZ-OD1 2.66Å; K101-D391 PolarHBondContact NZ-OD1 2.94Å; K101-D391 IonicContact NZ-OD2 3.66Å; K101-D391 PolarHBondContact NZ-OD2 2.72Å
102	K	87.7	Confident	91.6	Very high	142 Å²	142	36.3 Å²	36.3	62%	0.617	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-121.9	12.5	-178.1	-59.6	-178	-177.5	174.6	0	113.2	F100 D391	F100-K102 PolarHBondContact O-N 3.17Å; K102-D391 WeakPolarHBondContact CE-OD2 3.32Å; K102-D391 IonicContact NZ-OD2 3.95Å; K102-D391 PolarHBondContact NZ-OD2 3.05Å
103	Y	87.6	Confident	91.5	Very high	47 Å²	47	35.3 Å²	35.3	18%	0.184	19%	0.192	C	C	.	.	S	Bend	trans	-138.3	143.3	-172.6	-57.5	-74.6	0	0	0	110	F100 E111 L112	F100-Y103 PolarHBondContact O-N 2.78Å; Y103-E111 HydrophobicContact CD1-CB 4.13Å; Y103-E111 HydrophobicContact CE1-CB 3.92Å; Y103-E111 WeakPolarHBondContact CE1-OE2 3.49Å; Y103-L112 HydrophobicContact CD2-CD1 4.28Å; Y103-L112 HydrophobicContact CE1-CD2 4.36Å; Y103-L112 HydrophobicContact CE2-CD1 4.43Å; Y103-L112 HydrophobicContact CE2-CD2 3.93Å; Y103-L112 HydrophobicContact CE2-CG 4.5Å
104	T	86	Confident	91.4	Very high	60 Å²	60	35.3 Å²	35.3	37%	0.368	19%	0.192	S	C	.	.			trans	-79.1	158.2	162.7	56.5	0	0	0	0	109.7	A106 S107 A108 E293	T104-A106 PolarHBondContact O-N 2.88Å; T104-A106 VanDerWaalsContact O-N 3.09Å; T104-S107 PolarHBondContact N-OG 2.97Å; T104-S107 PolarHBondContact O-N 3.02Å; T104-S107 VanDerWaalsContact O-N 3.12Å; T104-S107 WeakPolarHBondContact OG1-CB 3.48Å; T104-S107 PolarHBondContact OG1-N 3.42Å; T104-A108 VanDerWaalsContact O-CB 3.28Å; T104-A108 WeakPolarHBondContact O-CB 3.39Å; T104-A108 PolarHBondContact O-N 2.82Å; T104-E293 VanDerWaalsContact CB-OE1 3.26Å; T104-E293 WeakPolarHBondContact CB-OE1 3.09Å; T104-E293 WeakPolarHBondContact CG2-OE1 3.21Å
105	P	83.9	Confident	91.3	Very high	36 Å²	36	35.5 Å²	35.5	23%	0.234	19%	0.193	C	C	.	.	H	α-helix	trans	-53	-27.8	170	-28.1	37	0	0	0	113.4	K109 V136 L138 E293	P105-K109 VanDerWaalsContact O-CE 3.29Å; P105-K109 WeakPolarHBondContact O-CE 3.4Å; P105-K109 WeakPolarHBondContact O-CG 3.24Å; P105-V136 HydrophobicContact CB-CB 4.3Å; P105-L138 HydrophobicContact CG-CD1 4.46Å; P105-E293 WeakPolarHBondContact CD-OE1 3.42Å; P105-E293 HydrophobicContact CG-CG 4.43Å
106	A	85.5	Confident	91.2	Very high	68 Å²	68	35.5 Å²	35.5	56%	0.562	19%	0.193	S	C	*	.	H	α-helix	trans	-75.1	-51.8	171.7	0	0	0	0	0	112.9	T104 A108 K109	T104-A106 PolarHBondContact O-N 2.88Å; T104-A106 VanDerWaalsContact O-N 3.09Å; A106-A108 VanDerWaalsContact C-N 3.3Å; A106-A108 PolarHBondContact O-N 3.27Å; A106-K109 PolarHBondContact O-N 2.77Å
107	S	89	Confident	91	Very high	26 Å²	26	38.1 Å²	38.1	18%	0.182	21%	0.207	C	C	.	.	H	α-helix	trans	-68.8	-29.7	-177	99.2	0	0	0	0	112.3	T104 K109 S110 E111	T104-S107 PolarHBondContact N-OG 2.97Å; T104-S107 PolarHBondContact O-N 3.02Å; T104-S107 VanDerWaalsContact O-N 3.12Å; T104-S107 WeakPolarHBondContact OG1-CB 3.48Å; T104-S107 PolarHBondContact OG1-N 3.42Å; S107-K109 PolarHBondContact O-N 3.11Å; S107-S110 PolarHBondContact O-N 2.82Å; S107-S110 VanDerWaalsContact O-N 3.11Å; S107-S110 PolarHBondContact O-OG 3.24Å; S107-S110 VanDerWaalsContact O-OG 3.04Å; S107-E111 WeakPolarHBondContact CB-OE1 3.17Å; S107-E111 VanDerWaalsContact O-CB 3.3Å; S107-E111 WeakPolarHBondContact O-CB 3.38Å; S107-E111 WeakPolarHBondContact O-CG 3.36Å; S107-E111 PolarHBondContact O-N 3.03Å; S107-E111 PolarHBondContact OG-OE1 3Å
108	A	88.7	Confident	90.9	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-54	-36.6	173	0	0	0	0	0	113.4	F100 T104 A106 S110 L112 V136	F100-A108 HydrophobicContact CD1-CB 3.77Å; F100-A108 HydrophobicContact CE1-CB 3.92Å; T104-A108 VanDerWaalsContact O-CB 3.28Å; T104-A108 WeakPolarHBondContact O-CB 3.39Å; T104-A108 PolarHBondContact O-N 2.82Å; A106-A108 VanDerWaalsContact C-N 3.3Å; A106-A108 PolarHBondContact O-N 3.27Å; A108-S110 VanDerWaalsContact C-N 3.35Å; A108-S110 PolarHBondContact O-N 3.34Å; A108-L112 HydrophobicContact CB-CD1 4.16Å; A108-L112 WeakPolarHBondContact O-CB 3.4Å; A108-L112 PolarHBondContact O-N 3.07Å; A108-L112 VanDerWaalsContact O-N 3.14Å; A108-V136 HydrophobicContact CB-CG2 3.97Å
109	K	91.1	Very high	90.6	Very high	71 Å²	71	36.9 Å²	36.9	31%	0.309	20%	0.202	S	C	.	.	H	α-helix	trans	-69	-32.2	-179.6	-58.1	178.4	-168.8	-157.4	0	112.5	P105 A106 S107 I133 A134 D135	P105-K109 VanDerWaalsContact O-CE 3.29Å; P105-K109 WeakPolarHBondContact O-CE 3.4Å; P105-K109 WeakPolarHBondContact O-CG 3.24Å; A106-K109 PolarHBondContact O-N 2.77Å; S107-K109 PolarHBondContact O-N 3.11Å; K109-I133 HydrophobicContact CG-CG2 4.49Å; K109-A134 WeakPolarHBondContact CD-O 3.44Å; K109-A134 WeakPolarHBondContact CE-O 3.16Å; K109-A134 PolarHBondContact NZ-O 3.16Å; K109-D135 WeakPolarHBondContact CE-OD1 3.46Å; K109-D135 IonicContact NZ-OD1 2.76Å; K109-D135 PolarHBondContact NZ-OD1 3.37Å
110	S	89.1	Confident	90.2	Very high	67 Å²	67	43.5 Å²	43.5	47%	0.469	23%	0.225	S	C	.	.	H	α-helix	trans	-91.3	-37.8	178.4	62.9	0	0	0	0	112.6	R66 S107 A108	R66-S110 WeakPolarHBondContact CD-O 3.15Å; R66-S110 PolarHBondContact NH1-O 2.87Å; S107-S110 PolarHBondContact O-N 2.82Å; S107-S110 VanDerWaalsContact O-N 3.11Å; S107-S110 PolarHBondContact O-OG 3.24Å; S107-S110 VanDerWaalsContact O-OG 3.04Å; A108-S110 VanDerWaalsContact C-N 3.35Å; A108-S110 PolarHBondContact O-N 3.34Å
111	E	92.5	Very high	89.9	Confident	79 Å²	79	43.4 Å²	43.4	37%	0.369	22%	0.224	S	C	.	.	H	α-helix	trans	-89.4	-18.6	-171.5	-69.2	-171.1	-103.3	0	0	115.7	R66 Y103 S107	R66-E111 WeakPolarHBondContact CB-O 3.12Å; R66-E111 PolarHBondContact N-O 3.44Å; Y103-E111 HydrophobicContact CD1-CB 4.13Å; Y103-E111 HydrophobicContact CE1-CB 3.92Å; Y103-E111 WeakPolarHBondContact CE1-OE2 3.49Å; S107-E111 WeakPolarHBondContact CB-OE1 3.17Å; S107-E111 VanDerWaalsContact O-CB 3.3Å; S107-E111 WeakPolarHBondContact O-CB 3.38Å; S107-E111 WeakPolarHBondContact O-CG 3.36Å; S107-E111 PolarHBondContact O-N 3.03Å; S107-E111 PolarHBondContact OG-OE1 3Å
112	L	94.4	Very high	89.7	Confident	5 Å²	5	41.1 Å²	41.1	3%	0.026	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	156.5	-179.5	-60.5	174.1	0	0	0	112.4	T64 F100 Y103 A108 I133	T64-L112 CarbonylContact O-C 3.19Å; T64-L112 WeakPolarHBondContact O-CA 3.09Å; T64-L112 WeakPolarHBondContact O-CD2 3.5Å; F100-L112 HydrophobicContact CD1-CD1 3.97Å; F100-L112 HydrophobicContact CE1-CD1 3.53Å; F100-L112 HydrophobicContact CZ-CD1 4.37Å; Y103-L112 HydrophobicContact CD2-CD1 4.28Å; Y103-L112 HydrophobicContact CE1-CD2 4.36Å; Y103-L112 HydrophobicContact CE2-CD1 4.43Å; Y103-L112 HydrophobicContact CE2-CD2 3.93Å; Y103-L112 HydrophobicContact CE2-CG 4.5Å; A108-L112 HydrophobicContact CB-CD1 4.16Å; A108-L112 WeakPolarHBondContact O-CB 3.4Å; A108-L112 PolarHBondContact O-N 3.07Å; A108-L112 VanDerWaalsContact O-N 3.14Å; L112-I133 HydrophobicContact CB-CD1 4.04Å
113	L	93.9	Very high	89.4	Confident	7 Å²	7	41 Å²	41	4%	0.037	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	140.1	171.8	-79	176.6	0	0	0	109.8	T64 R66 F115 K130 K132	T64-L113 PolarHBondContact N-O 2.83Å; T64-L113 PolarHBondContact O-N 3.32Å; T64-L113 PolarHBondContact OG1-O 2.86Å; R66-L113 HydrophobicContact CB-CD1 4.22Å; R66-L113 HydrophobicContact CB-CG 4.09Å; R66-L113 HydrophobicContact CG-CD1 3.88Å; R66-L113 HydrophobicContact CG-CG 4.04Å; L113-F115 HydrophobicContact CB-CE2 3.92Å; L113-F115 HydrophobicContact CD1-CE2 4.43Å; L113-K130 HydrophobicContact CD1-CD 4.45Å; L113-K130 HydrophobicContact CD2-CG 4.34Å; L113-K132 HydrophobicContact CD2-CG 4.31Å
114	I	95.9	Very high	89.1	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	134.9	177.3	-64.4	174.6	0	0	0	108.4	V61 I62 L63 I93 V131 I133 L155 L157	V61-I114 HydrophobicContact CB-CG2 3.87Å; V61-I114 HydrophobicContact CG1-CG2 4.2Å; V61-I114 HydrophobicContact CG2-CG2 4.39Å; I62-I114 WeakPolarHBondContact O-CA 3.44Å; L63-I114 HydrophobicContact CG-CG1 4.34Å; I93-I114 HydrophobicContact CD1-CD1 3.83Å; I93-I114 HydrophobicContact CD1-CG2 3.89Å; I114-V131 HydrophobicContact CG2-CG2 4.4Å; I114-V131 PolarHBondContact N-O 3.05Å; I114-V131 VanDerWaalsContact N-O 3.09Å; I114-V131 PolarHBondContact O-N 3Å; I114-I133 HydrophobicContact CD1-CD1 3.95Å; I114-I133 HydrophobicContact CD1-CG1 3.55Å; I114-I133 HydrophobicContact CG1-CD1 4.28Å; I114-I133 HydrophobicContact CG1-CG1 4.11Å; I114-L155 HydrophobicContact CD1-CD1 4.01Å; I114-L157 HydrophobicContact CD1-CD2 3.81Å
115	F	95.6	Very high	89	Confident	5 Å²	5	49.6 Å²	49.6	2%	0.022	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	125.2	171.4	-69.5	-96.9	0	0	0	109.6	V61 I62 T64 L113 F121 R126 R127 I129 K130	V61-F115 CarbonylContact C-O 3.11Å; V61-F115 WeakPolarHBondContact CA-O 3.32Å; I62-F115 PolarHBondContact N-O 3.11Å; I62-F115 PolarHBondContact O-N 3.5Å; T64-F115 HydrophobicContact CG2-CD2 3.9Å; T64-F115 HydrophobicContact CG2-CE2 4.29Å; T64-F115 WeakPolarHBondContact OG1-CE2 3.33Å; L113-F115 HydrophobicContact CB-CE2 3.92Å; L113-F115 HydrophobicContact CD1-CE2 4.43Å; F115-F121 HydrophobicContact CB-CD2 4.32Å; F115-F121 HydrophobicContact CB-CE2 4.27Å; F115-F121 HydrophobicContact CD1-CD2 4.45Å; F115-F121 AromaticContact CD1-CE2 3.92Å; F115-F121 HydrophobicContact CD1-CE2 3.92Å; F115-F121 HydrophobicContact CD2-CD2 4.48Å; F115-F121 AromaticContact CD2-CE2 3.63Å; F115-F121 HydrophobicContact CD2-CE2 3.63Å; F115-F121 HydrophobicContact CD2-CZ 4.16Å; F115-F121 HydrophobicContact CE1-CE2 4.13Å; F115-F121 AromaticContact CE2-CE2 3.87Å; F115-F121 HydrophobicContact CE2-CE2 3.87Å; F115-F121 HydrophobicContact CE2-CZ 4.15Å; F115-F121 HydrophobicContact CG-CD2 4.18Å; F115-F121 AromaticContact CG-CE2 3.67Å; F115-F121 HydrophobicContact CG-CE2 3.67Å; F115-F121 HydrophobicContact CZ-CE2 4.11Å; F115-R126 HydrophobicContact CE1-CB 4.04Å; F115-R126 WeakPolarHBondContact CE1-O 3.42Å; F115-R126 HydrophobicContact CZ-CB 4.02Å; F115-R127 WeakPolarHBondContact CD1-O 3.35Å; F115-I129 WeakPolarHBondContact CA-O 3.34Å; F115-K130 HydrophobicContact CD1-CB 4.15Å; F115-K130 HydrophobicContact CE1-CB 3.8Å; F115-K130 HydrophobicContact CE1-CD 4.42Å; F115-K130 HydrophobicContact CE1-CG 4.13Å; F115-K130 HydrophobicContact CZ-CB 4.34Å; F115-K130 HydrophobicContact CZ-CD 4.31Å; F115-K130 HydrophobicContact CZ-CG 4.15Å
116	A	95.2	Very high	89	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	159.7	171.3	0	0	0	0	0	110.2	V61 S118 G128 I129 L161 V167	V61-A116 HydrophobicContact CG1-CB 3.87Å; A116-S118 PolarHBondContact O-N 3.24Å; A116-G128 CarbonylContact O-C 3.59Å; A116-I129 HydrophobicContact CB-CB 4.43Å; A116-I129 PolarHBondContact N-O 3.22Å; A116-I129 PolarHBondContact O-N 3.17Å; A116-L161 HydrophobicContact CB-CD1 3.63Å; A116-V167 HydrophobicContact CB-CG1 3.99Å
117	N	92.4	Very high	89.1	Confident	55 Å²	55	56.4 Å²	56.4	29%	0.294	25%	0.254	S	S	.	.	S	Bend	trans	46.3	61.3	-177	-179.2	21.9	0	0	0	112.2	G128	N117-G128 WeakPolarHBondContact O-CA 3.42Å
118	S	91.8	Very high	89.2	Confident	2 Å²	2	56.9 Å²	56.9	1%	0.014	26%	0.263	C	S	.	.			trans	-137.4	66.5	-179.1	-177.3	0	0	0	0	111.7	M56 A116 R120 F121 R127	M56-S118 PolarHBondContact SD-N 3.2Å; A116-S118 PolarHBondContact O-N 3.24Å; S118-R120 PolarHBondContact O-N 3.39Å; S118-F121 WeakPolarHBondContact OG-CB 3.33Å; S118-R127 WeakPolarHBondContact CB-O 3.29Å; S118-R127 PolarHBondContact OG-O 3.14Å
119	P	85.6	Confident	89.4	Confident	28 Å²	28	59.2 Å²	59.2	18%	0.182	28%	0.275	C	S	.	.	S	Bend	trans	-56.6	-34.4	-177.5	18.5	-30.5	0	0	0	114	Q54 M56 R196 M197	Q54-P119 WeakPolarHBondContact O-CB 3.12Å; M56-P119 HydrophobicContact CG-CB 4.35Å; P119-R196 CarbonylContact O-C 3.16Å; P119-R196 WeakPolarHBondContact O-CA 3.28Å; P119-R196 WeakPolarHBondContact O-CB 3.4Å; P119-M197 PolarHBondContact O-N 2.95Å
120	R	87	Confident	89.6	Confident	152 Å²	152	62.2 Å²	62.2	57%	0.574	29%	0.288	S	S	*	.	S	Bend	trans	-116.2	80.3	173.7	-65.8	-173.1	-179.7	-178.5	-0.9	111.5	S118 H195 R196	S118-R120 PolarHBondContact O-N 3.39Å; R120-H195 CarbonylContact C-O 3.52Å; R120-H195 VanDerWaalsContact CA-O 3.23Å; R120-H195 WeakPolarHBondContact CA-O 3.46Å; R120-R196 HydrophobicContact CG-CB 4.08Å
121	F	86.5	Confident	89.9	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	27%	0.267	C	S	.	.			trans	-86.1	107.3	177.2	-173	-90.8	0	0	0	112.6	I62 T64 F115 S118 R126 Y190 H195	I62-F121 HydrophobicContact CD1-CB 3.53Å; I62-F121 HydrophobicContact CD1-CG 4.05Å; T64-F121 HydrophobicContact CG2-CE1 3.75Å; T64-F121 HydrophobicContact CG2-CE2 4.22Å; T64-F121 HydrophobicContact CG2-CZ 3.6Å; F115-F121 HydrophobicContact CB-CD2 4.32Å; F115-F121 HydrophobicContact CB-CE2 4.27Å; F115-F121 HydrophobicContact CD1-CD2 4.45Å; F115-F121 AromaticContact CD1-CE2 3.92Å; F115-F121 HydrophobicContact CD1-CE2 3.92Å; F115-F121 HydrophobicContact CD2-CD2 4.48Å; F115-F121 AromaticContact CD2-CE2 3.63Å; F115-F121 HydrophobicContact CD2-CE2 3.63Å; F115-F121 HydrophobicContact CD2-CZ 4.16Å; F115-F121 HydrophobicContact CE1-CE2 4.13Å; F115-F121 AromaticContact CE2-CE2 3.87Å; F115-F121 HydrophobicContact CE2-CE2 3.87Å; F115-F121 HydrophobicContact CE2-CZ 4.15Å; F115-F121 HydrophobicContact CG-CD2 4.18Å; F115-F121 AromaticContact CG-CE2 3.67Å; F115-F121 HydrophobicContact CG-CE2 3.67Å; F115-F121 HydrophobicContact CZ-CE2 4.11Å; S118-F121 WeakPolarHBondContact OG-CB 3.33Å; F121-R126 HydrophobicContact CE2-CB 4.15Å; F121-R126 HydrophobicContact CE2-CG 4.39Å; F121-R126 HydrophobicContact CZ-CB 4.42Å; F121-R126 HydrophobicContact CZ-CG 4.16Å; F121-Y190 HydrophobicContact CB-CE2 4.3Å; F121-Y190 PolarHBondContact O-OH 3.43Å; F121-H195 CarbonylContact C-O 3.58Å; F121-H195 PolarHBondContact N-O 2.76Å; F121-H195 WeakPolarHBondContact O-CB 3.37Å
122	S	85.3	Confident	90.1	Very high	13 Å²	13	59.9 Å²	59.9	9%	0.091	27%	0.268	C	S	.	.			trans	-105.5	142.3	168.5	141.4	0	0	0	0	110.8	Q124 K125 R126	S122-Q124 PolarHBondContact O-N 2.76Å; S122-Q124 VanDerWaalsContact O-N 3.11Å; S122-Q124 PolarHBondContact OG-N 2.87Å; S122-Q124 PolarHBondContact OG-OE1 2.86Å; S122-K125 PolarHBondContact O-N 2.94Å; S122-K125 VanDerWaalsContact O-N 3.14Å; S122-K125 PolarHBondContact OG-N 2.88Å; S122-R126 PolarHBondContact O-N 2.82Å
123	R	80.7	Confident	90.2	Very high	139 Å²	139	59.8 Å²	59.8	53%	0.525	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.7	-35.9	175.4	176.9	-176.8	-178.8	-167.3	-1.8	113.5	K68 R126	K68-R123 PolarHBondContact O-NE 2.88Å; K68-R123 PolarHBondContact O-NH2 2.77Å; R123-R126 VanDerWaalsContact O-CG 3.25Å; R123-R126 WeakPolarHBondContact O-CG 3.44Å; R123-R126 PolarHBondContact O-NE 3.04Å; R123-R126 VanDerWaalsContact O-NE 3.09Å
124	Q	80.7	Confident	90.3	Very high	146 Å²	146	61.3 Å²	61.3	68%	0.682	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-46.5	-179.7	-60.6	83.9	-15.3	0	0	111.5	S122	S122-Q124 PolarHBondContact O-N 2.76Å; S122-Q124 VanDerWaalsContact O-N 3.11Å; S122-Q124 PolarHBondContact OG-N 2.87Å; S122-Q124 PolarHBondContact OG-OE1 2.86Å
125	K	84.9	Confident	90.2	Very high	143 Å²	143	64 Å²	64	62%	0.622	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-29.2	-173	-68.7	179.5	175.8	171.7	0	114	S122 R127	S122-K125 PolarHBondContact O-N 2.94Å; S122-K125 VanDerWaalsContact O-N 3.14Å; S122-K125 PolarHBondContact OG-N 2.88Å; K125-R127 HydrophobicContact CB-CG 4.28Å; K125-R127 PolarHBondContact O-N 3.13Å
126	R	84.4	Confident	90.2	Very high	82 Å²	82	63.9 Å²	63.9	31%	0.309	30%	0.296	S	S	.	.			trans	35.7	47.8	179.5	-54.2	-165.8	-170.7	-166.5	8.3	114.5	R66 I67 F115 F121 S122 R123	R66-R126 PolarHBondContact O-NH1 2.84Å; I67-R126 PolarHBondContact O-NH2 3.2Å; I67-R126 VanDerWaalsContact O-NH2 3.11Å; F115-R126 HydrophobicContact CE1-CB 4.04Å; F115-R126 WeakPolarHBondContact CE1-O 3.42Å; F115-R126 HydrophobicContact CZ-CB 4.02Å; F121-R126 HydrophobicContact CE2-CB 4.15Å; F121-R126 HydrophobicContact CE2-CG 4.39Å; F121-R126 HydrophobicContact CZ-CB 4.42Å; F121-R126 HydrophobicContact CZ-CG 4.16Å; S122-R126 PolarHBondContact O-N 2.82Å; R123-R126 VanDerWaalsContact O-CG 3.25Å; R123-R126 WeakPolarHBondContact O-CG 3.44Å; R123-R126 PolarHBondContact O-NE 3.04Å; R123-R126 VanDerWaalsContact O-NE 3.09Å
127	R	86.6	Confident	90.1	Very high	164 Å²	164	66.7 Å²	66.7	62%	0.619	31%	0.31	S	S	*	.			trans	-69.5	168.6	-179.1	-72.9	-179.9	172.8	-169.9	-5.5	111.4	F115 S118 K125	F115-R127 WeakPolarHBondContact CD1-O 3.35Å; S118-R127 WeakPolarHBondContact CB-O 3.29Å; S118-R127 PolarHBondContact OG-O 3.14Å; K125-R127 HydrophobicContact CB-CG 4.28Å; K125-R127 PolarHBondContact O-N 3.13Å
128	G	90.2	Very high	90.2	Very high	36 Å²	36	65 Å²	65	37%	0.371	30%	0.301	S	S	.	.	S	Bend	trans	89.3	179.6	179.7	0	0	0	0	0	114.6	A116 N117 K130	A116-G128 CarbonylContact O-C 3.59Å; N117-G128 WeakPolarHBondContact O-CA 3.42Å; G128-K130 PolarHBondContact O-N 3.48Å
129	I	94	Very high	90.1	Very high	50 Å²	50	65.7 Å²	65.7	26%	0.256	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	105.7	-174.1	-56.6	-59.6	0	0	0	109.6	F115 A116 R159 L161 D165	F115-I129 WeakPolarHBondContact CA-O 3.34Å; A116-I129 HydrophobicContact CB-CB 4.43Å; A116-I129 PolarHBondContact N-O 3.22Å; A116-I129 PolarHBondContact O-N 3.17Å; I129-R159 VanDerWaalsContact CG2-NH2 3.26Å; I129-L161 HydrophobicContact CG2-CD2 3.96Å; I129-D165 HydrophobicContact CG1-CB 4.25Å; I129-D165 HydrophobicContact CG2-CB 4.43Å
130	K	94.7	Very high	89.9	Confident	134 Å²	134	64.9 Å²	64.9	58%	0.583	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.2	128.6	178.8	177	-178.7	165.6	-171.6	0	111.3	L113 F115 G128	L113-K130 HydrophobicContact CD1-CD 4.45Å; L113-K130 HydrophobicContact CD2-CG 4.34Å; F115-K130 HydrophobicContact CD1-CB 4.15Å; F115-K130 HydrophobicContact CE1-CB 3.8Å; F115-K130 HydrophobicContact CE1-CD 4.42Å; F115-K130 HydrophobicContact CE1-CG 4.13Å; F115-K130 HydrophobicContact CZ-CB 4.34Å; F115-K130 HydrophobicContact CZ-CD 4.31Å; F115-K130 HydrophobicContact CZ-CG 4.15Å; G128-K130 PolarHBondContact O-N 3.48Å
131	V	95.7	Very high	89.4	Confident	6 Å²	6	59 Å²	59	4%	0.036	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	159.2	177.8	-132.7	0	0	0	0	111.1	I114 L157 R159 L161	I114-V131 HydrophobicContact CG2-CG2 4.4Å; I114-V131 PolarHBondContact N-O 3.05Å; I114-V131 VanDerWaalsContact N-O 3.09Å; I114-V131 PolarHBondContact O-N 3Å; V131-L157 HydrophobicContact CB-CD2 3.98Å; V131-L157 HydrophobicContact CG1-CB 4.39Å; V131-L157 HydrophobicContact CG1-CD1 4.25Å; V131-L157 HydrophobicContact CG1-CD2 4.06Å; V131-L157 HydrophobicContact CG1-CG 4.48Å; V131-R159 HydrophobicContact CG1-CB 4.19Å; V131-L161 HydrophobicContact CG1-CD2 4.33Å; V131-L161 HydrophobicContact CG2-CD1 4.13Å; V131-L161 HydrophobicContact CG2-CD2 3.92Å; V131-L161 HydrophobicContact CG2-CG 4.43Å
132	K	96	Very high	88.5	Confident	91 Å²	91	62.4 Å²	62.4	40%	0.396	30%	0.302	S	S	.	.			trans	-113.9	163.5	175.1	-59.5	163.6	173.3	-178.9	0	110.7	L113 L157 E158	L113-K132 HydrophobicContact CD2-CG 4.31Å; K132-L157 WeakPolarHBondContact O-CA 3.48Å; K132-E158 HydrophobicContact CB-CB 4.37Å; K132-E158 HydrophobicContact CB-CG 4.07Å; K132-E158 HydrophobicContact CD-CG 4.42Å; K132-E158 WeakPolarHBondContact CD-OE1 3.13Å; K132-E158 WeakPolarHBondContact CD-OE2 3.14Å; K132-E158 IonicContact NZ-OE1 3.81Å; K132-E158 PolarHBondContact NZ-OE1 2.87Å; K132-E158 IonicContact NZ-OE2 3.05Å; K132-E158 PolarHBondContact NZ-OE2 3.01Å; K132-E158 PolarHBondContact O-N 2.89Å
133	I	96.6	Very high	87.4	Confident	2 Å²	2	64 Å²	64	1%	0.01	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	117.7	-177.1	-55	172.4	0	0	0	109.7	K109 L112 I114 D135 V136 K156	K109-I133 HydrophobicContact CG-CG2 4.49Å; L112-I133 HydrophobicContact CB-CD1 4.04Å; I114-I133 HydrophobicContact CD1-CD1 3.95Å; I114-I133 HydrophobicContact CD1-CG1 3.55Å; I114-I133 HydrophobicContact CG1-CD1 4.28Å; I114-I133 HydrophobicContact CG1-CG1 4.11Å; I133-D135 WeakPolarHBondContact CG2-O 3.48Å; I133-V136 HydrophobicContact CG2-CG2 3.51Å; I133-K156 CarbonylContact C-O 3.2Å
134	A	95.8	Very high	86.3	Confident	39 Å²	39	58.8 Å²	58.8	32%	0.322	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	-37.7	170.5	0	0	0	0	0	111.6	K109 K156 E158	K109-A134 WeakPolarHBondContact CD-O 3.44Å; K109-A134 WeakPolarHBondContact CE-O 3.16Å; K109-A134 PolarHBondContact NZ-O 3.16Å; A134-K156 PolarHBondContact N-O 2.89Å; A134-E158 HydrophobicContact CB-CG 4.08Å
135	D	95.4	Very high	85	Confident	56 Å²	56	58.7 Å²	58.7	30%	0.299	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	154.8	178.7	-156.8	39.2	0	0	0	115.9	K109 I133 N137 L155 K156	K109-D135 WeakPolarHBondContact CE-OD1 3.46Å; K109-D135 IonicContact NZ-OD1 2.76Å; K109-D135 PolarHBondContact NZ-OD1 3.37Å; I133-D135 WeakPolarHBondContact CG2-O 3.48Å; D135-N137 PolarHBondContact OD2-ND2 3.27Å; D135-L155 CarbonylContact O-C 3.58Å; D135-L155 VanDerWaalsContact O-CA 3.32Å; D135-L155 WeakPolarHBondContact O-CA 3.35Å; D135-K156 HydrophobicContact CB-CB 3.99Å; D135-K156 PolarHBondContact N-O 3.46Å; D135-K156 VanDerWaalsContact N-O 3.11Å; D135-K156 PolarHBondContact O-N 2.7Å
136	V	94.9	Very high	83.6	Confident	4 Å²	4	59.9 Å²	59.9	2%	0.024	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	111.7	-175.9	-180	0	0	0	0	109.7	F100 P105 A108 I133 L138 L155	F100-V136 HydrophobicContact CD1-CG1 3.88Å; F100-V136 HydrophobicContact CE1-CG1 3.87Å; F100-V136 HydrophobicContact CE1-CG2 4.2Å; F100-V136 HydrophobicContact CG-CG1 4.25Å; F100-V136 HydrophobicContact CZ-CG1 4.25Å; P105-V136 HydrophobicContact CB-CB 4.3Å; A108-V136 HydrophobicContact CB-CG2 3.97Å; I133-V136 HydrophobicContact CG2-CG2 3.51Å; V136-L138 HydrophobicContact CG1-CD2 3.71Å; V136-L138 HydrophobicContact CG1-CG 4.21Å; V136-L155 HydrophobicContact CB-CD2 4.35Å; V136-L155 HydrophobicContact CG1-CD2 3.96Å; V136-L155 HydrophobicContact CG2-CD2 4.18Å
137	N	93.4	Very high	82.6	Confident	58 Å²	58	60.2 Å²	60.2	31%	0.31	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	126.6	174.2	-67.9	-84.7	0	0	0	110.1	D135 Y139 A153 I154	D135-N137 PolarHBondContact OD2-ND2 3.27Å; N137-Y139 HydrophobicContact CB-CE2 3.68Å; N137-Y139 WeakPolarHBondContact CB-OH 3.3Å; N137-A153 CarbonylContact O-C 3.52Å; N137-A153 VanDerWaalsContact O-CA 3.23Å; N137-A153 WeakPolarHBondContact O-CA 3.4Å; N137-I154 PolarHBondContact N-O 2.92Å; N137-I154 PolarHBondContact O-N 2.84Å
138	L	93.4	Very high	81.8	Confident	19 Å²	19	55.4 Å²	55.4	10%	0.099	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	124.1	-175.1	-53.9	-177.5	0	0	0	110	A97 F100 P105 V136 A153 T290 L291	A97-L138 HydrophobicContact CB-CB 4.39Å; A97-L138 HydrophobicContact CB-CD2 4.31Å; F100-L138 HydrophobicContact CB-CD1 3.98Å; F100-L138 HydrophobicContact CB-CD2 3.83Å; F100-L138 HydrophobicContact CD2-CD2 3.6Å; F100-L138 HydrophobicContact CE2-CD2 4.39Å; F100-L138 HydrophobicContact CG-CD2 3.75Å; P105-L138 HydrophobicContact CG-CD1 4.46Å; V136-L138 HydrophobicContact CG1-CD2 3.71Å; V136-L138 HydrophobicContact CG1-CG 4.21Å; L138-A153 HydrophobicContact CD2-CB 3.6Å; L138-T290 CarbonylContact O-C 3.54Å; L138-T290 VanDerWaalsContact O-CA 3.3Å; L138-T290 WeakPolarHBondContact O-CA 3.34Å; L138-L291 HydrophobicContact CB-CB 4.28Å; L138-L291 HydrophobicContact CB-CD1 4.3Å; L138-L291 PolarHBondContact O-N 2.74Å
139	Y	89.8	Confident	81.2	Confident	18 Å²	18	55.1 Å²	55.1	7%	0.071	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	143.8	-175.8	-59	-80.7	0	0	0	112.4	N137 G151 I152 I154 V278 V282 V288 T290 L291	N137-Y139 HydrophobicContact CB-CE2 3.68Å; N137-Y139 WeakPolarHBondContact CB-OH 3.3Å; Y139-G151 VanDerWaalsContact O-CA 3.25Å; Y139-G151 WeakPolarHBondContact O-CA 3.39Å; Y139-G151 PolarHBondContact O-N 2.89Å; Y139-I152 PolarHBondContact N-O 3.01Å; Y139-I154 HydrophobicContact CD2-CD1 4.34Å; Y139-I154 HydrophobicContact CD2-CG1 4.19Å; Y139-I154 HydrophobicContact CE2-CB 4.06Å; Y139-I154 HydrophobicContact CE2-CD1 3.75Å; Y139-I154 HydrophobicContact CE2-CG1 3.76Å; Y139-V278 HydrophobicContact CD1-CG1 4.29Å; Y139-V278 HydrophobicContact CD2-CG1 4.24Å; Y139-V278 HydrophobicContact CG-CG1 3.79Å; Y139-V282 HydrophobicContact CD1-CG2 4.17Å; Y139-V282 HydrophobicContact CE1-CG2 3.5Å; Y139-V282 HydrophobicContact CE2-CG2 4.19Å; Y139-V288 HydrophobicContact CD1-CB 4.17Å; Y139-V288 HydrophobicContact CD1-CG1 3.99Å; Y139-V288 HydrophobicContact CE1-CB 4.34Å; Y139-T290 HydrophobicContact CD1-CG2 4.13Å; Y139-T290 HydrophobicContact CE1-CG2 3.76Å; Y139-L291 WeakPolarHBondContact O-CD1 3.47Å
140	G	82.4	Confident	80.7	Confident	11 Å²	11	55.5 Å²	55.5	11%	0.113	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	156.2	178.4	0	0	0	0	0	113.3	L149 Q289	G140-L149 CarbonylContact C-O 3.48Å; G140-L149 WeakPolarHBondContact CA-O 3.45Å; G140-Q289 PolarHBondContact N-O 2.77Å
141	L	75.8	Confident	80.4	Confident	27 Å²	27	49.1 Å²	49.1	14%	0.141	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	126.2	162.1	-77.5	175.1	0	0	0	109.8	W143 L149 L255 V278	L141-W143 PolarHBondContact O-N 3.28Å; L141-L149 PolarHBondContact N-O 3.21Å; L141-L149 PolarHBondContact O-N 2.69Å; L141-L255 HydrophobicContact CD1-CD1 3.41Å; L141-L255 VanDerWaalsContact CD1-CD1 3.41Å; L141-V278 HydrophobicContact CD2-CG2 4.43Å
142	P	68	Low	80.3	Confident	72 Å²	72	49 Å²	49	47%	0.468	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	130.3	175.8	-22.6	33.5	0	0	0	111.9	R221	P142-R221 PolarHBondContact O-NE 3.09Å; P142-R221 PolarHBondContact O-NH2 3.48Å
143	W	62.7	Low	80.2	Confident	46 Å²	46	44.7 Å²	44.7	17%	0.174	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	143.7	-175.8	-168.3	-94.4	0	0	0	112	L141 N145 N146 E147 L149 L211 I396	L141-W143 PolarHBondContact O-N 3.28Å; W143-N145 PolarHBondContact O-N 3.38Å; W143-N146 PolarHBondContact O-N 3.15Å; W143-E147 WeakPolarHBondContact CA-O 3.5Å; W143-E147 HydrophobicContact CB-CB 4.1Å; W143-E147 PolarHBondContact N-O 3.32Å; W143-E147 WeakPolarHBondContact O-CA 3.45Å; W143-E147 WeakPolarHBondContact O-CB 3.11Å; W143-E147 PolarHBondContact O-N 3.09Å; W143-L149 HydrophobicContact CB-CD1 4.21Å; W143-L149 HydrophobicContact CB-CG 3.84Å; W143-L149 HydrophobicContact CD2-CD1 3.46Å; W143-L149 VanDerWaalsContact CD2-CD1 3.46Å; W143-L149 HydrophobicContact CD2-CG 4.08Å; W143-L149 HydrophobicContact CE3-CD1 3.41Å; W143-L149 VanDerWaalsContact CE3-CD1 3.41Å; W143-L149 HydrophobicContact CE3-CG 4.32Å; W143-L149 HydrophobicContact CG-CD1 3.83Å; W143-L149 HydrophobicContact CG-CG 3.87Å; W143-L149 HydrophobicContact CH2-CD1 4.34Å; W143-L149 HydrophobicContact CZ2-CD1 4.42Å; W143-L149 HydrophobicContact CZ3-CD1 3.87Å; W143-L211 HydrophobicContact CH2-CD1 3.7Å; W143-L211 HydrophobicContact CH2-CD2 3.54Å; W143-L211 HydrophobicContact CH2-CG 4.19Å; W143-L211 HydrophobicContact CZ2-CD2 4.24Å; W143-L211 HydrophobicContact CZ3-CD1 3.85Å; W143-L211 HydrophobicContact CZ3-CD2 4.14Å; W143-L211 HydrophobicContact CZ3-CG 4.44Å; W143-I396 HydrophobicContact CH2-CD1 4.33Å; W143-I396 HydrophobicContact CZ2-CD1 4.48Å; W143-I396 HydrophobicContact CZ2-CG2 4.48Å
144	G	56.7	Low	80.2	Confident	31 Å²	31	45 Å²	45	32%	0.32	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.7	-136.1	-169	0	0	0	0	0	111.5	R221	G144-R221 PolarHBondContact O-NH2 2.84Å
145	N	54.1	Low	80.2	Confident	143 Å²	143	43.2 Å²	43.2	77%	0.765	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.9	-0.9	174.4	-65.9	-11	0	0	0	113.4	W143	W143-N145 PolarHBondContact O-N 3.38Å
146	N	55	Low	80.3	Confident	168 Å²	168	45.5 Å²	45.5	90%	0.898	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-166.1	4.7	-178.8	-104.4	-26.1	0	0	0	115.5	W143	W143-N146 PolarHBondContact O-N 3.15Å
147	E	63.9	Low	80.4	Confident	90 Å²	90	45.5 Å²	45.5	42%	0.421	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	145.9	174.1	-65.8	-164.4	157.2	0	0	110.3	W143 Q298	W143-E147 WeakPolarHBondContact CA-O 3.5Å; W143-E147 HydrophobicContact CB-CB 4.1Å; W143-E147 PolarHBondContact N-O 3.32Å; W143-E147 WeakPolarHBondContact O-CA 3.45Å; W143-E147 WeakPolarHBondContact O-CB 3.11Å; W143-E147 PolarHBondContact O-N 3.09Å; E147-Q298 PolarHBondContact OE2-NE2 3.05Å
148	T	69.6	Low	80.5	Confident	63 Å²	63	47.9 Å²	47.9	39%	0.387	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	111.2	169.7	-44.9	0	0	0	0	109.3	L291	T148-L291 HydrophobicContact CG2-CD2 4.05Å
149	L	76.5	Confident	80.6	Confident	30 Å²	30	51.9 Å²	51.9	16%	0.157	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	160.1	173.8	-73.4	-174.6	0	0	0	111.1	G140 L141 W143 G151	G140-L149 CarbonylContact C-O 3.48Å; G140-L149 WeakPolarHBondContact CA-O 3.45Å; L141-L149 PolarHBondContact N-O 3.21Å; L141-L149 PolarHBondContact O-N 2.69Å; W143-L149 HydrophobicContact CB-CD1 4.21Å; W143-L149 HydrophobicContact CB-CG 3.84Å; W143-L149 HydrophobicContact CD2-CD1 3.46Å; W143-L149 VanDerWaalsContact CD2-CD1 3.46Å; W143-L149 HydrophobicContact CD2-CG 4.08Å; W143-L149 HydrophobicContact CE3-CD1 3.41Å; W143-L149 VanDerWaalsContact CE3-CD1 3.41Å; W143-L149 HydrophobicContact CE3-CG 4.32Å; W143-L149 HydrophobicContact CG-CD1 3.83Å; W143-L149 HydrophobicContact CG-CG 3.87Å; W143-L149 HydrophobicContact CH2-CD1 4.34Å; W143-L149 HydrophobicContact CZ2-CD1 4.42Å; W143-L149 HydrophobicContact CZ3-CD1 3.87Å; L149-G151 PolarHBondContact O-N 2.95Å
150	R	84.2	Confident	81	Confident	57 Å²	57	53.9 Å²	53.9	22%	0.215	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	116.3	166.8	-68.6	-134.3	-178.5	69.9	6.8	109.7	A97 D98 L291 V295	A97-R150 HydrophobicContact CB-CB 3.97Å; A97-R150 WeakPolarHBondContact O-CD 3.09Å; D98-R150 HydrophobicContact CB-CB 4.18Å; D98-R150 WeakPolarHBondContact OD1-CD 3.27Å; D98-R150 WeakPolarHBondContact OD1-CG 3.39Å; D98-R150 IonicContact OD1-CZ 3.42Å; D98-R150 IonicContact OD1-NE 2.7Å; D98-R150 IonicContact OD1-NH1 3.76Å; D98-R150 PolarHBondContact OD1-NH1 3.3Å; R150-L291 HydrophobicContact CB-CD1 4.33Å; R150-L291 HydrophobicContact CG-CD1 3.99Å; R150-V295 PolarHBondContact NH2-O 2.78Å
151	G	88.7	Confident	81.6	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.01	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	-129.1	178.2	0	0	0	0	0	111.9	A97 Y139 L149 L255	A97-G151 WeakPolarHBondContact CB-O 3.45Å; A97-G151 PolarHBondContact N-O 3.23Å; Y139-G151 VanDerWaalsContact O-CA 3.25Å; Y139-G151 WeakPolarHBondContact O-CA 3.39Å; Y139-G151 PolarHBondContact O-N 2.89Å; L149-G151 PolarHBondContact O-N 2.95Å; G151-L255 WeakPolarHBondContact O-CD2 3.22Å
152	I	93.1	Very high	82.5	Confident	4 Å²	4	53.3 Å²	53.3	2%	0.021	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	156.7	175.5	68	173.7	0	0	0	111.7	I94 T95 Y139 V253 V278 A279	I94-I152 HydrophobicContact CG2-CB 4.26Å; I94-I152 HydrophobicContact CG2-CD1 4.18Å; T95-I152 CarbonylContact O-C 3.51Å; T95-I152 WeakPolarHBondContact O-CA 3.19Å; Y139-I152 PolarHBondContact N-O 3.01Å; I152-V253 HydrophobicContact CG2-CB 3.94Å; I152-V253 HydrophobicContact CG2-CG1 4.49Å; I152-V253 HydrophobicContact CG2-CG2 3.83Å; I152-V278 HydrophobicContact CD1-CB 3.84Å; I152-V278 HydrophobicContact CD1-CG1 3.82Å; I152-V278 HydrophobicContact CG1-CB 4.15Å; I152-V278 HydrophobicContact CG1-CG1 3.81Å; I152-A279 HydrophobicContact CD1-CB 4.11Å
153	A	94.8	Very high	83.7	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	140.4	165.5	0	0	0	0	0	109.7	I94 T95 A97 F100 N137 L138 L155	I94-A153 WeakPolarHBondContact CA-O 3.38Å; T95-A153 HydrophobicContact CG2-CB 4.05Å; T95-A153 PolarHBondContact N-O 2.8Å; T95-A153 PolarHBondContact O-N 3.38Å; A97-A153 HydrophobicContact CB-CB 4.39Å; F100-A153 HydrophobicContact CD2-CB 3.97Å; F100-A153 HydrophobicContact CE2-CB 3.79Å; N137-A153 CarbonylContact O-C 3.52Å; N137-A153 VanDerWaalsContact O-CA 3.23Å; N137-A153 WeakPolarHBondContact O-CA 3.4Å; L138-A153 HydrophobicContact CD2-CB 3.6Å; A153-L155 HydrophobicContact CB-CD2 4.17Å
154	I	95.8	Very high	85	Confident	9 Å²	9	58.5 Å²	58.5	5%	0.046	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	123.9	172.9	-53.8	178.4	0	0	0	107.4	L92 I93 I94 N137 Y139 A279 V282 F283	L92-I154 HydrophobicContact CD2-CG2 4.4Å; I93-I154 WeakPolarHBondContact O-CA 3.47Å; I94-I154 HydrophobicContact CG1-CG1 4.3Å; N137-I154 PolarHBondContact N-O 2.92Å; N137-I154 PolarHBondContact O-N 2.84Å; Y139-I154 HydrophobicContact CD2-CD1 4.34Å; Y139-I154 HydrophobicContact CD2-CG1 4.19Å; Y139-I154 HydrophobicContact CE2-CB 4.06Å; Y139-I154 HydrophobicContact CE2-CD1 3.75Å; Y139-I154 HydrophobicContact CE2-CG1 3.76Å; I154-A279 HydrophobicContact CD1-CB 4.12Å; I154-V282 HydrophobicContact CD1-CB 4.21Å; I154-V282 HydrophobicContact CD1-CG1 4.06Å; I154-V282 HydrophobicContact CD1-CG2 4.4Å; I154-F283 HydrophobicContact CD1-CE1 4.3Å; I154-F283 HydrophobicContact CD1-CZ 4.22Å; I154-F283 HydrophobicContact CG2-CE1 4.25Å; I154-F283 HydrophobicContact CG2-CZ 4.25Å
155	L	96.6	Very high	86.8	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.005	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	142.9	-176.2	-39.3	178.6	0	0	0	109.5	L63 L92 I93 T95 F100 I114 D135 V136 A153	L63-L155 HydrophobicContact CD2-CD1 4.12Å; L92-L155 WeakPolarHBondContact CA-O 3.44Å; I93-L155 HydrophobicContact CB-CB 4.26Å; I93-L155 HydrophobicContact CB-CD1 4.45Å; I93-L155 HydrophobicContact CG2-CD1 4.01Å; I93-L155 HydrophobicContact CG2-CG 4.42Å; I93-L155 PolarHBondContact N-O 2.77Å; I93-L155 PolarHBondContact O-N 2.65Å; T95-L155 HydrophobicContact CG2-CD1 3.99Å; T95-L155 HydrophobicContact CG2-CD2 4.5Å; T95-L155 HydrophobicContact CG2-CG 4.28Å; F100-L155 HydrophobicContact CE1-CD2 4.23Å; F100-L155 HydrophobicContact CE2-CD2 3.77Å; F100-L155 HydrophobicContact CZ-CD1 3.89Å; F100-L155 HydrophobicContact CZ-CD2 3.4Å; F100-L155 VanDerWaalsContact CZ-CD2 3.4Å; F100-L155 HydrophobicContact CZ-CG 4.3Å; I114-L155 HydrophobicContact CD1-CD1 4.01Å; D135-L155 CarbonylContact O-C 3.58Å; D135-L155 VanDerWaalsContact O-CA 3.32Å; D135-L155 WeakPolarHBondContact O-CA 3.35Å; V136-L155 HydrophobicContact CB-CD2 4.35Å; V136-L155 HydrophobicContact CG1-CD2 3.96Å; V136-L155 HydrophobicContact CG2-CD2 4.18Å; A153-L155 HydrophobicContact CB-CD2 4.17Å
156	K	96.7	Very high	88.6	Confident	103 Å²	103	55.2 Å²	55.2	45%	0.448	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	133	169.1	-163.1	-179.5	-173.9	-175.5	0	109.9	D91 I133 A134 D135	D91-K156 CarbonylContact O-C 3.47Å; D91-K156 WeakPolarHBondContact O-CA 3.11Å; D91-K156 WeakPolarHBondContact OD2-CE 3.46Å; D91-K156 IonicContact OD2-NZ 3.07Å; I133-K156 CarbonylContact C-O 3.2Å; A134-K156 PolarHBondContact N-O 2.89Å; D135-K156 HydrophobicContact CB-CB 3.99Å; D135-K156 PolarHBondContact N-O 3.46Å; D135-K156 VanDerWaalsContact N-O 3.11Å; D135-K156 PolarHBondContact O-N 2.7Å
157	L	97.2	Very high	90.6	Very high	5 Å²	5	47.4 Å²	47.4	3%	0.026	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	152.2	176.8	-66.8	177.9	0	0	0	112.3	L77 D91 I93 I114 V131 K132 R159 L161	L77-L157 HydrophobicContact CD1-CD1 4.34Å; D91-L157 HydrophobicContact CB-CB 4.24Å; D91-L157 PolarHBondContact O-N 3.05Å; I93-L157 HydrophobicContact CD1-CD1 3.89Å; I93-L157 HydrophobicContact CD1-CD2 3.72Å; I93-L157 HydrophobicContact CD1-CG 3.92Å; I114-L157 HydrophobicContact CD1-CD2 3.81Å; V131-L157 HydrophobicContact CB-CD2 3.98Å; V131-L157 HydrophobicContact CG1-CB 4.39Å; V131-L157 HydrophobicContact CG1-CD1 4.25Å; V131-L157 HydrophobicContact CG1-CD2 4.06Å; V131-L157 HydrophobicContact CG1-CG 4.48Å; K132-L157 WeakPolarHBondContact O-CA 3.48Å; L157-R159 VanDerWaalsContact C-N 3.28Å; L157-R159 WeakPolarHBondContact CB-O 3.46Å; L157-L161 HydrophobicContact CD1-CD1 4.07Å; L157-L161 HydrophobicContact CD1-CG 3.88Å
158	E	96	Very high	92	Very high	108 Å²	108	43.1 Å²	43.1	51%	0.505	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	-28.1	166.8	-78.1	-171.9	-156.5	0	0	112.4	K132 A134	K132-E158 HydrophobicContact CB-CB 4.37Å; K132-E158 HydrophobicContact CB-CG 4.07Å; K132-E158 HydrophobicContact CD-CG 4.42Å; K132-E158 WeakPolarHBondContact CD-OE1 3.13Å; K132-E158 WeakPolarHBondContact CD-OE2 3.14Å; K132-E158 IonicContact NZ-OE1 3.81Å; K132-E158 PolarHBondContact NZ-OE1 2.87Å; K132-E158 IonicContact NZ-OE2 3.05Å; K132-E158 PolarHBondContact NZ-OE2 3.01Å; K132-E158 PolarHBondContact O-N 2.89Å; A134-E158 HydrophobicContact CB-CG 4.08Å
159	R	95.7	Very high	93.3	Very high	102 Å²	102	40.3 Å²	40.3	39%	0.385	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	126	178.3	-172	-175.5	64.6	93.5	-23.7	109.7	I129 V131 L157 D165	I129-R159 VanDerWaalsContact CG2-NH2 3.26Å; V131-R159 HydrophobicContact CG1-CB 4.19Å; L157-R159 VanDerWaalsContact C-N 3.28Å; L157-R159 WeakPolarHBondContact CB-O 3.46Å; R159-D165 IonicContact CZ-OD1 2.72Å; R159-D165 VanDerWaalsContact CZ-OD1 3.25Å; R159-D165 IonicContact NH1-OD1 3.99Å; R159-D165 PolarHBondContact NH1-OD1 3.09Å; R159-D165 IonicContact NH1-OD2 2.94Å; R159-D165 PolarHBondContact NH1-OD2 2.81Å; R159-D165 IonicContact NH2-OD1 3.96Å; R159-D165 PolarHBondContact NH2-OD1 3Å
160	P	96.3	Very high	94.3	Very high	61 Å²	61	38.9 Å²	38.9	40%	0.396	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	142.7	167.9	-19.8	31	0	0	0	111.5	S90 D91	S90-P160 WeakPolarHBondContact O-CA 3.23Å; D91-P160 HydrophobicContact CB-CB 4.24Å; D91-P160 HydrophobicContact CB-CG 4.17Å
161	L	96.3	Very high	94.9	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.005	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	155.3	171.8	-54.8	-179.1	0	0	0	110.6	L77 T89 S90 A116 I129 V131 L157 D165 V167	L77-L161 HydrophobicContact CD1-CD1 4.46Å; L77-L161 HydrophobicContact CD2-CB 4.22Å; T89-L161 CarbonylContact C-O 3.53Å; T89-L161 WeakPolarHBondContact CA-O 3.36Å; S90-L161 PolarHBondContact N-O 2.86Å; S90-L161 PolarHBondContact O-N 2.98Å; A116-L161 HydrophobicContact CB-CD1 3.63Å; I129-L161 HydrophobicContact CG2-CD2 3.96Å; V131-L161 HydrophobicContact CG1-CD2 4.33Å; V131-L161 HydrophobicContact CG2-CD1 4.13Å; V131-L161 HydrophobicContact CG2-CD2 3.92Å; V131-L161 HydrophobicContact CG2-CG 4.43Å; L157-L161 HydrophobicContact CD1-CD1 4.07Å; L157-L161 HydrophobicContact CD1-CG 3.88Å; L161-D165 WeakPolarHBondContact CA-OD2 3.39Å; L161-D165 HydrophobicContact CB-CB 4.47Å; L161-D165 HydrophobicContact CD2-CB 4.47Å; L161-V167 HydrophobicContact CB-CG2 3.51Å; L161-V167 HydrophobicContact CD1-CG2 4.33Å
162	S	94.5	Very high	95.3	Very high	24 Å²	24	37.2 Å²	37.2	17%	0.168	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	177	-169.1	68.9	0	0	0	0	112.5	V164 D165 V167	S162-V164 PolarHBondContact O-N 2.94Å; S162-V164 VanDerWaalsContact O-N 3.14Å; S162-V164 WeakPolarHBondContact OG-CB 3.45Å; S162-V164 PolarHBondContact OG-N 2.87Å; S162-D165 PolarHBondContact N-OD2 3.42Å; S162-D165 WeakPolarHBondContact O-CB 3.48Å; S162-D165 PolarHBondContact O-N 3.02Å; S162-D165 PolarHBondContact OG-OD2 2.78Å; S162-V167 CarbonylContact C-O 3.55Å; S162-V167 WeakPolarHBondContact O-CG2 3.19Å; S162-V167 PolarHBondContact O-N 3.1Å
163	R	92.4	Very high	95.4	Very high	93 Å²	93	37.1 Å²	37.1	35%	0.351	19%	0.186	S	C	.	.	G	3₁₀ helix	trans	-53.1	-30.9	168.5	-177.9	179.7	177.3	165.8	1.5	113	V32 T39 F40 D165 N166 V167	V32-R163 HydrophobicContact CG2-CB 4.19Å; T39-R163 HydrophobicContact CG2-CG 3.88Å; T39-R163 VanDerWaalsContact O-CZ 3.22Å; T39-R163 PolarHBondContact O-NH2 2.68Å; F40-R163 HydrophobicContact CE1-CG 4.16Å; R163-D165 PolarHBondContact O-N 2.78Å; R163-N166 WeakPolarHBondContact O-CA 3.35Å; R163-N166 PolarHBondContact O-N 2.79Å; R163-V167 WeakPolarHBondContact CA-O 3.39Å; R163-V167 PolarHBondContact N-O 3.03Å
164	V	91.3	Very high	95.2	Very high	134 Å²	134	43.8 Å²	43.8	81%	0.812	22%	0.217	S	C	*	.	G	3₁₀ helix	trans	-68.7	-24.4	178.6	-171.9	0	0	0	0	112	S162 N166	S162-V164 PolarHBondContact O-N 2.94Å; S162-V164 VanDerWaalsContact O-N 3.14Å; S162-V164 WeakPolarHBondContact OG-CB 3.45Å; S162-V164 PolarHBondContact OG-N 2.87Å; V164-N166 PolarHBondContact O-N 3.12Å
165	D	94	Very high	94.9	Very high	14 Å²	14	48.7 Å²	48.7	8%	0.075	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-83.9	4.8	172.5	-57.7	-81.3	0	0	0	112.6	I129 R159 L161 S162 R163 V167	I129-D165 HydrophobicContact CG1-CB 4.25Å; I129-D165 HydrophobicContact CG2-CB 4.43Å; R159-D165 IonicContact CZ-OD1 2.72Å; R159-D165 VanDerWaalsContact CZ-OD1 3.25Å; R159-D165 IonicContact NH1-OD1 3.99Å; R159-D165 PolarHBondContact NH1-OD1 3.09Å; R159-D165 IonicContact NH1-OD2 2.94Å; R159-D165 PolarHBondContact NH1-OD2 2.81Å; R159-D165 IonicContact NH2-OD1 3.96Å; R159-D165 PolarHBondContact NH2-OD1 3Å; L161-D165 WeakPolarHBondContact CA-OD2 3.39Å; L161-D165 HydrophobicContact CB-CB 4.47Å; L161-D165 HydrophobicContact CD2-CB 4.47Å; S162-D165 PolarHBondContact N-OD2 3.42Å; S162-D165 WeakPolarHBondContact O-CB 3.48Å; S162-D165 PolarHBondContact O-N 3.02Å; S162-D165 PolarHBondContact OG-OD2 2.78Å; R163-D165 PolarHBondContact O-N 2.78Å; D165-V167 VanDerWaalsContact C-N 3.33Å; D165-V167 HydrophobicContact CB-CG2 4.19Å
166	N	92.8	Very high	94.4	Very high	92 Å²	92	51.2 Å²	51.2	49%	0.492	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.1	42.6	-167.5	-65.7	-18.6	0	0	0	113.4	F40 R163 V164	F40-N166 HydrophobicContact CE1-CB 4.35Å; R163-N166 WeakPolarHBondContact O-CA 3.35Å; R163-N166 PolarHBondContact O-N 2.79Å; V164-N166 PolarHBondContact O-N 3.12Å
167	V	95.1	Very high	94	Very high	3 Å²	3	47.9 Å²	47.9	2%	0.018	24%	0.238	C	C	.	.			trans	-125.6	153.9	171.1	-58.5	0	0	0	0	112.5	P58 L77 A116 L161 S162 R163 D165	P58-V167 WeakPolarHBondContact O-CA 3.42Å; P58-V167 WeakPolarHBondContact O-CB 3.26Å; P58-V167 WeakPolarHBondContact O-CG1 3.48Å; L77-V167 HydrophobicContact CD2-CB 4.21Å; L77-V167 HydrophobicContact CD2-CG2 3.73Å; A116-V167 HydrophobicContact CB-CG1 3.99Å; L161-V167 HydrophobicContact CB-CG2 3.51Å; L161-V167 HydrophobicContact CD1-CG2 4.33Å; S162-V167 CarbonylContact C-O 3.55Å; S162-V167 WeakPolarHBondContact O-CG2 3.19Å; S162-V167 PolarHBondContact O-N 3.1Å; R163-V167 WeakPolarHBondContact CA-O 3.39Å; R163-V167 PolarHBondContact N-O 3.03Å; D165-V167 VanDerWaalsContact C-N 3.33Å; D165-V167 HydrophobicContact CB-CG2 4.19Å
168	V	95.3	Very high	93.6	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.251	C	S	.	.			trans	-138	128.8	169	167.6	0	0	0	0	106.8	V32 Y33 T39 F40 P58 W59	V32-V168 HydrophobicContact CG1-CG1 4.15Å; V32-V168 HydrophobicContact CG1-CG2 3.81Å; Y33-V168 WeakPolarHBondContact O-CG1 3.46Å; T39-V168 HydrophobicContact CG2-CG2 3.67Å; F40-V168 HydrophobicContact CD2-CG2 4.5Å; F40-V168 HydrophobicContact CE2-CB 4.15Å; F40-V168 HydrophobicContact CE2-CG2 3.51Å; F40-V168 HydrophobicContact CZ-CG2 3.79Å; P58-V168 CarbonylContact C-O 3.58Å; P58-V168 PolarHBondContact O-N 2.84Å; P58-V168 VanDerWaalsContact O-N 3.13Å; W59-V168 WeakPolarHBondContact CA-O 3.47Å; W59-V168 WeakPolarHBondContact CB-O 3.49Å; W59-V168 PolarHBondContact N-O 2.88Å
169	P	96.9	Very high	93.3	Very high	4 Å²	4	45.3 Å²	45.3	3%	0.026	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-67.4	147.7	179	27.8	-35.4	0	0	0	112	C34 G35 L77 V78 H79 A87	C34-P169 CarbonylContact C-O 3.58Å; C34-P169 WeakPolarHBondContact CA-O 3.28Å; C34-P169 WeakPolarHBondContact CB-O 3.46Å; G35-P169 PolarHBondContact N-O 3.19Å; L77-P169 HydrophobicContact CD2-CB 4.27Å; L77-P169 HydrophobicContact CG-CB 4.16Å; L77-P169 CarbonylContact O-C 3.49Å; L77-P169 VanDerWaalsContact O-CA 3.24Å; L77-P169 WeakPolarHBondContact O-CA 3.34Å; V78-P169 VanDerWaalsContact C-CB 3.46Å; H79-P169 HydrophobicContact CB-CB 4.16Å; H79-P169 HydrophobicContact CB-CG 4.09Å; A87-P169 HydrophobicContact CB-CG 3.75Å
170	V	97.2	Very high	92.9	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.218	C	C	.	.	B	Isolated β-bridge	trans	-75.5	148.3	171.6	70.7	0	0	0	0	110.7	W59 L77 V78 H79 V241 V248 L250	W59-V170 HydrophobicContact CB-CB 4.04Å; W59-V170 HydrophobicContact CB-CG1 4.44Å; W59-V170 HydrophobicContact CD2-CB 3.8Å; W59-V170 HydrophobicContact CD2-CG2 4.2Å; W59-V170 HydrophobicContact CE3-CB 4.1Å; W59-V170 HydrophobicContact CE3-CG2 4.47Å; W59-V170 HydrophobicContact CG-CB 3.76Å; W59-V170 HydrophobicContact CG-CG1 4.39Å; L77-V170 PolarHBondContact O-N 3.35Å; V78-V170 HydrophobicContact CG1-CG1 3.96Å; H79-V170 PolarHBondContact N-O 2.84Å; V170-V241 HydrophobicContact CG2-CG1 4.06Å; V170-V248 HydrophobicContact CG2-CB 4.49Å; V170-V248 HydrophobicContact CG2-CG1 3.98Å; V170-V248 WeakPolarHBondContact CG2-O 3.44Å; V170-L250 HydrophobicContact CG1-CB 3.8Å; V170-L250 HydrophobicContact CG1-CD2 4.29Å; V170-L250 HydrophobicContact CG2-CB 4.25Å
171	C	96.9	Very high	92	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.014	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	152.1	169.8	-60	0	0	0	0	110.2	C34 V248 Y249 L250	C34-C171 HydrophobicContact CB-CB 4Å; C34-C171 WeakPolarHBondContact CB-SG 3.33Å; C34-C171 PolarHBondContact O-SG 3.35Å; C34-C171 WeakPolarHBondContact SG-CA 3.38Å; C34-C171 WeakPolarHBondContact SG-CB 3.44Å; C34-C171 CovalentContact SG-SG 2.04Å; C34-C171 PolarHBondContact SG-SG 2.96Å; C171-V248 PolarHBondContact N-O 3.34Å; C171-Y249 HydrophobicContact CB-CD1 3.51Å; C171-Y249 HydrophobicContact CB-CE1 3.76Å; C171-Y249 HydrophobicContact CB-CG 4.34Å; C171-Y249 WeakPolarHBondContact O-CA 3.5Å; C171-L250 WeakPolarHBondContact O-CB 3.42Å; C171-L250 PolarHBondContact O-N 2.82Å
172	L	95.8	Very high	91.2	Very high	22 Å²	22	41.9 Å²	41.9	12%	0.115	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	135.9	164.6	-53	173	0	0	0	108.4	V78 I94 L250 I276 F283	V78-L172 HydrophobicContact CB-CD2 4.04Å; V78-L172 HydrophobicContact CG1-CD2 4.09Å; I94-L172 HydrophobicContact CD1-CD2 4.19Å; L172-L250 HydrophobicContact CD2-CD2 4.23Å; L172-I276 HydrophobicContact CD2-CD1 4.36Å; L172-I276 HydrophobicContact CD2-CG1 3.83Å; L172-F283 HydrophobicContact CD1-CD2 3.7Å; L172-F283 HydrophobicContact CD1-CE2 3.71Å
173	A	94.6	Very high	90.9	Very high	2 Å²	2	41 Å²	41	2%	0.017	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-62.2	157.1	168.3	0	0	0	0	0	110.9	L250 Y251 H280	A173-L250 VanDerWaalsContact CB-O 3.31Å; A173-L250 WeakPolarHBondContact CB-O 3.25Å; A173-L250 PolarHBondContact N-O 2.62Å; A173-Y251 HydrophobicContact CB-CD1 3.48Å; A173-Y251 VanDerWaalsContact CB-CD1 3.48Å; A173-Y251 HydrophobicContact CB-CD2 3.93Å; A173-Y251 HydrophobicContact CB-CE1 3.55Å; A173-Y251 HydrophobicContact CB-CE2 3.99Å; A173-Y251 HydrophobicContact CB-CG 3.69Å; A173-H280 PolarHBondContact O-CE1 2.05Å; A173-H280 PolarHBondContact O-NE2 3.39Å
174	E	91.6	Very high	90.9	Very high	139 Å²	139	37 Å²	37	65%	0.65	20%	0.202	S	C	*	.	P	Polyproline II helix	trans	-60.7	150.4	-179.9	-65.6	-173.9	158.4	0	0	112.3	D176 S177	E174-D176 PolarHBondContact O-N 3.43Å; E174-S177 PolarHBondContact N-OG 2.66Å; E174-S177 VanDerWaalsContact O-CB 3.28Å; E174-S177 WeakPolarHBondContact O-CB 3.46Å; E174-S177 PolarHBondContact O-N 3.44Å; E174-S177 VanDerWaalsContact O-N 3.11Å; E174-S177 PolarHBondContact O-OG 2.85Å
175	R	88.8	Confident	91	Very high	113 Å²	113	30.6 Å²	30.6	43%	0.426	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	134.6	-178.3	-160.9	-178.7	-177.2	-82.7	3.4	109.9	S177 N277 H280 D281	R175-S177 PolarHBondContact O-N 2.85Å; R175-N277 VanDerWaalsContact CG-OD1 3.25Å; R175-N277 WeakPolarHBondContact CG-OD1 3.17Å; R175-H280 HydrophobicContact CG-CB 4.2Å; R175-D281 IonicContact CZ-OD1 3.38Å; R175-D281 IonicContact CZ-OD2 2.78Å; R175-D281 IonicContact NE-OD1 3.65Å; R175-D281 PolarHBondContact NE-OD1 2.9Å; R175-D281 VanDerWaalsContact NE-OD1 3.08Å; R175-D281 VanDerWaalsContact NH2-CG 3.28Å; R175-D281 IonicContact NH2-OD1 2.66Å; R175-D281 PolarHBondContact NH2-OD1 2.68Å; R175-D281 IonicContact NH2-OD2 3.91Å; R175-D281 PolarHBondContact NH2-OD2 2.94Å
176	D	86.2	Confident	91.1	Very high	54 Å²	54	29.9 Å²	29.9	29%	0.289	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.4	7.4	-176.5	-60.7	-65.2	0	0	0	116.3	E174 R209 Y220 N277	E174-D176 PolarHBondContact O-N 3.43Å; D176-R209 PolarHBondContact O-NH2 2.79Å; D176-R209 IonicContact OD1-NH2 2.79Å; D176-Y220 VanDerWaalsContact OD1-CE2 3.32Å; D176-Y220 WeakPolarHBondContact OD1-CE2 3.46Å; D176-N277 PolarHBondContact N-OD1 3.31Å; D176-N277 PolarHBondContact OD1-ND2 3.21Å
177	S	89	Confident	91.2	Very high	33 Å²	33	25.5 Å²	25.5	23%	0.231	14%	0.136	C	C	.	.			trans	-75.7	158.9	174.4	74.3	0	0	0	0	113	E174 R175 Y251	E174-S177 PolarHBondContact N-OG 2.66Å; E174-S177 VanDerWaalsContact O-CB 3.28Å; E174-S177 WeakPolarHBondContact O-CB 3.46Å; E174-S177 PolarHBondContact O-N 3.44Å; E174-S177 VanDerWaalsContact O-N 3.11Å; E174-S177 PolarHBondContact O-OG 2.85Å; R175-S177 PolarHBondContact O-N 2.85Å; S177-Y251 WeakPolarHBondContact OG-CE1 3.5Å
178	V	88.7	Confident	91.1	Very high	49 Å²	49	25.4 Å²	25.4	30%	0.297	14%	0.135	S	C	.	.			trans	-127	156.1	174.5	-65	0	0	0	0	109.2	P208 R209 Y251	V178-P208 HydrophobicContact CB-CB 4.27Å; V178-P208 HydrophobicContact CB-CG 3.71Å; V178-P208 HydrophobicContact CG1-CG 3.93Å; V178-P208 HydrophobicContact CG2-CG 3.84Å; V178-R209 HydrophobicContact CG1-CG 3.77Å; V178-Y251 WeakPolarHBondContact O-CE1 3.29Å
179	P	89.8	Confident	91	Very high	9 Å²	9	25.6 Å²	25.6	6%	0.058	14%	0.136	C	C	.	.			trans	-56.3	126.6	178.1	-26.1	34.7	0	0	0	111.6	I204 M240 Y251	P179-I204 HydrophobicContact CB-CG1 4.19Å; P179-I204 HydrophobicContact CG-CD1 4.45Å; P179-I204 HydrophobicContact CG-CG1 4.4Å; P179-M240 HydrophobicContact CG-CE 3.91Å; P179-Y251 HydrophobicContact CG-CD1 3.89Å; P179-Y251 HydrophobicContact CG-CD2 4.19Å; P179-Y251 HydrophobicContact CG-CE1 4.39Å; P179-Y251 HydrophobicContact CG-CG 3.77Å
180	P	86.6	Confident	90.8	Very high	22 Å²	22	26 Å²	26	14%	0.143	14%	0.137	C	C	.	.			trans	-69.7	151.4	178.9	24.6	-28.7	0	0	0	110.5	S182 A183 V244 Y251 Y685	P180-S182 PolarHBondContact O-N 3.15Å; P180-S182 VanDerWaalsContact O-N 3.11Å; P180-A183 HydrophobicContact CG-CB 3.97Å; P180-A183 VanDerWaalsContact O-CB 3.29Å; P180-A183 WeakPolarHBondContact O-CB 3.2Å; P180-A183 PolarHBondContact O-N 3.2Å; P180-V244 HydrophobicContact CG-CG1 4.18Å; P180-V244 HydrophobicContact CG-CG2 3.91Å; P180-Y251 WeakPolarHBondContact CD-OH 3.44Å; P180-Y685 WeakPolarHBondContact CB-OH 3.01Å
181	P	78.8	Confident	90.6	Very high	37 Å²	37	26.5 Å²	26.5	24%	0.24	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-23.5	-170.1	-25.8	37.7	0	0	0	115	Y682 V762	P181-Y682 HydrophobicContact CB-CD1 3.67Å; P181-Y682 HydrophobicContact CB-CD2 4.37Å; P181-Y682 HydrophobicContact CB-CE1 3.36Å; P181-Y682 HydrophobicContact CB-CE2 4.11Å; P181-Y682 HydrophobicContact CB-CG 4.18Å; P181-Y682 HydrophobicContact CG-CD1 3.52Å; P181-Y682 HydrophobicContact CG-CE1 3.25Å; P181-Y682 HydrophobicContact CG-CG 4.44Å; P181-V762 HydrophobicContact CB-CG1 3.92Å
182	S	79.9	Confident	90.2	Very high	34 Å²	34	30.1 Å²	30.1	24%	0.238	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-11.5	174.8	50.3	0	0	0	0	114.2	P180 Y685 L759	P180-S182 PolarHBondContact O-N 3.15Å; P180-S182 VanDerWaalsContact O-N 3.11Å; S182-Y685 WeakPolarHBondContact OG-CE1 3.26Å; S182-L759 WeakPolarHBondContact O-CD2 3.09Å
183	A	87.4	Confident	89.8	Confident	4 Å²	4	37.5 Å²	37.5	3%	0.033	18%	0.182	C	C	.	.			trans	-65.9	138.7	176.2	0	0	0	0	0	111.2	P180 C242 V244	P180-A183 HydrophobicContact CG-CB 3.97Å; P180-A183 VanDerWaalsContact O-CB 3.29Å; P180-A183 WeakPolarHBondContact O-CB 3.2Å; P180-A183 PolarHBondContact O-N 3.2Å; A183-C242 HydrophobicContact CB-CB 4.1Å; A183-V244 HydrophobicContact CB-CG2 4.09Å
184	S	91.3	Very high	89.5	Confident	9 Å²	9	43.2 Å²	43.2	6%	0.063	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	116.7	161.4	-59.4	0	0	0	0	107.4	Y186 L243 K751	S184-Y186 WeakPolarHBondContact CB-OH 3.39Å; S184-Y186 WeakPolarHBondContact O-CD2 3.27Å; S184-Y186 WeakPolarHBondContact O-CE2 3.49Å; S184-L243 PolarHBondContact O-N 3.4Å; S184-K751 PolarHBondContact OG-NZ 2.79Å
185	C	95	Very high	89.4	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	145	179.5	-67.5	0	0	0	0	110.8	I201 I202 I204 V241 C242	C185-I201 WeakPolarHBondContact O-CA 3.31Å; C185-I202 HydrophobicContact CB-CG1 3.96Å; C185-I202 PolarHBondContact O-N 2.94Å; C185-I204 HydrophobicContact CB-CD1 4Å; C185-I204 HydrophobicContact CB-CG1 4.1Å; C185-V241 CarbonylContact C-O 3.57Å; C185-V241 WeakPolarHBondContact CA-O 3.23Å; C185-C242 HydrophobicContact CB-CB 4.1Å; C185-C242 WeakPolarHBondContact CB-SG 3.37Å; C185-C242 WeakPolarHBondContact SG-CB 3.19Å; C185-C242 CovalentContact SG-SG 2.05Å; C185-C242 PolarHBondContact SG-SG 2.66Å
186	Y	95.3	Very high	89.4	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	148.3	-173.3	-48.6	-92.6	0	0	0	110.2	V44 V48 F57 S184 E200 I201 M240 V241 L243	V44-Y186 HydrophobicContact CG1-CE2 4.14Å; V48-Y186 HydrophobicContact CB-CD1 4.38Å; V48-Y186 HydrophobicContact CB-CE1 4.27Å; V48-Y186 HydrophobicContact CG1-CD1 4.03Å; V48-Y186 HydrophobicContact CG1-CE1 4.18Å; V48-Y186 HydrophobicContact CG2-CD1 3.72Å; V48-Y186 HydrophobicContact CG2-CE1 3.81Å; F57-Y186 HydrophobicContact CE2-CG 4.42Å; F57-Y186 HydrophobicContact CZ-CD1 4.24Å; F57-Y186 HydrophobicContact CZ-CD2 4.36Å; F57-Y186 AromaticContact CZ-CG 3.91Å; F57-Y186 HydrophobicContact CZ-CG 3.91Å; S184-Y186 WeakPolarHBondContact CB-OH 3.39Å; S184-Y186 WeakPolarHBondContact O-CD2 3.27Å; S184-Y186 WeakPolarHBondContact O-CE2 3.49Å; Y186-E200 VanDerWaalsContact CA-O 3.22Å; Y186-E200 WeakPolarHBondContact CA-O 3.33Å; Y186-I201 HydrophobicContact CD1-CG1 3.69Å; Y186-I201 HydrophobicContact CE1-CD1 3.97Å; Y186-I201 HydrophobicContact CE1-CG1 3.51Å; Y186-M240 WeakPolarHBondContact O-CA 3.5Å; Y186-V241 HydrophobicContact CD2-CG2 4.38Å; Y186-V241 PolarHBondContact N-O 2.93Å; Y186-V241 PolarHBondContact O-N 3.2Å; Y186-L243 HydrophobicContact CE2-CB 4.06Å
187	V	94.4	Very high	89.6	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	153.6	163.7	71.7	0	0	0	0	109.6	Y189 E200 I202 Q235 A238 Y273	V187-Y189 HydrophobicContact CG1-CD2 4.29Å; V187-Y189 HydrophobicContact CG1-CE1 4.35Å; V187-Y189 HydrophobicContact CG1-CE2 3.49Å; V187-Y189 VanDerWaalsContact CG1-CE2 3.49Å; V187-Y189 VanDerWaalsContact CG1-CZ 3.49Å; V187-Y189 WeakPolarHBondContact CG1-OH 3.28Å; V187-E200 PolarHBondContact N-O 2.79Å; V187-E200 VanDerWaalsContact N-O 3.09Å; V187-E200 PolarHBondContact O-N 3.1Å; V187-I202 HydrophobicContact CB-CD1 4.39Å; V187-I202 HydrophobicContact CB-CG2 4.29Å; V187-I202 HydrophobicContact CG1-CG2 3.56Å; V187-Q235 HydrophobicContact CG2-CG 4.33Å; V187-A238 HydrophobicContact CG2-CB 3.99Å; V187-Y273 HydrophobicContact CG2-CE1 3.97Å; V187-Y273 WeakPolarHBondContact CG2-OH 3.36Å
188	T	94	Very high	89.7	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	138.6	174.6	-52.8	0	0	0	0	111.2	N60 I74 M197 D198 E199 A238	N60-T188 WeakPolarHBondContact ND2-CB 3.32Å; N60-T188 WeakPolarHBondContact ND2-CG2 3.13Å; N60-T188 PolarHBondContact ND2-OG1 3.12Å; I74-T188 HydrophobicContact CD1-CG2 4.43Å; I74-T188 WeakPolarHBondContact CD1-O 3.48Å; T188-M197 HydrophobicContact CG2-CB 4.23Å; T188-M197 HydrophobicContact CG2-CE 3.65Å; T188-M197 HydrophobicContact CG2-SD 4.48Å; T188-D198 CarbonylContact C-O 3.58Å; T188-D198 WeakPolarHBondContact CA-O 3.08Å; T188-E199 HydrophobicContact CG2-CG 4.34Å; T188-E199 VanDerWaalsContact CG2-OE1 3.26Å; T188-E199 WeakPolarHBondContact CG2-OE1 3.43Å; T188-E199 WeakPolarHBondContact OG1-CG 3.22Å; T188-E199 PolarHBondContact OG1-OE1 2.89Å; T188-A238 WeakPolarHBondContact O-CB 3.16Å
189	Y	93.3	Very high	89.9	Confident	5 Å²	5	32.6 Å²	32.6	2%	0.02	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	160.7	171.5	-52.8	-93.7	0	0	0	109.9	V187 M197 D198 E200 E227 Y233 I234 Q235	V187-Y189 HydrophobicContact CG1-CD2 4.29Å; V187-Y189 HydrophobicContact CG1-CE1 4.35Å; V187-Y189 HydrophobicContact CG1-CE2 3.49Å; V187-Y189 VanDerWaalsContact CG1-CE2 3.49Å; V187-Y189 VanDerWaalsContact CG1-CZ 3.49Å; V187-Y189 WeakPolarHBondContact CG1-OH 3.28Å; Y189-M197 CarbonylContact O-C 3.32Å; Y189-M197 WeakPolarHBondContact O-CA 3.33Å; Y189-D198 PolarHBondContact N-O 2.82Å; Y189-D198 PolarHBondContact O-N 3.33Å; Y189-E200 HydrophobicContact CD2-CB 4.46Å; Y189-E200 HydrophobicContact CE2-CB 3.86Å; Y189-E200 VanDerWaalsContact CE2-OE2 3.25Å; Y189-E200 WeakPolarHBondContact CE2-OE2 3.47Å; Y189-E200 PolarHBondContact OH-OE2 3.17Å; Y189-E227 PolarHBondContact OH-OE2 3.19Å; Y189-Y233 VanDerWaalsContact CB-CD1 3.43Å; Y189-Y233 HydrophobicContact CG-CD1 4.26Å; Y189-I234 CarbonylContact C-O 3.44Å; Y189-I234 WeakPolarHBondContact CA-O 3.29Å; Y189-Q235 HydrophobicContact CD1-CB 3.93Å; Y189-Q235 HydrophobicContact CD1-CG 3.74Å; Y189-Q235 HydrophobicContact CE1-CB 4.29Å; Y189-Q235 HydrophobicContact CE1-CG 3.77Å; Y189-Q235 VanDerWaalsContact CE1-NE2 3.34Å; Y189-Q235 VanDerWaalsContact CE1-OE1 3.32Å
190	Y	93.2	Very high	89.9	Confident	13 Å²	13	34.1 Å²	34.1	5%	0.051	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	119.3	166.8	166.9	-93.8	0	0	0	108.9	T71 F121 K192 H195 R196 M197 Y233 I234	T71-Y190 HydrophobicContact CG2-CD1 3.9Å; T71-Y190 HydrophobicContact CG2-CE1 4.2Å; T71-Y190 HydrophobicContact CG2-CG 4.08Å; F121-Y190 HydrophobicContact CB-CE2 4.3Å; F121-Y190 PolarHBondContact O-OH 3.43Å; Y190-K192 HydrophobicContact CD1-CG 4.43Å; Y190-K192 HydrophobicContact CE1-CG 4.25Å; Y190-H195 PolarHBondContact OH-ND1 3.45Å; Y190-R196 CarbonylContact C-O 3.5Å; Y190-R196 WeakPolarHBondContact CA-O 3.49Å; Y190-M197 HydrophobicContact CD2-SD 3.99Å; Y190-M197 HydrophobicContact CG-SD 4.35Å; Y190-Y233 CarbonylContact O-C 3.56Å; Y190-Y233 WeakPolarHBondContact O-CA 3.31Å; Y190-I234 HydrophobicContact CD1-CB 4.26Å; Y190-I234 HydrophobicContact CD1-CD1 3.88Å; Y190-I234 HydrophobicContact CD1-CG1 4.09Å; Y190-I234 HydrophobicContact CE1-CD1 4.3Å; Y190-I234 PolarHBondContact N-O 2.82Å; Y190-I234 PolarHBondContact O-N 3.06Å
191	D	91.6	Very high	90.2	Very high	10 Å²	10	33.3 Å²	33.3	5%	0.053	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	120.8	174.9	-166.6	-19.5	0	0	0	110.5	R193 E194 H195 R196 Y233	D191-R193 VanDerWaalsContact C-N 3.29Å; D191-R193 PolarHBondContact O-N 3.44Å; D191-R193 PolarHBondContact OD1-N 3.34Å; D191-E194 HydrophobicContact CB-CB 4.23Å; D191-E194 WeakPolarHBondContact OD2-CG 3.08Å; D191-H195 WeakPolarHBondContact O-CA 3.3Å; D191-H195 PolarHBondContact O-N 3.41Å; D191-H195 VanDerWaalsContact O-N 3.17Å; D191-R196 HydrophobicContact CB-CG 4.48Å; D191-R196 PolarHBondContact N-O 3.41Å; D191-Y233 HydrophobicContact CB-CD1 3.94Å; D191-Y233 HydrophobicContact CB-CE1 3.62Å
192	K	88.5	Confident	90.8	Very high	78 Å²	78	31.8 Å²	31.8	34%	0.339	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-24.5	176.8	-62.6	169.9	-168.8	167.6	0	112.6	Y190 H195 Q232 Y233 I234	Y190-K192 HydrophobicContact CD1-CG 4.43Å; Y190-K192 HydrophobicContact CE1-CG 4.25Å; K192-H195 PolarHBondContact O-CE1 3.33Å; K192-H195 PolarHBondContact O-ND1 2.87Å; K192-H195 VanDerWaalsContact O-ND1 3.09Å; K192-Q232 WeakPolarHBondContact CB-O 3.41Å; K192-Q232 VanDerWaalsContact CD-O 3.23Å; K192-Q232 WeakPolarHBondContact CD-O 3.44Å; K192-Q232 WeakPolarHBondContact CG-O 3.42Å; K192-Q232 PolarHBondContact N-O 2.72Å; K192-Y233 WeakPolarHBondContact CE-O 3.26Å; K192-I234 HydrophobicContact CD-CG1 4.31Å; K192-I234 HydrophobicContact CG-CD1 4.36Å; K192-I234 HydrophobicContact CG-CG1 4.11Å
193	R	87.4	Confident	91.2	Very high	176 Å²	176	31.2 Å²	31.2	66%	0.664	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-61.1	178.6	-69.3	-164.1	177.5	164.9	0.2	112	D191 H195	D191-R193 VanDerWaalsContact C-N 3.29Å; D191-R193 PolarHBondContact O-N 3.44Å; D191-R193 PolarHBondContact OD1-N 3.34Å; R193-H195 PolarHBondContact O-N 2.66Å; R193-H195 VanDerWaalsContact O-N 3.13Å
194	E	88.7	Confident	91.2	Very high	122 Å²	122	31.4 Å²	31.4	57%	0.57	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-4.9	-176.6	-61.4	-49.8	123.5	0	0	113.5	D191 R196	D191-E194 HydrophobicContact CB-CB 4.23Å; D191-E194 WeakPolarHBondContact OD2-CG 3.08Å; E194-R196 HydrophobicContact CB-CG 3.84Å; E194-R196 PolarHBondContact O-N 3.37Å
195	H	89.7	Confident	90.5	Very high	68 Å²	68	31.4 Å²	31.4	32%	0.315	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	38.5	178.5	-68.4	-20.2	0	0	0	112.1	R120 F121 Y190 D191 K192 R193	R120-H195 CarbonylContact C-O 3.52Å; R120-H195 VanDerWaalsContact CA-O 3.23Å; R120-H195 WeakPolarHBondContact CA-O 3.46Å; F121-H195 CarbonylContact C-O 3.58Å; F121-H195 PolarHBondContact N-O 2.76Å; F121-H195 WeakPolarHBondContact O-CB 3.37Å; Y190-H195 PolarHBondContact OH-ND1 3.45Å; D191-H195 WeakPolarHBondContact O-CA 3.3Å; D191-H195 PolarHBondContact O-N 3.41Å; D191-H195 VanDerWaalsContact O-N 3.17Å; K192-H195 PolarHBondContact O-CE1 3.33Å; K192-H195 PolarHBondContact O-ND1 2.87Å; K192-H195 VanDerWaalsContact O-ND1 3.09Å; R193-H195 PolarHBondContact O-N 2.66Å; R193-H195 VanDerWaalsContact O-N 3.13Å
196	R	89.8	Confident	89.3	Confident	52 Å²	52	35.5 Å²	35.5	20%	0.196	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	160.1	-175.7	75.6	-168.8	-177	103.4	12.4	112.3	P119 R120 Y190 D191 E194 D198	P119-R196 CarbonylContact O-C 3.16Å; P119-R196 WeakPolarHBondContact O-CA 3.28Å; P119-R196 WeakPolarHBondContact O-CB 3.4Å; R120-R196 HydrophobicContact CG-CB 4.08Å; Y190-R196 CarbonylContact C-O 3.5Å; Y190-R196 WeakPolarHBondContact CA-O 3.49Å; D191-R196 HydrophobicContact CB-CG 4.48Å; D191-R196 PolarHBondContact N-O 3.41Å; E194-R196 HydrophobicContact CB-CG 3.84Å; E194-R196 PolarHBondContact O-N 3.37Å; R196-D198 VanDerWaalsContact CZ-CG 3.47Å; R196-D198 IonicContact CZ-OD1 3.06Å; R196-D198 IonicContact CZ-OD2 2.93Å; R196-D198 IonicContact NE-OD1 3.15Å; R196-D198 PolarHBondContact NE-OD1 3.01Å; R196-D198 IonicContact NE-OD2 2.71Å; R196-D198 IonicContact NH1-OD1 2.66Å; R196-D198 PolarHBondContact NH1-OD1 2.93Å; R196-D198 IonicContact NH2-OD1 2.7Å; R196-D198 PolarHBondContact NH2-OD1 3.21Å; R196-D198 IonicContact NH2-OD2 3.04Å; R196-D198 PolarHBondContact NH2-OD2 3.33Å
197	M	90.1	Very high	88.3	Confident	2 Å²	2	40.9 Å²	40.9	1%	0.01	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	141.2	167.8	-60.6	-77.1	-82.7	0	0	108.6	M56 N60 I62 I74 P119 T188 Y189 Y190	M56-M197 HydrophobicContact CB-CB 4.13Å; M56-M197 HydrophobicContact CB-CG 4.48Å; M56-M197 HydrophobicContact CE-CB 4.42Å; M56-M197 HydrophobicContact CE-CE 4.01Å; M56-M197 HydrophobicContact CE-CG 3.62Å; M56-M197 HydrophobicContact CE-SD 4.49Å; N60-M197 HydrophobicContact CB-CE 4.22Å; I62-M197 HydrophobicContact CD1-CE 4.45Å; I62-M197 HydrophobicContact CD1-CG 3.92Å; I62-M197 HydrophobicContact CD1-SD 3.79Å; I62-M197 HydrophobicContact CG1-CE 3.99Å; I62-M197 HydrophobicContact CG1-CG 4.46Å; I62-M197 HydrophobicContact CG1-SD 3.86Å; I74-M197 HydrophobicContact CD1-CE 3.95Å; I74-M197 HydrophobicContact CD1-SD 4.22Å; I74-M197 HydrophobicContact CG1-CE 3.96Å; I74-M197 HydrophobicContact CG1-SD 4.35Å; I74-M197 HydrophobicContact CG2-CE 3.93Å; P119-M197 PolarHBondContact O-N 2.95Å; T188-M197 HydrophobicContact CG2-CB 4.23Å; T188-M197 HydrophobicContact CG2-CE 3.65Å; T188-M197 HydrophobicContact CG2-SD 4.48Å; Y189-M197 CarbonylContact O-C 3.32Å; Y189-M197 WeakPolarHBondContact O-CA 3.33Å; Y190-M197 HydrophobicContact CD2-SD 3.99Å; Y190-M197 HydrophobicContact CG-SD 4.35Å
198	D	89.6	Confident	87.7	Confident	22 Å²	22	41.9 Å²	41.9	12%	0.118	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	123.3	-179.2	-87	-18.5	0	0	0	110	T188 Y189 R196 Y233	T188-D198 CarbonylContact C-O 3.58Å; T188-D198 WeakPolarHBondContact CA-O 3.08Å; Y189-D198 PolarHBondContact N-O 2.82Å; Y189-D198 PolarHBondContact O-N 3.33Å; R196-D198 VanDerWaalsContact CZ-CG 3.47Å; R196-D198 IonicContact CZ-OD1 3.06Å; R196-D198 IonicContact CZ-OD2 2.93Å; R196-D198 IonicContact NE-OD1 3.15Å; R196-D198 PolarHBondContact NE-OD1 3.01Å; R196-D198 IonicContact NE-OD2 2.71Å; R196-D198 IonicContact NH1-OD1 2.66Å; R196-D198 PolarHBondContact NH1-OD1 2.93Å; R196-D198 IonicContact NH2-OD1 2.7Å; R196-D198 PolarHBondContact NH2-OD1 3.21Å; R196-D198 IonicContact NH2-OD2 3.04Å; R196-D198 PolarHBondContact NH2-OD2 3.33Å; D198-Y233 HydrophobicContact CB-CE1 4.09Å; D198-Y233 WeakPolarHBondContact OD2-CE1 3.46Å; D198-Y233 PolarHBondContact OD2-OH 3.39Å
199	E	92.9	Very high	87.2	Confident	21 Å²	21	44.7 Å²	44.7	10%	0.098	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	139.8	176.7	-83.1	68.5	-171.6	0	0	110.5	V48 F57 N60 T188	V48-E199 HydrophobicContact CB-CB 4.49Å; V48-E199 HydrophobicContact CG1-CB 4.34Å; V48-E199 HydrophobicContact CG2-CB 3.95Å; F57-E199 HydrophobicContact CD1-CG 4.38Å; F57-E199 HydrophobicContact CD2-CG 3.48Å; F57-E199 VanDerWaalsContact CD2-CG 3.48Å; F57-E199 HydrophobicContact CE1-CG 4.28Å; F57-E199 HydrophobicContact CE2-CB 4.24Å; F57-E199 HydrophobicContact CE2-CG 3.36Å; F57-E199 HydrophobicContact CG-CG 4Å; F57-E199 HydrophobicContact CZ-CB 4.36Å; F57-E199 HydrophobicContact CZ-CG 3.79Å; F57-E199 PolarHBondContact N-OE1 3.34Å; N60-E199 PolarHBondContact ND2-OE1 3.37Å; T188-E199 HydrophobicContact CG2-CG 4.34Å; T188-E199 VanDerWaalsContact CG2-OE1 3.26Å; T188-E199 WeakPolarHBondContact CG2-OE1 3.43Å; T188-E199 WeakPolarHBondContact OG1-CG 3.22Å; T188-E199 PolarHBondContact OG1-OE1 2.89Å
200	E	90.6	Very high	86.5	Confident	42 Å²	42	45.5 Å²	45.5	20%	0.196	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	146.9	-179.4	-173	169.2	-130	0	0	112.3	Y186 V187 Y189 K230	Y186-E200 VanDerWaalsContact CA-O 3.22Å; Y186-E200 WeakPolarHBondContact CA-O 3.33Å; V187-E200 PolarHBondContact N-O 2.79Å; V187-E200 VanDerWaalsContact N-O 3.09Å; V187-E200 PolarHBondContact O-N 3.1Å; Y189-E200 HydrophobicContact CD2-CB 4.46Å; Y189-E200 HydrophobicContact CE2-CB 3.86Å; Y189-E200 VanDerWaalsContact CE2-OE2 3.25Å; Y189-E200 WeakPolarHBondContact CE2-OE2 3.47Å; Y189-E200 PolarHBondContact OH-OE2 3.17Å; E200-K230 IonicContact OE1-NZ 3.27Å; E200-K230 PolarHBondContact OE1-NZ 3.18Å; E200-K230 IonicContact OE2-NZ 3.32Å; E200-K230 PolarHBondContact OE2-NZ 3.09Å
201	I	92.3	Very high	85.4	Confident	5 Å²	5	46.8 Å²	46.8	3%	0.026	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	121.9	172.3	-63.7	-177.6	0	0	0	110.1	V48 C185 Y186 P747 T748 K751 P760	V48-I201 HydrophobicContact CG1-CG1 4.13Å; C185-I201 WeakPolarHBondContact O-CA 3.31Å; Y186-I201 HydrophobicContact CD1-CG1 3.69Å; Y186-I201 HydrophobicContact CE1-CD1 3.97Å; Y186-I201 HydrophobicContact CE1-CG1 3.51Å; I201-P747 HydrophobicContact CB-CB 3.98Å; I201-P747 HydrophobicContact CG2-CB 3.6Å; I201-T748 PolarHBondContact N-OG1 3.04Å; I201-K751 HydrophobicContact CD1-CB 3.48Å; I201-K751 VanDerWaalsContact CD1-CB 3.48Å; I201-K751 HydrophobicContact CD1-CD 4.13Å; I201-K751 HydrophobicContact CD1-CG 3.64Å; I201-P760 HydrophobicContact CG2-CB 3.65Å; I201-P760 HydrophobicContact CG2-CG 3.33Å
202	I	91.5	Very high	83.8	Confident	4 Å²	4	48.9 Å²	48.9	2%	0.021	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	154.1	179	66.1	178.8	0	0	0	112	C185 V187 I204 A225 E227 M240 Y273	C185-I202 HydrophobicContact CB-CG1 3.96Å; C185-I202 PolarHBondContact O-N 2.94Å; V187-I202 HydrophobicContact CB-CD1 4.39Å; V187-I202 HydrophobicContact CB-CG2 4.29Å; V187-I202 HydrophobicContact CG1-CG2 3.56Å; I202-I204 HydrophobicContact CD1-CD1 4.18Å; I202-I204 HydrophobicContact CG1-CD1 4.25Å; I202-A225 HydrophobicContact CB-CB 4.23Å; I202-A225 HydrophobicContact CD1-CB 3.7Å; I202-A225 HydrophobicContact CG1-CB 4.17Å; I202-E227 HydrophobicContact CG2-CG 4.03Å; I202-M240 HydrophobicContact CD1-CG 3.85Å; I202-M240 HydrophobicContact CD1-SD 3.92Å; I202-Y273 HydrophobicContact CD1-CE2 4.36Å
203	M	88.5	Confident	81.7	Confident	22 Å²	22	46.4 Å²	46.4	11%	0.108	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	113.5	178.3	-57.7	-177.3	-78.1	0	0	110.3	A225 M226 P747 P760 Y764 K824	M203-A225 CarbonylContact O-C 3.57Å; M203-A225 WeakPolarHBondContact O-CA 3.36Å; M203-M226 HydrophobicContact CB-CB 4.4Å; M203-M226 HydrophobicContact CB-CE 3.7Å; M203-M226 HydrophobicContact CE-CB 4.32Å; M203-M226 HydrophobicContact CE-CE 4.32Å; M203-M226 PolarHBondContact O-N 3.31Å; M203-M226 HydrophobicContact SD-CE 4.27Å; M203-P747 HydrophobicContact CE-CG 4.27Å; M203-P747 HydrophobicContact CG-CB 4.43Å; M203-P747 HydrophobicContact CG-CG 3.6Å; M203-P747 HydrophobicContact SD-CG 3.9Å; M203-P760 WeakPolarHBondContact CG-O 3.4Å; M203-Y764 HydrophobicContact SD-CD1 4.42Å; M203-Y764 HydrophobicContact SD-CE1 4.14Å; M203-K824 PolarHBondContact SD-NZ 2.92Å
204	I	87.4	Confident	79.7	Confident	9 Å²	9	46.6 Å²	46.6	5%	0.046	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	140.1	175.4	-51	-57.2	0	0	0	109.5	P179 C185 I202 P208 V223 A225 M240	P179-I204 HydrophobicContact CB-CG1 4.19Å; P179-I204 HydrophobicContact CG-CD1 4.45Å; P179-I204 HydrophobicContact CG-CG1 4.4Å; C185-I204 HydrophobicContact CB-CD1 4Å; C185-I204 HydrophobicContact CB-CG1 4.1Å; I202-I204 HydrophobicContact CD1-CD1 4.18Å; I202-I204 HydrophobicContact CG1-CD1 4.25Å; I204-P208 HydrophobicContact CG2-CB 3.65Å; I204-V223 HydrophobicContact CG2-CG1 4.33Å; I204-A225 HydrophobicContact CD1-CB 4.03Å; I204-M240 HydrophobicContact CD1-SD 3.7Å
205	T	76.8	Confident	77.5	Confident	8 Å²	8	43.5 Å²	43.5	5%	0.049	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	144	174.4	48.1	0	0	0	0	110.8	K207 P208 C224 M226 L270	T205-K207 CarbonylContact O-C 3.6Å; T205-K207 PolarHBondContact O-N 3.27Å; T205-K207 VanDerWaalsContact O-N 3.1Å; T205-K207 PolarHBondContact OG1-O 3.47Å; T205-P208 VanDerWaalsContact O-CA 3.32Å; T205-P208 WeakPolarHBondContact O-CA 3.23Å; T205-C224 PolarHBondContact OG1-O 2.96Å; T205-M226 HydrophobicContact CG2-CG 3.76Å; T205-M226 HydrophobicContact CG2-SD 4.32Å; T205-L270 HydrophobicContact CG2-CD2 4.28Å
206	R	70.2	Confident	75.5	Confident	87 Å²	87	51 Å²	51	33%	0.328	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	-30.8	-175.9	176.3	174.8	-77.9	-160.8	-2.8	113.1	P208 F681 Y682 E826 K829	R206-P208 VanDerWaalsContact C-CD 3.5Å; R206-P208 WeakPolarHBondContact O-CD 3.41Å; R206-F681 VanDerWaalsContact NH1-CD1 3.33Å; R206-F681 VanDerWaalsContact NH2-CE2 3.32Å; R206-Y682 PolarHBondContact NE-OH 2.94Å; R206-Y682 PolarHBondContact NH2-OH 3.28Å; R206-Y682 VanDerWaalsContact NH2-OH 3.07Å; R206-E826 WeakPolarHBondContact CB-OE1 3.32Å; R206-E826 WeakPolarHBondContact CB-OE2 3.47Å; R206-E826 VanDerWaalsContact CD-OE2 3.31Å; R206-E826 WeakPolarHBondContact CD-OE2 3.42Å; R206-E826 PolarHBondContact N-OE1 2.81Å; R206-E826 IonicContact NE-OE2 3.97Å; R206-K829 VanDerWaalsContact CZ-CE 3.47Å; R206-K829 VanDerWaalsContact CZ-NZ 3.27Å
207	K	74.9	Confident	73.4	Confident	112 Å²	112	51.6 Å²	51.6	49%	0.487	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	93.3	159.3	-64.1	176.6	-177.7	173.9	0	106	T205 D828	T205-K207 CarbonylContact O-C 3.6Å; T205-K207 PolarHBondContact O-N 3.27Å; T205-K207 VanDerWaalsContact O-N 3.1Å; T205-K207 PolarHBondContact OG1-O 3.47Å; K207-D828 IonicContact NZ-OD2 3.69Å; K207-D828 PolarHBondContact NZ-OD2 3.37Å
208	P	80	Confident	71.4	Confident	21 Å²	21	54.8 Å²	54.8	14%	0.136	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	-43.4	-173.3	24.7	-34.3	0	0	0	110.8	V178 I204 T205 R206 C210 V223 C224	V178-P208 HydrophobicContact CB-CB 4.27Å; V178-P208 HydrophobicContact CB-CG 3.71Å; V178-P208 HydrophobicContact CG1-CG 3.93Å; V178-P208 HydrophobicContact CG2-CG 3.84Å; I204-P208 HydrophobicContact CG2-CB 3.65Å; T205-P208 VanDerWaalsContact O-CA 3.32Å; T205-P208 WeakPolarHBondContact O-CA 3.23Å; R206-P208 VanDerWaalsContact C-CD 3.5Å; R206-P208 WeakPolarHBondContact O-CD 3.41Å; P208-C210 PolarHBondContact O-N 3.42Å; P208-V223 HydrophobicContact CB-CG1 4.06Å; P208-V223 CarbonylContact O-C 3.53Å; P208-V223 VanDerWaalsContact O-CA 3.3Å; P208-V223 WeakPolarHBondContact O-CA 3.23Å; P208-C224 PolarHBondContact O-N 2.92Å
209	R	84	Confident	69.8	Low	60 Å²	60	58.8 Å²	58.8	23%	0.226	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	113.5	172.5	-68.1	174.6	177.7	-86.8	19.5	108.9	D176 V178 Y220 G222 E275	D176-R209 PolarHBondContact O-NH2 2.79Å; D176-R209 IonicContact OD1-NH2 2.79Å; V178-R209 HydrophobicContact CG1-CG 3.77Å; R209-Y220 VanDerWaalsContact NH1-CG 3.25Å; R209-G222 WeakPolarHBondContact CA-O 3.2Å; R209-E275 IonicContact CZ-OE1 2.85Å; R209-E275 IonicContact CZ-OE2 3.15Å; R209-E275 IonicContact NH1-OE1 2.64Å; R209-E275 PolarHBondContact NH1-OE1 2.93Å; R209-E275 IonicContact NH1-OE2 2.68Å; R209-E275 PolarHBondContact NH1-OE2 2.92Å; R209-E275 IonicContact NH2-OE2 2.66Å
210	C	78.2	Confident	67.8	Low	22 Å²	22	62.6 Å²	62.6	15%	0.149	33%	0.326	C	S	.	.			trans	-106.2	176.9	173	58.2	0	0	0	0	110	P208 A212 R221 G222 C224	P208-C210 PolarHBondContact O-N 3.42Å; C210-A212 PolarHBondContact O-N 3.39Å; C210-R221 CarbonylContact O-C 3.6Å; C210-R221 VanDerWaalsContact O-O 3.06Å; C210-G222 PolarHBondContact N-O 2.82Å; C210-C224 HydrophobicContact CB-CB 3.65Å; C210-C224 WeakPolarHBondContact CB-SG 3.17Å; C210-C224 WeakPolarHBondContact SG-CB 2.94Å; C210-C224 PolarHBondContact SG-N 2.8Å; C210-C224 VanDerWaalsContact SG-N 3.43Å; C210-C224 CovalentContact SG-SG 2.03Å; C210-C224 PolarHBondContact SG-SG 3.13Å
211	L	70.9	Confident	66.7	Low	39 Å²	39	62 Å²	62	20%	0.204	32%	0.322	C	S	.	.	S	Bend	trans	56	6.4	174.5	-74.9	159.1	0	0	0	116.9	W143 A213 R221 L258 F272 L398	W143-L211 HydrophobicContact CH2-CD1 3.7Å; W143-L211 HydrophobicContact CH2-CD2 3.54Å; W143-L211 HydrophobicContact CH2-CG 4.19Å; W143-L211 HydrophobicContact CZ2-CD2 4.24Å; W143-L211 HydrophobicContact CZ3-CD1 3.85Å; W143-L211 HydrophobicContact CZ3-CD2 4.14Å; W143-L211 HydrophobicContact CZ3-CG 4.44Å; L211-A213 PolarHBondContact O-N 2.78Å; L211-R221 HydrophobicContact CB-CB 3.69Å; L211-R221 WeakPolarHBondContact O-CD 3.44Å; L211-L258 HydrophobicContact CD1-CD1 3.68Å; L211-L258 HydrophobicContact CD1-CD2 4.13Å; L211-L258 HydrophobicContact CG-CD1 4.4Å; L211-F272 HydrophobicContact CD1-CD2 3.88Å; L211-F272 HydrophobicContact CD1-CE2 3.65Å; L211-F272 HydrophobicContact CD1-CG 4.45Å; L211-F272 HydrophobicContact CD1-CZ 3.99Å; L211-L398 HydrophobicContact CD2-CD1 3.66Å; L211-L398 HydrophobicContact CD2-CD2 3.74Å; L211-L398 HydrophobicContact CD2-CG 4.37Å; L211-L398 HydrophobicContact CG-CD1 4.04Å
212	A	57.4	Low	66.3	Low	55 Å²	55	61.9 Å²	61.9	46%	0.455	32%	0.322	S	S	.	.			trans	-52.9	128.9	177.5	0	0	0	0	0	110.5	C210	C210-A212 PolarHBondContact O-N 3.39Å
213	A	45.2	Very low	66.2	Low	26 Å²	26	61.7 Å²	61.7	22%	0.215	32%	0.322	C	S	.	.			trans	-70	141.2	175.8	0	0	0	0	0	110.2	L211 S215	L211-A213 PolarHBondContact O-N 2.78Å; A213-S215 WeakPolarHBondContact CB-OG 3.37Å; A213-S215 PolarHBondContact O-N 3.07Å
214	N	45.9	Very low	66.2	Low	180 Å²	180	60.7 Å²	60.7	96%	0.963	32%	0.316	S	S	*	.	S	Bend	trans	-72.2	24.2	173.3	-73.1	3	0	0	0	113
215	S	42.4	Very low	66.3	Low	56 Å²	56	60.2 Å²	60.2	39%	0.392	31%	0.314	S	S	.	.	S	Bend	trans	-81.9	146.3	176.7	47.1	0	0	0	0	110.8	A213 A217	A213-S215 WeakPolarHBondContact CB-OG 3.37Å; A213-S215 PolarHBondContact O-N 3.07Å; S215-A217 WeakPolarHBondContact CB-O 3.1Å; S215-A217 CarbonylContact O-C 3.56Å; S215-A217 PolarHBondContact O-N 2.92Å; S215-A217 VanDerWaalsContact O-N 3.07Å; S215-A217 PolarHBondContact OG-O 2.99Å
216	K	46.9	Very low	66.7	Low	227 Å²	227	60.8 Å²	60.8	99%	0.987	32%	0.316	S	S	*	.	S	Bend	trans	-57.5	-24.2	179.4	-71.5	-172.5	175.1	-175	0	114
217	A	46.2	Very low	67.5	Low	63 Å²	63	57 Å²	57	52%	0.521	30%	0.303	S	S	.	.	S	Bend	trans	-98.5	123.7	161.8	0	0	0	0	0	109	S215 Q219	S215-A217 WeakPolarHBondContact CB-O 3.1Å; S215-A217 CarbonylContact O-C 3.56Å; S215-A217 PolarHBondContact O-N 2.92Å; S215-A217 VanDerWaalsContact O-N 3.07Å; S215-A217 PolarHBondContact OG-O 2.99Å; A217-Q219 PolarHBondContact O-N 2.96Å
218	P	48.5	Very low	67.7	Low	70 Å²	70	55 Å²	55	46%	0.455	30%	0.295	S	S	.	.			trans	-73.8	91.3	176.7	30.4	-34.1	0	0	0	109.8	Y220	P218-Y220 VanDerWaalsContact C-N 3.31Å; P218-Y220 HydrophobicContact CB-CD1 4.12Å; P218-Y220 HydrophobicContact CB-CE1 3.78Å; P218-Y220 HydrophobicContact CG-CE1 3.93Å; P218-Y220 PolarHBondContact O-N 2.98Å
219	Q	54.6	Low	67.5	Low	105 Å²	105	57.8 Å²	57.8	49%	0.491	31%	0.305	S	S	.	.			trans	-69	94.3	166.3	-68.1	-170.5	5.1	0	0	107.9	A217	A217-Q219 PolarHBondContact O-N 2.96Å
220	Y	51.7	Low	67.3	Low	102 Å²	102	58.4 Å²	58.4	40%	0.4	31%	0.309	S	S	.	.			trans	-60.3	137.4	-171.2	-61	-59.5	0	0	0	112.5	D176 R209 P218	D176-Y220 VanDerWaalsContact OD1-CE2 3.32Å; D176-Y220 WeakPolarHBondContact OD1-CE2 3.46Å; R209-Y220 VanDerWaalsContact NH1-CG 3.25Å; P218-Y220 VanDerWaalsContact C-N 3.31Å; P218-Y220 HydrophobicContact CB-CD1 4.12Å; P218-Y220 HydrophobicContact CB-CE1 3.78Å; P218-Y220 HydrophobicContact CG-CE1 3.93Å; P218-Y220 PolarHBondContact O-N 2.98Å
221	R	67.3	Low	67.1	Low	28 Å²	28	67.8 Å²	67.8	11%	0.106	34%	0.341	C	S	.	.			trans	-135.1	55.8	-177.7	-71.2	-177.1	-179.4	143	12	111.7	P142 G144 C210 L211 F272	P142-R221 PolarHBondContact O-NE 3.09Å; P142-R221 PolarHBondContact O-NH2 3.48Å; G144-R221 PolarHBondContact O-NH2 2.84Å; C210-R221 CarbonylContact O-C 3.6Å; C210-R221 VanDerWaalsContact O-O 3.06Å; L211-R221 HydrophobicContact CB-CB 3.69Å; L211-R221 WeakPolarHBondContact O-CD 3.44Å; R221-F272 WeakPolarHBondContact O-CE2 3.09Å; R221-F272 WeakPolarHBondContact O-CZ 3.46Å
222	G	83.7	Confident	67.8	Low	3 Å²	3	69.7 Å²	69.7	3%	0.031	35%	0.349	C	S	.	.			trans	81.2	169.3	158.2	0	0	0	0	0	116.3	R209 C210 Y273 E275	R209-G222 WeakPolarHBondContact CA-O 3.2Å; C210-G222 PolarHBondContact N-O 2.82Å; G222-Y273 CarbonylContact C-O 3.34Å; G222-Y273 WeakPolarHBondContact CA-O 3.32Å; G222-E275 WeakPolarHBondContact CA-OE1 3.33Å; G222-E275 PolarHBondContact N-OE1 3.03Å
223	V	88.9	Confident	69.4	Low	1 Å²	1	69.6 Å²	69.6	1%	0.006	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	142.7	177.6	179.9	0	0	0	0	110.1	I204 P208 M240 Y273 E275	I204-V223 HydrophobicContact CG2-CG1 4.33Å; P208-V223 HydrophobicContact CB-CG1 4.06Å; P208-V223 CarbonylContact O-C 3.53Å; P208-V223 VanDerWaalsContact O-CA 3.3Å; P208-V223 WeakPolarHBondContact O-CA 3.23Å; V223-M240 HydrophobicContact CB-CE 3.93Å; V223-M240 HydrophobicContact CG1-CE 3.77Å; V223-M240 HydrophobicContact CG1-SD 4.29Å; V223-M240 HydrophobicContact CG2-CE 4.36Å; V223-Y273 PolarHBondContact N-O 3.07Å; V223-Y273 PolarHBondContact O-N 2.85Å; V223-E275 HydrophobicContact CG2-CG 4.26Å
224	C	89	Confident	71.6	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	142.8	171.5	-79.4	0	0	0	0	112.2	T205 P208 C210 L258 L270 G271	T205-C224 PolarHBondContact OG1-O 2.96Å; P208-C224 PolarHBondContact O-N 2.92Å; C210-C224 HydrophobicContact CB-CB 3.65Å; C210-C224 WeakPolarHBondContact CB-SG 3.17Å; C210-C224 WeakPolarHBondContact SG-CB 2.94Å; C210-C224 PolarHBondContact SG-N 2.8Å; C210-C224 VanDerWaalsContact SG-N 3.43Å; C210-C224 CovalentContact SG-SG 2.03Å; C210-C224 PolarHBondContact SG-SG 3.13Å; C224-L258 WeakPolarHBondContact SG-CD1 2.98Å; C224-L270 HydrophobicContact CB-CB 4.43Å; C224-L270 HydrophobicContact CB-CD1 4.28Å; C224-G271 WeakPolarHBondContact CA-O 3.5Å
225	A	90.7	Very high	74	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	151.7	168.7	0	0	0	0	0	110.6	I202 M203 I204 E227 L270 G271 Y273	I202-A225 HydrophobicContact CB-CB 4.23Å; I202-A225 HydrophobicContact CD1-CB 3.7Å; I202-A225 HydrophobicContact CG1-CB 4.17Å; M203-A225 CarbonylContact O-C 3.57Å; M203-A225 WeakPolarHBondContact O-CA 3.36Å; I204-A225 HydrophobicContact CD1-CB 4.03Å; A225-E227 HydrophobicContact CB-CG 4.47Å; A225-E227 PolarHBondContact O-N 2.92Å; A225-L270 CarbonylContact O-C 3.56Å; A225-L270 WeakPolarHBondContact O-CA 3.38Å; A225-G271 PolarHBondContact N-O 3.47Å; A225-G271 PolarHBondContact O-N 3.11Å; A225-Y273 HydrophobicContact CB-CE2 4.06Å
226	M	85.1	Confident	76.5	Confident	19 Å²	19	60.6 Å²	60.6	9%	0.094	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	112.4	176.3	-63.2	-177.5	-69.1	0	0	109.8	M203 T205 L270	M203-M226 HydrophobicContact CB-CB 4.4Å; M203-M226 HydrophobicContact CB-CE 3.7Å; M203-M226 HydrophobicContact CE-CB 4.32Å; M203-M226 HydrophobicContact CE-CE 4.32Å; M203-M226 PolarHBondContact O-N 3.31Å; M203-M226 HydrophobicContact SD-CE 4.27Å; T205-M226 HydrophobicContact CG2-CG 3.76Å; T205-M226 HydrophobicContact CG2-SD 4.32Å; M226-L270 HydrophobicContact CB-CD2 4.45Å; M226-L270 HydrophobicContact CG-CD2 3.86Å
227	E	86.3	Confident	78.8	Confident	9 Å²	9	49.8 Å²	49.8	4%	0.042	23%	0.233	C	C	.	.			trans	-141.6	144.1	-172	-74.9	178.2	-117.7	0	0	112.3	Y189 I202 A225 Q235 N269 G271 Y273	Y189-E227 PolarHBondContact OH-OE2 3.19Å; I202-E227 HydrophobicContact CG2-CG 4.03Å; A225-E227 HydrophobicContact CB-CG 4.47Å; A225-E227 PolarHBondContact O-N 2.92Å; E227-Q235 PolarHBondContact OE2-NE2 3Å; E227-N269 CarbonylContact O-C 3.52Å; E227-N269 WeakPolarHBondContact O-CB 3.5Å; E227-G271 WeakPolarHBondContact OE1-CA 3.44Å; E227-Y273 WeakPolarHBondContact OE1-CE2 3.25Å; E227-Y273 VanDerWaalsContact OE1-CZ 3.29Å; E227-Y273 PolarHBondContact OE1-OH 2.87Å; E227-Y273 PolarHBondContact OE2-OH 3.08Å
228	E	79.1	Confident	81.2	Confident	68 Å²	68	46.8 Å²	46.8	32%	0.318	21%	0.208	S	C	.	.			trans	-93.8	140.9	178.8	-57	-159.4	127.3	0	0	111.9	K230 S721 R723	E228-K230 PolarHBondContact O-N 3.03Å; E228-S721 WeakPolarHBondContact OE1-CB 3.4Å; E228-S721 PolarHBondContact OE1-OG 2.73Å; E228-R723 IonicContact OE1-CZ 2.87Å; E228-R723 IonicContact OE1-NE 2.72Å; E228-R723 PolarHBondContact OE1-NE 3.39Å; E228-R723 VanDerWaalsContact OE1-NE 3.15Å; E228-R723 IonicContact OE1-NH2 3.08Å; E228-R723 PolarHBondContact OE1-NH2 2.89Å; E228-R723 IonicContact OE2-CZ 3.86Å; E228-R723 IonicContact OE2-NE 2.65Å; E228-R723 PolarHBondContact OE2-NE 3.2Å; E228-R723 IonicContact OE2-NH1 2.85Å; E228-R723 IonicContact OE2-NH2 3.39Å; E228-R723 PolarHBondContact OE2-NH2 2.92Å
229	K	74.9	Confident	83.6	Confident	81 Å²	81	43.4 Å²	43.4	35%	0.352	19%	0.187	S	C	.	.			trans	-72.1	94.9	-178.8	-167.1	-179.6	-173.9	173.5	0	112.5	R231 Q257 T393	K229-R231 PolarHBondContact O-N 2.92Å; K229-Q257 VanDerWaalsContact CB-OE1 3.32Å; K229-Q257 VanDerWaalsContact CD-OE1 3.26Å; K229-T393 VanDerWaalsContact NZ-CB 3.28Å; K229-T393 PolarHBondContact NZ-OG1 2.99Å
230	K	80.9	Confident	85.6	Confident	72 Å²	72	38.4 Å²	38.4	31%	0.313	16%	0.163	S	C	.	.			trans	-79	93.3	169.7	-57.4	178.2	174.1	173.1	0	110.8	E200 E228 Q232 Y233	E200-K230 IonicContact OE1-NZ 3.27Å; E200-K230 PolarHBondContact OE1-NZ 3.18Å; E200-K230 IonicContact OE2-NZ 3.32Å; E200-K230 PolarHBondContact OE2-NZ 3.09Å; E228-K230 PolarHBondContact O-N 3.03Å; K230-Q232 PolarHBondContact O-N 3.27Å; K230-Y233 HydrophobicContact CB-CD2 3.42Å; K230-Y233 VanDerWaalsContact CB-CD2 3.42Å; K230-Y233 HydrophobicContact CB-CE2 3.88Å; K230-Y233 HydrophobicContact CB-CG 4.24Å; K230-Y233 HydrophobicContact CD-CD2 4.15Å; K230-Y233 HydrophobicContact CD-CE2 3.98Å; K230-Y233 HydrophobicContact CG-CD2 4.37Å; K230-Y233 HydrophobicContact CG-CE2 4.42Å; K230-Y233 PolarHBondContact O-N 3.21Å
231	R	74.7	Confident	87.7	Confident	219 Å²	219	33.6 Å²	33.6	83%	0.826	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.7	-23.8	-175.2	-67.4	-172	-176.2	-172.7	3.5	115.5	K229	K229-R231 PolarHBondContact O-N 2.92Å
232	Q	84.9	Confident	89.1	Confident	79 Å²	79	32.2 Å²	32.2	37%	0.369	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-9.2	-168.3	-50.8	-172.2	46.5	0	0	113.1	K192 K230	K192-Q232 WeakPolarHBondContact CB-O 3.41Å; K192-Q232 VanDerWaalsContact CD-O 3.23Å; K192-Q232 WeakPolarHBondContact CD-O 3.44Å; K192-Q232 WeakPolarHBondContact CG-O 3.42Å; K192-Q232 PolarHBondContact N-O 2.72Å; K230-Q232 PolarHBondContact O-N 3.27Å
233	Y	90.3	Very high	89.5	Confident	54 Å²	54	33.4 Å²	33.4	21%	0.212	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	165.5	-169.1	-69.1	-102.2	0	0	0	112.9	Y189 Y190 D191 K192 D198 K230	Y189-Y233 VanDerWaalsContact CB-CD1 3.43Å; Y189-Y233 HydrophobicContact CG-CD1 4.26Å; Y190-Y233 CarbonylContact O-C 3.56Å; Y190-Y233 WeakPolarHBondContact O-CA 3.31Å; D191-Y233 HydrophobicContact CB-CD1 3.94Å; D191-Y233 HydrophobicContact CB-CE1 3.62Å; K192-Y233 WeakPolarHBondContact CE-O 3.26Å; D198-Y233 HydrophobicContact CB-CE1 4.09Å; D198-Y233 WeakPolarHBondContact OD2-CE1 3.46Å; D198-Y233 PolarHBondContact OD2-OH 3.39Å; K230-Y233 HydrophobicContact CB-CD2 3.42Å; K230-Y233 VanDerWaalsContact CB-CD2 3.42Å; K230-Y233 HydrophobicContact CB-CE2 3.88Å; K230-Y233 HydrophobicContact CB-CG 4.24Å; K230-Y233 HydrophobicContact CD-CD2 4.15Å; K230-Y233 HydrophobicContact CD-CE2 3.98Å; K230-Y233 HydrophobicContact CG-CD2 4.37Å; K230-Y233 HydrophobicContact CG-CE2 4.42Å; K230-Y233 PolarHBondContact O-N 3.21Å
234	I	92.4	Very high	89.6	Confident	22 Å²	22	34.7 Å²	34.7	11%	0.113	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	130.6	163.8	-57.1	178.6	0	0	0	107.7	T71 I74 Y189 Y190 K192	T71-I234 HydrophobicContact CG2-CD1 3.86Å; I74-I234 WeakPolarHBondContact CD1-O 3.39Å; Y189-I234 CarbonylContact C-O 3.44Å; Y189-I234 WeakPolarHBondContact CA-O 3.29Å; Y190-I234 HydrophobicContact CD1-CB 4.26Å; Y190-I234 HydrophobicContact CD1-CD1 3.88Å; Y190-I234 HydrophobicContact CD1-CG1 4.09Å; Y190-I234 HydrophobicContact CE1-CD1 4.3Å; Y190-I234 PolarHBondContact N-O 2.82Å; Y190-I234 PolarHBondContact O-N 3.06Å; K192-I234 HydrophobicContact CD-CG1 4.31Å; K192-I234 HydrophobicContact CG-CD1 4.36Å; K192-I234 HydrophobicContact CG-CG1 4.11Å
235	Q	94.8	Very high	89.4	Confident	22 Å²	22	42.1 Å²	42.1	10%	0.103	19%	0.192	C	C	.	.			trans	-129.6	-9.9	179.1	-162.7	-176.9	3	0	0	112.2	V187 Y189 E227 G237 A238 Y254 Y273	V187-Q235 HydrophobicContact CG2-CG 4.33Å; Y189-Q235 HydrophobicContact CD1-CB 3.93Å; Y189-Q235 HydrophobicContact CD1-CG 3.74Å; Y189-Q235 HydrophobicContact CE1-CB 4.29Å; Y189-Q235 HydrophobicContact CE1-CG 3.77Å; Y189-Q235 VanDerWaalsContact CE1-NE2 3.34Å; Y189-Q235 VanDerWaalsContact CE1-OE1 3.32Å; E227-Q235 PolarHBondContact OE2-NE2 3Å; Q235-G237 PolarHBondContact O-N 3.45Å; Q235-A238 HydrophobicContact CG-CB 4.11Å; Q235-A238 WeakPolarHBondContact O-CB 3.43Å; Q235-A238 PolarHBondContact O-N 2.99Å; Q235-Y254 HydrophobicContact CB-CD1 3.91Å; Q235-Y254 HydrophobicContact CB-CE1 3.89Å; Q235-Y254 HydrophobicContact CB-CG 4.34Å; Q235-Y254 HydrophobicContact CG-CD1 3.77Å; Q235-Y254 HydrophobicContact CG-CD2 3.9Å; Q235-Y254 HydrophobicContact CG-CE1 4.04Å; Q235-Y254 HydrophobicContact CG-CE2 4.16Å; Q235-Y254 HydrophobicContact CG-CG 3.68Å; Q235-Y254 VanDerWaalsContact NE2-CD2 3.31Å; Q235-Y254 WeakPolarHBondContact O-CB 3.23Å; Q235-Y254 VanDerWaalsContact O-CD1 3.23Å; Q235-Y254 WeakPolarHBondContact O-CD1 3.49Å; Q235-Y254 PolarHBondContact OE1-OH 3.24Å; Q235-Y273 PolarHBondContact NE2-OH 2.85Å
236	L	95.5	Very high	89.3	Confident	28 Å²	28	46.9 Å²	46.9	15%	0.147	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	124.5	-176.4	-172.7	61.2	0	0	0	110.7	C73 I74 A96 D98 A238 L255	C73-L236 VanDerWaalsContact CA-O 3.32Å; C73-L236 WeakPolarHBondContact CA-O 3.35Å; C73-L236 WeakPolarHBondContact CB-O 3.25Å; C73-L236 VanDerWaalsContact SG-CG 3.58Å; C73-L236 PolarHBondContact SG-O 3.3Å; C73-L236 VanDerWaalsContact SG-O 3.4Å; I74-L236 PolarHBondContact N-O 3.14Å; A96-L236 HydrophobicContact CB-CD1 3.76Å; A96-L236 HydrophobicContact CB-CG 4.11Å; D98-L236 HydrophobicContact CB-CD2 4.41Å; L236-A238 VanDerWaalsContact C-N 3.3Å; L236-A238 PolarHBondContact O-N 3.49Å; L236-L255 VanDerWaalsContact CD1-O 3.26Å; L236-L255 WeakPolarHBondContact CD1-O 3.13Å
237	G	96.3	Very high	89.6	Confident	0 Å²	0	48 Å²	48	0%	0	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.7	0.5	-175.6	0	0	0	0	0	115.8	I74 T95 Q235 Y254	I74-G237 CarbonylContact C-O 3.6Å; I74-G237 CarbonylContact O-C 3.53Å; I74-G237 WeakPolarHBondContact O-CA 3.43Å; T95-G237 WeakPolarHBondContact OG1-CA 3.48Å; Q235-G237 PolarHBondContact O-N 3.45Å; G237-Y254 PolarHBondContact N-O 3.17Å
238	A	96.5	Very high	90.1	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.227	C	C	.	.			trans	-63.4	144	177.5	0	0	0	0	0	112.1	I74 V187 T188 Q235 L236 Y254	I74-A238 HydrophobicContact CB-CB 4.07Å; I74-A238 HydrophobicContact CD1-CB 4.17Å; I74-A238 HydrophobicContact CG2-CB 4.13Å; V187-A238 HydrophobicContact CG2-CB 3.99Å; T188-A238 WeakPolarHBondContact O-CB 3.16Å; Q235-A238 HydrophobicContact CG-CB 4.11Å; Q235-A238 WeakPolarHBondContact O-CB 3.43Å; Q235-A238 PolarHBondContact O-N 2.99Å; L236-A238 VanDerWaalsContact C-N 3.3Å; L236-A238 PolarHBondContact O-N 3.49Å; A238-Y254 PolarHBondContact O-N 2.91Å
239	P	97.3	Very high	90.9	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	135.3	176.1	34	-36	0	0	0	111.3	N60 V241 L250	N60-P239 WeakPolarHBondContact OD1-CG 3.43Å; P239-V241 HydrophobicContact CB-CG1 3.8Å; P239-V241 HydrophobicContact CG-CG1 4.21Å; P239-L250 HydrophobicContact CB-CD1 3.43Å; P239-L250 VanDerWaalsContact CB-CD1 3.43Å
240	M	96.5	Very high	92	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	110.1	155.2	176.1	178.9	80.6	0	0	107.9	P179 Y186 I202 I204 V223 Y251 G252 Y273	P179-M240 HydrophobicContact CG-CE 3.91Å; Y186-M240 WeakPolarHBondContact O-CA 3.5Å; I202-M240 HydrophobicContact CD1-CG 3.85Å; I202-M240 HydrophobicContact CD1-SD 3.92Å; I204-M240 HydrophobicContact CD1-SD 3.7Å; V223-M240 HydrophobicContact CB-CE 3.93Å; V223-M240 HydrophobicContact CG1-CE 3.77Å; V223-M240 HydrophobicContact CG1-SD 4.29Å; V223-M240 HydrophobicContact CG2-CE 4.36Å; M240-Y251 VanDerWaalsContact CE-CB 3.49Å; M240-Y251 PolarHBondContact O-N 2.64Å; M240-Y251 VanDerWaalsContact O-N 3.07Å; M240-G252 PolarHBondContact N-O 2.68Å; M240-Y273 HydrophobicContact CB-CD1 3.39Å; M240-Y273 HydrophobicContact CB-CE1 3.52Å; M240-Y273 HydrophobicContact CB-CG 3.94Å; M240-Y273 HydrophobicContact CE-CG 4.49Å; M240-Y273 HydrophobicContact CG-CD1 4.43Å; M240-Y273 HydrophobicContact CG-CE1 4.47Å; M240-Y273 HydrophobicContact SD-CD1 4.39Å; M240-Y273 HydrophobicContact SD-CD2 3.91Å; M240-Y273 HydrophobicContact SD-CE2 4.23Å; M240-Y273 HydrophobicContact SD-CG 4Å
241	V	96.8	Very high	92.7	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	141.5	178.3	-55.4	0	0	0	0	110.1	F57 W59 V170 C185 Y186 P239 V248 Y249 L250	F57-V241 HydrophobicContact CD2-CG2 4.34Å; F57-V241 HydrophobicContact CE2-CG2 3.87Å; F57-V241 HydrophobicContact CZ-CG2 4.41Å; W59-V241 HydrophobicContact CZ2-CG2 4.33Å; V170-V241 HydrophobicContact CG2-CG1 4.06Å; C185-V241 CarbonylContact C-O 3.57Å; C185-V241 WeakPolarHBondContact CA-O 3.23Å; Y186-V241 HydrophobicContact CD2-CG2 4.38Å; Y186-V241 PolarHBondContact N-O 2.93Å; Y186-V241 PolarHBondContact O-N 3.2Å; P239-V241 HydrophobicContact CB-CG1 3.8Å; P239-V241 HydrophobicContact CG-CG1 4.21Å; V241-V248 HydrophobicContact CB-CG1 3.53Å; V241-V248 HydrophobicContact CG1-CG1 4.29Å; V241-V248 HydrophobicContact CG2-CG1 3.8Å; V241-Y249 CarbonylContact C-O 3.6Å; V241-Y249 VanDerWaalsContact CA-O 3.31Å; V241-Y249 WeakPolarHBondContact CA-O 3.28Å; V241-L250 HydrophobicContact CG1-CD1 4.45Å
242	C	95.9	Very high	93.6	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	137.4	177.1	-55.6	0	0	0	0	110.6	A183 C185 Y249 Y251	A183-C242 HydrophobicContact CB-CB 4.1Å; C185-C242 HydrophobicContact CB-CB 4.1Å; C185-C242 WeakPolarHBondContact CB-SG 3.37Å; C185-C242 WeakPolarHBondContact SG-CB 3.19Å; C185-C242 CovalentContact SG-SG 2.05Å; C185-C242 PolarHBondContact SG-SG 2.66Å; C242-Y249 PolarHBondContact N-O 3.27Å; C242-Y249 PolarHBondContact O-N 3.03Å; C242-Y251 HydrophobicContact CB-CD2 3.69Å; C242-Y251 HydrophobicContact CB-CE2 3.75Å
243	L	93.3	Very high	94.1	Very high	27 Å²	27	25.7 Å²	25.7	14%	0.141	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	116.1	175.1	179.1	58.1	0	0	0	109.2	V44 S184 Y186 V248	V44-L243 HydrophobicContact CB-CD2 4.36Å; V44-L243 HydrophobicContact CG2-CD1 4.17Å; S184-L243 PolarHBondContact O-N 3.4Å; Y186-L243 HydrophobicContact CE2-CB 4.06Å; L243-V248 HydrophobicContact CD1-CG2 4.05Å
244	V	90.7	Very high	94.4	Very high	29 Å²	29	24 Å²	24	18%	0.176	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	123.1	179.4	-173.7	0	0	0	0	107.7	P180 A183 S246 R247 Y249 Y251	P180-V244 HydrophobicContact CG-CG1 4.18Å; P180-V244 HydrophobicContact CG-CG2 3.91Å; A183-V244 HydrophobicContact CB-CG2 4.09Å; V244-S246 VanDerWaalsContact C-N 3.3Å; V244-S246 PolarHBondContact O-N 3.47Å; V244-R247 PolarHBondContact N-O 3.17Å; V244-R247 PolarHBondContact O-N 2.02Å; V244-Y249 HydrophobicContact CB-CD2 3.99Å; V244-Y249 HydrophobicContact CB-CE2 4.05Å; V244-Y249 HydrophobicContact CG2-CD2 4.27Å; V244-Y251 HydrophobicContact CG2-CE2 4.25Å
245	N	85.3	Confident	94.4	Very high	156 Å²	156	24 Å²	24	83%	0.834	13%	0.127	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.5	49.8	178.1	-58.4	-4.4	0	0	0	113.2	R247	N245-R247 PolarHBondContact O-N 3.2Å
246	S	87	Confident	94	Very high	99 Å²	99	24.3 Å²	24.3	69%	0.692	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.3	18.3	-178.4	-50.1	0	0	0	0	115.8	V244	V244-S246 VanDerWaalsContact C-N 3.3Å; V244-S246 PolarHBondContact O-N 3.47Å
247	R	92.3	Very high	93.7	Very high	44 Å²	44	23.4 Å²	23.4	17%	0.166	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	147.1	173.2	-170.6	152.5	-65.2	-171.3	2.6	111.7	C34 Y83 V244 N245 Y249	C34-R247 WeakPolarHBondContact O-CD 3.09Å; Y83-R247 PolarHBondContact O-NH1 3.29Å; V244-R247 PolarHBondContact N-O 3.17Å; V244-R247 PolarHBondContact O-N 2.02Å; N245-R247 PolarHBondContact O-N 3.2Å; R247-Y249 HydrophobicContact CB-CE2 3.75Å; R247-Y249 HydrophobicContact CG-CE2 4Å; R247-Y249 WeakPolarHBondContact O-CD2 3.3Å; R247-Y249 WeakPolarHBondContact O-CE2 3.46Å
248	V	96.2	Very high	93.1	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	125.7	-175	-175.8	0	0	0	0	111.8	G35 V44 W59 V170 C171 V241 L243	G35-V248 WeakPolarHBondContact CA-O 3.04Å; G35-V248 PolarHBondContact O-N 2.83Å; V44-V248 HydrophobicContact CB-CG2 4.29Å; V44-V248 HydrophobicContact CG1-CG2 3.87Å; V44-V248 HydrophobicContact CG2-CG2 3.42Å; V44-V248 VanDerWaalsContact CG2-CG2 3.42Å; W59-V248 HydrophobicContact CH2-CB 3.76Å; W59-V248 HydrophobicContact CH2-CG1 3.76Å; W59-V248 HydrophobicContact CH2-CG2 3.8Å; W59-V248 HydrophobicContact CZ2-CB 4.19Å; W59-V248 HydrophobicContact CZ2-CG1 3.65Å; W59-V248 HydrophobicContact CZ2-CG2 4.38Å; W59-V248 HydrophobicContact CZ3-CB 4.33Å; V170-V248 HydrophobicContact CG2-CB 4.49Å; V170-V248 HydrophobicContact CG2-CG1 3.98Å; V170-V248 WeakPolarHBondContact CG2-O 3.44Å; C171-V248 PolarHBondContact N-O 3.34Å; V241-V248 HydrophobicContact CB-CG1 3.53Å; V241-V248 HydrophobicContact CG1-CG1 4.29Å; V241-V248 HydrophobicContact CG2-CG1 3.8Å; L243-V248 HydrophobicContact CD1-CG2 4.05Å
249	Y	96.7	Very high	92.4	Very high	37 Å²	37	24.1 Å²	24.1	15%	0.145	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	133.8	-177.6	-59.9	-89.6	0	0	0	111.5	C171 V241 C242 V244 R247 Y251	C171-Y249 HydrophobicContact CB-CD1 3.51Å; C171-Y249 HydrophobicContact CB-CE1 3.76Å; C171-Y249 HydrophobicContact CB-CG 4.34Å; C171-Y249 WeakPolarHBondContact O-CA 3.5Å; V241-Y249 CarbonylContact C-O 3.6Å; V241-Y249 VanDerWaalsContact CA-O 3.31Å; V241-Y249 WeakPolarHBondContact CA-O 3.28Å; C242-Y249 PolarHBondContact N-O 3.27Å; C242-Y249 PolarHBondContact O-N 3.03Å; V244-Y249 HydrophobicContact CB-CD2 3.99Å; V244-Y249 HydrophobicContact CB-CE2 4.05Å; V244-Y249 HydrophobicContact CG2-CD2 4.27Å; R247-Y249 HydrophobicContact CB-CE2 3.75Å; R247-Y249 HydrophobicContact CG-CE2 4Å; R247-Y249 WeakPolarHBondContact O-CD2 3.3Å; R247-Y249 WeakPolarHBondContact O-CE2 3.46Å; Y249-Y251 PolarHBondContact O-N 2.75Å
250	L	97	Very high	91.3	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	108.1	169.9	177.6	65.9	0	0	0	109.3	V78 V170 C171 L172 A173 P239 V241 G252 I276	V78-L250 HydrophobicContact CG1-CD2 3.73Å; V170-L250 HydrophobicContact CG1-CB 3.8Å; V170-L250 HydrophobicContact CG1-CD2 4.29Å; V170-L250 HydrophobicContact CG2-CB 4.25Å; C171-L250 WeakPolarHBondContact O-CB 3.42Å; C171-L250 PolarHBondContact O-N 2.82Å; L172-L250 HydrophobicContact CD2-CD2 4.23Å; A173-L250 VanDerWaalsContact CB-O 3.31Å; A173-L250 WeakPolarHBondContact CB-O 3.25Å; A173-L250 PolarHBondContact N-O 2.62Å; P239-L250 HydrophobicContact CB-CD1 3.43Å; P239-L250 VanDerWaalsContact CB-CD1 3.43Å; V241-L250 HydrophobicContact CG1-CD1 4.45Å; L250-G252 VanDerWaalsContact CD1-O 3.3Å; L250-G252 WeakPolarHBondContact CD1-O 3.44Å; L250-I276 HydrophobicContact CD2-CD1 3.61Å; L250-I276 HydrophobicContact CD2-CG1 4.16Å; L250-I276 HydrophobicContact CG-CD1 4.08Å; L250-I276 HydrophobicContact CG-CG1 4.33Å
251	Y	95.2	Very high	90.3	Very high	21 Å²	21	28.3 Å²	28.3	8%	0.082	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	-28	176.9	-84.2	-86.4	0	0	0	112.6	A173 S177 V178 P179 P180 M240 C242 V244 Y249	A173-Y251 HydrophobicContact CB-CD1 3.48Å; A173-Y251 VanDerWaalsContact CB-CD1 3.48Å; A173-Y251 HydrophobicContact CB-CD2 3.93Å; A173-Y251 HydrophobicContact CB-CE1 3.55Å; A173-Y251 HydrophobicContact CB-CE2 3.99Å; A173-Y251 HydrophobicContact CB-CG 3.69Å; S177-Y251 WeakPolarHBondContact OG-CE1 3.5Å; V178-Y251 WeakPolarHBondContact O-CE1 3.29Å; P179-Y251 HydrophobicContact CG-CD1 3.89Å; P179-Y251 HydrophobicContact CG-CD2 4.19Å; P179-Y251 HydrophobicContact CG-CE1 4.39Å; P179-Y251 HydrophobicContact CG-CG 3.77Å; P180-Y251 WeakPolarHBondContact CD-OH 3.44Å; M240-Y251 VanDerWaalsContact CE-CB 3.49Å; M240-Y251 PolarHBondContact O-N 2.64Å; M240-Y251 VanDerWaalsContact O-N 3.07Å; C242-Y251 HydrophobicContact CB-CD2 3.69Å; C242-Y251 HydrophobicContact CB-CE2 3.75Å; V244-Y251 HydrophobicContact CG2-CE2 4.25Å; Y249-Y251 PolarHBondContact O-N 2.75Å
252	G	94.8	Very high	88.8	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.6	175.1	176.2	0	0	0	0	0	114.5	M240 L250 G274	M240-G252 PolarHBondContact N-O 2.68Å; L250-G252 VanDerWaalsContact CD1-O 3.3Å; L250-G252 WeakPolarHBondContact CD1-O 3.44Å; G252-G274 CarbonylContact C-O 3.59Å; G252-G274 WeakPolarHBondContact CA-O 3.48Å
253	V	95.9	Very high	87.6	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	127.6	-173.8	-178.2	0	0	0	0	109.3	I94 I152 L255 Y273 G274 I276	I94-V253 HydrophobicContact CG2-CG2 3.65Å; I152-V253 HydrophobicContact CG2-CB 3.94Å; I152-V253 HydrophobicContact CG2-CG1 4.49Å; I152-V253 HydrophobicContact CG2-CG2 3.83Å; V253-L255 HydrophobicContact CG1-CD2 4.31Å; V253-L255 WeakPolarHBondContact O-CG 3.36Å; V253-L255 PolarHBondContact O-N 3.46Å; V253-Y273 CarbonylContact O-C 3.54Å; V253-Y273 VanDerWaalsContact O-CA 3.28Å; V253-Y273 WeakPolarHBondContact O-CA 3.38Å; V253-G274 PolarHBondContact N-O 3.02Å; V253-G274 PolarHBondContact O-N 3.49Å; V253-I276 HydrophobicContact CG2-CD1 4.39Å
254	Y	95.5	Very high	86.4	Confident	20 Å²	20	37.3 Å²	37.3	8%	0.078	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	118.5	-179.4	-177.2	-88.4	0	0	0	110.9	Q235 G237 A238 N256 Q257 Y273	Q235-Y254 HydrophobicContact CB-CD1 3.91Å; Q235-Y254 HydrophobicContact CB-CE1 3.89Å; Q235-Y254 HydrophobicContact CB-CG 4.34Å; Q235-Y254 HydrophobicContact CG-CD1 3.77Å; Q235-Y254 HydrophobicContact CG-CD2 3.9Å; Q235-Y254 HydrophobicContact CG-CE1 4.04Å; Q235-Y254 HydrophobicContact CG-CE2 4.16Å; Q235-Y254 HydrophobicContact CG-CG 3.68Å; Q235-Y254 VanDerWaalsContact NE2-CD2 3.31Å; Q235-Y254 WeakPolarHBondContact O-CB 3.23Å; Q235-Y254 VanDerWaalsContact O-CD1 3.23Å; Q235-Y254 WeakPolarHBondContact O-CD1 3.49Å; Q235-Y254 PolarHBondContact OE1-OH 3.24Å; G237-Y254 PolarHBondContact N-O 3.17Å; A238-Y254 PolarHBondContact O-N 2.91Å; Y254-N256 VanDerWaalsContact CE2-O 3.29Å; Y254-N256 WeakPolarHBondContact CE2-O 3.38Å; Y254-N256 VanDerWaalsContact CZ-C 3.44Å; Y254-Q257 WeakPolarHBondContact OH-CB 3.39Å; Y254-Q257 PolarHBondContact OH-N 2.95Å; Y254-Y273 AromaticContact CD2-CE1 3.91Å; Y254-Y273 HydrophobicContact CD2-CE1 3.91Å; Y254-Y273 HydrophobicContact CD2-CE2 4.36Å; Y254-Y273 AromaticContact CD2-CZ 3.8Å; Y254-Y273 HydrophobicContact CG-CE1 4.24Å
255	L	92.1	Very high	85.4	Confident	20 Å²	20	41.2 Å²	41.2	11%	0.105	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	-38.8	179.1	-55.8	-173.6	0	0	0	112.1	A96 L141 G151 L236 V253 F272	A96-L255 HydrophobicContact CB-CD2 3.58Å; L141-L255 HydrophobicContact CD1-CD1 3.41Å; L141-L255 VanDerWaalsContact CD1-CD1 3.41Å; G151-L255 WeakPolarHBondContact O-CD2 3.22Å; L236-L255 VanDerWaalsContact CD1-O 3.26Å; L236-L255 WeakPolarHBondContact CD1-O 3.13Å; V253-L255 HydrophobicContact CG1-CD2 4.31Å; V253-L255 WeakPolarHBondContact O-CG 3.36Å; V253-L255 PolarHBondContact O-N 3.46Å; L255-F272 HydrophobicContact CB-CD1 4.2Å; L255-F272 HydrophobicContact CD1-CE1 4.27Å; L255-F272 PolarHBondContact N-O 3.42Å
256	N	88.1	Confident	84.5	Confident	29 Å²	29	34.6 Å²	34.6	16%	0.155	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.6	171.9	-174.4	-154	-8.9	0	0	0	112.9	Y254 F272 R394 I396	Y254-N256 VanDerWaalsContact CE2-O 3.29Å; Y254-N256 WeakPolarHBondContact CE2-O 3.38Å; Y254-N256 VanDerWaalsContact CZ-C 3.44Å; N256-F272 VanDerWaalsContact O-CB 3.24Å; N256-F272 WeakPolarHBondContact O-CB 3.41Å; N256-F272 PolarHBondContact O-N 2.65Å; N256-R394 PolarHBondContact ND2-O 3.43Å; N256-R394 PolarHBondContact OD1-O 3.14Å; N256-R394 VanDerWaalsContact OD1-O 3.13Å; N256-I396 WeakPolarHBondContact ND2-CD1 3.49Å
257	Q	88	Confident	84	Confident	10 Å²	10	35.7 Å²	35.7	5%	0.047	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	134.6	166.1	-171	167	63.6	0	0	110.6	K229 Y254 N269 V395 I396	K229-Q257 VanDerWaalsContact CB-OE1 3.32Å; K229-Q257 VanDerWaalsContact CD-OE1 3.26Å; Y254-Q257 WeakPolarHBondContact OH-CB 3.39Å; Y254-Q257 PolarHBondContact OH-N 2.95Å; Q257-N269 HydrophobicContact CG-CB 4.42Å; Q257-V395 WeakPolarHBondContact O-CA 3.47Å; Q257-I396 PolarHBondContact O-N 2.84Å; Q257-I396 VanDerWaalsContact O-N 3.13Å
258	L	84.1	Confident	83.5	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	147	170.9	-43.7	173.4	0	0	0	109.2	L211 C224 N269 L270 F272 I396 L398	L211-L258 HydrophobicContact CD1-CD1 3.68Å; L211-L258 HydrophobicContact CD1-CD2 4.13Å; L211-L258 HydrophobicContact CG-CD1 4.4Å; C224-L258 WeakPolarHBondContact SG-CD1 2.98Å; L258-N269 WeakPolarHBondContact O-CA 3.28Å; L258-L270 HydrophobicContact CB-CB 4.36Å; L258-L270 PolarHBondContact N-O 3.06Å; L258-L270 PolarHBondContact O-N 3.24Å; L258-F272 HydrophobicContact CD1-CB 4.08Å; L258-F272 HydrophobicContact CD1-CD2 4.07Å; L258-F272 HydrophobicContact CD1-CG 4.27Å; L258-F272 HydrophobicContact CD2-CB 4.06Å; L258-F272 HydrophobicContact CD2-CG 4.28Å; L258-F272 HydrophobicContact CG-CB 3.88Å; L258-F272 HydrophobicContact CG-CG 4.41Å; L258-I396 CarbonylContact C-O 3.46Å; L258-I396 WeakPolarHBondContact CA-O 3.08Å; L258-I396 HydrophobicContact CD2-CB 3.85Å; L258-I396 HydrophobicContact CD2-CD1 4.21Å; L258-I396 HydrophobicContact CD2-CG2 4.22Å; L258-L398 HydrophobicContact CB-CD1 4.31Å; L258-L398 HydrophobicContact CD1-CD1 3.95Å; L258-L398 HydrophobicContact CG-CD1 4.5Å
259	S	81.8	Confident	83	Confident	14 Å²	14	37.5 Å²	37.5	10%	0.098	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	103.3	168.3	-164.4	0	0	0	0	108.7	K261 Q268 N269 I396 R397 L398	S259-K261 PolarHBondContact O-N 3.28Å; S259-Q268 CarbonylContact C-O 3.59Å; S259-Q268 WeakPolarHBondContact CA-O 3.21Å; S259-N269 PolarHBondContact OG-OD1 2.98Å; S259-I396 PolarHBondContact N-O 2.96Å; S259-R397 WeakPolarHBondContact O-CA 3.06Å; S259-L398 PolarHBondContact O-N 3.04Å
260	L	74.9	Confident	82.6	Confident	21 Å²	21	36.1 Å²	36.1	11%	0.11	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	97.9	179.4	-169.1	77.1	0	0	0	108.6	I262 K267 Q268 L270 L398 V400	L260-I262 HydrophobicContact CD2-CD1 4.14Å; L260-I262 HydrophobicContact CD2-CG1 4.21Å; L260-I262 HydrophobicContact CG-CD1 4.27Å; L260-I262 HydrophobicContact CG-CG1 4.23Å; L260-I262 WeakPolarHBondContact O-CD1 3.3Å; L260-K267 WeakPolarHBondContact O-CA 3.44Å; L260-Q268 HydrophobicContact CB-CB 4.25Å; L260-Q268 PolarHBondContact N-O 3.26Å; L260-Q268 PolarHBondContact O-N 2.72Å; L260-L270 HydrophobicContact CB-CD1 4.35Å; L260-L270 HydrophobicContact CD2-CD1 4.4Å; L260-L398 HydrophobicContact CD1-CB 4.22Å; L260-V400 HydrophobicContact CD1-CG2 3.49Å; L260-V400 VanDerWaalsContact CD1-CG2 3.49Å; L260-V400 HydrophobicContact CD2-CG2 4.23Å; L260-V400 HydrophobicContact CG-CG2 3.74Å
261	K	73.8	Confident	82.3	Confident	68 Å²	68	36.1 Å²	36.1	30%	0.296	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	115.4	169.3	-70.4	177.2	164.3	-166.3	0	108.7	S259 K267 L398 N399 V400	S259-K261 PolarHBondContact O-N 3.28Å; K261-K267 HydrophobicContact CG-CG 4.34Å; K261-L398 PolarHBondContact N-O 2.79Å; K261-N399 VanDerWaalsContact CD-OD1 3.27Å; K261-N399 WeakPolarHBondContact CD-OD1 3.47Å; K261-N399 WeakPolarHBondContact O-CA 3.37Å; K261-V400 PolarHBondContact O-N 2.83Å
262	I	66.8	Low	82.1	Confident	13 Å²	13	35.5 Å²	35.5	7%	0.067	18%	0.179	C	C	.	.	S	Bend	trans	-98.7	-32.5	174.2	-51	103.1	0	0	0	111.5	L260 V266 V400 L402 Y715 T718	L260-I262 HydrophobicContact CD2-CD1 4.14Å; L260-I262 HydrophobicContact CD2-CG1 4.21Å; L260-I262 HydrophobicContact CG-CD1 4.27Å; L260-I262 HydrophobicContact CG-CG1 4.23Å; L260-I262 WeakPolarHBondContact O-CD1 3.3Å; I262-V266 HydrophobicContact CD1-CG1 3.81Å; I262-V266 PolarHBondContact N-O 2.65Å; I262-V400 HydrophobicContact CG1-CB 4.39Å; I262-V400 HydrophobicContact CG1-CG2 3.92Å; I262-V400 HydrophobicContact CG2-CB 4.28Å; I262-L402 HydrophobicContact CG2-CD1 4.45Å; I262-Y715 HydrophobicContact CB-CD2 4.08Å; I262-Y715 HydrophobicContact CB-CE2 4.35Å; I262-Y715 HydrophobicContact CB-CG 4.36Å; I262-Y715 HydrophobicContact CG1-CD2 4.41Å; I262-Y715 HydrophobicContact CG2-CD1 3.71Å; I262-Y715 HydrophobicContact CG2-CD2 3.6Å; I262-Y715 HydrophobicContact CG2-CE1 3.92Å; I262-Y715 HydrophobicContact CG2-CE2 3.81Å; I262-Y715 HydrophobicContact CG2-CG 3.53Å; I262-T718 HydrophobicContact CD1-CG2 3.38Å; I262-T718 HydrophobicContact CG1-CG2 4.3Å
263	N	69	Low	82	Confident	57 Å²	57	35.5 Å²	35.5	31%	0.305	18%	0.179	S	C	.	.	S	Bend	trans	-149.4	-169.9	167.5	62.1	56.2	0	0	0	108.9	N265 V266	N263-N265 PolarHBondContact O-N 3.32Å; N263-N265 WeakPolarHBondContact OD1-CA 3.32Å; N263-N265 PolarHBondContact OD1-N 3.13Å; N263-V266 WeakPolarHBondContact ND2-CG2 3.34Å; N263-V266 PolarHBondContact OD1-N 3.12Å
264	N	69.1	Low	81.7	Confident	146 Å²	146	35.5 Å²	35.5	78%	0.781	18%	0.179	S	C	*	.	S	Bend	trans	-63.1	-30.4	-178.4	-68.4	-6.3	0	0	0	113
265	N	68.6	Low	80.9	Confident	110 Å²	110	35.3 Å²	35.3	59%	0.588	18%	0.179	S	C	*	.	S	Bend	trans	-104.2	-33.7	-167.5	-54.5	4.4	0	0	0	112	N263 S786	N263-N265 PolarHBondContact O-N 3.32Å; N263-N265 WeakPolarHBondContact OD1-CA 3.32Å; N263-N265 PolarHBondContact OD1-N 3.13Å; N265-S786 VanDerWaalsContact C-OG 3.29Å; N265-S786 PolarHBondContact O-OG 3.06Å
266	V	68.2	Low	80.8	Confident	17 Å²	17	34.6 Å²	34.6	10%	0.103	18%	0.175	C	C	.	.			trans	-95.5	122.7	-179.2	-175.5	0	0	0	0	111.1	I262 N263 S786	I262-V266 HydrophobicContact CD1-CG1 3.81Å; I262-V266 PolarHBondContact N-O 2.65Å; N263-V266 WeakPolarHBondContact ND2-CG2 3.34Å; N263-V266 PolarHBondContact OD1-N 3.12Å; V266-S786 WeakPolarHBondContact CA-OG 3.41Å; V266-S786 WeakPolarHBondContact CG2-OG 3.39Å
267	K	76.3	Confident	80.8	Confident	123 Å²	123	34.2 Å²	34.2	54%	0.535	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	117	177.7	-61.3	166.3	-167.4	130.2	0	109	L260 K261	L260-K267 WeakPolarHBondContact O-CA 3.44Å; K261-K267 HydrophobicContact CG-CG 4.34Å
268	Q	81.7	Confident	80.7	Confident	32 Å²	32	34.8 Å²	34.8	15%	0.15	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	141	169.6	179.4	65.2	52.1	0	0	109.4	S259 L260 L270 G717 T718	S259-Q268 CarbonylContact C-O 3.59Å; S259-Q268 WeakPolarHBondContact CA-O 3.21Å; L260-Q268 HydrophobicContact CB-CB 4.25Å; L260-Q268 PolarHBondContact N-O 3.26Å; L260-Q268 PolarHBondContact O-N 2.72Å; Q268-L270 HydrophobicContact CG-CD2 3.8Å; Q268-L270 HydrophobicContact CG-CG 4.24Å; Q268-G717 WeakPolarHBondContact CG-O 3.42Å; Q268-T718 HydrophobicContact CB-CG2 4.08Å
269	N	85.2	Confident	81	Confident	49 Å²	49	34.8 Å²	34.8	26%	0.262	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	140.2	166.8	-59.8	-48.1	0	0	0	109.3	E227 Q257 L258 S259	E227-N269 CarbonylContact O-C 3.52Å; E227-N269 WeakPolarHBondContact O-CB 3.5Å; Q257-N269 HydrophobicContact CG-CB 4.42Å; L258-N269 WeakPolarHBondContact O-CA 3.28Å; S259-N269 PolarHBondContact OG-OD1 2.98Å
270	L	87.3	Confident	81.5	Confident	9 Å²	9	35.9 Å²	35.9	5%	0.047	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	137.1	179.6	-57.5	172.6	0	0	0	109.2	T205 C224 A225 M226 L258 L260 Q268	T205-L270 HydrophobicContact CG2-CD2 4.28Å; C224-L270 HydrophobicContact CB-CB 4.43Å; C224-L270 HydrophobicContact CB-CD1 4.28Å; A225-L270 CarbonylContact O-C 3.56Å; A225-L270 WeakPolarHBondContact O-CA 3.38Å; M226-L270 HydrophobicContact CB-CD2 4.45Å; M226-L270 HydrophobicContact CG-CD2 3.86Å; L258-L270 HydrophobicContact CB-CB 4.36Å; L258-L270 PolarHBondContact N-O 3.06Å; L258-L270 PolarHBondContact O-N 3.24Å; L260-L270 HydrophobicContact CB-CD1 4.35Å; L260-L270 HydrophobicContact CD2-CD1 4.4Å; Q268-L270 HydrophobicContact CG-CD2 3.8Å; Q268-L270 HydrophobicContact CG-CG 4.24Å
271	G	90.9	Very high	82.1	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	138.9	165.6	0	0	0	0	0	110	C224 A225 E227	C224-G271 WeakPolarHBondContact CA-O 3.5Å; A225-G271 PolarHBondContact N-O 3.47Å; A225-G271 PolarHBondContact O-N 3.11Å; E227-G271 WeakPolarHBondContact OE1-CA 3.44Å
272	F	91.4	Very high	82.9	Confident	7 Å²	7	34.7 Å²	34.7	3%	0.031	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	119.6	-178.7	-177.3	-121.4	0	0	0	112.3	L211 R221 L255 N256 L258	L211-F272 HydrophobicContact CD1-CD2 3.88Å; L211-F272 HydrophobicContact CD1-CE2 3.65Å; L211-F272 HydrophobicContact CD1-CG 4.45Å; L211-F272 HydrophobicContact CD1-CZ 3.99Å; R221-F272 WeakPolarHBondContact O-CE2 3.09Å; R221-F272 WeakPolarHBondContact O-CZ 3.46Å; L255-F272 HydrophobicContact CB-CD1 4.2Å; L255-F272 HydrophobicContact CD1-CE1 4.27Å; L255-F272 PolarHBondContact N-O 3.42Å; N256-F272 VanDerWaalsContact O-CB 3.24Å; N256-F272 WeakPolarHBondContact O-CB 3.41Å; N256-F272 PolarHBondContact O-N 2.65Å; L258-F272 HydrophobicContact CD1-CB 4.08Å; L258-F272 HydrophobicContact CD1-CD2 4.07Å; L258-F272 HydrophobicContact CD1-CG 4.27Å; L258-F272 HydrophobicContact CD2-CB 4.06Å; L258-F272 HydrophobicContact CD2-CG 4.28Å; L258-F272 HydrophobicContact CG-CB 3.88Å; L258-F272 HydrophobicContact CG-CG 4.41Å
273	Y	93.1	Very high	84	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	118.3	-175.4	-60.8	-88.5	0	0	0	110.9	V187 I202 G222 V223 A225 E227 Q235 M240 V253 Y254 E275	V187-Y273 HydrophobicContact CG2-CE1 3.97Å; V187-Y273 WeakPolarHBondContact CG2-OH 3.36Å; I202-Y273 HydrophobicContact CD1-CE2 4.36Å; G222-Y273 CarbonylContact C-O 3.34Å; G222-Y273 WeakPolarHBondContact CA-O 3.32Å; V223-Y273 PolarHBondContact N-O 3.07Å; V223-Y273 PolarHBondContact O-N 2.85Å; A225-Y273 HydrophobicContact CB-CE2 4.06Å; E227-Y273 WeakPolarHBondContact OE1-CE2 3.25Å; E227-Y273 VanDerWaalsContact OE1-CZ 3.29Å; E227-Y273 PolarHBondContact OE1-OH 2.87Å; E227-Y273 PolarHBondContact OE2-OH 3.08Å; Q235-Y273 PolarHBondContact NE2-OH 2.85Å; M240-Y273 HydrophobicContact CB-CD1 3.39Å; M240-Y273 HydrophobicContact CB-CE1 3.52Å; M240-Y273 HydrophobicContact CB-CG 3.94Å; M240-Y273 HydrophobicContact CE-CG 4.49Å; M240-Y273 HydrophobicContact CG-CD1 4.43Å; M240-Y273 HydrophobicContact CG-CE1 4.47Å; M240-Y273 HydrophobicContact SD-CD1 4.39Å; M240-Y273 HydrophobicContact SD-CD2 3.91Å; M240-Y273 HydrophobicContact SD-CE2 4.23Å; M240-Y273 HydrophobicContact SD-CG 4Å; V253-Y273 CarbonylContact O-C 3.54Å; V253-Y273 VanDerWaalsContact O-CA 3.28Å; V253-Y273 WeakPolarHBondContact O-CA 3.38Å; Y254-Y273 AromaticContact CD2-CE1 3.91Å; Y254-Y273 HydrophobicContact CD2-CE1 3.91Å; Y254-Y273 HydrophobicContact CD2-CE2 4.36Å; Y254-Y273 AromaticContact CD2-CZ 3.8Å; Y254-Y273 HydrophobicContact CG-CE1 4.24Å; Y273-E275 PolarHBondContact O-N 3.44Å
274	G	89.2	Confident	85	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	125.5	170.9	0	0	0	0	0	110.1	G252 V253	G252-G274 CarbonylContact C-O 3.59Å; G252-G274 WeakPolarHBondContact CA-O 3.48Å; V253-G274 PolarHBondContact N-O 3.02Å; V253-G274 PolarHBondContact O-N 3.49Å
275	E	79.7	Confident	85.8	Confident	17 Å²	17	32.6 Å²	32.6	8%	0.079	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	143.5	178.5	-86.9	164.8	-138.4	0	0	112.2	R209 G222 V223 Y273 N277	R209-E275 IonicContact CZ-OE1 2.85Å; R209-E275 IonicContact CZ-OE2 3.15Å; R209-E275 IonicContact NH1-OE1 2.64Å; R209-E275 PolarHBondContact NH1-OE1 2.93Å; R209-E275 IonicContact NH1-OE2 2.68Å; R209-E275 PolarHBondContact NH1-OE2 2.92Å; R209-E275 IonicContact NH2-OE2 2.66Å; G222-E275 WeakPolarHBondContact CA-OE1 3.33Å; G222-E275 PolarHBondContact N-OE1 3.03Å; V223-E275 HydrophobicContact CG2-CG 4.26Å; Y273-E275 PolarHBondContact O-N 3.44Å; E275-N277 PolarHBondContact O-N 3.11Å; E275-N277 VanDerWaalsContact O-N 3.15Å; E275-N277 PolarHBondContact OE2-ND2 3.15Å
276	I	89.3	Confident	86.6	Confident	5 Å²	5	32.6 Å²	32.6	3%	0.026	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-3	-173.5	-151.7	57.6	0	0	0	114.4	I94 L172 L250 V253 V278 A279 H280	I94-I276 HydrophobicContact CD1-CD1 3.81Å; I94-I276 HydrophobicContact CG2-CD1 4.19Å; L172-I276 HydrophobicContact CD2-CD1 4.36Å; L172-I276 HydrophobicContact CD2-CG1 3.83Å; L250-I276 HydrophobicContact CD2-CD1 3.61Å; L250-I276 HydrophobicContact CD2-CG1 4.16Å; L250-I276 HydrophobicContact CG-CD1 4.08Å; L250-I276 HydrophobicContact CG-CG1 4.33Å; V253-I276 HydrophobicContact CG2-CD1 4.39Å; I276-V278 PolarHBondContact O-N 2.92Å; I276-V278 VanDerWaalsContact O-N 3.14Å; I276-A279 HydrophobicContact CD1-CB 4.11Å; I276-A279 HydrophobicContact CG1-CB 4.18Å; I276-A279 WeakPolarHBondContact O-CA 2.9Å; I276-A279 WeakPolarHBondContact O-CB 2.99Å; I276-A279 PolarHBondContact O-N 3.14Å; I276-H280 PolarHBondContact O-N 3.07Å
277	N	87.9	Confident	87	Confident	21 Å²	21	42.2 Å²	42.2	11%	0.112	22%	0.224	C	C	.	.	H	α-helix	trans	-49.7	-37	178.3	-83.5	-18.2	0	0	0	114.6	R175 D176 E275 A279 H280 D281	R175-N277 VanDerWaalsContact CG-OD1 3.25Å; R175-N277 WeakPolarHBondContact CG-OD1 3.17Å; D176-N277 PolarHBondContact N-OD1 3.31Å; D176-N277 PolarHBondContact OD1-ND2 3.21Å; E275-N277 PolarHBondContact O-N 3.11Å; E275-N277 VanDerWaalsContact O-N 3.15Å; E275-N277 PolarHBondContact OE2-ND2 3.15Å; N277-A279 VanDerWaalsContact C-N 3.27Å; N277-A279 PolarHBondContact O-N 3.13Å; N277-H280 WeakPolarHBondContact O-CB 3.36Å; N277-H280 PolarHBondContact O-N 3.1Å; N277-D281 PolarHBondContact O-N 3.01Å
278	V	87	Confident	87.2	Confident	22 Å²	22	38.4 Å²	38.4	13%	0.133	21%	0.21	C	C	.	.	H	α-helix	trans	-59.3	-39	175.8	168.6	0	0	0	0	111.4	Y139 L141 I152 I276 D281 V282 V288	Y139-V278 HydrophobicContact CD1-CG1 4.29Å; Y139-V278 HydrophobicContact CD2-CG1 4.24Å; Y139-V278 HydrophobicContact CG-CG1 3.79Å; L141-V278 HydrophobicContact CD2-CG2 4.43Å; I152-V278 HydrophobicContact CD1-CB 3.84Å; I152-V278 HydrophobicContact CD1-CG1 3.82Å; I152-V278 HydrophobicContact CG1-CB 4.15Å; I152-V278 HydrophobicContact CG1-CG1 3.81Å; I276-V278 PolarHBondContact O-N 2.92Å; I276-V278 VanDerWaalsContact O-N 3.14Å; V278-D281 PolarHBondContact O-N 3.49Å; V278-V282 VanDerWaalsContact O-CG2 3.28Å; V278-V282 WeakPolarHBondContact O-CG2 3.29Å; V278-V282 PolarHBondContact O-N 3.26Å; V278-V282 VanDerWaalsContact O-N 3.1Å; V278-V288 HydrophobicContact CG1-CG1 4.26Å
279	A	90.6	Very high	86.8	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-70.1	-40	177.2	0	0	0	0	0	111.6	I94 I152 I154 I276 N277 D281 V282 F283	I94-A279 HydrophobicContact CD1-CB 3.64Å; I152-A279 HydrophobicContact CD1-CB 4.11Å; I154-A279 HydrophobicContact CD1-CB 4.12Å; I276-A279 HydrophobicContact CD1-CB 4.11Å; I276-A279 HydrophobicContact CG1-CB 4.18Å; I276-A279 WeakPolarHBondContact O-CA 2.9Å; I276-A279 WeakPolarHBondContact O-CB 2.99Å; I276-A279 PolarHBondContact O-N 3.14Å; N277-A279 VanDerWaalsContact C-N 3.27Å; N277-A279 PolarHBondContact O-N 3.13Å; A279-D281 VanDerWaalsContact C-N 3.34Å; A279-D281 PolarHBondContact O-N 3.38Å; A279-V282 PolarHBondContact O-N 3.41Å; A279-F283 HydrophobicContact CB-CD2 4.19Å; A279-F283 HydrophobicContact CB-CE2 3.83Å; A279-F283 HydrophobicContact CB-CZ 4.46Å; A279-F283 VanDerWaalsContact O-CB 3.27Å; A279-F283 WeakPolarHBondContact O-CB 3.26Å; A279-F283 WeakPolarHBondContact O-CD2 3.36Å; A279-F283 WeakPolarHBondContact O-CG 3.22Å; A279-F283 PolarHBondContact O-N 2.88Å
280	H	91.1	Very high	86.4	Confident	37 Å²	37	45.4 Å²	45.4	17%	0.171	25%	0.247	C	C	.	.	H	α-helix	trans	-58.1	-45.3	173.4	-75.7	-54	0	0	0	112.2	A173 R175 I276 N277 F283 S284	A173-H280 PolarHBondContact O-CE1 2.05Å; A173-H280 PolarHBondContact O-NE2 3.39Å; R175-H280 HydrophobicContact CG-CB 4.2Å; I276-H280 PolarHBondContact O-N 3.07Å; N277-H280 WeakPolarHBondContact O-CB 3.36Å; N277-H280 PolarHBondContact O-N 3.1Å; H280-F283 PolarHBondContact O-N 3.05Å; H280-S284 VanDerWaalsContact O-CB 3.27Å; H280-S284 WeakPolarHBondContact O-CB 3.36Å; H280-S284 PolarHBondContact O-N 2.82Å; H280-S284 PolarHBondContact O-OG 3.2Å
281	D	88.7	Confident	85.5	Confident	29 Å²	29	46 Å²	46	16%	0.155	25%	0.25	C	S	.	.	H	α-helix	trans	-68.7	-39.2	-178.6	-74.1	-24.1	0	0	0	111.9	R175 N277 V278 A279 S284 G285 K286 V288	R175-D281 IonicContact CZ-OD1 3.38Å; R175-D281 IonicContact CZ-OD2 2.78Å; R175-D281 IonicContact NE-OD1 3.65Å; R175-D281 PolarHBondContact NE-OD1 2.9Å; R175-D281 VanDerWaalsContact NE-OD1 3.08Å; R175-D281 VanDerWaalsContact NH2-CG 3.28Å; R175-D281 IonicContact NH2-OD1 2.66Å; R175-D281 PolarHBondContact NH2-OD1 2.68Å; R175-D281 IonicContact NH2-OD2 3.91Å; R175-D281 PolarHBondContact NH2-OD2 2.94Å; N277-D281 PolarHBondContact O-N 3.01Å; V278-D281 PolarHBondContact O-N 3.49Å; A279-D281 VanDerWaalsContact C-N 3.34Å; A279-D281 PolarHBondContact O-N 3.38Å; D281-S284 PolarHBondContact O-N 3.25Å; D281-G285 PolarHBondContact O-N 2.88Å; D281-K286 HydrophobicContact CB-CB 4.29Å; D281-K286 HydrophobicContact CB-CD 4Å; D281-K286 WeakPolarHBondContact O-CB 3.05Å; D281-K286 PolarHBondContact O-N 3.37Å; D281-K286 WeakPolarHBondContact OD1-CD 3.45Å; D281-K286 WeakPolarHBondContact OD1-CE 3.05Å; D281-K286 IonicContact OD1-NZ 3.06Å; D281-K286 PolarHBondContact OD1-NZ 2.55Å; D281-V288 HydrophobicContact CB-CG2 3.74Å
282	V	89.1	Confident	83.9	Confident	34 Å²	34	50.4 Å²	50.4	21%	0.206	28%	0.281	C	S	.	.	H	α-helix	trans	-62.8	-47.7	171.5	170.4	0	0	0	0	111.9	Y139 I154 V278 A279 S284 G285 V288	Y139-V282 HydrophobicContact CD1-CG2 4.17Å; Y139-V282 HydrophobicContact CE1-CG2 3.5Å; Y139-V282 HydrophobicContact CE2-CG2 4.19Å; I154-V282 HydrophobicContact CD1-CB 4.21Å; I154-V282 HydrophobicContact CD1-CG1 4.06Å; I154-V282 HydrophobicContact CD1-CG2 4.4Å; V278-V282 VanDerWaalsContact O-CG2 3.28Å; V278-V282 WeakPolarHBondContact O-CG2 3.29Å; V278-V282 PolarHBondContact O-N 3.26Å; V278-V282 VanDerWaalsContact O-N 3.1Å; A279-V282 PolarHBondContact O-N 3.41Å; V282-S284 PolarHBondContact O-N 2.92Å; V282-G285 PolarHBondContact O-N 2.03Å; V282-V288 HydrophobicContact CG2-CB 4.11Å; V282-V288 HydrophobicContact CG2-CG2 3.86Å
283	F	91	Very high	82	Confident	26 Å²	26	55.7 Å²	55.7	11%	0.114	31%	0.306	C	S	.	.	H	α-helix	trans	-70.3	-19	179.6	-64.3	-30.1	0	0	0	113.3	V78 R80 L92 I94 I154 L172 A279 H280 G285	V78-F283 HydrophobicContact CG2-CZ 4.49Å; R80-F283 HydrophobicContact CG-CB 3.91Å; R80-F283 HydrophobicContact CG-CD1 4.14Å; R80-F283 HydrophobicContact CG-CD2 4.17Å; R80-F283 HydrophobicContact CG-CG 3.81Å; R80-F283 PolarHBondContact NE-O 2.89Å; R80-F283 PolarHBondContact NH2-O 3.19Å; L92-F283 HydrophobicContact CD1-CE1 3.86Å; L92-F283 HydrophobicContact CD1-CZ 4.02Å; I94-F283 HydrophobicContact CD1-CE2 4.33Å; I94-F283 HydrophobicContact CD1-CZ 4.4Å; I154-F283 HydrophobicContact CD1-CE1 4.3Å; I154-F283 HydrophobicContact CD1-CZ 4.22Å; I154-F283 HydrophobicContact CG2-CE1 4.25Å; I154-F283 HydrophobicContact CG2-CZ 4.25Å; L172-F283 HydrophobicContact CD1-CD2 3.7Å; L172-F283 HydrophobicContact CD1-CE2 3.71Å; A279-F283 HydrophobicContact CB-CD2 4.19Å; A279-F283 HydrophobicContact CB-CE2 3.83Å; A279-F283 HydrophobicContact CB-CZ 4.46Å; A279-F283 VanDerWaalsContact O-CB 3.27Å; A279-F283 WeakPolarHBondContact O-CB 3.26Å; A279-F283 WeakPolarHBondContact O-CD2 3.36Å; A279-F283 WeakPolarHBondContact O-CG 3.22Å; A279-F283 PolarHBondContact O-N 2.88Å; H280-F283 PolarHBondContact O-N 3.05Å; F283-G285 VanDerWaalsContact C-N 3.31Å
284	S	89.1	Confident	79.4	Confident	80 Å²	80	62.7 Å²	62.7	56%	0.559	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	1.1	168.3	-52.8	0	0	0	0	113.4	H280 D281 V282 K286	H280-S284 VanDerWaalsContact O-CB 3.27Å; H280-S284 WeakPolarHBondContact O-CB 3.36Å; H280-S284 PolarHBondContact O-N 2.82Å; H280-S284 PolarHBondContact O-OG 3.2Å; D281-S284 PolarHBondContact O-N 3.25Å; V282-S284 PolarHBondContact O-N 2.92Å; S284-K286 VanDerWaalsContact C-N 3.33Å; S284-K286 PolarHBondContact O-N 2.86Å
285	G	85.9	Confident	77.1	Confident	66 Å²	66	65.6 Å²	65.6	68%	0.68	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.2	10.7	179.7	0	0	0	0	0	115.5	D281 V282 F283	D281-G285 PolarHBondContact O-N 2.88Å; V282-G285 PolarHBondContact O-N 2.03Å; F283-G285 VanDerWaalsContact C-N 3.31Å
286	K	85	Confident	74.9	Confident	110 Å²	110	70.4 Å²	70.4	48%	0.478	39%	0.387	S	S	.	.			trans	-71.8	142.4	174.9	-58.8	-179.8	-170.1	164.2	0	110.1	D281 S284 V288	D281-K286 HydrophobicContact CB-CB 4.29Å; D281-K286 HydrophobicContact CB-CD 4Å; D281-K286 WeakPolarHBondContact O-CB 3.05Å; D281-K286 PolarHBondContact O-N 3.37Å; D281-K286 WeakPolarHBondContact OD1-CD 3.45Å; D281-K286 WeakPolarHBondContact OD1-CE 3.05Å; D281-K286 IonicContact OD1-NZ 3.06Å; D281-K286 PolarHBondContact OD1-NZ 2.55Å; S284-K286 VanDerWaalsContact C-N 3.33Å; S284-K286 PolarHBondContact O-N 2.86Å; K286-V288 PolarHBondContact O-N 3.48Å
287	K	78.1	Confident	72.1	Confident	220 Å²	220	80 Å²	80	96%	0.957	42%	0.423	S	S	*	.			trans	-69.8	100	170.3	-75.3	-175.4	175.5	179.2	0	110
288	V	79.9	Confident	69.4	Low	42 Å²	42	82.8 Å²	82.8	26%	0.255	44%	0.435	S	S	.	.			trans	-91.8	143.4	167.7	-174.2	0	0	0	0	109.3	Y139 V278 D281 V282 K286 T290	Y139-V288 HydrophobicContact CD1-CB 4.17Å; Y139-V288 HydrophobicContact CD1-CG1 3.99Å; Y139-V288 HydrophobicContact CE1-CB 4.34Å; V278-V288 HydrophobicContact CG1-CG1 4.26Å; D281-V288 HydrophobicContact CB-CG2 3.74Å; V282-V288 HydrophobicContact CG2-CB 4.11Å; V282-V288 HydrophobicContact CG2-CG2 3.86Å; K286-V288 PolarHBondContact O-N 3.48Å; V288-T290 PolarHBondContact O-N 3.19Å; V288-T290 VanDerWaalsContact O-N 3.13Å
289	Q	74.3	Confident	66.5	Low	150 Å²	150	87 Å²	87	70%	0.701	46%	0.463	S	S	*	.			trans	-68.5	109.8	-179.8	-165.9	173.7	33.3	0	0	111.2	G140	G140-Q289 PolarHBondContact N-O 2.77Å
290	T	75.3	Confident	63.4	Low	78 Å²	78	89.5 Å²	89.5	48%	0.479	49%	0.489	S	S	.	.	B	Isolated β-bridge	trans	-73.3	144.9	169.7	48.3	0	0	0	0	110.7	L138 Y139 V288 S292	L138-T290 CarbonylContact O-C 3.54Å; L138-T290 VanDerWaalsContact O-CA 3.3Å; L138-T290 WeakPolarHBondContact O-CA 3.34Å; Y139-T290 HydrophobicContact CD1-CG2 4.13Å; Y139-T290 HydrophobicContact CE1-CG2 3.76Å; V288-T290 PolarHBondContact O-N 3.19Å; V288-T290 VanDerWaalsContact O-N 3.13Å; T290-S292 PolarHBondContact O-N 2.79Å
291	L	69.9	Low	60.2	Low	23 Å²	23	94.2 Å²	94.2	12%	0.12	52%	0.52	C	S	.	.	P	Polyproline II helix	trans	-71.6	121	172.2	-67.9	160.7	0	0	0	109.2	A97 L138 Y139 T148 R150 V295	A97-L291 HydrophobicContact CB-CD1 4.15Å; L138-L291 HydrophobicContact CB-CB 4.28Å; L138-L291 HydrophobicContact CB-CD1 4.3Å; L138-L291 PolarHBondContact O-N 2.74Å; Y139-L291 WeakPolarHBondContact O-CD1 3.47Å; T148-L291 HydrophobicContact CG2-CD2 4.05Å; R150-L291 HydrophobicContact CB-CD1 4.33Å; R150-L291 HydrophobicContact CG-CD1 3.99Å; L291-V295 HydrophobicContact CD2-CG2 4.29Å
292	S	56	Low	57.1	Low	91 Å²	91	101.7 Å²	101.7	64%	0.636	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-63.2	151	171.3	-172.6	0	0	0	0	110.7	T290 N294 V295	T290-S292 PolarHBondContact O-N 2.79Å; S292-N294 PolarHBondContact O-N 3.03Å; S292-V295 PolarHBondContact O-N 2.89Å
293	E	51.5	Low	54	Low	119 Å²	119	105.8 Å²	105.8	56%	0.556	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.4	-28.2	-172.5	-74	-177.1	116.2	0	0	113.6	T104 P105 V295	T104-E293 VanDerWaalsContact CB-OE1 3.26Å; T104-E293 WeakPolarHBondContact CB-OE1 3.09Å; T104-E293 WeakPolarHBondContact CG2-OE1 3.21Å; P105-E293 WeakPolarHBondContact CD-OE1 3.42Å; P105-E293 HydrophobicContact CG-CG 4.43Å; E293-V295 PolarHBondContact O-N 2.77Å
294	N	39.1	Very low	50.9	Low	147 Å²	147	113.4 Å²	113.4	79%	0.786	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.3	35.8	-172.3	-65.8	-38.1	0	0	0	114.9	S292 D296	S292-N294 PolarHBondContact O-N 3.03Å; N294-D296 PolarHBondContact O-N 3.05Å
295	V	40.6	Very low	47.9	Very low	61 Å²	61	118.6 Å²	118.6	37%	0.37	63%	0.627	S	S	.	*			trans	-77	76.6	166	-175.7	0	0	0	0	109.8	R150 L291 S292 E293	R150-V295 PolarHBondContact NH2-O 2.78Å; L291-V295 HydrophobicContact CD2-CG2 4.29Å; S292-V295 PolarHBondContact O-N 2.89Å; E293-V295 PolarHBondContact O-N 2.77Å
296	D	33	Very low	45	Very low	118 Å²	118	120.7 Å²	120.7	63%	0.631	63%	0.628	S	S	*	*			trans	-84.6	145.8	177.8	-153.9	-11.6	0	0	0	111.7	N294 Q298	N294-D296 PolarHBondContact O-N 3.05Å; D296-Q298 PolarHBondContact O-N 3.46Å
297	R	31.1	Very low	42.2	Very low	207 Å²	207	123.1 Å²	123.1	78%	0.781	65%	0.645	S	S	*	*			trans	23.4	85.1	171.5	-64.8	144.6	-157.6	-131.4	3.4	118.1
298	Q	31.2	Very low	39.9	Very low	78 Å²	78	120.3 Å²	120.3	36%	0.364	64%	0.635	S	S	.	*			trans	-49.3	130.8	146.7	-130.4	-158.8	-7.2	0	0	108.8	E147 D296 G300 R394	E147-Q298 PolarHBondContact OE2-NE2 3.05Å; D296-Q298 PolarHBondContact O-N 3.46Å; Q298-G300 PolarHBondContact O-N 3.49Å; Q298-R394 PolarHBondContact O-NH2 2.63Å
299	P	26.2	Very low	37.4	Very low	110 Å²	110	123.2 Å²	123.2	71%	0.714	66%	0.663	S	S	*	*			trans	-57.3	114.9	-162.3	20.2	-33.2	0	0	0	112.1	V301	P299-V301 PolarHBondContact O-N 2.93Å
300	G	25.3	Very low	35.4	Very low	54 Å²	54	121 Å²	121	56%	0.557	67%	0.665	S	S	*	*			trans	-66.1	115.9	169.6	0	0	0	0	0	108.9	Q298 K302	Q298-G300 PolarHBondContact O-N 3.49Å; G300-K302 PolarHBondContact O-N 2.96Å
301	V	23.3	Very low	33.2	Very low	136 Å²	136	122.3 Å²	122.3	82%	0.824	68%	0.677	S	S	*	*			trans	-50.4	112.1	162.8	176	0	0	0	0	106.5	P299 P303	P299-V301 PolarHBondContact O-N 2.93Å; V301-P303 VanDerWaalsContact O-N 3.16Å
302	K	23.3	Very low	31.3	Very low	185 Å²	185	126.5 Å²	126.5	80%	0.804	71%	0.708	S	S	*	*			trans	-53.6	125.2	-179	-69.7	-179.9	-180	175.6	0	107.2	G300 H304	G300-K302 PolarHBondContact O-N 2.96Å; K302-H304 PolarHBondContact O-N 3.45Å
303	P	24.4	Very low	30.2	Very low	121 Å²	121	128.2 Å²	128.2	79%	0.786	72%	0.72	S	S	*	*			trans	-59.6	117.3	174.6	24.5	-32	0	0	0	107.1	V301 K305	V301-P303 VanDerWaalsContact O-N 3.16Å; P303-K305 PolarHBondContact O-N 3.28Å
304	H	26.8	Very low	29.1	Very low	185 Å²	185	128.1 Å²	128.1	86%	0.856	73%	0.733	S	S	*	*			trans	-58.1	113.7	170.3	-89.2	-89	0	0	0	106.7	K302 P306	K302-H304 PolarHBondContact O-N 3.45Å; H304-P306 VanDerWaalsContact O-N 3.14Å
305	K	25.9	Very low	28.9	Very low	189 Å²	189	126.9 Å²	126.9	82%	0.822	74%	0.735	S	S	*	*			trans	-51	120.8	175.4	-164.1	-179.2	-171.7	-175.2	0	106.6	P303 I307	P303-K305 PolarHBondContact O-N 3.28Å; K305-I307 PolarHBondContact O-N 2.95Å
306	P	24.4	Very low	28.5	Very low	110 Å²	110	129.1 Å²	129.1	71%	0.714	75%	0.753	S	S	*	*			trans	-61.1	112.3	-179.2	23.8	-32.3	0	0	0	107.7	H304 H308	H304-P306 VanDerWaalsContact O-N 3.14Å; P306-H308 PolarHBondContact O-N 3.19Å
307	I	27.3	Very low	28.5	Very low	162 Å²	162	128 Å²	128	83%	0.831	76%	0.755	S	S	*	*			trans	-66.1	122.1	168.8	-64.3	174.5	0	0	0	105	K305 A309	K305-I307 PolarHBondContact O-N 2.95Å; I307-A309 PolarHBondContact O-N 2.99Å
308	H	29.6	Very low	28.6	Very low	160 Å²	160	123.7 Å²	123.7	74%	0.741	76%	0.756	S	S	*	*			trans	-60.1	113.3	176.4	-84.1	-112	0	0	0	108.6	P306 S310	P306-H308 PolarHBondContact O-N 3.19Å; H308-S310 PolarHBondContact O-N 2.61Å
309	A	26.9	Very low	28.6	Very low	103 Å²	103	125 Å²	125	85%	0.851	78%	0.781	S	S	*	*			trans	-75.8	67.8	169.1	0	0	0	0	0	109.1	I307 S311	I307-A309 PolarHBondContact O-N 2.99Å; A309-S311 PolarHBondContact O-N 2.77Å
310	S	31.4	Very low	28.8	Very low	105 Å²	105	125.1 Å²	125.1	73%	0.734	79%	0.785	S	S	*	*			trans	-69.1	110.2	166.2	-60.5	0	0	0	0	107.8	H308	H308-S310 PolarHBondContact O-N 2.61Å
311	S	30.3	Very low	29.2	Very low	104 Å²	104	133.5 Å²	133.5	73%	0.727	80%	0.799	S	S	*	*			trans	-71.2	142.3	178.6	49.3	0	0	0	0	111.9	A309	A309-S311 PolarHBondContact O-N 2.77Å
312	S	29.2	Very low	29.6	Very low	111 Å²	111	132.5 Å²	132.5	78%	0.776	79%	0.785	S	S	*	*			trans	50.2	102.6	153.8	60.3	0	0	0	0	118.9
313	S	32.6	Very low	30	Very low	128 Å²	128	130.9 Å²	130.9	90%	0.895	78%	0.779	S	S	*	*				-157.8	160.1	106.2	62.8	0	0	0	0	110.7
314	S	29.6	Very low	30.4	Very low	117 Å²	117	135.5 Å²	135.5	82%	0.818	78%	0.78	S	S	*	*			trans	-114.7	127.2	-169.3	53.2	0	0	0	0	112.6
315	S	34.2	Very low	30.6	Very low	121 Å²	121	136.9 Å²	136.9	85%	0.846	78%	0.778	S	S	*	*			trans	-154.8	138.1	156.6	52.2	0	0	0	0	112.4
316	S	33.2	Very low	30.8	Very low	107 Å²	107	139.3 Å²	139.3	75%	0.748	78%	0.782	S	S	*	*			trans	-80.3	171.4	162	58.7	0	0	0	0	109.4
317	S	32.9	Very low	31	Very low	94 Å²	94	145.9 Å²	145.9	66%	0.657	79%	0.792	S	S	*	*			cis	-162.2	152	15.4	-9.3	0	0	0	0	111.9
318	S	32.7	Very low	31.2	Very low	117 Å²	117	144.3 Å²	144.3	82%	0.818	79%	0.791	S	S	*	*			trans	56.2	142.4	134.5	-53.1	0	0	0	0	124.4
319	A	32	Very low	30.9	Very low	107 Å²	107	147.1 Å²	147.1	88%	0.884	80%	0.795	S	S	*	*			trans	83.8	155.7	151.4	0	0	0	0	0	119.6
320	S	29.7	Very low	31	Very low	112 Å²	112	149.6 Å²	149.6	78%	0.783	79%	0.792	S	S	*	*			trans	-158	136.7	-157.4	58.9	0	0	0	0	113.4
321	R	33	Very low	30.7	Very low	230 Å²	230	151.7 Å²	151.7	87%	0.868	79%	0.793	S	S	*	*			trans	167.6	157.4	158.4	-101.8	179.7	163	143.9	4.6	109.5
322	E	32.7	Very low	30.4	Very low	114 Å²	114	151.2 Å²	151.2	53%	0.533	79%	0.79	S	S	.	*			cis	-162.4	168.2	-24.7	-135.1	-173.2	102	0	0	110.3
323	K	32.2	Very low	30.5	Very low	152 Å²	152	154.4 Å²	154.4	66%	0.661	79%	0.793	S	S	*	*			trans	64.9	118.9	153.4	-74.5	166.4	171.5	112.6	0	122.2
324	R	31.2	Very low	30	Very low	217 Å²	217	155.6 Å²	155.6	82%	0.819	79%	0.787	S	S	*	*			trans	76.8	145	134.2	-72.4	-175.8	172.3	-165	-0.1	120
325	R	31.8	Very low	29.8	Very low	215 Å²	215	160.3 Å²	160.3	81%	0.811	79%	0.789	S	S	*	*			cis	-168.6	166.9	-23	-144	-178.7	-176.5	-172.8	0.7	111.1
326	R	30.3	Very low	29.4	Very low	239 Å²	239	161.4 Å²	161.4	90%	0.902	78%	0.784	S	S	*	*			trans	81.9	137.9	175.5	-60.6	177.1	164.5	169.1	-4.3	113.9
327	R	29	Very low	29.3	Very low	248 Å²	248	161.1 Å²	161.1	94%	0.936	78%	0.779	S	S	*	*			cis	-114.5	156.7	-0	-87.6	-180	161.1	152.4	-7	113
328	T	30.1	Very low	28.9	Very low	129 Å²	129	163.9 Å²	163.9	79%	0.791	79%	0.785	S	S	*	*			trans	-88.9	163.6	169.7	40.7	0	0	0	0	111
329	R	24.7	Very low	28.4	Very low	220 Å²	220	162.8 Å²	162.8	83%	0.83	78%	0.778	S	S	*	*			cis	82.5	150.9	30.4	-139.8	-168.7	-164.5	-138.7	5.4	115
330	I	29	Very low	28.1	Very low	154 Å²	154	163.2 Å²	163.2	79%	0.79	77%	0.769	S	S	*	*			trans	80.4	123.3	-164.4	-53.8	171.6	0	0	0	111.1
331	I	24.4	Very low	28.1	Very low	149 Å²	149	167.3 Å²	167.3	76%	0.764	77%	0.773	S	S	*	*			cis	80.7	99.6	-5.2	-45.8	172.6	0	0	0	118.8
332	S	24.9	Very low	27.8	Very low	95 Å²	95	164 Å²	164	66%	0.664	77%	0.771	S	S	*	*			trans	-175.2	156.5	154.9	-92	0	0	0	0	108.4
333	E	29.8	Very low	27.9	Very low	178 Å²	178	163.4 Å²	163.4	83%	0.832	78%	0.778	S	S	*	*			cis	-154.1	-167	-4.2	-133.1	146.7	-106.2	0	0	112.4
334	I	22.9	Very low	27.6	Very low	152 Å²	152	161.8 Å²	161.8	78%	0.779	78%	0.781	S	S	*	*			trans	-115.6	138.7	-168.2	-64.4	162.6	0	0	0	111.9
335	Y	24.7	Very low	27.6	Very low	217 Å²	217	159.3 Å²	159.3	85%	0.851	78%	0.782	S	S	*	*			trans	-169.9	158.1	138.4	-120.4	-84.1	0	0	0	113.7
336	I	26.4	Very low	27.5	Very low	144 Å²	144	154.1 Å²	154.1	74%	0.738	78%	0.779	S	S	*	*			trans	-146.5	129.5	178.5	-68.4	176.6	0	0	0	105.6
337	P	30.4	Very low	27.4	Very low	100 Å²	100	153.1 Å²	153.1	65%	0.649	78%	0.775	S	S	*	*				-158.6	159.3	83.3	41.6	-20.3	0	0	0	120.1
338	I	24.1	Very low	27.8	Very low	153 Å²	153	146.5 Å²	146.5	79%	0.785	76%	0.764	S	S	*	*				35.5	123.7	128.7	-50.9	160	0	0	0	116.8
339	S	24	Very low	27.8	Very low	94 Å²	94	147 Å²	147	66%	0.657	76%	0.758	S	S	*	*				-172.2	175.4	52.8	-147	0	0	0	0	117.1
340	T	24.6	Very low	28.1	Very low	116 Å²	116	142.1 Å²	142.1	71%	0.712	74%	0.744	S	S	*	*			trans	72.4	131.2	149	39	0	0	0	0	124.4
341	K	28.9	Very low	28.2	Very low	198 Å²	198	142.9 Å²	142.9	86%	0.861	74%	0.742	S	S	*	*			trans	81.7	103.2	143	-73.5	179.7	-179.9	-177.8	0	121.5
342	L	28	Very low	28.5	Very low	159 Å²	159	146.8 Å²	146.8	83%	0.832	75%	0.747	S	S	*	*			trans	-51.7	164.6	135.5	-118.4	76.3	0	0	0	111.5
343	P	33.9	Very low	28.9	Very low	102 Å²	102	147.1 Å²	147.1	66%	0.662	75%	0.749	S	S	*	*				-152.4	167.6	54	42.6	-22.7	0	0	0	119.4
344	T	26.4	Very low	29	Very low	119 Å²	119	148.2 Å²	148.2	73%	0.73	75%	0.751	S	S	*	*			trans	52.5	137	148.9	51	0	0	0	0	119.9
345	I	31.1	Very low	29.5	Very low	164 Å²	164	146 Å²	146	84%	0.841	75%	0.749	S	S	*	*				-164.6	153.5	72	-83.8	175.8	0	0	0	106.6
346	S	30.9	Very low	30	Very low	107 Å²	107	140 Å²	140	75%	0.748	74%	0.739	S	S	*	*			cis	-141.7	-168.7	15.7	68.5	0	0	0	0	113.6
347	R	28.2	Very low	30.4	Very low	217 Å²	217	138.6 Å²	138.6	82%	0.819	74%	0.742	S	S	*	*			trans	-150.8	159.4	156.5	-136.6	-177.4	178	-166	-0.8	106.3
348	P	36.6	Very low	30.6	Very low	110 Å²	110	138.6 Å²	138.6	71%	0.714	74%	0.744	S	S	*	*				-150	165.2	76.8	40.4	-18.6	0	0	0	113.8
349	E	30.7	Very low	31	Very low	140 Å²	140	136.3 Å²	136.3	65%	0.654	74%	0.742	S	S	*	*				55.5	145.3	92.8	-45.6	-143.4	106.4	0	0	117.2
350	Q	31.1	Very low	31.5	Very low	116 Å²	116	136.7 Å²	136.7	54%	0.542	75%	0.745	S	S	.	*			cis	-165.2	166.1	-0	-125.6	177.8	45.6	0	0	112.6
351	K	30.1	Very low	31.9	Very low	170 Å²	170	135.6 Å²	135.6	74%	0.739	74%	0.742	S	S	*	*			trans	72.7	120.7	147.1	-76.5	167.2	175.7	143.6	0	124.9
352	R	30.6	Very low	32	Very low	231 Å²	231	131.5 Å²	131.5	87%	0.872	74%	0.738	S	S	*	*				91	144.4	126.5	-93.9	-176.1	173.5	179.1	-2.1	124.2
353	S	32.9	Very low	32.1	Very low	102 Å²	102	129.6 Å²	129.6	71%	0.713	74%	0.738	S	S	*	*			trans	76.4	120.2	162.2	-57.9	0	0	0	0	116.8
354	K	32.5	Very low	31.9	Very low	201 Å²	201	130.2 Å²	130.2	87%	0.874	75%	0.745	S	S	*	*				63.7	131	73.4	-71.8	-174	175	-172.3	0	113.1
355	S	33.6	Very low	32.1	Very low	106 Å²	106	129.6 Å²	129.6	74%	0.741	75%	0.745	S	S	*	*			cis	-165	-166	-10.7	49.8	0	0	0	0	107.7
356	S	35.2	Very low	32.1	Very low	90 Å²	90	126.7 Å²	126.7	63%	0.629	74%	0.739	S	S	*	*			cis	-169.2	173.6	10.9	-0.5	0	0	0	0	110.4
357	S	34.1	Very low	32.1	Very low	115 Å²	115	128 Å²	128	80%	0.804	74%	0.738	S	S	*	*			trans	66.7	148.7	159.1	30.8	0	0	0	0	119.5
358	S	35	Very low	32.3	Very low	100 Å²	100	122.7 Å²	122.7	70%	0.699	73%	0.734	S	S	*	*			cis	-167.7	155.3	-6.4	44.9	0	0	0	0	113.4
359	S	33.2	Very low	32.1	Very low	105 Å²	105	122.9 Å²	122.9	73%	0.734	74%	0.739	S	S	*	*			trans	44.2	146	143.1	58.7	0	0	0	0	123.3
360	S	33.5	Very low	32.1	Very low	102 Å²	102	121 Å²	121	71%	0.713	74%	0.741	S	S	*	*			cis	-175.3	166.6	-7.5	51	0	0	0	0	113.8
361	S	33.7	Very low	32.3	Very low	94 Å²	94	125.6 Å²	125.6	66%	0.657	76%	0.759	S	S	*	*			trans	65.7	124.3	137.3	60.5	0	0	0	0	124.9
362	S	30.5	Very low	32.1	Very low	112 Å²	112	128.6 Å²	128.6	78%	0.783	77%	0.766	S	S	*	*			trans	64.2	161	141.2	54.7	0	0	0	0	119.7
363	S	31.5	Very low	32.1	Very low	119 Å²	119	124.7 Å²	124.7	83%	0.832	77%	0.767	S	S	*	*			cis	-148.8	-174.3	14.8	-28.4	0	0	0	0	113.2
364	S	28.1	Very low	31.8	Very low	114 Å²	114	125 Å²	125	80%	0.797	77%	0.765	S	S	*	*			trans	-124.3	143.6	-170.9	55.3	0	0	0	0	116.3
365	S	32.3	Very low	31.8	Very low	106 Å²	106	123.4 Å²	123.4	74%	0.741	76%	0.764	S	S	*	*			trans	-175.3	129.4	156.1	48.8	0	0	0	0	109.1
366	S	29.6	Very low	31.5	Very low	103 Å²	103	123.4 Å²	123.4	72%	0.72	76%	0.764	S	S	*	*				52.6	130.2	73.1	64.3	0	0	0	0	113.3
367	D	31.6	Very low	31.3	Very low	134 Å²	134	130.7 Å²	130.7	72%	0.717	78%	0.778	S	S	*	*			cis	-163.3	172.3	44.4	-140	-56.9	0	0	0	114.6
368	S	31.6	Very low	30.8	Very low	106 Å²	106	134.1 Å²	134.1	74%	0.741	78%	0.781	S	S	*	*			trans	39.4	150.3	143.7	-77	0	0	0	0	123.8
369	S	33.7	Very low	30.6	Very low	115 Å²	115	135 Å²	135	80%	0.804	79%	0.787	S	S	*	*			cis	-157.5	179.3	7	61.2	0	0	0	0	114.3
370	S	30.2	Very low	30.3	Very low	101 Å²	101	139.2 Å²	139.2	71%	0.706	79%	0.792	S	S	*	*			trans	-65.7	157.8	-170.4	59.8	0	0	0	0	120.5
371	K	34	Very low	30.1	Very low	212 Å²	212	142.1 Å²	142.1	92%	0.922	80%	0.8	S	S	*	*				-164.1	154.2	117	-109	166.9	-175	175.2	0	113.9
372	R	27.3	Very low	29.7	Very low	233 Å²	233	144.2 Å²	144.2	88%	0.879	80%	0.804	S	S	*	*			trans	-96.1	148	176.5	-68.6	176.9	174.1	173.2	-2.9	111.7
373	V	31.2	Very low	29.7	Very low	148 Å²	148	144.2 Å²	144.2	90%	0.897	80%	0.804	S	S	*	*			trans	-141.3	145.9	133.5	-179.5	0	0	0	0	108.3
374	T	26.5	Very low	29.4	Very low	109 Å²	109	148.3 Å²	148.3	67%	0.669	81%	0.806	S	S	*	*			trans	-98.1	149.8	-176.8	-30.5	0	0	0	0	111.6
375	I	32.5	Very low	29.3	Very low	167 Å²	167	148 Å²	148	86%	0.856	80%	0.804	S	S	*	*			trans	-168.3	141.7	136.5	-101.1	152.2	0	0	0	109.7
376	S	26	Very low	29	Very low	106 Å²	106	147.5 Å²	147.5	74%	0.741	81%	0.806	S	S	*	*			trans	-89.7	140	-177.2	-47.1	0	0	0	0	112.3
377	R	30.9	Very low	28.9	Very low	244 Å²	244	151.4 Å²	151.4	92%	0.921	81%	0.813	S	S	*	*			trans	-160.1	155.5	150.1	-119.3	166.4	-175.9	144.2	3.5	112.6
378	E	24.7	Very low	28.8	Very low	187 Å²	187	150.3 Å²	150.3	87%	0.874	80%	0.804	S	S	*	*			trans	-74.5	145.9	-174	-56.2	146.4	92.4	0	0	112.5
379	S	30.5	Very low	28.6	Very low	117 Å²	117	149.3 Å²	149.3	82%	0.818	80%	0.802	S	S	*	*			trans	-139.6	136.3	152.1	61.6	0	0	0	0	109.8	D381	S379-D381 PolarHBondContact O-N 2.8Å
380	K	26.5	Very low	28.6	Very low	195 Å²	195	148.1 Å²	148.1	85%	0.848	79%	0.787	S	S	*	*			trans	-79.3	114.1	-177.7	-74.9	167.7	174.7	165.1	0	109.9	N382	K380-N382 PolarHBondContact O-N 2.68Å
381	D	28.3	Very low	28.7	Very low	163 Å²	163	146.8 Å²	146.8	87%	0.872	77%	0.771	S	S	*	*			trans	-80.2	117.9	170.5	-144.7	-22.6	0	0	0	110.7	S379 S383	S379-D381 PolarHBondContact O-N 2.8Å; D381-S383 PolarHBondContact O-N 2.74Å
382	N	25.4	Very low	28.8	Very low	138 Å²	138	139.6 Å²	139.6	74%	0.738	75%	0.748	S	S	*	*			trans	-87.7	72.4	-166.9	-99.5	-52.9	0	0	0	111.4	K380 K384	K380-N382 PolarHBondContact O-N 2.68Å; N382-K384 VanDerWaalsContact C-N 3.29Å; N382-K384 PolarHBondContact O-N 2.85Å
383	S	30.8	Very low	29.5	Very low	112 Å²	112	130.8 Å²	130.8	78%	0.783	72%	0.72	S	S	*	*			trans	-68	86.4	169.8	64.3	0	0	0	0	110.8	D381 S385	D381-S383 PolarHBondContact O-N 2.74Å; S383-S385 VanDerWaalsContact C-N 3.29Å; S383-S385 PolarHBondContact O-N 2.99Å
384	K	26.1	Very low	30.4	Very low	205 Å²	205	128.7 Å²	128.7	89%	0.891	70%	0.696	S	S	*	*			trans	-61.5	83	174.2	-93.9	178.9	171.9	172.3	0	111.3	N382 A386	N382-K384 VanDerWaalsContact C-N 3.29Å; N382-K384 PolarHBondContact O-N 2.85Å; K384-A386 PolarHBondContact O-N 3.35Å; K384-A386 VanDerWaalsContact O-N 3.12Å
385	S	26.6	Very low	31.5	Very low	107 Å²	107	125.9 Å²	125.9	75%	0.748	68%	0.679	S	S	*	*			trans	-66.7	106.3	158	59.1	0	0	0	0	107.8	S383 E387	S383-S385 VanDerWaalsContact C-N 3.29Å; S383-S385 PolarHBondContact O-N 2.99Å; S385-E387 PolarHBondContact O-N 3.29Å; S385-E387 VanDerWaalsContact O-N 3.12Å
386	A	26	Very low	32.5	Very low	95 Å²	95	119.9 Å²	119.9	79%	0.785	65%	0.648	S	S	*	*			trans	-59.8	117.2	173.8	0	0	0	0	0	109.3	K384 E388	K384-A386 PolarHBondContact O-N 3.35Å; K384-A386 VanDerWaalsContact O-N 3.12Å; A386-E388 PolarHBondContact O-N 3.5Å; A386-E388 VanDerWaalsContact O-N 3.13Å
387	E	25.9	Very low	33.6	Very low	185 Å²	185	123.4 Å²	123.4	86%	0.864	65%	0.645	S	S	*	*			trans	-58	116.3	176.3	-63.8	-177.7	114	0	0	109.3	S385 A389	S385-E387 PolarHBondContact O-N 3.29Å; S385-E387 VanDerWaalsContact O-N 3.12Å; E387-A389 PolarHBondContact O-N 2.76Å
388	E	30.8	Very low	34.5	Very low	112 Å²	112	113.7 Å²	113.7	52%	0.523	61%	0.611	S	S	.	*			trans	-67	92.2	164.5	-74.7	-155.1	155.7	0	0	107	K68 K72 A386 D390	K68-E388 IonicContact NZ-OE1 3.36Å; K68-E388 PolarHBondContact NZ-OE1 2.86Å; K72-E388 IonicContact NZ-OE2 3.8Å; K72-E388 PolarHBondContact NZ-OE2 2.9Å; K72-E388 VanDerWaalsContact NZ-OE2 3.15Å; A386-E388 PolarHBondContact O-N 3.5Å; A386-E388 VanDerWaalsContact O-N 3.13Å; E388-D390 PolarHBondContact O-N 2.96Å
389	A	26	Very low	35.6	Very low	85 Å²	85	110.8 Å²	110.8	70%	0.702	60%	0.602	S	S	*	*			trans	-47.9	129.3	-177.5	0	0	0	0	0	111.4	E387 D391	E387-A389 PolarHBondContact O-N 2.76Å; A389-D391 PolarHBondContact O-N 2.76Å
390	D	34.1	Very low	36.2	Very low	90 Å²	90	107.9 Å²	107.9	48%	0.481	58%	0.579	S	S	.	*			trans	-73	65.4	-170.9	-173	45.4	0	0	0	113.4	E388 S392 T393	E388-D390 PolarHBondContact O-N 2.96Å; D390-S392 PolarHBondContact O-N 2.97Å; D390-S392 PolarHBondContact OD1-OG 2.76Å; D390-T393 PolarHBondContact OD2-OG1 2.7Å
391	D	33.5	Very low	36.8	Very low	72 Å²	72	107 Å²	107	39%	0.385	58%	0.575	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.9	13.9	172	-178.6	49.7	0	0	0	112.6	K101 K102 A389	K101-D391 IonicContact NZ-OD1 2.66Å; K101-D391 PolarHBondContact NZ-OD1 2.94Å; K101-D391 IonicContact NZ-OD2 3.66Å; K101-D391 PolarHBondContact NZ-OD2 2.72Å; K102-D391 WeakPolarHBondContact CE-OD2 3.32Å; K102-D391 IonicContact NZ-OD2 3.95Å; K102-D391 PolarHBondContact NZ-OD2 3.05Å; A389-D391 PolarHBondContact O-N 2.76Å
392	S	34.9	Very low	37	Very low	61 Å²	61	103.6 Å²	103.6	43%	0.427	56%	0.556	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100.5	-7.1	-177.3	83	0	0	0	0	115	D390	D390-S392 PolarHBondContact O-N 2.97Å; D390-S392 PolarHBondContact OD1-OG 2.76Å
393	T	42.2	Very low	37.2	Very low	49 Å²	49	103.4 Å²	103.4	30%	0.301	56%	0.56	S	S	.	*			trans	-128.8	63	-178.3	66.2	0	0	0	0	115.6	K229 D390 V395	K229-T393 VanDerWaalsContact NZ-CB 3.28Å; K229-T393 PolarHBondContact NZ-OG1 2.99Å; D390-T393 PolarHBondContact OD2-OG1 2.7Å; T393-V395 VanDerWaalsContact C-N 3.27Å; T393-V395 PolarHBondContact O-N 2.91Å
394	R	50.6	Low	37	Very low	103 Å²	103	106.7 Å²	106.7	39%	0.389	56%	0.56	S	S	.	*			trans	-69	70.4	170	-85.8	-171.7	161.6	-152.8	-2.7	112.7	N256 Q298 I396	N256-R394 PolarHBondContact ND2-O 3.43Å; N256-R394 PolarHBondContact OD1-O 3.14Å; N256-R394 VanDerWaalsContact OD1-O 3.13Å; Q298-R394 PolarHBondContact O-NH2 2.63Å; R394-I396 PolarHBondContact O-N 3.26Å; R394-I396 VanDerWaalsContact O-N 3.07Å
395	V	49.4	Very low	37	Very low	50 Å²	50	102.5 Å²	102.5	30%	0.303	55%	0.552	S	S	.	*			trans	-57.7	113.1	-178.9	-177.6	0	0	0	0	112	Q257 T393	Q257-V395 WeakPolarHBondContact O-CA 3.47Å; T393-V395 VanDerWaalsContact C-N 3.27Å; T393-V395 PolarHBondContact O-N 2.91Å
396	I	53.1	Low	37.1	Very low	42 Å²	42	108 Å²	108	22%	0.215	56%	0.557	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-76.6	129.3	176.3	-65.9	167.4	0	0	0	108.7	W143 N256 Q257 L258 S259 R394 L398	W143-I396 HydrophobicContact CH2-CD1 4.33Å; W143-I396 HydrophobicContact CZ2-CD1 4.48Å; W143-I396 HydrophobicContact CZ2-CG2 4.48Å; N256-I396 WeakPolarHBondContact ND2-CD1 3.49Å; Q257-I396 PolarHBondContact O-N 2.84Å; Q257-I396 VanDerWaalsContact O-N 3.13Å; L258-I396 CarbonylContact C-O 3.46Å; L258-I396 WeakPolarHBondContact CA-O 3.08Å; L258-I396 HydrophobicContact CD2-CB 3.85Å; L258-I396 HydrophobicContact CD2-CD1 4.21Å; L258-I396 HydrophobicContact CD2-CG2 4.22Å; S259-I396 PolarHBondContact N-O 2.96Å; R394-I396 PolarHBondContact O-N 3.26Å; R394-I396 VanDerWaalsContact O-N 3.07Å; I396-L398 HydrophobicContact CG2-CD2 3.87Å; I396-L398 HydrophobicContact CG2-CG 4.37Å
397	R	49.3	Very low	37.3	Very low	179 Å²	179	110 Å²	110	68%	0.675	55%	0.553	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-98.9	121.3	179	-71.5	172.4	171.1	176.4	-0.9	110.2	S259	S259-R397 WeakPolarHBondContact O-CA 3.06Å
398	L	49.5	Very low	37.4	Very low	41 Å²	41	105.8 Å²	105.8	22%	0.215	55%	0.55	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	130.3	176.9	-56.7	179.5	0	0	0	109	L211 L258 S259 L260 K261 I396	L211-L398 HydrophobicContact CD2-CD1 3.66Å; L211-L398 HydrophobicContact CD2-CD2 3.74Å; L211-L398 HydrophobicContact CD2-CG 4.37Å; L211-L398 HydrophobicContact CG-CD1 4.04Å; L258-L398 HydrophobicContact CB-CD1 4.31Å; L258-L398 HydrophobicContact CD1-CD1 3.95Å; L258-L398 HydrophobicContact CG-CD1 4.5Å; S259-L398 PolarHBondContact O-N 3.04Å; L260-L398 HydrophobicContact CD1-CB 4.22Å; K261-L398 PolarHBondContact N-O 2.79Å; I396-L398 HydrophobicContact CG2-CD2 3.87Å; I396-L398 HydrophobicContact CG2-CG 4.37Å
399	N	47.4	Very low	37.5	Very low	125 Å²	125	103.5 Å²	103.5	67%	0.668	55%	0.55	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-101.1	118.5	175.7	-60.3	-39.8	0	0	0	108.9	K261 K401	K261-N399 VanDerWaalsContact CD-OD1 3.27Å; K261-N399 WeakPolarHBondContact CD-OD1 3.47Å; K261-N399 WeakPolarHBondContact O-CA 3.37Å; N399-K401 PolarHBondContact O-N 3.02Å
400	V	43.6	Very low	37.8	Very low	57 Å²	57	105.7 Å²	105.7	35%	0.345	55%	0.549	S	S	.	.			trans	-76.1	115.4	174.1	-177.3	0	0	0	0	109.1	L260 K261 I262 L402	L260-V400 HydrophobicContact CD1-CG2 3.49Å; L260-V400 VanDerWaalsContact CD1-CG2 3.49Å; L260-V400 HydrophobicContact CD2-CG2 4.23Å; L260-V400 HydrophobicContact CG-CG2 3.74Å; K261-V400 PolarHBondContact O-N 2.83Å; I262-V400 HydrophobicContact CG1-CB 4.39Å; I262-V400 HydrophobicContact CG1-CG2 3.92Å; I262-V400 HydrophobicContact CG2-CB 4.28Å; V400-L402 VanDerWaalsContact C-N 3.33Å; V400-L402 PolarHBondContact O-N 2.9Å
401	K	38.5	Very low	37.6	Very low	177 Å²	177	109.1 Å²	109.1	77%	0.77	57%	0.567	S	S	*	*			trans	-70.2	92	165.6	-85.8	-174.7	176	176.2	0	108.4	N399 V403	N399-K401 PolarHBondContact O-N 3.02Å; K401-V403 PolarHBondContact O-N 2.88Å
402	L	32.9	Very low	37.5	Very low	90 Å²	90	116.3 Å²	116.3	47%	0.471	59%	0.589	S	S	.	*			trans	-64.2	116.6	170.7	-156.3	80.1	0	0	0	108.8	I262 V400 K404 Y715	I262-L402 HydrophobicContact CG2-CD1 4.45Å; V400-L402 VanDerWaalsContact C-N 3.33Å; V400-L402 PolarHBondContact O-N 2.9Å; L402-K404 PolarHBondContact O-N 3.44Å; L402-Y715 HydrophobicContact CD1-CD1 3.64Å; L402-Y715 HydrophobicContact CD1-CE1 3.56Å; L402-Y715 HydrophobicContact CD2-CE1 3.98Å; L402-Y715 HydrophobicContact CG-CE1 4.46Å
403	V	29.7	Very low	37.1	Very low	135 Å²	135	122 Å²	122	82%	0.818	61%	0.606	S	S	*	*			trans	-68.8	99.5	177.8	-179.3	0	0	0	0	108.4	K401 T405	K401-V403 PolarHBondContact O-N 2.88Å; V403-T405 PolarHBondContact O-N 2.69Å
404	K	27.5	Very low	36.4	Very low	180 Å²	180	127.1 Å²	127.1	78%	0.783	63%	0.631	S	S	*	*			trans	-68.8	118.4	169.7	-68	-177.5	179.2	179.9	0	108.5	L402 R406	L402-K404 PolarHBondContact O-N 3.44Å; K404-R406 PolarHBondContact O-N 3.43Å
405	T	26.6	Very low	35.6	Very low	118 Å²	118	132.1 Å²	132.1	72%	0.724	66%	0.656	S	S	*	*			trans	-54.7	129.6	163.6	37.1	0	0	0	0	109.4	V403 L407	V403-T405 PolarHBondContact O-N 2.69Å; T405-L407 PolarHBondContact O-N 3.15Å
406	R	27.7	Very low	34.8	Very low	223 Å²	223	136.5 Å²	136.5	84%	0.842	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	56	-173.7	-77.7	-174.6	168.2	-174.6	-2.3	112.9	K404	K404-R406 PolarHBondContact O-N 3.43Å
407	L	30.4	Very low	33.6	Very low	136 Å²	136	144.2 Å²	144.2	71%	0.712	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.2	-34.5	167.2	-93.4	72.8	0	0	0	112.5	T405 A409	T405-L407 PolarHBondContact O-N 3.15Å; L407-A409 PolarHBondContact O-N 2.84Å
408	A	28.6	Very low	32.7	Very low	96 Å²	96	147.3 Å²	147.3	79%	0.793	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	11.1	-178.7	0	0	0	0	0	115.3
409	A	32.4	Very low	31.9	Very low	65 Å²	65	150.3 Å²	150.3	54%	0.537	75%	0.748	S	S	.	*	T	Hydrogen-bonded Turn	trans	-109.4	-15.3	-178.1	0	0	0	0	0	114.1	L407	L407-A409 PolarHBondContact O-N 2.84Å
410	L	32.9	Very low	31.2	Very low	130 Å²	130	152 Å²	152	68%	0.681	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	-30.3	-178.4	-73.8	161.5	0	0	0	112.6	R412	L410-R412 PolarHBondContact O-N 3.22Å
411	L	29.6	Very low	30.8	Very low	162 Å²	162	157.7 Å²	157.7	85%	0.848	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	38	-179.3	-62.5	174.5	0	0	0	114.3
412	R	30.5	Very low	30.4	Very low	224 Å²	224	154.6 Å²	154.6	85%	0.845	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.5	13.5	173.9	-75.9	-162.8	174.9	-161.6	-1.9	115.3	L410 N414	L410-R412 PolarHBondContact O-N 3.22Å; R412-N414 VanDerWaalsContact C-N 3.3Å; R412-N414 PolarHBondContact O-N 3.34Å; R412-N414 VanDerWaalsContact O-N 3.15Å
413	F	27.3	Very low	30.4	Very low	179 Å²	179	154 Å²	154	79%	0.785	79%	0.791	S	S	*	*			trans	-85.5	67.7	167.4	-78.3	-81.7	0	0	0	111.9
414	N	27	Very low	30.5	Very low	157 Å²	157	153 Å²	153	84%	0.84	79%	0.789	S	S	*	*			trans	-177.9	88	147.9	-98.2	-24.5	0	0	0	112.4	R412	R412-N414 VanDerWaalsContact C-N 3.3Å; R412-N414 PolarHBondContact O-N 3.34Å; R412-N414 VanDerWaalsContact O-N 3.15Å
415	K	33.2	Very low	30.6	Very low	209 Å²	209	149.7 Å²	149.7	91%	0.909	79%	0.789	S	S	*	*			trans	-154.9	141.2	144.4	-113.7	167.5	-173	177.1	0	109.4
416	T	32.8	Very low	30.8	Very low	141 Å²	141	150.1 Å²	150.1	87%	0.865	80%	0.797	S	S	*	*			trans	-90.5	165.4	-155.1	33	0	0	0	0	115.2
417	K	29.1	Very low	31	Very low	205 Å²	205	145.5 Å²	145.5	89%	0.891	80%	0.799	S	S	*	*			trans	-52.9	139.1	-173.5	-57.1	168.7	179	174	0	114.5
418	R	30.1	Very low	31.2	Very low	244 Å²	244	144.3 Å²	144.3	92%	0.921	80%	0.802	S	S	*	*				-144.9	141.1	129.1	-74.3	-157.8	175.6	-170.8	-1.8	110.1
419	P	32	Very low	31.2	Very low	103 Å²	103	148.9 Å²	148.9	67%	0.669	81%	0.812	S	S	*	*			trans	-110.4	170.7	-173.8	39.7	-33.5	0	0	0	115.7
420	H	32.7	Very low	31	Very low	162 Å²	162	148.5 Å²	148.5	75%	0.75	82%	0.815	S	S	*	*			trans	69.5	152.1	172.6	-51	-72.4	0	0	0	116.4
421	H	34.9	Very low	30.9	Very low	175 Å²	175	150.7 Å²	150.7	81%	0.81	82%	0.822	S	S	*	*			cis	-129.7	-172.5	7.6	-111.6	-65.2	0	0	0	113.5
422	S	31.6	Very low	30.8	Very low	113 Å²	113	151.6 Å²	151.6	79%	0.79	82%	0.821	S	S	*	*			trans	-94.8	155	-162.5	46.9	0	0	0	0	116.9
423	G	33	Very low	30.7	Very low	77 Å²	77	147.3 Å²	147.3	79%	0.794	81%	0.814	S	S	*	*			trans	-171	64	177.4	0	0	0	0	0	118.8
424	S	31	Very low	30.8	Very low	113 Å²	113	145.5 Å²	145.5	79%	0.79	81%	0.811	S	S	*	*			trans	38.6	118.5	150.8	-56.7	0	0	0	0	124.2
425	S	28.4	Very low	30.9	Very low	112 Å²	112	143.1 Å²	143.1	78%	0.783	80%	0.804	S	S	*	*				72.1	104	126.2	-54.5	0	0	0	0	122.7
426	S	32	Very low	30.8	Very low	127 Å²	127	141.6 Å²	141.6	89%	0.888	80%	0.8	S	S	*	*				-172.7	87.1	125	34.1	0	0	0	0	112	S428	S426-S428 PolarHBondContact O-N 2.92Å
427	S	32.1	Very low	30.6	Very low	126 Å²	126	140.4 Å²	140.4	88%	0.881	80%	0.795	S	S	*	*			trans	-81	110.9	175.6	38.4	0	0	0	0	111.9
428	S	33.6	Very low	30.7	Very low	111 Å²	111	138.1 Å²	138.1	78%	0.776	79%	0.791	S	S	*	*			trans	-73.9	134.6	158.7	56.4	0	0	0	0	109.5	S426 G430	S426-S428 PolarHBondContact O-N 2.92Å; S428-G430 PolarHBondContact O-N 3.43Å
429	L	28.3	Very low	30.8	Very low	191 Å²	191	132.2 Å²	132.2	100%	1	78%	0.784	S	S	*	*			trans	-65.5	91.8	171.7	-83.7	159.3	0	0	0	110.7
430	G	28.7	Very low	30.9	Very low	58 Å²	58	133.7 Å²	133.7	60%	0.598	79%	0.787	S	S	*	*			trans	-106.2	137	157.5	0	0	0	0	0	108.6	S428 E432	S428-G430 PolarHBondContact O-N 3.43Å; G430-E432 PolarHBondContact O-N 2.89Å; G430-E432 VanDerWaalsContact O-N 3.11Å
431	E	30.7	Very low	31	Very low	175 Å²	175	136 Å²	136	82%	0.818	79%	0.789	S	S	*	*			trans	-60.5	114.9	178	-70.1	169.2	114.5	0	0	110.7
432	E	28.2	Very low	31.1	Very low	181 Å²	181	133 Å²	133	85%	0.846	79%	0.785	S	S	*	*			trans	-81.9	114.6	174.2	-175	160.6	-149	0	0	108.9	G430 I434	G430-E432 PolarHBondContact O-N 2.89Å; G430-E432 VanDerWaalsContact O-N 3.11Å; E432-I434 PolarHBondContact O-N 2.9Å
433	I	28.7	Very low	31.4	Very low	135 Å²	135	137 Å²	137	69%	0.692	79%	0.788	S	S	*	*			trans	-75.6	97.4	177.1	-61.5	169.9	0	0	0	107.3	P435	I433-P435 VanDerWaalsContact O-CD 3.3Å; I433-P435 WeakPolarHBondContact O-CD 3.3Å
434	I	29.5	Very low	32	Very low	141 Å²	141	135.5 Å²	135.5	72%	0.723	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-54.6	117.7	168.4	-58.9	175.2	0	0	0	107.4	E432	E432-I434 PolarHBondContact O-N 2.9Å
435	P	28.9	Very low	33	Very low	107 Å²	107	135.7 Å²	135.7	70%	0.695	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-60.4	143.2	171.4	-19	32.1	0	0	0	109.1	I433	I433-P435 VanDerWaalsContact O-CD 3.3Å; I433-P435 WeakPolarHBondContact O-CD 3.3Å
436	H	29.6	Very low	34.1	Very low	176 Å²	176	133.3 Å²	133.3	82%	0.815	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-52	136.8	170.1	-58.4	-35.9	0	0	0	109.4	L438	H436-L438 PolarHBondContact O-N 3.43Å
437	P	30.1	Very low	35.3	Very low	117 Å²	117	134.3 Å²	134.3	76%	0.76	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-56.7	139.8	179.4	24.8	-33.7	0	0	0	109.2
438	L	29.9	Very low	36.6	Very low	157 Å²	157	128.9 Å²	128.9	82%	0.822	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-55.1	141.4	164.8	-69.7	167.2	0	0	0	107.8	H436 D440	H436-L438 PolarHBondContact O-N 3.43Å; L438-D440 PolarHBondContact O-N 3.48Å
439	P	32.8	Very low	38	Very low	119 Å²	119	129.5 Å²	129.5	77%	0.773	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-54.6	132.5	176.9	23.9	-33.4	0	0	0	109.3	R441	P439-R441 PolarHBondContact O-N 2.85Å
440	D	34	Very low	39.6	Very low	135 Å²	135	123.2 Å²	123.2	72%	0.722	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-53.1	135.6	-177.3	-104.8	-63.2	0	0	0	110.4	L438	L438-D440 PolarHBondContact O-N 3.48Å
441	R	35.6	Very low	41	Very low	211 Å²	211	126.7 Å²	126.7	80%	0.796	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-56.8	131.9	168.9	-79.5	-176.5	168.7	-170.3	-5	108	P439 K443	P439-R441 PolarHBondContact O-N 2.85Å; R441-K443 PolarHBondContact O-N 3.11Å
442	P	37.3	Very low	42.5	Very low	112 Å²	112	122.4 Å²	122.4	73%	0.727	69%	0.693	S	S	*	*			trans	-59.9	111.5	-179.8	23.2	-32.9	0	0	0	110.1	G444	P442-G444 PolarHBondContact O-N 3.49Å
443	K	36.2	Very low	44.1	Very low	196 Å²	196	115.7 Å²	115.7	85%	0.852	66%	0.662	S	S	*	*			trans	-83.3	48.4	177.9	-71.2	173.8	-178.6	160	0	111.2	R441	R441-K443 PolarHBondContact O-N 3.11Å
444	G	45.6	Very low	45.4	Very low	45 Å²	45	119.6 Å²	119.6	46%	0.464	67%	0.668	S	S	.	*	S	Bend	trans	-163.9	158.7	-179.2	0	0	0	0	0	111.8	P442	P442-G444 PolarHBondContact O-N 3.49Å
445	P	52.4	Low	46.5	Very low	117 Å²	117	115 Å²	115	76%	0.76	65%	0.647	S	S	*	*			trans	-65	142.6	175.3	28.7	-34.5	0	0	0	110.8	I447	P445-I447 PolarHBondContact O-N 3.08Å; P445-I447 VanDerWaalsContact O-N 3.15Å
446	V	51.1	Low	47.8	Very low	62 Å²	62	114.6 Å²	114.6	38%	0.376	64%	0.642	S	S	.	*			trans	-73.5	105.6	172.1	179.6	0	0	0	0	108.3	P455 L467	V446-P455 HydrophobicContact CB-CG 4.28Å; V446-P455 HydrophobicContact CG1-CG 4.43Å; V446-P455 WeakPolarHBondContact O-CG 3.2Å; V446-L467 HydrophobicContact CG2-CB 4.31Å
447	I	58.8	Low	48.6	Very low	148 Å²	148	114.6 Å²	114.6	76%	0.759	64%	0.64	S	S	*	*			trans	-86.1	118.3	174.6	-60	172.3	0	0	0	107.9	P445	P445-I447 PolarHBondContact O-N 3.08Å; P445-I447 VanDerWaalsContact O-N 3.15Å
448	C	58.2	Low	49.2	Very low	13 Å²	13	112 Å²	112	9%	0.088	62%	0.623	C	S	.	*			trans	-72.4	142.4	172.9	-58.6	0	0	0	0	110.3	T450 Q453 C469	C448-T450 PolarHBondContact O-N 3.02Å; C448-Q453 HydrophobicContact CB-CB 3.79Å; C448-C469 WeakPolarHBondContact CA-SG 3.39Å; C448-C469 HydrophobicContact CB-CB 3.72Å; C448-C469 WeakPolarHBondContact CB-SG 3.13Å; C448-C469 WeakPolarHBondContact SG-CB 3.38Å; C448-C469 CovalentContact SG-SG 2.04Å; C448-C469 PolarHBondContact SG-SG 2.94Å
449	P	63.4	Low	50	Low	124 Å²	124	110.2 Å²	110.2	81%	0.805	62%	0.619	S	S	*	*	S	Bend	trans	-67.5	-19.8	-176	27.8	-35.6	0	0	0	113.2
450	T	63	Low	50.5	Low	59 Å²	59	110.2 Å²	110.2	36%	0.362	62%	0.619	S	S	.	*	S	Bend	trans	-98.3	119.9	-179.8	-17.1	0	0	0	0	110.5	C448 G452 Q453	C448-T450 PolarHBondContact O-N 3.02Å; T450-G452 PolarHBondContact O-N 2.91Å; T450-Q453 PolarHBondContact O-N 3.43Å; T450-Q453 VanDerWaalsContact OG1-CD 3.29Å; T450-Q453 PolarHBondContact OG1-OE1 2.88Å
451	P	58.2	Low	50.7	Low	131 Å²	131	111.4 Å²	111.4	85%	0.851	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.3	133.3	175.9	-27.2	35.6	0	0	0	112.4
452	G	61.5	Low	50.9	Low	84 Å²	84	105.3 Å²	105.3	87%	0.866	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	93	-16.6	-179.9	0	0	0	0	0	115.6	T450	T450-G452 PolarHBondContact O-N 2.91Å
453	Q	62.5	Low	50.7	Low	41 Å²	41	105.5 Å²	105.5	19%	0.192	62%	0.619	C	S	.	*			trans	-72.7	136.9	174.3	-72.3	-173.2	-28.5	0	0	112.1	C448 T450 P470 H472	C448-Q453 HydrophobicContact CB-CB 3.79Å; T450-Q453 PolarHBondContact O-N 3.43Å; T450-Q453 VanDerWaalsContact OG1-CD 3.29Å; T450-Q453 PolarHBondContact OG1-OE1 2.88Å; Q453-P470 PolarHBondContact NE2-O 2.91Å; Q453-P470 PolarHBondContact OE1-O 3.01Å; Q453-H472 PolarHBondContact NE2-ND1 2.88Å
454	R	55.5	Low	50.5	Low	217 Å²	217	103.1 Å²	103.1	82%	0.819	62%	0.616	S	S	*	*			trans	-108.8	137.8	171.1	-63.6	-176.2	-178.1	-176.6	1.1	109.5	V456	R454-V456 PolarHBondContact O-N 2.85Å
455	P	53.1	Low	50.1	Low	45 Å²	45	103.3 Å²	103.3	29%	0.292	62%	0.618	S	S	.	*	P	Polyproline II helix	trans	-61	133.9	173.4	-20.6	31.2	0	0	0	111.2	V446 L467 I468	V446-P455 HydrophobicContact CB-CG 4.28Å; V446-P455 HydrophobicContact CG1-CG 4.43Å; V446-P455 WeakPolarHBondContact O-CG 3.2Å; P455-L467 HydrophobicContact CB-CB 3.96Å; P455-L467 HydrophobicContact CB-CD2 4.35Å; P455-I468 WeakPolarHBondContact CA-O 3.39Å
456	V	55.3	Low	49.5	Very low	97 Å²	97	103.2 Å²	103.2	59%	0.588	62%	0.615	S	S	*	*	B	Isolated β-bridge	trans	-87.5	135.9	-179.4	-177.3	0	0	0	0	109.6	R454 I468	R454-V456 PolarHBondContact O-N 2.85Å; V456-I468 PolarHBondContact N-O 3.39Å
457	K	46.8	Very low	49.2	Very low	176 Å²	176	104.3 Å²	104.3	77%	0.765	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-90.6	127	174.2	-172.7	-174.3	176.2	-173.2	0	109.1	L467	K457-L467 HydrophobicContact CB-CD2 4.5Å
458	P	43.2	Very low	48.6	Very low	63 Å²	63	103.1 Å²	103.1	41%	0.409	61%	0.612	S	S	.	*	P	Polyproline II helix	trans	-65.4	161	174.7	27.1	-33.8	0	0	0	112.1
459	T	46.5	Very low	48.1	Very low	119 Å²	119	103.8 Å²	103.8	73%	0.73	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-64.2	161.7	-177.5	34.1	0	0	0	0	113.4	D461	T459-D461 VanDerWaalsContact C-N 3.31Å; T459-D461 PolarHBondContact O-N 2.95Å; T459-D461 VanDerWaalsContact O-N 3.09Å
460	P	42.3	Very low	47.5	Very low	119 Å²	119	101 Å²	101	77%	0.773	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.8	-25.5	-157.7	-28	37.3	0	0	0	117.3	S462	P460-S462 VanDerWaalsContact C-N 3.33Å; P460-S462 PolarHBondContact O-N 3.03Å
461	D	39.2	Very low	46.8	Very low	160 Å²	160	104.5 Å²	104.5	86%	0.856	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	2.7	-162.7	-53.7	-52.7	0	0	0	115	T459	T459-D461 VanDerWaalsContact C-N 3.31Å; T459-D461 PolarHBondContact O-N 2.95Å; T459-D461 VanDerWaalsContact O-N 3.09Å
462	S	38.5	Very low	46.1	Very low	83 Å²	83	105.9 Å²	105.9	58%	0.58	62%	0.615	S	S	*	*			trans	-108.2	101.3	173.9	-166.1	0	0	0	0	112.3	P460 N464	P460-S462 VanDerWaalsContact C-N 3.33Å; P460-S462 PolarHBondContact O-N 3.03Å; S462-N464 PolarHBondContact O-N 2.92Å
463	S	32.9	Very low	45.1	Very low	116 Å²	116	109.2 Å²	109.2	81%	0.811	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	36.3	-176	52.7	0	0	0	0	115.1
464	N	32.2	Very low	43.6	Very low	146 Å²	146	114.9 Å²	114.9	78%	0.781	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-163	54.3	164.2	-92.4	-48.1	0	0	0	112.6	S462	S462-N464 PolarHBondContact O-N 2.92Å
465	G	38.1	Very low	42.5	Very low	50 Å²	50	108.2 Å²	108.2	52%	0.515	64%	0.636	S	S	.	*	P	Polyproline II helix	trans	-76.3	127.8	177.2	0	0	0	0	0	114.6
466	V	38.6	Very low	41.3	Very low	115 Å²	115	113.1 Å²	113.1	70%	0.697	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-89.7	146.2	167.2	177.6	0	0	0	0	109.5
467	L	46.2	Very low	39.9	Very low	85 Å²	85	117 Å²	117	45%	0.445	67%	0.669	S	S	.	*	P	Polyproline II helix	trans	-77.9	129.7	175.3	-67.5	175.1	0	0	0	110.9	V446 P455 K457	V446-L467 HydrophobicContact CG2-CB 4.31Å; P455-L467 HydrophobicContact CB-CB 3.96Å; P455-L467 HydrophobicContact CB-CD2 4.35Å; K457-L467 HydrophobicContact CB-CD2 4.5Å
468	I	46.1	Very low	39	Very low	122 Å²	122	115.2 Å²	115.2	63%	0.626	67%	0.667	S	S	*	*	B	Isolated β-bridge	trans	-126.5	144.8	-178.4	-52	179.1	0	0	0	109.4	P455 V456	P455-I468 WeakPolarHBondContact CA-O 3.39Å; V456-I468 PolarHBondContact N-O 3.39Å
469	C	47.1	Very low	38.1	Very low	28 Å²	28	118 Å²	118	19%	0.189	68%	0.682	C	S	.	*	P	Polyproline II helix	trans	-93.9	133.3	174.6	-64.3	0	0	0	0	110.5	C448	C448-C469 WeakPolarHBondContact CA-SG 3.39Å; C448-C469 HydrophobicContact CB-CB 3.72Å; C448-C469 WeakPolarHBondContact CB-SG 3.13Å; C448-C469 WeakPolarHBondContact SG-CB 3.38Å; C448-C469 CovalentContact SG-SG 2.04Å; C448-C469 PolarHBondContact SG-SG 2.94Å
470	P	50.1	Low	37.2	Very low	64 Å²	64	117.6 Å²	117.6	42%	0.416	68%	0.681	S	S	.	*	P	Polyproline II helix	trans	-75.9	128	-178.5	29.7	-33.5	0	0	0	111.8	Q453	Q453-P470 PolarHBondContact NE2-O 2.91Å; Q453-P470 PolarHBondContact OE1-O 3.01Å
471	T	48.3	Very low	36.3	Very low	134 Å²	134	119.5 Å²	119.5	82%	0.822	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-85.2	141	172.5	45.3	0	0	0	0	111.4	D473	T471-D473 PolarHBondContact O-N 3.13Å; T471-D473 VanDerWaalsContact O-N 3.15Å
472	H	44.1	Very low	35.8	Very low	159 Å²	159	117.4 Å²	117.4	74%	0.736	68%	0.68	S	S	*	*	S	Bend	trans	-80.3	87.6	171.9	-73.1	92.8	0	0	0	110.4	Q453	Q453-H472 PolarHBondContact NE2-ND1 2.88Å
473	D	40.5	Very low	35.2	Very low	154 Å²	154	120.1 Å²	120.1	82%	0.824	69%	0.693	S	S	*	*			trans	-161.5	139.3	137	-125.3	-31.8	0	0	0	111.4	T471 A475	T471-D473 PolarHBondContact O-N 3.13Å; T471-D473 VanDerWaalsContact O-N 3.15Å; D473-A475 PolarHBondContact O-N 2.8Å
474	N	32.3	Very low	35	Very low	160 Å²	160	119.7 Å²	119.7	86%	0.856	69%	0.688	S	S	*	*			trans	-102.2	53.8	-165.3	-150.6	23.3	0	0	0	112.8
475	A	31	Very low	34.7	Very low	77 Å²	77	120.7 Å²	120.7	64%	0.636	69%	0.692	S	S	*	*			trans	-136.7	97.4	176.2	0	0	0	0	0	110.6	D473 H477	D473-A475 PolarHBondContact O-N 2.8Å; A475-H477 VanDerWaalsContact C-N 3.32Å; A475-H477 PolarHBondContact O-N 3.13Å
476	I	27.9	Very low	34.5	Very low	149 Å²	149	123.1 Å²	123.1	76%	0.764	70%	0.698	S	S	*	*			trans	-79.6	78.6	-175	-57.5	177.9	0	0	0	110.4	I478	I476-I478 HydrophobicContact CG2-CD1 4.27Å; I476-I478 HydrophobicContact CG2-CG1 3.77Å; I476-I478 PolarHBondContact O-N 3.07Å
477	H	26.2	Very low	33.9	Very low	179 Å²	179	124.2 Å²	124.2	83%	0.829	71%	0.705	S	S	*	*			trans	-85	96.4	164.8	-111.1	-84.4	0	0	0	109.7	A475 V479	A475-H477 VanDerWaalsContact C-N 3.32Å; A475-H477 PolarHBondContact O-N 3.13Å; H477-V479 PolarHBondContact O-N 3.43Å
478	I	28.6	Very low	33	Very low	137 Å²	137	124.3 Å²	124.3	70%	0.703	72%	0.719	S	S	*	*			trans	-72.2	116.9	177.3	-58.9	176.6	0	0	0	109.1	I476 P480	I476-I478 HydrophobicContact CG2-CD1 4.27Å; I476-I478 HydrophobicContact CG2-CG1 3.77Å; I476-I478 PolarHBondContact O-N 3.07Å; I478-P480 WeakPolarHBondContact O-CD 3.2Å
479	V	23.4	Very low	32	Very low	122 Å²	122	127.4 Å²	127.4	74%	0.739	73%	0.731	S	S	*	*			trans	-100.9	103.8	166.7	179.6	0	0	0	0	108.4	H477 L481	H477-V479 PolarHBondContact O-N 3.43Å; V479-L481 PolarHBondContact O-N 2.82Å
480	P	28.1	Very low	30.9	Very low	110 Å²	110	136.1 Å²	136.1	71%	0.714	76%	0.761	S	S	*	*			trans	-88.2	102.7	-177.1	33	-32.4	0	0	0	111.6	I478	I478-P480 WeakPolarHBondContact O-CD 3.2Å
481	L	23.7	Very low	29.9	Very low	159 Å²	159	139.1 Å²	139.1	83%	0.832	78%	0.78	S	S	*	*			trans	-83.8	139.2	158.3	-116.8	73.5	0	0	0	109.9	V479	V479-L481 PolarHBondContact O-N 2.82Å
482	P	27.8	Very low	28.9	Very low	117 Å²	117	136.9 Å²	136.9	76%	0.76	77%	0.77	S	S	*	*			trans	-91	136.1	-161.8	33.6	-35.3	0	0	0	114.5
483	T	25.4	Very low	27.9	Very low	139 Å²	139	135.5 Å²	135.5	85%	0.853	78%	0.778	S	S	*	*			trans	-142	155.9	154.1	36.6	0	0	0	0	110.9
484	P	29.2	Very low	27.2	Very low	108 Å²	108	131.7 Å²	131.7	70%	0.701	76%	0.764	S	S	*	*			trans	-119.5	138.1	-147.2	37.5	-25.7	0	0	0	117.1
485	L	26.4	Very low	26.9	Very low	167 Å²	167	132.3 Å²	132.3	87%	0.874	77%	0.766	S	S	*	*			trans	66.5	159.3	145	-67.1	170.4	0	0	0	119.3
486	P	33.8	Very low	26.8	Very low	100 Å²	100	136.9 Å²	136.9	65%	0.649	77%	0.774	S	S	*	*			cis	-130.6	-179.7	-15.4	33.7	-14.5	0	0	0	114.9
487	T	26.4	Very low	26.8	Very low	138 Å²	138	134.1 Å²	134.1	85%	0.847	77%	0.773	S	S	*	*			trans	63.1	106.8	155.6	37.9	0	0	0	0	119.4
488	A	26.5	Very low	26.7	Very low	87 Å²	87	131.3 Å²	131.3	72%	0.719	77%	0.769	S	S	*	*			trans	-126.6	142.6	134	0	0	0	0	0	107.7
489	E	24.9	Very low	26.8	Very low	188 Å²	188	131 Å²	131	88%	0.879	77%	0.768	S	S	*	*			trans	-76.2	144.6	169.1	-67	160.2	110.1	0	0	109.5
490	Y	24	Very low	27.1	Very low	211 Å²	211	133.2 Å²	133.2	83%	0.827	77%	0.773	S	S	*	*			trans	-138.6	129.8	162.6	-100.7	-86	0	0	0	109.5	S492	Y490-S492 PolarHBondContact O-N 3.06Å
491	P	28.8	Very low	27.3	Very low	126 Å²	126	132.7 Å²	132.7	82%	0.818	77%	0.767	S	S	*	*			trans	-80.6	112.3	175.2	31	-31.9	0	0	0	110.3
492	S	27.1	Very low	27.7	Very low	88 Å²	88	131.8 Å²	131.8	62%	0.615	76%	0.762	S	S	*	*			trans	-101.9	92.2	175.2	43	0	0	0	0	111.8	Y490 S494	Y490-S492 PolarHBondContact O-N 3.06Å; S492-S494 PolarHBondContact O-N 3.15Å
493	S	24.8	Very low	28.1	Very low	129 Å²	129	130.2 Å²	130.2	90%	0.902	75%	0.747	S	S	*	*			trans	-75	71.8	164.6	59.4	0	0	0	0	110.6
494	S	24.7	Very low	28.3	Very low	74 Å²	74	126 Å²	126	52%	0.517	72%	0.721	S	S	.	*	S	Bend	trans	-149.5	131.9	176.9	51.6	0	0	0	0	109.2	S492 E496	S492-S494 PolarHBondContact O-N 3.15Å; S494-E496 VanDerWaalsContact C-N 3.35Å; S494-E496 PolarHBondContact O-N 2.78Å
495	L	26.2	Very low	28.6	Very low	174 Å²	174	125.7 Å²	125.7	91%	0.911	72%	0.722	S	S	*	*			trans	-73.1	87	179.9	-74.1	80.4	0	0	0	110.5	A497	L495-A497 PolarHBondContact O-N 2.85Å
496	E	29.3	Very low	29.2	Very low	173 Å²	173	120.2 Å²	120.2	81%	0.808	69%	0.693	S	S	*	*			trans	-73.6	66.7	163.9	-71	-162	133.8	0	0	110.7	S494 V498	S494-E496 VanDerWaalsContact C-N 3.35Å; S494-E496 PolarHBondContact O-N 2.78Å; E496-V498 PolarHBondContact O-N 2.85Å; E496-V498 VanDerWaalsContact O-N 3.1Å
497	A	26.4	Very low	29.3	Very low	90 Å²	90	119.4 Å²	119.4	74%	0.744	69%	0.688	S	S	*	*			trans	-72.7	92.6	161.2	0	0	0	0	0	108.9	L495	L495-A497 PolarHBondContact O-N 2.85Å
498	V	26.2	Very low	29.9	Very low	120 Å²	120	122.8 Å²	122.8	73%	0.727	69%	0.691	S	S	*	*	S	Bend	trans	-169.6	136.7	153.5	136.1	0	0	0	0	109.9	E496 M500	E496-V498 PolarHBondContact O-N 2.85Å; E496-V498 VanDerWaalsContact O-N 3.1Å; V498-M500 PolarHBondContact O-N 2.88Å
499	N	30.6	Very low	30.5	Very low	130 Å²	130	122.2 Å²	122.2	70%	0.695	67%	0.671	S	S	*	*			trans	64.6	23.9	167.3	-63.4	-6.6	0	0	0	119.9	V501	N499-V501 PolarHBondContact O-N 3.33Å
500	M	29.2	Very low	31.1	Very low	170 Å²	170	118.9 Å²	118.9	84%	0.837	66%	0.659	S	S	*	*			trans	-74.5	101.1	141.7	-85.1	-174	68.2	0	0	108.9	V498 I502	V498-M500 PolarHBondContact O-N 2.88Å; M500-I502 PolarHBondContact O-N 2.95Å
501	V	32.1	Very low	32.1	Very low	98 Å²	98	114.6 Å²	114.6	59%	0.594	65%	0.648	S	S	*	*			trans	-74.1	93.4	170.1	-178.7	0	0	0	0	108.5	N499 L503	N499-V501 PolarHBondContact O-N 3.33Å; V501-L503 PolarHBondContact O-N 3.01Å; V501-L503 VanDerWaalsContact O-N 3.15Å
502	I	31.9	Very low	32.5	Very low	140 Å²	140	113.1 Å²	113.1	72%	0.718	64%	0.641	S	S	*	*			trans	-68.7	107	166.2	-59.7	176.2	0	0	0	106.7	M500	M500-I502 PolarHBondContact O-N 2.95Å
503	L	35.5	Very low	33	Very low	85 Å²	85	116 Å²	116	45%	0.445	65%	0.649	S	S	.	*	P	Polyproline II helix	trans	-59.2	122.4	168.3	-76.3	165.6	0	0	0	108	V501 T669	V501-L503 PolarHBondContact O-N 3.01Å; V501-L503 VanDerWaalsContact O-N 3.15Å; L503-T669 HydrophobicContact CD2-CG2 3.83Å
504	P	30.5	Very low	33.7	Very low	49 Å²	49	116.5 Å²	116.5	32%	0.318	64%	0.638	S	S	.	*	P	Polyproline II helix	trans	-63.3	144	177.7	27.1	-34.2	0	0	0	109.8	L506 M661 T669	P504-L506 PolarHBondContact O-N 3.28Å; P504-L506 VanDerWaalsContact O-N 3.1Å; P504-M661 HydrophobicContact CG-CE 3.65Å; P504-T669 HydrophobicContact CG-CG2 4.15Å
505	S	34.9	Very low	34.3	Very low	103 Å²	103	119 Å²	119	72%	0.72	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-57.4	116.8	171.8	34.6	0	0	0	0	109.4
506	L	38.7	Very low	35.1	Very low	51 Å²	51	112.6 Å²	112.6	27%	0.267	62%	0.616	S	S	.	*	P	Polyproline II helix	trans	-60.2	137.3	178.5	-73.7	167	0	0	0	109.3	P504 K508 L656 P658 M661	P504-L506 PolarHBondContact O-N 3.28Å; P504-L506 VanDerWaalsContact O-N 3.1Å; L506-K508 PolarHBondContact O-N 3.19Å; L506-L656 HydrophobicContact CD1-CB 3.89Å; L506-L656 HydrophobicContact CD1-CD1 3.8Å; L506-L656 HydrophobicContact CD1-CG 4.49Å; L506-P658 HydrophobicContact CD2-CB 4.28Å; L506-P658 HydrophobicContact CD2-CG 4.13Å; L506-M661 HydrophobicContact CD2-CE 3.68Å; L506-M661 HydrophobicContact CD2-SD 4.33Å
507	P	37.5	Very low	36.1	Very low	83 Å²	83	105.3 Å²	105.3	54%	0.539	59%	0.585	S	S	.	*	P	Polyproline II helix	trans	-59.1	136.3	171.6	26.4	-33.4	0	0	0	108.6	Y509	P507-Y509 PolarHBondContact O-N 3.46Å
508	K	38	Very low	37.4	Very low	209 Å²	209	108 Å²	108	91%	0.909	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-53.2	126.6	174.7	-71.5	-177.8	176.6	-179.6	0	108.5	L506 D510	L506-K508 PolarHBondContact O-N 3.19Å; K508-D510 PolarHBondContact O-N 3.03Å
509	Y	39.6	Very low	39.2	Very low	75 Å²	75	103.9 Å²	103.9	29%	0.294	56%	0.56	S	S	.	*	P	Polyproline II helix	trans	-63.4	121.8	171.1	-82.4	-84.7	0	0	0	108.2	P507 M511 L656 L657 M736	P507-Y509 PolarHBondContact O-N 3.46Å; Y509-M511 WeakPolarHBondContact O-CG 2.89Å; Y509-M511 PolarHBondContact O-N 3.07Å; Y509-L656 HydrophobicContact CE2-CD2 4.43Å; Y509-L657 PolarHBondContact OH-O 3.43Å; Y509-M736 HydrophobicContact CD2-SD 4.11Å; Y509-M736 HydrophobicContact CE2-SD 4.32Å; Y509-M736 HydrophobicContact CG-SD 4.42Å
510	D	37.3	Very low	41	Very low	118 Å²	118	101.9 Å²	101.9	63%	0.631	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-68.8	119.4	170.5	-169.8	-10.4	0	0	0	108.3	K508 S512	K508-D510 PolarHBondContact O-N 3.03Å; D510-S512 VanDerWaalsContact OD1-CB 3.27Å; D510-S512 WeakPolarHBondContact OD1-CB 3.26Å; D510-S512 PolarHBondContact OD1-N 3.19Å; D510-S512 VanDerWaalsContact OD1-N 3.09Å; D510-S512 PolarHBondContact OD1-OG 3.1Å
511	M	44.6	Very low	42.9	Very low	121 Å²	121	95.5 Å²	95.5	60%	0.596	52%	0.515	S	S	*	.			trans	-113	14	-176.6	-51.1	-155.5	-38.2	0	0	111.8	Y509 I516	Y509-M511 WeakPolarHBondContact O-CG 2.89Å; Y509-M511 PolarHBondContact O-N 3.07Å; M511-I516 HydrophobicContact CB-CD1 3.69Å; M511-I516 HydrophobicContact CE-CD1 4.2Å; M511-I516 HydrophobicContact CG-CD1 3.65Å; M511-I516 HydrophobicContact SD-CD1 3.4Å; M511-I516 WeakPolarHBondContact SD-CD1 3.39Å
512	S	38	Very low	44.6	Very low	96 Å²	96	91.4 Å²	91.4	67%	0.671	49%	0.489	S	S	*	.	S	Bend	trans	-72.4	-42.1	-171.4	-47.6	0	0	0	0	112.8	D510	D510-S512 VanDerWaalsContact OD1-CB 3.27Å; D510-S512 WeakPolarHBondContact OD1-CB 3.26Å; D510-S512 PolarHBondContact OD1-N 3.19Å; D510-S512 VanDerWaalsContact OD1-N 3.09Å; D510-S512 PolarHBondContact OD1-OG 3.1Å
513	D	37.3	Very low	46	Very low	148 Å²	148	92.2 Å²	92.2	79%	0.791	49%	0.494	S	S	*	.	S	Bend	trans	-107.7	4.3	-160.4	-66.2	-4.8	0	0	0	114.9
514	Q	39.6	Very low	47	Very low	140 Å²	140	90.2 Å²	90.2	65%	0.654	49%	0.485	S	S	*	.	S	Bend	trans	-138.4	132.9	-175.3	-65.5	-172.3	-13.8	0	0	112.4	I516	Q514-I516 WeakPolarHBondContact O-CG1 3.35Å; Q514-I516 PolarHBondContact O-N 2.92Å
515	T	37	Very low	47.7	Very low	127 Å²	127	94.3 Å²	94.3	78%	0.779	50%	0.5	S	S	*	.			trans	-65.7	103.4	171	40.9	0	0	0	0	109.9	A517	T515-A517 PolarHBondContact O-N 2.73Å
516	I	44	Very low	47.9	Very low	39 Å²	39	93.7 Å²	93.7	20%	0.2	49%	0.489	C	S	.	.			trans	-75.4	94.8	-175.2	-58.7	-173.1	0	0	0	110.5	M511 Q514 H521 S559	M511-I516 HydrophobicContact CB-CD1 3.69Å; M511-I516 HydrophobicContact CE-CD1 4.2Å; M511-I516 HydrophobicContact CG-CD1 3.65Å; M511-I516 HydrophobicContact SD-CD1 3.4Å; M511-I516 WeakPolarHBondContact SD-CD1 3.39Å; Q514-I516 WeakPolarHBondContact O-CG1 3.35Å; Q514-I516 PolarHBondContact O-N 2.92Å; I516-H521 WeakPolarHBondContact CG2-CE1 3.4Å; I516-S559 WeakPolarHBondContact O-CB 3.24Å
517	A	49.9	Very low	47.7	Very low	19 Å²	19	96.1 Å²	96.1	16%	0.157	50%	0.502	C	S	.	.			trans	73	134.4	160.3	0	0	0	0	0	118	T515 H519	T515-A517 PolarHBondContact O-N 2.73Å; A517-H519 WeakPolarHBondContact CB-O 3.35Å; A517-H519 PolarHBondContact O-N 3.38Å
518	D	53.6	Low	47.3	Very low	146 Å²	146	98.8 Å²	98.8	78%	0.781	51%	0.51	S	S	*	.	S	Bend	trans	-77.8	9.2	157.6	55.5	-11	0	0	0	112.9
519	H	64.2	Low	46.7	Very low	34 Å²	34	95.4 Å²	95.4	16%	0.157	51%	0.507	C	S	.	.	S	Bend	trans	-143.6	160.7	-168.1	56.6	-99.4	0	0	0	114.2	A517 H521 C732 V772	A517-H519 WeakPolarHBondContact CB-O 3.35Å; A517-H519 PolarHBondContact O-N 3.38Å; H519-H521 AromaticContact CD2-CD2 3.83Å; H519-H521 AromaticContact CD2-NE2 3.94Å; H519-H521 AromaticContact NE2-NE2 3.65Å; H519-H521 PolarHBondContact O-N 3.1Å; H519-C732 WeakPolarHBondContact NE2-CB 3.17Å; H519-V772 HydrophobicContact CB-CB 4.37Å; H519-V772 HydrophobicContact CB-CG1 3.77Å; H519-V772 HydrophobicContact CB-CG2 3.63Å; H519-V772 VanDerWaalsContact CD2-CG1 3.43Å; H519-V772 WeakPolarHBondContact CD2-CG1 3.5Å; H519-V772 VanDerWaalsContact CG-CG1 3.46Å
520	E	67.2	Low	46	Very low	88 Å²	88	95.1 Å²	95.1	41%	0.411	53%	0.526	S	S	.	.			trans	-80.6	118.2	-170.6	-165	-167.3	165.4	0	0	113.8	R739	E520-R739 HydrophobicContact CB-CG 4.42Å; E520-R739 HydrophobicContact CG-CG 4.28Å; E520-R739 PolarHBondContact O-N 3.41Å; E520-R739 WeakPolarHBondContact OE1-CD 3.36Å; E520-R739 IonicContact OE1-CZ 3.84Å; E520-R739 IonicContact OE1-NE 2.77Å; E520-R739 IonicContact OE1-NH1 2.77Å; E520-R739 PolarHBondContact OE1-NH1 2.66Å; E520-R739 WeakPolarHBondContact OE2-CD 3.49Å; E520-R739 WeakPolarHBondContact OE2-CG 3.38Å
521	H	68.9	Low	45.3	Very low	37 Å²	37	98.6 Å²	98.6	17%	0.171	54%	0.539	C	S	.	.	B	Isolated β-bridge	trans	-84.4	143.7	172.1	-78.3	-155.9	0	0	0	112.6	I516 H519 L523	I516-H521 WeakPolarHBondContact CG2-CE1 3.4Å; H519-H521 AromaticContact CD2-CD2 3.83Å; H519-H521 AromaticContact CD2-NE2 3.94Å; H519-H521 AromaticContact NE2-NE2 3.65Å; H519-H521 PolarHBondContact O-N 3.1Å; H521-L523 PolarHBondContact O-N 2.88Å
522	I	68.4	Low	44.3	Very low	11 Å²	11	96.5 Å²	96.5	6%	0.056	54%	0.536	C	S	.	.			trans	-85.8	103	171.1	-56.5	-179.6	0	0	0	108.2	V524 A601 P737 R739	I522-V524 HydrophobicContact CG2-CG2 4.41Å; I522-V524 PolarHBondContact O-N 3.49Å; I522-A601 HydrophobicContact CD1-CB 4.27Å; I522-A601 HydrophobicContact CG2-CB 4.38Å; I522-P737 HydrophobicContact CB-CB 4.13Å; I522-P737 HydrophobicContact CB-CG 4.19Å; I522-P737 PolarHBondContact N-O 3.4Å; I522-P737 WeakPolarHBondContact O-CG 3.41Å; I522-R739 HydrophobicContact CD1-CB 4.08Å; I522-R739 HydrophobicContact CG1-CB 4.13Å; I522-R739 HydrophobicContact CG1-CG 4.32Å
523	L	61.6	Low	43.6	Very low	157 Å²	157	95.3 Å²	95.3	82%	0.822	53%	0.532	S	S	*	.			trans	-63	131.6	173.1	-61.1	179.5	0	0	0	110.8	H521	H521-L523 PolarHBondContact O-N 2.88Å
524	V	56.1	Low	43.1	Very low	43 Å²	43	92.4 Å²	92.4	26%	0.261	52%	0.516	S	S	.	.			trans	-126.4	128.4	175.9	-176.7	0	0	0	0	107.9	I522 A535 P737	I522-V524 HydrophobicContact CG2-CG2 4.41Å; I522-V524 PolarHBondContact O-N 3.49Å; V524-A535 HydrophobicContact CG1-CB 3.58Å; V524-P737 HydrophobicContact CG2-CG 4.27Å
525	Q	44.8	Very low	42.5	Very low	136 Å²	136	85.9 Å²	85.9	64%	0.636	49%	0.486	S	S	*	.			trans	-104.2	102.6	-175.3	-173.2	176.5	9.6	0	0	110.7	N527 A535	Q525-N527 PolarHBondContact O-N 3.2Å; Q525-A535 VanDerWaalsContact O-CB 3.23Å; Q525-A535 WeakPolarHBondContact O-CB 3.18Å
526	D	40.5	Very low	41.9	Very low	90 Å²	90	88 Å²	88	48%	0.481	48%	0.484	S	S	.	.			trans	-81.3	93.8	177.2	-70	-26.1	0	0	0	111	I528	D526-I528 VanDerWaalsContact C-N 3.32Å; D526-I528 HydrophobicContact CB-CG1 4.31Å; D526-I528 PolarHBondContact O-N 2.77Å
527	N	33.9	Very low	41.1	Very low	101 Å²	101	89.8 Å²	89.8	54%	0.54	51%	0.511	S	S	.	.			trans	-73.6	83.7	170.5	-76.5	4	0	0	0	110.5	Q525 V529	Q525-N527 PolarHBondContact O-N 3.2Å; N527-V529 PolarHBondContact O-N 2.77Å; N527-V529 VanDerWaalsContact O-N 3.13Å
528	I	28.4	Very low	39.9	Very low	140 Å²	140	97.7 Å²	97.7	72%	0.718	54%	0.537	S	S	*	.			trans	-83.3	80	174	-51.8	-179.6	0	0	0	110	D526	D526-I528 VanDerWaalsContact C-N 3.32Å; D526-I528 HydrophobicContact CB-CG1 4.31Å; D526-I528 PolarHBondContact O-N 2.77Å
529	V	26.1	Very low	38.8	Very low	138 Å²	138	92.2 Å²	92.2	84%	0.836	51%	0.509	S	S	*	.	S	Bend	trans	-142.3	121.9	160.9	-176.4	0	0	0	0	107.5	N527	N527-V529 PolarHBondContact O-N 2.77Å; N527-V529 VanDerWaalsContact O-N 3.13Å
530	G	25.3	Very low	37.1	Very low	68 Å²	68	95 Å²	95	70%	0.701	54%	0.539	S	S	*	.	S	Bend	trans	45.6	97.8	165.1	0	0	0	0	0	118
531	E	22.6	Very low	35.2	Very low	192 Å²	192	94.7 Å²	94.7	90%	0.897	55%	0.546	S	S	*	.	S	Bend	trans	62.8	110.3	163.7	-55.1	-172.8	158.1	0	0	117.8
532	S	23.6	Very low	33	Very low	76 Å²	76	98 Å²	98	53%	0.531	57%	0.572	S	S	.	*			trans	74.8	109.6	177.4	-54.2	0	0	0	0	116.9	I534	S532-I534 PolarHBondContact O-N 2.77Å
533	A	23.4	Very low	31	Very low	71 Å²	71	105 Å²	105	59%	0.587	61%	0.609	S	S	*	*			trans	-67.5	122.4	169.5	0	0	0	0	0	112
534	I	25.6	Very low	29.2	Very low	88 Å²	88	104.9 Å²	104.9	45%	0.451	61%	0.608	S	S	.	*			trans	-142.3	77.5	-173	-62.7	-179.9	0	0	0	110.4	S532 N706	S532-I534 PolarHBondContact O-N 2.77Å; I534-N706 HydrophobicContact CB-CB 4.08Å; I534-N706 HydrophobicContact CG2-CB 3.58Å; I534-N706 WeakPolarHBondContact CG2-ND2 3.11Å
535	A	27.3	Very low	27.8	Very low	3 Å²	3	110 Å²	110	3%	0.025	63%	0.632	C	S	.	*			trans	-76.6	119.6	170.9	0	0	0	0	0	112.7	V524 Q525 N706 G707	V524-A535 HydrophobicContact CG1-CB 3.58Å; Q525-A535 VanDerWaalsContact O-CB 3.23Å; Q525-A535 WeakPolarHBondContact O-CB 3.18Å; A535-N706 WeakPolarHBondContact CA-O 3.45Å; A535-N706 WeakPolarHBondContact CB-O 3.43Å; A535-N706 PolarHBondContact N-O 2.68Å; A535-N706 CarbonylContact O-C 3.57Å; A535-N706 WeakPolarHBondContact O-CA 3.2Å; A535-N706 WeakPolarHBondContact O-CB 3.29Å; A535-N706 PolarHBondContact O-ND2 3.26Å; A535-G707 PolarHBondContact O-N 3.35Å
536	K	24.9	Very low	26.8	Very low	172 Å²	172	106.5 Å²	106.5	75%	0.748	63%	0.633	S	S	*	*			trans	-82.6	119.4	168.8	-80.7	177.1	178.6	163.9	0	109.7	R538 N706	K536-R538 PolarHBondContact O-N 3.24Å; K536-R538 VanDerWaalsContact O-N 3.07Å; K536-N706 VanDerWaalsContact CG-ND2 3.32Å; K536-N706 WeakPolarHBondContact CG-ND2 3.39Å
537	G	26.8	Very low	26.1	Very low	75 Å²	75	108.4 Å²	108.4	77%	0.773	64%	0.642	S	S	*	*			trans	-65.6	105.8	167.3	0	0	0	0	0	111
538	R	25.4	Very low	25.9	Very low	185 Å²	185	106.8 Å²	106.8	70%	0.698	65%	0.649	S	S	*	*			trans	-141.4	110.6	173.2	-167.9	178.1	-168.3	-179	-0.2	109.6	K536 A540	K536-R538 PolarHBondContact O-N 3.24Å; K536-R538 VanDerWaalsContact O-N 3.07Å; R538-A540 PolarHBondContact O-N 3.44Å
539	T	30.2	Very low	25.8	Very low	32 Å²	32	108.3 Å²	108.3	20%	0.196	66%	0.659	C	S	.	*			trans	-80.7	99.5	-178.2	39.2	0	0	0	0	111.3	Y595 L598	T539-Y595 PolarHBondContact OG1-O 2.84Å; T539-Y595 VanDerWaalsContact OG1-O 3.1Å; T539-L598 HydrophobicContact CG2-CB 4.03Å; T539-L598 HydrophobicContact CG2-CD1 4.26Å
540	A	27.6	Very low	25.8	Very low	93 Å²	93	107.9 Å²	107.9	77%	0.769	66%	0.662	S	S	*	*			trans	-92.5	99.8	167.9	0	0	0	0	0	109.6	R538 C542	R538-A540 PolarHBondContact O-N 3.44Å; A540-C542 PolarHBondContact O-N 3.35Å
541	S	27.3	Very low	25.8	Very low	81 Å²	81	112.8 Å²	112.8	57%	0.566	67%	0.668	S	S	*	*			trans	-95.4	68	177.3	61.5	0	0	0	0	111.1
542	C	24.1	Very low	25.9	Very low	107 Å²	107	111.9 Å²	111.9	72%	0.723	66%	0.664	S	S	*	*			trans	-152.6	77.6	177.2	-91.1	0	0	0	0	111.6	A540	A540-C542 PolarHBondContact O-N 3.35Å
543	D	25	Very low	25.9	Very low	157 Å²	157	113.8 Å²	113.8	84%	0.84	68%	0.677	S	S	*	*			trans	-112.2	109.7	155.8	-89	-48.3	0	0	0	108.5
544	I	25.2	Very low	26	Very low	154 Å²	154	118.8 Å²	118.8	79%	0.79	69%	0.693	S	S	*	*			trans	-104.1	94.6	171.9	-60.1	176.1	0	0	0	106.8	G546	I544-G546 PolarHBondContact O-N 3.06Å
545	I	25.1	Very low	25.9	Very low	150 Å²	150	121.1 Å²	121.1	77%	0.769	71%	0.706	S	S	*	*			trans	-75.6	72.9	171.1	-54	-178.9	0	0	0	108.2	I547	I545-I547 PolarHBondContact O-N 3.09Å
546	G	25.3	Very low	25.8	Very low	64 Å²	64	126.6 Å²	126.6	66%	0.66	74%	0.741	S	S	*	*			trans	-81.5	93.4	-175.8	0	0	0	0	0	112.6	I544	I544-G546 PolarHBondContact O-N 3.06Å
547	I	26	Very low	25.8	Very low	130 Å²	130	122.4 Å²	122.4	67%	0.667	75%	0.747	S	S	*	*			trans	-124.6	103.6	164.8	-54.7	173.2	0	0	0	109.1	I545	I545-I547 PolarHBondContact O-N 3.09Å
548	G	27.9	Very low	25.7	Very low	67 Å²	67	127.3 Å²	127.3	69%	0.691	75%	0.747	S	S	*	*	S	Bend	trans	70.6	97.2	159.7	0	0	0	0	0	118.2
549	N	27	Very low	25.7	Very low	172 Å²	172	122.2 Å²	122.2	92%	0.92	74%	0.74	S	S	*	*			trans	33.4	91.9	146.1	-59.5	-4	0	0	0	119.3
550	S	27.2	Very low	25.5	Very low	128 Å²	128	125.8 Å²	125.8	90%	0.895	77%	0.766	S	S	*	*			trans	-153.9	172	147.1	-160.8	0	0	0	0	111.8
551	M	24.2	Very low	25.3	Very low	171 Å²	171	124.1 Å²	124.1	84%	0.842	76%	0.757	S	S	*	*			trans	-91.9	165.7	-163.9	-68	-177.3	69.2	0	0	115.7
552	H	25.3	Very low	25.1	Very low	173 Å²	173	127.9 Å²	127.9	80%	0.801	77%	0.766	S	S	*	*			trans	-43.5	145.3	-175	-56.5	-86.4	0	0	0	118
553	S	23.9	Very low	25.2	Very low	116 Å²	116	131.2 Å²	131.2	81%	0.811	77%	0.768	S	S	*	*			trans	-153.6	140.1	137.5	-82.4	0	0	0	0	110.8
554	L	24.7	Very low	25.2	Very low	177 Å²	177	130.8 Å²	130.8	93%	0.927	77%	0.765	S	S	*	*			trans	-97	95.6	179.4	-75.7	167.8	0	0	0	110.3
555	L	22.8	Very low	25.1	Very low	137 Å²	137	126.2 Å²	126.2	72%	0.717	76%	0.755	S	S	*	*			trans	-139.2	155	171.5	-75.2	175	0	0	0	109.5	G557	L555-G557 PolarHBondContact O-N 2.83Å
556	P	26.3	Very low	25.1	Very low	117 Å²	117	126.1 Å²	126.1	76%	0.76	76%	0.756	S	S	*	*			trans	-58.4	136.5	170.4	26.2	-34.2	0	0	0	110	K558	P556-K558 PolarHBondContact O-N 2.91Å; P556-K558 VanDerWaalsContact O-N 3.12Å
557	G	25.1	Very low	25.2	Very low	84 Å²	84	132.3 Å²	132.3	87%	0.866	77%	0.768	S	S	*	*			trans	-62.7	112.7	-172.7	0	0	0	0	0	112.2	L555	L555-G557 PolarHBondContact O-N 2.83Å
558	K	24.6	Very low	25.2	Very low	179 Å²	179	134 Å²	134	78%	0.778	78%	0.777	S	S	*	*			trans	-66.8	135.9	169.1	-62.5	-177.6	178	-175.5	0	108.9	P556 S560	P556-K558 PolarHBondContact O-N 2.91Å; P556-K558 VanDerWaalsContact O-N 3.12Å; K558-S560 PolarHBondContact O-N 2.98Å
559	S	25.8	Very low	25.1	Very low	78 Å²	78	136.3 Å²	136.3	55%	0.545	77%	0.773	S	S	.	*			trans	-78	87.7	173.6	-166.3	0	0	0	0	109.7	I516	I516-S559 WeakPolarHBondContact O-CB 3.24Å
560	S	24.6	Very low	25.1	Very low	107 Å²	107	133.7 Å²	133.7	75%	0.748	77%	0.768	S	S	*	*			trans	-75.6	123.5	168.7	53.9	0	0	0	0	109.6	K558	K558-S560 PolarHBondContact O-N 2.98Å
561	G	24.9	Very low	25	Very low	57 Å²	57	137.3 Å²	137.3	59%	0.588	76%	0.762	S	S	*	*			trans	-72.7	-174.9	170	0	0	0	0	0	113.2
562	E	23	Very low	25.2	Very low	161 Å²	161	137.5 Å²	137.5	75%	0.752	77%	0.765	S	S	*	*			trans	68.9	111.1	171.3	-161	-177.7	-177.4	0	0	118.4	I564	E562-I564 HydrophobicContact CG-CG1 4.3Å; E562-I564 WeakPolarHBondContact OE1-CD1 3.5Å
563	K	25.5	Very low	25.2	Very low	177 Å²	177	134.1 Å²	134.1	77%	0.77	76%	0.758	S	S	*	*				-139.5	136.5	121.2	-81.4	-150.5	173.4	-172.4	0	110.4
564	I	24.5	Very low	25.2	Very low	148 Å²	148	135.4 Å²	135.4	76%	0.759	76%	0.756	S	S	*	*			trans	-90.8	146.4	179.8	-66	168.1	0	0	0	110.3	E562	E562-I564 HydrophobicContact CG-CG1 4.3Å; E562-I564 WeakPolarHBondContact OE1-CD1 3.5Å
565	G	24	Very low	25.3	Very low	57 Å²	57	132.5 Å²	132.5	59%	0.588	75%	0.745	S	S	*	*			trans	99.4	144.6	166.3	0	0	0	0	0	115
566	N	24.9	Very low	25.3	Very low	149 Å²	149	132.2 Å²	132.2	80%	0.797	75%	0.75	S	S	*	*			cis	-143.6	-174.6	-0.9	-79.8	-30	0	0	0	110
567	E	26.2	Very low	25.2	Very low	193 Å²	193	134.8 Å²	134.8	90%	0.902	75%	0.752	S	S	*	*			trans	-24.2	134.6	175.2	-61.8	166.2	110.6	0	0	117.1
568	I	27.5	Very low	25.1	Very low	167 Å²	167	135.4 Å²	135.4	86%	0.856	75%	0.748	S	S	*	*			trans	-114.7	112.4	161.8	-59.6	179.5	0	0	0	107.5
569	D	26.2	Very low	25	Very low	114 Å²	114	135 Å²	135	61%	0.61	75%	0.754	S	S	*	*			trans	-59.8	139.4	178.2	177.7	27.5	0	0	0	111.6	R571	D569-R571 VanDerWaalsContact C-N 3.25Å; D569-R571 PolarHBondContact O-N 2.92Å
570	S	25.4	Very low	24.7	Very low	118 Å²	118	140.4 Å²	140.4	83%	0.825	77%	0.767	S	S	*	*	S	Bend	trans	-81.4	64.3	-178.8	58.8	0	0	0	0	112
571	R	25.2	Very low	24.7	Very low	204 Å²	204	141.4 Å²	141.4	77%	0.77	77%	0.769	S	S	*	*			trans	-131.8	124.7	166.5	-67.5	-171.9	-175.2	-116.1	-1.7	111.2	D569 P573	D569-R571 VanDerWaalsContact C-N 3.25Å; D569-R571 PolarHBondContact O-N 2.92Å; R571-P573 WeakPolarHBondContact O-CD 3.4Å
572	I	28.3	Very low	24.7	Very low	174 Å²	174	144.4 Å²	144.4	89%	0.892	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-88.6	120.7	173.5	-58.6	171.1	0	0	0	108.4
573	P	25.1	Very low	24.7	Very low	102 Å²	102	141.3 Å²	141.3	66%	0.662	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-90.4	146.9	160.6	7.2	13.1	0	0	0	110.4	R571	R571-P573 WeakPolarHBondContact O-CD 3.4Å
574	D	24.4	Very low	24.7	Very low	143 Å²	143	138.9 Å²	138.9	77%	0.765	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-64.4	137	175.5	-170.9	-3.3	0	0	0	111.5	T576	D574-T576 PolarHBondContact OD1-OG1 2.03Å
575	V	27	Very low	24.7	Very low	116 Å²	116	137.3 Å²	137.3	70%	0.703	77%	0.771	S	S	*	*			trans	-131.2	83.2	-180	-175	0	0	0	0	110.4	E577	V575-E577 VanDerWaalsContact C-N 3.3Å; V575-E577 HydrophobicContact CG1-CB 4.44Å; V575-E577 PolarHBondContact O-N 2.77Å
576	T	23.3	Very low	24.8	Very low	132 Å²	132	147 Å²	147	81%	0.81	79%	0.79	S	S	*	*			trans	-93.7	50.2	166.9	-50.4	0	0	0	0	110.8	D574	D574-T576 PolarHBondContact OD1-OG1 2.03Å
577	E	23.2	Very low	25	Very low	171 Å²	171	142.6 Å²	142.6	80%	0.799	78%	0.78	S	S	*	*			trans	-122.9	129.1	177.1	-73.6	-143.7	131.2	0	0	113.6	V575 L579	V575-E577 VanDerWaalsContact C-N 3.3Å; V575-E577 HydrophobicContact CG1-CB 4.44Å; V575-E577 PolarHBondContact O-N 2.77Å; E577-L579 PolarHBondContact O-N 2.83Å
578	A	22.5	Very low	25	Very low	96 Å²	96	142.2 Å²	142.2	79%	0.793	78%	0.784	S	S	*	*			trans	-86.6	109.2	179.3	0	0	0	0	0	111.8	K580	A578-K580 PolarHBondContact O-N 3.03Å
579	L	22.7	Very low	25.1	Very low	170 Å²	170	138.1 Å²	138.1	89%	0.89	77%	0.77	S	S	*	*			trans	-56.3	99.5	177.8	-90.5	159.9	0	0	0	113.2	E577 T581	E577-L579 PolarHBondContact O-N 2.83Å; L579-T581 PolarHBondContact O-N 2.94Å
580	K	20.3	Very low	25	Very low	192 Å²	192	139.9 Å²	139.9	84%	0.835	79%	0.786	S	S	*	*			trans	-73.6	105.3	168.8	-75.3	172.2	179.6	163.9	0	110.1	A578 V582	A578-K580 PolarHBondContact O-N 3.03Å; K580-V582 PolarHBondContact O-N 3.28Å
581	T	25.6	Very low	25.1	Very low	129 Å²	129	141.5 Å²	141.5	79%	0.791	78%	0.78	S	S	*	*			trans	-69.5	101.8	172.1	59.1	0	0	0	0	110.8	L579	L579-T581 PolarHBondContact O-N 2.94Å
582	V	23.6	Very low	25.2	Very low	119 Å²	119	140 Å²	140	72%	0.721	78%	0.781	S	S	*	*			trans	-84.7	134.5	172	-176.3	0	0	0	0	109.1	K580	K580-V582 PolarHBondContact O-N 3.28Å
583	P	23.6	Very low	25.4	Very low	96 Å²	96	138.2 Å²	138.2	62%	0.623	77%	0.769	S	S	*	*			trans	-68	147.9	173.7	29.3	-35	0	0	0	111.4	T585	P583-T585 PolarHBondContact O-N 2.91Å
584	C	24.3	Very low	25.8	Very low	127 Å²	127	142.6 Å²	142.6	86%	0.858	78%	0.78	S	S	*	*			trans	-67.2	98.9	-176.5	-56.6	0	0	0	0	112
585	T	25.8	Very low	26.7	Very low	115 Å²	115	142 Å²	142	71%	0.706	77%	0.768	S	S	*	*			trans	-133.7	76.4	-179.2	59	0	0	0	0	114.1	P583	P583-T585 PolarHBondContact O-N 2.91Å
586	R	26.4	Very low	27.5	Very low	260 Å²	260	141.1 Å²	141.1	98%	0.981	76%	0.76	S	S	*	*			trans	-164.6	125.2	141.1	-121.4	174.8	179.6	164.5	0.2	112.8
587	G	28.3	Very low	29.6	Very low	57 Å²	57	141.4 Å²	141.4	59%	0.588	75%	0.752	S	S	*	*			trans	159.1	111.8	175.4	0	0	0	0	0	110.3	S589	G587-S589 PolarHBondContact O-N 2.83Å
588	N	26.2	Very low	32.1	Very low	184 Å²	184	135.1 Å²	135.1	98%	0.984	72%	0.723	S	S	*	*			trans	-76.2	89.9	-178	-81.8	-4.7	0	0	0	110.9
589	S	29.3	Very low	34.9	Very low	82 Å²	82	130.6 Å²	130.6	57%	0.573	69%	0.686	S	S	*	*			trans	-141.1	127.2	161.2	61.6	0	0	0	0	109.4	G587 E591	G587-S589 PolarHBondContact O-N 2.83Å; S589-E591 PolarHBondContact O-N 2.95Å; S589-E591 VanDerWaalsContact O-N 3.12Å
590	T	25.5	Very low	37.6	Very low	151 Å²	151	122.9 Å²	122.9	93%	0.926	65%	0.648	S	S	*	*	S	Bend	trans	-89	46.9	-172.7	48.6	0	0	0	0	112.2
591	E	27.4	Very low	40.5	Very low	151 Å²	151	113.9 Å²	113.9	71%	0.706	61%	0.609	S	S	*	*			trans	-148.1	48.6	-173.2	-130.6	156.4	-128.3	0	0	113.1	S589 H593	S589-E591 PolarHBondContact O-N 2.95Å; S589-E591 VanDerWaalsContact O-N 3.12Å; E591-H593 PolarHBondContact O-N 2.84Å
592	H	26.4	Very low	43.1	Very low	172 Å²	172	107.8 Å²	107.8	80%	0.796	57%	0.572	S	S	*	*			trans	-65.6	95.2	170.6	-79.7	-66.2	0	0	0	111.4
593	H	32.8	Very low	45.6	Very low	137 Å²	137	102.4 Å²	102.4	63%	0.634	54%	0.54	S	S	*	.			trans	-66.1	143.9	171.6	-75.7	-75.5	0	0	0	112.4	E591 Y595	E591-H593 PolarHBondContact O-N 2.84Å; H593-Y595 HydrophobicContact CB-CD2 3.84Å; H593-Y595 HydrophobicContact CB-CE2 3.54Å; H593-Y595 PolarHBondContact O-N 2.04Å
594	Q	34.1	Very low	48.8	Very low	194 Å²	194	97.8 Å²	97.8	91%	0.907	51%	0.51	S	S	*	.			trans	-91.1	54.7	-153.6	-161.3	173.2	-0.7	0	0	114.1
595	Y	42.8	Very low	52	Low	130 Å²	130	92 Å²	92	51%	0.51	47%	0.471	S	S	.	.			trans	-89.1	1	-169.1	-69.6	-69.8	0	0	0	117.1	T539 H593 H597	T539-Y595 PolarHBondContact OG1-O 2.84Å; T539-Y595 VanDerWaalsContact OG1-O 3.1Å; H593-Y595 HydrophobicContact CB-CD2 3.84Å; H593-Y595 HydrophobicContact CB-CE2 3.54Å; H593-Y595 PolarHBondContact O-N 2.04Å; Y595-H597 PolarHBondContact O-N 3.29Å
596	D	43.8	Very low	55.2	Low	98 Å²	98	86.6 Å²	86.6	52%	0.524	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-16.1	-174.2	-108.4	-56.7	0	0	0	115.7
597	H	67.1	Low	58.3	Low	138 Å²	138	74.6 Å²	74.6	64%	0.639	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.2	61.6	-167.7	-60.5	-19.4	0	0	0	113.5	Y595 W789	Y595-H597 PolarHBondContact O-N 3.29Å; H597-W789 WeakPolarHBondContact O-CZ2 3.45Å; H597-W789 PolarHBondContact O-NE1 3.1Å
598	L	76	Confident	61.2	Low	39 Å²	39	73.6 Å²	73.6	20%	0.204	37%	0.373	C	S	.	.			trans	-85	162	167	-73.9	173	0	0	0	112.2	T539 F727	T539-L598 HydrophobicContact CG2-CB 4.03Å; T539-L598 HydrophobicContact CG2-CD1 4.26Å; L598-F727 HydrophobicContact CD2-CE2 4.29Å; L598-F727 HydrophobicContact CD2-CZ 4.05Å
599	P	81.4	Confident	64.1	Low	1 Å²	1	65.8 Å²	65.8	1%	0.006	33%	0.332	C	S	.	.			trans	-77.4	147.6	178.7	31	-32.1	0	0	0	112.1	F711 F727 R739 W789	P599-F711 HydrophobicContact CB-CE1 4.09Å; P599-F711 HydrophobicContact CB-CZ 4.31Å; P599-F727 HydrophobicContact CG-CB 4Å; P599-F727 HydrophobicContact CG-CD2 4.16Å; P599-F727 HydrophobicContact CG-CG 4.1Å; P599-R739 PolarHBondContact O-NE 2.82Å; P599-R739 PolarHBondContact O-NH2 2.75Å; P599-W789 HydrophobicContact CB-CD2 4Å; P599-W789 HydrophobicContact CB-CE3 4.41Å; P599-W789 HydrophobicContact CB-CG 4.07Å; P599-W789 HydrophobicContact CG-CD2 4.25Å; P599-W789 HydrophobicContact CG-CE3 4.36Å
600	G	78.3	Confident	66.7	Low	9 Å²	9	66 Å²	66	9%	0.093	33%	0.333	C	S	.	.			trans	-86.3	-171.2	175.9	0	0	0	0	0	114.4	S729	G600-S729 PolarHBondContact O-OG 2.83Å
601	A	81.8	Confident	69.4	Low	2 Å²	2	62.6 Å²	62.6	2%	0.017	33%	0.328	C	S	.	.			trans	-77.4	136.7	-178.1	0	0	0	0	0	112.1	I522 G603 Q709 S729 P737	I522-A601 HydrophobicContact CD1-CB 4.27Å; I522-A601 HydrophobicContact CG2-CB 4.38Å; A601-G603 VanDerWaalsContact C-N 3.35Å; A601-Q709 PolarHBondContact O-N 3.23Å; A601-S729 VanDerWaalsContact CA-OG 3.31Å; A601-S729 WeakPolarHBondContact CA-OG 3.39Å; A601-P737 HydrophobicContact CB-CB 3.73Å; A601-P737 HydrophobicContact CB-CG 4.41Å
602	S	79.3	Confident	71.8	Confident	2 Å²	2	60.9 Å²	60.9	1%	0.014	33%	0.333	C	S	.	.			trans	-71	-31.4	172.1	-164.4	0	0	0	0	112.2	V604 G620 T621 V708 S729 P780	S602-V604 VanDerWaalsContact C-N 3.28Å; S602-V604 WeakPolarHBondContact O-CG2 3.45Å; S602-V604 PolarHBondContact O-N 2.8Å; S602-V604 VanDerWaalsContact O-N 3.09Å; S602-G620 PolarHBondContact OG-O 2.89Å; S602-T621 PolarHBondContact OG-OG1 3.36Å; S602-V708 WeakPolarHBondContact O-CG1 3.37Å; S602-S729 PolarHBondContact N-OG 2.79Å; S602-P780 WeakPolarHBondContact OG-CD 3.41Å; S602-P780 WeakPolarHBondContact OG-CG 3.4Å
603	G	77.9	Confident	74.5	Confident	5 Å²	5	55.8 Å²	55.8	5%	0.052	32%	0.317	C	S	.	.			trans	51.4	35.5	165.1	0	0	0	0	0	116.5	A601 I653 G654	A601-G603 VanDerWaalsContact C-N 3.35Å; G603-I653 WeakPolarHBondContact O-CA 3.42Å; G603-G654 CarbonylContact C-O 3.58Å; G603-G654 VanDerWaalsContact C-O 3.28Å; G603-G654 WeakPolarHBondContact CA-O 3.25Å; G603-G654 PolarHBondContact O-N 2.94Å; G603-G654 VanDerWaalsContact O-O 3.13Å
604	V	89.2	Confident	76.9	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	120.5	179.9	172.3	0	0	0	0	108.4	S602 T619 G620 L622 V634 V651 Y652 I653 V708	S602-V604 VanDerWaalsContact C-N 3.28Å; S602-V604 WeakPolarHBondContact O-CG2 3.45Å; S602-V604 PolarHBondContact O-N 2.8Å; S602-V604 VanDerWaalsContact O-N 3.09Å; V604-T619 WeakPolarHBondContact O-CG2 3.33Å; V604-G620 PolarHBondContact O-N 3.07Å; V604-L622 HydrophobicContact CG2-CB 4.07Å; V604-V634 HydrophobicContact CG1-CG1 3.72Å; V604-V634 HydrophobicContact CG1-CG2 4.14Å; V604-V651 HydrophobicContact CG1-CG1 3.64Å; V604-Y652 WeakPolarHBondContact CA-O 3.48Å; V604-I653 HydrophobicContact CG2-CD1 4.15Å; V604-I653 HydrophobicContact CG2-CG1 4.11Å; V604-I653 HydrophobicContact CG2-CG2 4.25Å; V604-V708 HydrophobicContact CG2-CG1 4.33Å
605	H	91.4	Very high	79.5	Confident	6 Å²	6	46.8 Å²	46.8	3%	0.028	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	134.2	-174.8	-60.1	-72.6	0	0	0	110.5	F607 V651 Y652 L657	H605-F607 HydrophobicContact CB-CE2 4.06Å; H605-V651 WeakPolarHBondContact O-CA 3.45Å; H605-Y652 PolarHBondContact N-O 2.96Å; H605-Y652 PolarHBondContact O-N 2.91Å; H605-L657 HydrophobicContact CB-CD1 3.93Å
606	I	93	Very high	81.6	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	128.1	-169.6	-59.6	167.1	0	0	0	108.6	L617 C618 T636 V641 V651 L696	I606-L617 PolarHBondContact O-N 3.35Å; I606-C618 PolarHBondContact N-O 3.25Å; I606-C618 PolarHBondContact O-N 3.1Å; I606-T636 HydrophobicContact CD1-CG2 3.67Å; I606-V641 HydrophobicContact CG2-CG2 4.03Å; I606-V651 HydrophobicContact CG1-CG2 4.32Å; I606-L696 HydrophobicContact CD1-CD1 3.85Å; I606-L696 HydrophobicContact CG1-CD1 4.19Å; I606-L696 HydrophobicContact CG2-CD1 4.44Å
607	F	91.3	Very high	83.8	Confident	9 Å²	9	40.3 Å²	40.3	4%	0.039	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	144.8	-176.7	-70	-98.2	0	0	0	111.1	H605 I614 E615 P616 Y649 Q650 L657 L666 L670	H605-F607 HydrophobicContact CB-CE2 4.06Å; F607-I614 HydrophobicContact CB-CG2 4.24Å; F607-I614 HydrophobicContact CD1-CG2 3.51Å; F607-I614 HydrophobicContact CE1-CG2 4.09Å; F607-I614 HydrophobicContact CG-CG2 4.12Å; F607-E615 CarbonylContact C-O 3.45Å; F607-E615 VanDerWaalsContact CA-O 3.24Å; F607-E615 WeakPolarHBondContact CA-O 3.41Å; F607-P616 HydrophobicContact CD1-CB 3.95Å; F607-P616 HydrophobicContact CE1-CB 3.64Å; F607-P616 HydrophobicContact CE1-CG 4.34Å; F607-P616 HydrophobicContact CZ-CB 4.25Å; F607-Y649 WeakPolarHBondContact O-CA 3.39Å; F607-Q650 PolarHBondContact N-O 2.96Å; F607-Q650 PolarHBondContact O-N 3.45Å; F607-L657 HydrophobicContact CE2-CD1 4.22Å; F607-L657 HydrophobicContact CZ-CD1 3.78Å; F607-L666 HydrophobicContact CE1-CD2 4.22Å; F607-L666 HydrophobicContact CZ-CD2 4.47Å; F607-L670 HydrophobicContact CD2-CD2 3.6Å; F607-L670 HydrophobicContact CE2-CD2 3.96Å; F607-L670 HydrophobicContact CG-CD2 4.21Å
608	L	89.3	Confident	85	Confident	36 Å²	36	34 Å²	34	19%	0.188	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	128.4	162.5	-178.4	60.6	0	0	0	108.7	E615 L617 N647 Y649	L608-E615 PolarHBondContact N-O 3.12Å; L608-E615 PolarHBondContact O-N 2.95Å; L608-L617 HydrophobicContact CB-CD1 3.91Å; L608-L617 HydrophobicContact CB-CD2 4.14Å; L608-L617 HydrophobicContact CB-CG 3.98Å; L608-N647 HydrophobicContact CD1-CB 3.74Å; L608-Y649 HydrophobicContact CD1-CD1 4.36Å; L608-Y649 HydrophobicContact CD1-CE1 4.17Å
609	V	87.1	Confident	85.8	Confident	20 Å²	20	32.1 Å²	32.1	12%	0.121	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	120.8	174.4	-177	0	0	0	0	109.9	S613 I614 K648 Q650 L670	V609-S613 WeakPolarHBondContact CA-O 3.19Å; V609-I614 HydrophobicContact CG1-CG1 4.46Å; V609-I614 HydrophobicContact CG2-CG1 4.28Å; V609-I614 HydrophobicContact CG2-CG2 4.49Å; V609-K648 PolarHBondContact N-O 2.89Å; V609-Q650 HydrophobicContact CG2-CB 4.26Å; V609-Q650 HydrophobicContact CG2-CG 3.92Å; V609-L670 HydrophobicContact CG2-CD1 4.44Å
610	S	84.9	Confident	86.3	Confident	85 Å²	85	32 Å²	32	59%	0.594	21%	0.213	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-134	103	-177.2	-170.8	0	0	0	0	109.8	S612 S613	S610-S612 PolarHBondContact O-N 2.88Å; S610-S613 PolarHBondContact N-O 3.4Å; S610-S613 WeakPolarHBondContact O-CB 3.41Å; S610-S613 PolarHBondContact O-N 3.19Å
611	G	81.7	Confident	86.9	Confident	80 Å²	80	31.6 Å²	31.6	83%	0.825	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	61	-115.8	-169.7	0	0	0	0	0	110.9
612	S	78.8	Confident	87.2	Confident	116 Å²	116	31.6 Å²	31.6	81%	0.811	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97	-0.3	173.4	57.7	0	0	0	0	114.1	S610	S610-S612 PolarHBondContact O-N 2.88Å
613	S	82.6	Confident	87.6	Confident	65 Å²	65	33.4 Å²	33.4	46%	0.455	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	138	175.7	-168.5	0	0	0	0	111	V609 S610	V609-S613 WeakPolarHBondContact CA-O 3.19Å; S610-S613 PolarHBondContact N-O 3.4Å; S610-S613 WeakPolarHBondContact O-CB 3.41Å; S610-S613 PolarHBondContact O-N 3.19Å
614	I	83.9	Confident	87.8	Confident	34 Å²	34	34.4 Å²	34.4	17%	0.174	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	105	177.6	-58.8	175.9	0	0	0	107.3	F607 V609 A663 L666 N667 L670	F607-I614 HydrophobicContact CB-CG2 4.24Å; F607-I614 HydrophobicContact CD1-CG2 3.51Å; F607-I614 HydrophobicContact CE1-CG2 4.09Å; F607-I614 HydrophobicContact CG-CG2 4.12Å; V609-I614 HydrophobicContact CG1-CG1 4.46Å; V609-I614 HydrophobicContact CG2-CG1 4.28Å; V609-I614 HydrophobicContact CG2-CG2 4.49Å; I614-A663 HydrophobicContact CD1-CB 4.25Å; I614-A663 WeakPolarHBondContact CD1-O 3.37Å; I614-L666 HydrophobicContact CG2-CD2 3.87Å; I614-N667 HydrophobicContact CD1-CB 3.97Å; I614-L670 HydrophobicContact CD1-CD1 4.33Å; I614-L670 HydrophobicContact CG2-CD1 3.82Å
615	E	86.9	Confident	87.1	Confident	107 Å²	107	37.3 Å²	37.3	50%	0.5	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	122.4	-174.1	-174	177.5	-179.5	0	0	111.1	F607 L608 L617	F607-E615 CarbonylContact C-O 3.45Å; F607-E615 VanDerWaalsContact CA-O 3.24Å; F607-E615 WeakPolarHBondContact CA-O 3.41Å; L608-E615 PolarHBondContact N-O 3.12Å; L608-E615 PolarHBondContact O-N 2.95Å; E615-L617 PolarHBondContact O-N 3.45Å
616	P	87.1	Confident	86.1	Confident	38 Å²	38	48.5 Å²	48.5	25%	0.247	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	114.9	175.4	29	-33.1	0	0	0	110.8	F607 Y775	F607-P616 HydrophobicContact CD1-CB 3.95Å; F607-P616 HydrophobicContact CE1-CB 3.64Å; F607-P616 HydrophobicContact CE1-CG 4.34Å; F607-P616 HydrophobicContact CZ-CB 4.25Å; P616-Y775 HydrophobicContact CB-CD2 4.1Å; P616-Y775 HydrophobicContact CB-CE2 3.63Å; P616-Y775 HydrophobicContact CG-CE1 4.45Å; P616-Y775 HydrophobicContact CG-CE2 3.69Å; P616-Y775 WeakPolarHBondContact CG-OH 3.23Å
617	L	89.9	Confident	85	Confident	54 Å²	54	52.3 Å²	52.3	28%	0.283	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	-53.1	-178.4	-64.7	-177.5	0	0	0	112.7	I606 L608 E615 Y649	I606-L617 PolarHBondContact O-N 3.35Å; L608-L617 HydrophobicContact CB-CD1 3.91Å; L608-L617 HydrophobicContact CB-CD2 4.14Å; L608-L617 HydrophobicContact CB-CG 3.98Å; E615-L617 PolarHBondContact O-N 3.45Å; L617-Y649 HydrophobicContact CD1-CD1 4.2Å; L617-Y649 HydrophobicContact CD1-CE1 3.94Å
618	C	93.3	Very high	84.3	Confident	5 Å²	5	56 Å²	56	3%	0.034	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.7	167.7	-160.9	35.1	0	0	0	0	112.9	I606 C640 I777	I606-C618 PolarHBondContact N-O 3.25Å; I606-C618 PolarHBondContact O-N 3.1Å; C618-C640 HydrophobicContact CB-CB 3.59Å; C618-C640 WeakPolarHBondContact CB-SG 3.31Å; C618-C640 WeakPolarHBondContact SG-CB 3.43Å; C618-C640 CovalentContact SG-SG 2.02Å; C618-C640 PolarHBondContact SG-SG 2.94Å; C618-I777 HydrophobicContact CB-CB 4.38Å; C618-I777 VanDerWaalsContact CB-O 3.26Å; C618-I777 WeakPolarHBondContact CB-O 3.1Å
619	T	92.6	Very high	83.7	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	164.4	173.8	-58.7	0	0	0	0	110.1	V604 T636 Y775 I777 G778 S779	V604-T619 WeakPolarHBondContact O-CG2 3.33Å; T619-T636 PolarHBondContact O-OG1 2.91Å; T619-Y775 PolarHBondContact N-O 2.71Å; T619-Y775 PolarHBondContact OG1-O 2.85Å; T619-I777 PolarHBondContact N-O 3.21Å; T619-G778 CarbonylContact O-C 3.57Å; T619-G778 VanDerWaalsContact O-CA 3.29Å; T619-G778 WeakPolarHBondContact O-CA 3.32Å; T619-S779 VanDerWaalsContact CB-OG 3.24Å; T619-S779 WeakPolarHBondContact CB-OG 3Å; T619-S779 WeakPolarHBondContact CG2-OG 3.04Å; T619-S779 PolarHBondContact OG1-OG 3.07Å
620	G	92	Very high	83.5	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	37%	0.367	C	S	.	.			trans	-144.7	-168.9	168.7	0	0	0	0	0	112.2	S602 V604 V635	S602-G620 PolarHBondContact OG-O 2.89Å; V604-G620 PolarHBondContact O-N 3.07Å; G620-V635 WeakPolarHBondContact CA-O 3.46Å
621	T	91.6	Very high	83.5	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	132.6	173.1	-44.4	0	0	0	0	110.2	S602 Y623 V634 V635 F711 P780 Q791	S602-T621 PolarHBondContact OG-OG1 3.36Å; T621-Y623 PolarHBondContact O-N 3.34Å; T621-V634 WeakPolarHBondContact O-CA 3.5Å; T621-V635 PolarHBondContact N-O 3.21Å; T621-V635 PolarHBondContact O-N 3.42Å; T621-F711 HydrophobicContact CG2-CD2 4.05Å; T621-P780 HydrophobicContact CG2-CB 4.48Å; T621-P780 WeakPolarHBondContact OG1-CB 3.41Å; T621-P780 WeakPolarHBondContact OG1-CD 3.25Å; T621-Q791 PolarHBondContact OG1-NE2 3.38Å
622	L	88.4	Confident	83.9	Confident	2 Å²	2	57.5 Å²	57.5	1%	0.01	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	120.2	171.8	-171.3	66.5	0	0	0	109.5	V604 V634 I653 V704 P710	V604-L622 HydrophobicContact CG2-CB 4.07Å; L622-V634 HydrophobicContact CD1-CG2 3.94Å; L622-I653 HydrophobicContact CD1-CD1 4.04Å; L622-V704 HydrophobicContact CD2-CG2 4.28Å; L622-P710 WeakPolarHBondContact O-CA 3.23Å; L622-P710 WeakPolarHBondContact O-CB 3.09Å
623	Y	86.9	Confident	84.4	Confident	40 Å²	40	52.2 Å²	52.2	16%	0.157	27%	0.268	C	S	.	.			trans	-92.4	105.7	176.6	175.7	-102.4	0	0	0	109.9	T621 K625 S631 E633 L713 V830	T621-Y623 PolarHBondContact O-N 3.34Å; Y623-K625 HydrophobicContact CD1-CG 4.49Å; Y623-K625 HydrophobicContact CE1-CD 4.43Å; Y623-K625 HydrophobicContact CE1-CG 3.7Å; Y623-S631 WeakPolarHBondContact O-CB 3.07Å; Y623-S631 PolarHBondContact O-OG 2.95Å; Y623-E633 HydrophobicContact CD1-CB 4.21Å; Y623-E633 WeakPolarHBondContact CD1-OE2 3.47Å; Y623-E633 PolarHBondContact N-O 2.95Å; Y623-L713 HydrophobicContact CD2-CD1 4Å; Y623-L713 HydrophobicContact CD2-CG 4.12Å; Y623-L713 HydrophobicContact CE2-CD1 3.52Å; Y623-L713 HydrophobicContact CE2-CG 3.79Å; Y623-V830 HydrophobicContact CD1-CB 4.37Å; Y623-V830 HydrophobicContact CD1-CG1 3.62Å; Y623-V830 HydrophobicContact CD2-CG2 4.43Å; Y623-V830 HydrophobicContact CE1-CB 4.03Å; Y623-V830 HydrophobicContact CE1-CG1 3.61Å; Y623-V830 HydrophobicContact CE2-CB 4.44Å; Y623-V830 HydrophobicContact CE2-CG2 4.41Å; Y623-V830 HydrophobicContact CG-CG1 4.15Å
624	A	81.2	Confident	84.9	Confident	25 Å²	25	49.1 Å²	49.1	21%	0.207	25%	0.246	C	C	.	.			trans	-102.2	122.8	174.8	0	0	0	0	0	110.9	V704 P710	A624-V704 HydrophobicContact CB-CG2 3.85Å; A624-P710 HydrophobicContact CB-CB 3.86Å; A624-P710 HydrophobicContact CB-CG 3.98Å
625	K	74.8	Confident	85.2	Confident	62 Å²	62	47.6 Å²	47.6	27%	0.27	24%	0.238	S	C	.	.			trans	-67	136.9	173.5	-66.8	153.9	173.3	154.5	0	108.8	Y623 G627 Q628 E633 Q834	Y623-K625 HydrophobicContact CD1-CG 4.49Å; Y623-K625 HydrophobicContact CE1-CD 4.43Å; Y623-K625 HydrophobicContact CE1-CG 3.7Å; K625-G627 PolarHBondContact O-N 3.37Å; K625-Q628 HydrophobicContact CB-CG 4.3Å; K625-Q628 WeakPolarHBondContact O-CB 2.98Å; K625-Q628 PolarHBondContact O-N 2.88Å; K625-E633 WeakPolarHBondContact CE-OE2 3.44Å; K625-E633 IonicContact NZ-OE1 2.76Å; K625-E633 PolarHBondContact NZ-OE1 2.02Å; K625-E633 IonicContact NZ-OE2 2.85Å; K625-E633 PolarHBondContact NZ-OE2 2.83Å; K625-Q834 VanDerWaalsContact NZ-OE1 3.14Å
626	R	71	Confident	85.5	Confident	240 Å²	240	42.5 Å²	42.5	91%	0.906	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56	113.4	-167.6	-174.6	179.4	-173.8	150.1	6.5	112.6
627	G	70.6	Confident	85.7	Confident	80 Å²	80	40.7 Å²	40.7	83%	0.825	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	94.6	9.8	-178.8	0	0	0	0	0	114.8	K625	K625-G627 PolarHBondContact O-N 3.37Å
628	Q	76	Confident	85.5	Confident	86 Å²	86	38.5 Å²	38.5	40%	0.402	19%	0.192	S	C	.	.			trans	-94.5	133.4	165.6	-64.8	-171.4	-35.5	0	0	110.6	K625	K625-Q628 HydrophobicContact CB-CG 4.3Å; K625-Q628 WeakPolarHBondContact O-CB 2.98Å; K625-Q628 PolarHBondContact O-N 2.88Å
629	E	76.7	Confident	85.3	Confident	136 Å²	136	42.4 Å²	42.4	64%	0.636	21%	0.206	S	C	*	.	S	Bend	trans	-87	-8.1	175	-61.7	-175.1	174.1	0	0	113.4	K703 V704	E629-K703 CarbonylContact O-C 3.52Å; E629-K703 WeakPolarHBondContact O-CA 3.47Å; E629-V704 PolarHBondContact O-N 3.03Å
630	Y	81.8	Confident	85.1	Confident	97 Å²	97	42.9 Å²	42.9	38%	0.38	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	136.7	-178	-65.8	-97.8	0	0	0	110.5	R701 V702 K703	Y630-R701 PolarHBondContact O-NH2 2.94Å; Y630-V702 CarbonylContact C-O 3.54Å; Y630-V702 VanDerWaalsContact CA-O 3.23Å; Y630-V702 WeakPolarHBondContact CA-O 3.46Å; Y630-K703 HydrophobicContact CD1-CB 3.91Å; Y630-K703 HydrophobicContact CD1-CG 4.33Å; Y630-K703 HydrophobicContact CE1-CB 3.58Å; Y630-K703 HydrophobicContact CE1-CD 4.27Å; Y630-K703 HydrophobicContact CE1-CG 3.83Å; Y630-K703 HydrophobicContact CE2-CG 4.44Å
631	S	86.6	Confident	84.9	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	148	172.6	-172.4	0	0	0	0	112.3	Y623 E633 V702	Y623-S631 WeakPolarHBondContact O-CB 3.07Å; Y623-S631 PolarHBondContact O-OG 2.95Å; S631-E633 PolarHBondContact OG-N 2.69Å; S631-V702 PolarHBondContact N-O 3.3Å; S631-V702 PolarHBondContact O-N 2.91Å
632	D	88.9	Confident	84.1	Confident	21 Å²	21	45.4 Å²	45.4	11%	0.112	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	8.8	173.9	45.8	6	0	0	0	110.8	K697 L698 R701	D632-K697 HydrophobicContact CB-CD 4.36Å; D632-K697 VanDerWaalsContact CG-CE 3.47Å; D632-K697 CarbonylContact O-C 2.9Å; D632-K697 WeakPolarHBondContact O-CA 3.34Å; D632-K697 IonicContact OD1-NZ 3.88Å; D632-K697 PolarHBondContact OD1-NZ 3.28Å; D632-K697 WeakPolarHBondContact OD2-CE 3.24Å; D632-K697 IonicContact OD2-NZ 2.68Å; D632-K697 PolarHBondContact OD2-NZ 3.2Å; D632-L698 HydrophobicContact CB-CB 4.28Å; D632-L698 PolarHBondContact O-N 3.47Å; D632-R701 HydrophobicContact CB-CB 4.44Å; D632-R701 HydrophobicContact CB-CG 3.97Å; D632-R701 IonicContact OD2-NE 3.76Å
633	E	90.1	Very high	83.1	Confident	5 Å²	5	49.5 Å²	49.5	2%	0.023	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	109.9	-174.4	-72.8	159.8	-161.3	0	0	109.8	Y623 K625 S631 M695 K697 Q834	Y623-E633 HydrophobicContact CD1-CB 4.21Å; Y623-E633 WeakPolarHBondContact CD1-OE2 3.47Å; Y623-E633 PolarHBondContact N-O 2.95Å; K625-E633 WeakPolarHBondContact CE-OE2 3.44Å; K625-E633 IonicContact NZ-OE1 2.76Å; K625-E633 PolarHBondContact NZ-OE1 2.02Å; K625-E633 IonicContact NZ-OE2 2.85Å; K625-E633 PolarHBondContact NZ-OE2 2.83Å; S631-E633 PolarHBondContact OG-N 2.69Å; E633-M695 HydrophobicContact CG-SD 4.37Å; E633-K697 HydrophobicContact CG-CD 3.89Å; E633-K697 IonicContact OE1-NZ 3.25Å; E633-K697 PolarHBondContact OE1-NZ 3.17Å; E633-Q834 PolarHBondContact OE1-NE2 3.39Å
634	V	91.8	Very high	82.1	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	136.2	175.3	168.1	0	0	0	0	109.5	V604 T621 L622 V651 I653 M695 L696 L698	V604-V634 HydrophobicContact CG1-CG1 3.72Å; V604-V634 HydrophobicContact CG1-CG2 4.14Å; T621-V634 WeakPolarHBondContact O-CA 3.5Å; L622-V634 HydrophobicContact CD1-CG2 3.94Å; V634-V651 HydrophobicContact CG2-CG1 4.48Å; V634-I653 HydrophobicContact CG2-CD1 4.44Å; V634-M695 CarbonylContact O-C 3.28Å; V634-M695 WeakPolarHBondContact O-CA 3.48Å; V634-L696 HydrophobicContact CB-CB 4.26Å; V634-L696 HydrophobicContact CG1-CD1 4.27Å; V634-L696 PolarHBondContact N-O 3.44Å; V634-L696 PolarHBondContact O-N 3.2Å; V634-L698 HydrophobicContact CG2-CD1 4.07Å; V634-L698 HydrophobicContact CG2-CG 4.4Å
635	V	91	Very high	81	Confident	2 Å²	2	54.4 Å²	54.4	1%	0.012	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	135.2	179.6	177.9	0	0	0	0	109.7	G620 T621 M693 I794 V830	G620-V635 WeakPolarHBondContact CA-O 3.46Å; T621-V635 PolarHBondContact N-O 3.21Å; T621-V635 PolarHBondContact O-N 3.42Å; V635-M693 HydrophobicContact CG1-CB 4.48Å; V635-I794 HydrophobicContact CG1-CD1 3.67Å; V635-V830 HydrophobicContact CG2-CG2 4.03Å
636	T	92.8	Very high	80.5	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	-179.7	176.1	-167.3	0	0	0	0	111.3	I606 T619 C640 V641 M693 T694 G778 I794	I606-T636 HydrophobicContact CD1-CG2 3.67Å; T619-T636 PolarHBondContact O-OG1 2.91Å; T636-C640 HydrophobicContact CG2-CB 4.45Å; T636-C640 PolarHBondContact OG1-SG 2.91Å; T636-V641 HydrophobicContact CG2-CG2 4.06Å; T636-M693 WeakPolarHBondContact O-CA 3.37Å; T636-T694 PolarHBondContact N-O 2.8Å; T636-T694 PolarHBondContact O-N 2.88Å; T636-G778 VanDerWaalsContact OG1-CA 3.27Å; T636-G778 WeakPolarHBondContact OG1-CA 3.11Å; T636-I794 WeakPolarHBondContact O-CD1 3.42Å
637	A	90.9	Very high	80.5	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	144.8	178.1	0	0	0	0	0	111.5	R639 C640 I777 I794	A637-R639 PolarHBondContact O-N 2.77Å; A637-C640 HydrophobicContact CB-CB 4.46Å; A637-C640 WeakPolarHBondContact O-CB 3.5Å; A637-C640 PolarHBondContact O-N 3.43Å; A637-I777 HydrophobicContact CB-CG2 4.17Å; A637-I794 HydrophobicContact CB-CG2 4.02Å
638	S	87.6	Confident	81.2	Confident	7 Å²	7	54.6 Å²	54.6	5%	0.049	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-30	177.9	-64.9	0	0	0	0	113.5	C640 V641 D690 G692 M693 T694	S638-C640 PolarHBondContact O-N 3.47Å; S638-V641 CarbonylContact O-C 3.58Å; S638-V641 VanDerWaalsContact O-C 3.32Å; S638-V641 PolarHBondContact O-N 3.33Å; S638-D690 WeakPolarHBondContact CB-O 2.87Å; S638-G692 PolarHBondContact N-O 2.66Å; S638-G692 WeakPolarHBondContact OG-CA 3.29Å; S638-M693 PolarHBondContact OG-N 2.9Å; S638-M693 PolarHBondContact OG-O 3.01Å; S638-T694 WeakPolarHBondContact CA-OG1 3.39Å; S638-T694 PolarHBondContact OG-OG1 2.94Å
639	R	87.3	Confident	81.9	Confident	88 Å²	88	51.3 Å²	51.3	33%	0.332	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-27.5	170.9	-177.9	172.2	-57.6	-64.9	-1.9	114.5	A637 D690 D796	A637-R639 PolarHBondContact O-N 2.77Å; R639-D690 IonicContact CZ-OD2 2.66Å; R639-D690 VanDerWaalsContact CZ-OD2 3.25Å; R639-D690 PolarHBondContact N-O 2.89Å; R639-D690 IonicContact NH1-OD2 2.71Å; R639-D690 PolarHBondContact NH1-OD2 2.97Å; R639-D690 IonicContact NH2-OD2 2.94Å; R639-D690 PolarHBondContact NH2-OD2 3.12Å; R639-D796 IonicContact CZ-OD2 2.81Å; R639-D796 IonicContact NE-OD2 3.42Å; R639-D796 PolarHBondContact NE-OD2 2.82Å; R639-D796 IonicContact NH2-OD2 2.75Å
640	C	89.4	Confident	82.6	Confident	10 Å²	10	45.5 Å²	45.5	7%	0.068	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-35.1	-177.9	148.8	0	0	0	0	112.4	C618 T636 A637 S638 I777	C618-C640 HydrophobicContact CB-CB 3.59Å; C618-C640 WeakPolarHBondContact CB-SG 3.31Å; C618-C640 WeakPolarHBondContact SG-CB 3.43Å; C618-C640 CovalentContact SG-SG 2.02Å; C618-C640 PolarHBondContact SG-SG 2.94Å; T636-C640 HydrophobicContact CG2-CB 4.45Å; T636-C640 PolarHBondContact OG1-SG 2.91Å; A637-C640 HydrophobicContact CB-CB 4.46Å; A637-C640 WeakPolarHBondContact O-CB 3.5Å; A637-C640 PolarHBondContact O-N 3.43Å; S638-C640 PolarHBondContact O-N 3.47Å; C640-I777 HydrophobicContact CB-CG2 3.91Å
641	V	87.2	Confident	83.1	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.229	C	C	.	.	S	Bend	trans	-131.5	85.5	175.7	-172.5	0	0	0	0	109.3	I606 T636 S638 Y649 V676 T694 L696	I606-V641 HydrophobicContact CG2-CG2 4.03Å; T636-V641 HydrophobicContact CG2-CG2 4.06Å; S638-V641 CarbonylContact O-C 3.58Å; S638-V641 VanDerWaalsContact O-C 3.32Å; S638-V641 PolarHBondContact O-N 3.33Å; V641-Y649 HydrophobicContact CG1-CD1 4.15Å; V641-Y649 HydrophobicContact CG1-CD2 3.66Å; V641-Y649 HydrophobicContact CG1-CE1 4Å; V641-Y649 HydrophobicContact CG1-CE2 3.47Å; V641-Y649 VanDerWaalsContact CG1-CE2 3.47Å; V641-Y649 HydrophobicContact CG1-CG 3.98Å; V641-Y649 HydrophobicContact CG2-CD1 4.47Å; V641-V676 HydrophobicContact CG1-CG1 3.74Å; V641-V676 HydrophobicContact CG1-CG2 4.28Å; V641-T694 HydrophobicContact CB-CG2 4.13Å; V641-T694 HydrophobicContact CG1-CG2 4.4Å; V641-T694 PolarHBondContact O-OG1 3.35Å; V641-L696 HydrophobicContact CB-CD2 4.2Å; V641-L696 HydrophobicContact CG1-CD2 3.88Å; V641-L696 HydrophobicContact CG2-CD1 4.32Å; V641-L696 HydrophobicContact CG2-CD2 4.09Å
642	P	75.5	Confident	83.2	Confident	52 Å²	52	41.4 Å²	41.4	34%	0.338	23%	0.231	S	C	.	.			trans	-67.7	142.1	172.3	28.2	-34	0	0	0	110.4	T644 Y649	P642-T644 VanDerWaalsContact C-N 3.28Å; P642-T644 PolarHBondContact O-N 3.26Å; P642-Y649 PolarHBondContact O-OH 3.42Å
643	P	66.6	Low	83	Confident	88 Å²	88	40.8 Å²	40.8	57%	0.571	23%	0.228	S	C	*	.	S	Bend	trans	-75.9	-11	-175.3	30.5	-36	0	0	0	114.3	A678	P643-A678 HydrophobicContact CB-CB 3.93Å; P643-A678 HydrophobicContact CG-CB 3.91Å
644	T	65.6	Low	82.3	Confident	116 Å²	116	40.8 Å²	40.8	71%	0.712	23%	0.23	S	C	*	.			trans	-91.6	103.4	-176.2	42.4	0	0	0	0	112.4	P642	P642-T644 VanDerWaalsContact C-N 3.28Å; P642-T644 PolarHBondContact O-N 3.26Å
645	G	59.5	Low	81.1	Confident	53 Å²	53	41.4 Å²	41.4	55%	0.546	23%	0.234	S	C	.	.	S	Bend	trans	145.8	159.3	165.6	0	0	0	0	0	113.1	N647	G645-N647 PolarHBondContact O-N 2.89Å
646	N	63.8	Low	80.2	Confident	173 Å²	173	42.5 Å²	42.5	93%	0.925	24%	0.239	S	C	*	.			trans	-75.5	33.2	173.8	-73.1	0.8	0	0	0	112.5	K648	N646-K648 PolarHBondContact O-N 2.66Å
647	N	70.4	Confident	79.5	Confident	72 Å²	72	43 Å²	43	39%	0.385	24%	0.242	S	C	.	.			trans	-74.5	120.1	-171.7	-72.2	-1.2	0	0	0	110.5	L608 G645 Y649	L608-N647 HydrophobicContact CD1-CB 3.74Å; G645-N647 PolarHBondContact O-N 2.89Å; N647-Y649 HydrophobicContact CB-CD2 4.2Å; N647-Y649 HydrophobicContact CB-CE1 4.09Å; N647-Y649 HydrophobicContact CB-CE2 3.55Å; N647-Y649 VanDerWaalsContact CB-CZ 3.49Å; N647-Y649 PolarHBondContact ND2-OH 2.89Å; N647-Y649 VanDerWaalsContact ND2-OH 3.1Å; N647-Y649 WeakPolarHBondContact O-CD2 3.43Å; N647-Y649 PolarHBondContact O-N 3.5Å; N647-Y649 VanDerWaalsContact O-N 3.12Å
648	K	85.6	Confident	78.5	Confident	141 Å²	141	43.7 Å²	43.7	61%	0.613	25%	0.247	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-81.6	91	173.8	-68.5	-172.4	177.9	-174.2	0	109.8	V609 N646	V609-K648 PolarHBondContact N-O 2.89Å; N646-K648 PolarHBondContact O-N 2.66Å
649	Y	91	Very high	77.6	Confident	17 Å²	17	49.5 Å²	49.5	7%	0.067	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	135	170.5	-56.3	-73.3	0	0	0	110.5	F607 L608 L617 V641 P642 N647 V673 V676	F607-Y649 WeakPolarHBondContact O-CA 3.39Å; L608-Y649 HydrophobicContact CD1-CD1 4.36Å; L608-Y649 HydrophobicContact CD1-CE1 4.17Å; L617-Y649 HydrophobicContact CD1-CD1 4.2Å; L617-Y649 HydrophobicContact CD1-CE1 3.94Å; V641-Y649 HydrophobicContact CG1-CD1 4.15Å; V641-Y649 HydrophobicContact CG1-CD2 3.66Å; V641-Y649 HydrophobicContact CG1-CE1 4Å; V641-Y649 HydrophobicContact CG1-CE2 3.47Å; V641-Y649 VanDerWaalsContact CG1-CE2 3.47Å; V641-Y649 HydrophobicContact CG1-CG 3.98Å; V641-Y649 HydrophobicContact CG2-CD1 4.47Å; P642-Y649 PolarHBondContact O-OH 3.42Å; N647-Y649 HydrophobicContact CB-CD2 4.2Å; N647-Y649 HydrophobicContact CB-CE1 4.09Å; N647-Y649 HydrophobicContact CB-CE2 3.55Å; N647-Y649 VanDerWaalsContact CB-CZ 3.49Å; N647-Y649 PolarHBondContact ND2-OH 2.89Å; N647-Y649 VanDerWaalsContact ND2-OH 3.1Å; N647-Y649 WeakPolarHBondContact O-CD2 3.43Å; N647-Y649 PolarHBondContact O-N 3.5Å; N647-Y649 VanDerWaalsContact O-N 3.12Å; Y649-V673 WeakPolarHBondContact O-CB 3.45Å; Y649-V673 WeakPolarHBondContact O-CG2 3.36Å; Y649-V673 PolarHBondContact O-N 3.49Å; Y649-V676 HydrophobicContact CD2-CG2 4.16Å
650	Q	91.4	Very high	76.5	Confident	13 Å²	13	54.2 Å²	54.2	6%	0.061	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	159	171.1	-60.4	-175.3	-19.5	0	0	110.1	F607 V609 N667 L670 I671 E672	F607-Q650 PolarHBondContact N-O 2.96Å; F607-Q650 PolarHBondContact O-N 3.45Å; V609-Q650 HydrophobicContact CG2-CB 4.26Å; V609-Q650 HydrophobicContact CG2-CG 3.92Å; Q650-N667 PolarHBondContact OE1-OD1 2.98Å; Q650-L670 HydrophobicContact CB-CB 3.99Å; Q650-L670 HydrophobicContact CB-CD1 4.37Å; Q650-I671 CarbonylContact C-O 3.55Å; Q650-I671 WeakPolarHBondContact CA-O 3.37Å; Q650-E672 HydrophobicContact CG-CG 4.41Å
651	V	91.5	Very high	75.5	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	126.1	-173.9	-177	0	0	0	0	110.6	V604 H605 I606 V634 I653 I671 V673 L696 L698	V604-V651 HydrophobicContact CG1-CG1 3.64Å; H605-V651 WeakPolarHBondContact O-CA 3.45Å; I606-V651 HydrophobicContact CG1-CG2 4.32Å; V634-V651 HydrophobicContact CG2-CG1 4.48Å; V651-I653 HydrophobicContact CG1-CD1 4.44Å; V651-I653 HydrophobicContact CG1-CG1 3.94Å; V651-I671 PolarHBondContact N-O 3.27Å; V651-I671 WeakPolarHBondContact O-CB 3.33Å; V651-I671 PolarHBondContact O-N 2.91Å; V651-V673 HydrophobicContact CG2-CG2 3.91Å; V651-L696 HydrophobicContact CG2-CD1 4.03Å; V651-L698 HydrophobicContact CB-CD2 3.95Å; V651-L698 HydrophobicContact CG2-CD2 3.74Å
652	Y	88.5	Confident	74.7	Confident	11 Å²	11	58.6 Å²	58.6	4%	0.043	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	134.9	164.4	-179.2	-100.1	0	0	0	109.4	V604 H605 L656 P658	V604-Y652 WeakPolarHBondContact CA-O 3.48Å; H605-Y652 PolarHBondContact N-O 2.96Å; H605-Y652 PolarHBondContact O-N 2.91Å; Y652-L656 VanDerWaalsContact CE1-O 3.23Å; Y652-L656 WeakPolarHBondContact CE1-O 3.27Å; Y652-L656 PolarHBondContact OH-O 3.11Å; Y652-P658 HydrophobicContact CE1-CG 4.36Å; Y652-P658 HydrophobicContact CE2-CG 3.95Å
653	I	84.9	Confident	74.6	Confident	8 Å²	8	58.7 Å²	58.7	4%	0.041	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	111.7	172.7	-55.7	-161	0	0	0	109.3	G603 V604 L622 V634 V651 L698 V702 V708	G603-I653 WeakPolarHBondContact O-CA 3.42Å; V604-I653 HydrophobicContact CG2-CD1 4.15Å; V604-I653 HydrophobicContact CG2-CG1 4.11Å; V604-I653 HydrophobicContact CG2-CG2 4.25Å; L622-I653 HydrophobicContact CD1-CD1 4.04Å; V634-I653 HydrophobicContact CG2-CD1 4.44Å; V651-I653 HydrophobicContact CG1-CD1 4.44Å; V651-I653 HydrophobicContact CG1-CG1 3.94Å; I653-L698 HydrophobicContact CD1-CD1 4.06Å; I653-V702 HydrophobicContact CD1-CB 4.31Å; I653-V702 HydrophobicContact CD1-CG1 4.33Å; I653-V702 HydrophobicContact CD1-CG2 3.98Å; I653-V702 HydrophobicContact CG2-CG1 4.49Å; I653-V708 HydrophobicContact CG2-CG1 4.08Å; I653-V708 HydrophobicContact CG2-CG2 4.19Å
654	G	76.4	Confident	74.7	Confident	6 Å²	6	58.3 Å²	58.3	6%	0.062	32%	0.319	C	S	.	.	S	Bend	trans	175.5	149.7	-176	0	0	0	0	0	109.8	G603 L656	G603-G654 CarbonylContact C-O 3.58Å; G603-G654 VanDerWaalsContact C-O 3.28Å; G603-G654 WeakPolarHBondContact CA-O 3.25Å; G603-G654 PolarHBondContact O-N 2.94Å; G603-G654 VanDerWaalsContact O-O 3.13Å; G654-L656 VanDerWaalsContact C-N 3.33Å; G654-L656 PolarHBondContact O-N 2.89Å
655	S	66.6	Low	75.1	Confident	13 Å²	13	56.2 Å²	56.2	9%	0.091	30%	0.301	C	S	.	.	S	Bend	trans	-70.4	-26.5	-177.2	46.7	0	0	0	0	114	P737	S655-P737 WeakPolarHBondContact O-CB 3.09Å; S655-P737 VanDerWaalsContact O-CD 3.3Å; S655-P737 WeakPolarHBondContact O-CD 3.04Å; S655-P737 VanDerWaalsContact O-CG 3.32Å; S655-P737 WeakPolarHBondContact O-CG 3.35Å
656	L	72.3	Confident	75.9	Confident	24 Å²	24	54.6 Å²	54.6	13%	0.126	28%	0.28	C	S	.	.	S	Bend	trans	-107.9	123.3	-179.1	-67.4	164	0	0	0	109.2	L506 Y509 Y652 G654 P658 M736	L506-L656 HydrophobicContact CD1-CB 3.89Å; L506-L656 HydrophobicContact CD1-CD1 3.8Å; L506-L656 HydrophobicContact CD1-CG 4.49Å; Y509-L656 HydrophobicContact CE2-CD2 4.43Å; Y652-L656 VanDerWaalsContact CE1-O 3.23Å; Y652-L656 WeakPolarHBondContact CE1-O 3.27Å; Y652-L656 PolarHBondContact OH-O 3.11Å; G654-L656 VanDerWaalsContact C-N 3.33Å; G654-L656 PolarHBondContact O-N 2.89Å; L656-P658 VanDerWaalsContact O-CD 3.32Å; L656-P658 WeakPolarHBondContact O-CD 3.48Å; L656-M736 HydrophobicContact CD2-CE 3.78Å; L656-M736 HydrophobicContact CD2-SD 3.45Å; L656-M736 WeakPolarHBondContact CD2-SD 3.38Å
657	L	76.9	Confident	76.5	Confident	10 Å²	10	49.9 Å²	49.9	5%	0.052	25%	0.254	C	S	.	.			trans	-79.3	115.7	174.6	179.5	63.5	0	0	0	109.5	Y509 H605 F607 R659 V731 G735 Y775	Y509-L657 PolarHBondContact OH-O 3.43Å; H605-L657 HydrophobicContact CB-CD1 3.93Å; F607-L657 HydrophobicContact CE2-CD1 4.22Å; F607-L657 HydrophobicContact CZ-CD1 3.78Å; L657-R659 PolarHBondContact O-N 2.9Å; L657-V731 HydrophobicContact CB-CG1 4.25Å; L657-V731 HydrophobicContact CB-CG2 4.33Å; L657-V731 HydrophobicContact CD2-CG2 3.93Å; L657-G735 PolarHBondContact N-O 3.35Å; L657-Y775 HydrophobicContact CD2-CD2 4.34Å; L657-Y775 HydrophobicContact CD2-CE2 4.36Å
658	P	70.6	Confident	76.8	Confident	16 Å²	16	54.7 Å²	54.7	10%	0.104	27%	0.267	C	S	.	.			trans	-68.8	128.2	-174.4	-19.7	33.3	0	0	0	112.4	L506 Y652 L656 M661 L666	L506-P658 HydrophobicContact CD2-CB 4.28Å; L506-P658 HydrophobicContact CD2-CG 4.13Å; Y652-P658 HydrophobicContact CE1-CG 4.36Å; Y652-P658 HydrophobicContact CE2-CG 3.95Å; L656-P658 VanDerWaalsContact O-CD 3.32Å; L656-P658 WeakPolarHBondContact O-CD 3.48Å; P658-M661 HydrophobicContact CB-CB 4.32Å; P658-M661 HydrophobicContact CB-CG 4.03Å; P658-M661 HydrophobicContact CB-SD 3.58Å; P658-M661 VanDerWaalsContact CB-SD 3.58Å; P658-M661 HydrophobicContact CG-SD 3.9Å; P658-L666 HydrophobicContact CG-CD1 4.34Å
659	R	69.3	Low	76.4	Confident	128 Å²	128	48.4 Å²	48.4	48%	0.483	24%	0.241	S	C	.	.	S	Bend	trans	-106.4	-28.9	176.9	-76.1	-170	160.9	-132.8	-5.7	115.6	L657 Q733	L657-R659 PolarHBondContact O-N 2.9Å; R659-Q733 PolarHBondContact NH1-O 3.4Å; R659-Q733 PolarHBondContact NH2-O 3.09Å
660	K	63.6	Low	76.1	Confident	187 Å²	187	48.3 Å²	48.3	81%	0.813	24%	0.241	S	C	*	.	S	Bend	trans	-113.5	38.4	-177	-63.7	-174.3	-180	178.8	0	112.3
661	M	67.6	Low	76	Confident	45 Å²	45	49.3 Å²	49.3	22%	0.222	25%	0.246	C	C	.	.			trans	-100.4	139.8	171.9	-85.9	-179.1	160.3	0	0	110.8	P504 L506 P658 L666	P504-M661 HydrophobicContact CG-CE 3.65Å; L506-M661 HydrophobicContact CD2-CE 3.68Å; L506-M661 HydrophobicContact CD2-SD 4.33Å; P658-M661 HydrophobicContact CB-CB 4.32Å; P658-M661 HydrophobicContact CB-CG 4.03Å; P658-M661 HydrophobicContact CB-SD 3.58Å; P658-M661 VanDerWaalsContact CB-SD 3.58Å; P658-M661 HydrophobicContact CG-SD 3.9Å; M661-L666 HydrophobicContact CB-CB 4.41Å
662	A	71.6	Confident	75.9	Confident	57 Å²	57	52.6 Å²	52.6	47%	0.471	26%	0.262	S	S	.	.			trans	-65.7	148.6	166.8	0	0	0	0	0	110.3	D664 Q665 L666	A662-D664 VanDerWaalsContact C-N 3.26Å; A662-D664 WeakPolarHBondContact CB-OD1 3.37Å; A662-D664 PolarHBondContact O-N 3.05Å; A662-Q665 HydrophobicContact CB-CG 4.44Å; A662-Q665 PolarHBondContact O-N 2.93Å; A662-Q665 VanDerWaalsContact O-N 3.07Å; A662-L666 PolarHBondContact O-N 3.18Å
663	A	72.1	Confident	76	Confident	55 Å²	55	53 Å²	53	46%	0.455	27%	0.265	S	S	.	.	H	α-helix	trans	-62.7	-31	-171.2	0	0	0	0	0	113.3	I614 N667	I614-A663 HydrophobicContact CD1-CB 4.25Å; I614-A663 WeakPolarHBondContact CD1-O 3.37Å; A663-N667 VanDerWaalsContact O-CB 3.22Å; A663-N667 WeakPolarHBondContact O-CB 3.49Å; A663-N667 PolarHBondContact O-N 2.96Å
664	D	69.8	Low	76.1	Confident	80 Å²	80	54.3 Å²	54.3	43%	0.428	28%	0.281	S	S	.	.	H	α-helix	trans	-66.7	-40.6	174.4	70.8	-55	0	0	0	112.2	A662 R668	A662-D664 VanDerWaalsContact C-N 3.26Å; A662-D664 WeakPolarHBondContact CB-OD1 3.37Å; A662-D664 PolarHBondContact O-N 3.05Å; D664-R668 VanDerWaalsContact O-CG 3.29Å; D664-R668 WeakPolarHBondContact O-CG 3.43Å; D664-R668 PolarHBondContact O-N 3.38Å
665	Q	74.2	Confident	76.7	Confident	72 Å²	72	58.1 Å²	58.1	34%	0.336	30%	0.3	S	S	.	.	H	α-helix	trans	-70.5	-42.2	177.1	-60.7	-58	-47.7	0	0	111	A662 R668	A662-Q665 HydrophobicContact CB-CG 4.44Å; A662-Q665 PolarHBondContact O-N 2.93Å; A662-Q665 VanDerWaalsContact O-N 3.07Å; Q665-R668 PolarHBondContact O-N 3Å
666	L	75.1	Confident	77.7	Confident	19 Å²	19	59.9 Å²	59.9	10%	0.099	31%	0.31	C	S	.	.	H	α-helix	trans	-60.8	-49.5	174.8	-177	61.4	0	0	0	110.7	F607 I614 P658 M661 A662 R668 T669 L670	F607-L666 HydrophobicContact CE1-CD2 4.22Å; F607-L666 HydrophobicContact CZ-CD2 4.47Å; I614-L666 HydrophobicContact CG2-CD2 3.87Å; P658-L666 HydrophobicContact CG-CD1 4.34Å; M661-L666 HydrophobicContact CB-CB 4.41Å; A662-L666 PolarHBondContact O-N 3.18Å; L666-R668 PolarHBondContact O-N 3.27Å; L666-T669 WeakPolarHBondContact O-CA 3.43Å; L666-T669 PolarHBondContact O-N 2.8Å; L666-T669 PolarHBondContact O-OG1 2.99Å; L666-L670 HydrophobicContact CG-CD1 4.28Å; L666-L670 HydrophobicContact CG-CG 4.41Å; L666-L670 WeakPolarHBondContact O-CG 3.24Å; L666-L670 PolarHBondContact O-N 2.89Å
667	N	76.2	Confident	78.3	Confident	73 Å²	73	61.4 Å²	61.4	39%	0.39	32%	0.315	S	S	.	.	H	α-helix	trans	-56	-35.1	178.4	-169.4	37.9	0	0	0	113.2	I614 Q650 A663 T669 L670	I614-N667 HydrophobicContact CD1-CB 3.97Å; Q650-N667 PolarHBondContact OE1-OD1 2.98Å; A663-N667 VanDerWaalsContact O-CB 3.22Å; A663-N667 WeakPolarHBondContact O-CB 3.49Å; A663-N667 PolarHBondContact O-N 2.96Å; N667-T669 PolarHBondContact O-N 3Å; N667-L670 PolarHBondContact O-N 3.35Å
668	R	77.2	Confident	78.3	Confident	174 Å²	174	62 Å²	62	66%	0.657	32%	0.321	S	S	*	.	H	α-helix	trans	-66.6	-20.4	174.4	-71.5	167.3	-173.4	-128.5	2.9	114.2	D664 Q665 L666	D664-R668 VanDerWaalsContact O-CG 3.29Å; D664-R668 WeakPolarHBondContact O-CG 3.43Å; D664-R668 PolarHBondContact O-N 3.38Å; Q665-R668 PolarHBondContact O-N 3Å; L666-R668 PolarHBondContact O-N 3.27Å
669	T	78.2	Confident	78	Confident	9 Å²	9	64.8 Å²	64.8	6%	0.055	33%	0.33	C	S	.	.	H	α-helix	trans	-99.7	-8.4	177.4	66.4	0	0	0	0	113.6	L503 P504 L666 N667	L503-T669 HydrophobicContact CD2-CG2 3.83Å; P504-T669 HydrophobicContact CG-CG2 4.15Å; L666-T669 WeakPolarHBondContact O-CA 3.43Å; L666-T669 PolarHBondContact O-N 2.8Å; L666-T669 PolarHBondContact O-OG1 2.99Å; N667-T669 PolarHBondContact O-N 3Å
670	L	84.9	Confident	77.6	Confident	15 Å²	15	60 Å²	60	8%	0.079	32%	0.315	C	S	.	.			trans	-84	137.8	179.1	-73	178	0	0	0	111.3	F607 V609 I614 Q650 L666 N667	F607-L670 HydrophobicContact CD2-CD2 3.6Å; F607-L670 HydrophobicContact CE2-CD2 3.96Å; F607-L670 HydrophobicContact CG-CD2 4.21Å; V609-L670 HydrophobicContact CG2-CD1 4.44Å; I614-L670 HydrophobicContact CD1-CD1 4.33Å; I614-L670 HydrophobicContact CG2-CD1 3.82Å; Q650-L670 HydrophobicContact CB-CB 3.99Å; Q650-L670 HydrophobicContact CB-CD1 4.37Å; L666-L670 HydrophobicContact CG-CD1 4.28Å; L666-L670 HydrophobicContact CG-CG 4.41Å; L666-L670 WeakPolarHBondContact O-CG 3.24Å; L666-L670 PolarHBondContact O-N 2.89Å; N667-L670 PolarHBondContact O-N 3.35Å
671	I	88.3	Confident	77.4	Confident	33 Å²	33	52.5 Å²	52.5	17%	0.169	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	121.6	-176	-55.3	175.9	0	0	0	108.7	Q650 V651 L698 H700 V702	Q650-I671 CarbonylContact C-O 3.55Å; Q650-I671 WeakPolarHBondContact CA-O 3.37Å; V651-I671 PolarHBondContact N-O 3.27Å; V651-I671 WeakPolarHBondContact O-CB 3.33Å; V651-I671 PolarHBondContact O-N 2.91Å; I671-L698 HydrophobicContact CG2-CB 4.07Å; I671-L698 HydrophobicContact CG2-CD1 4.22Å; I671-L698 HydrophobicContact CG2-CD2 4.38Å; I671-L698 HydrophobicContact CG2-CG 4.45Å; I671-H700 HydrophobicContact CG2-CB 4.48Å; I671-V702 HydrophobicContact CD1-CG1 4.27Å; I671-V702 HydrophobicContact CD1-CG2 3.47Å; I671-V702 VanDerWaalsContact CD1-CG2 3.47Å
672	E	89.5	Confident	76.8	Confident	70 Å²	70	52 Å²	52	33%	0.327	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	135.7	-179.4	-64.8	-161.1	137.3	0	0	112.5	Q650 K699	Q650-E672 HydrophobicContact CG-CG 4.41Å; E672-K699 HydrophobicContact CB-CD 3.86Å; E672-K699 HydrophobicContact CB-CG 4.16Å; E672-K699 PolarHBondContact O-N 3.05Å; E672-K699 WeakPolarHBondContact OE2-CD 3.38Å; E672-K699 WeakPolarHBondContact OE2-CE 3.22Å; E672-K699 IonicContact OE2-NZ 2.8Å; E672-K699 PolarHBondContact OE2-NZ 3.47Å
673	V	91	Very high	75.6	Confident	19 Å²	19	54.8 Å²	54.8	12%	0.115	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	129.5	164.8	-177.7	0	0	0	0	108.4	Y649 V651 N675 V676 L696 L698	Y649-V673 WeakPolarHBondContact O-CB 3.45Å; Y649-V673 WeakPolarHBondContact O-CG2 3.36Å; Y649-V673 PolarHBondContact O-N 3.49Å; V651-V673 HydrophobicContact CG2-CG2 3.91Å; V673-N675 WeakPolarHBondContact CG1-O 3.49Å; V673-V676 HydrophobicContact CG1-CG2 3.85Å; V673-L696 HydrophobicContact CG1-CB 4.09Å; V673-L696 HydrophobicContact CG1-CD2 4.35Å; V673-L696 HydrophobicContact CG2-CB 4.22Å; V673-L696 HydrophobicContact CG2-CD1 4.17Å; V673-L698 HydrophobicContact CG2-CD2 4.26Å
674	G	87.4	Confident	74.4	Confident	36 Å²	36	55.6 Å²	55.6	37%	0.371	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	-49	172.8	0	0	0	0	0	111.8	K697	G674-K697 PolarHBondContact N-O 3.07Å
675	N	88.4	Confident	73.6	Confident	86 Å²	86	56.2 Å²	56.2	46%	0.46	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	140.5	-178.7	-65.3	69.7	0	0	0	110.9	V673 Y677 K697	V673-N675 WeakPolarHBondContact CG1-O 3.49Å; N675-Y677 HydrophobicContact CB-CD2 4.11Å; N675-Y677 HydrophobicContact CB-CE2 3.39Å; N675-K697 HydrophobicContact CB-CB 4.26Å; N675-K697 PolarHBondContact N-O 2.81Å; N675-K697 PolarHBondContact O-N 2.79Å
676	V	88	Confident	72.6	Confident	50 Å²	50	58.6 Å²	58.6	30%	0.303	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	111.2	175.2	178.8	0	0	0	0	108.5	V641 Y649 V673 T694 L696	V641-V676 HydrophobicContact CG1-CG1 3.74Å; V641-V676 HydrophobicContact CG1-CG2 4.28Å; Y649-V676 HydrophobicContact CD2-CG2 4.16Å; V673-V676 HydrophobicContact CG1-CG2 3.85Å; V676-T694 HydrophobicContact CG1-CG2 3.58Å; V676-L696 HydrophobicContact CB-CD2 4.48Å; V676-L696 HydrophobicContact CG1-CD2 4.11Å; V676-L696 HydrophobicContact CG2-CD2 4.06Å
677	Y	84.6	Confident	71.7	Confident	55 Å²	55	66.1 Å²	66.1	22%	0.216	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	83.5	177.6	-57.7	-89.4	0	0	0	110	N675 M695 K697 V833 D837	N675-Y677 HydrophobicContact CB-CD2 4.11Å; N675-Y677 HydrophobicContact CB-CE2 3.39Å; Y677-M695 WeakPolarHBondContact CB-O 3.41Å; Y677-M695 HydrophobicContact CD2-CE 3.3Å; Y677-M695 HydrophobicContact CE2-CE 3.84Å; Y677-M695 HydrophobicContact CG-CE 3.79Å; Y677-M695 PolarHBondContact N-O 2.99Å; Y677-M695 PolarHBondContact O-N 2.99Å; Y677-K697 HydrophobicContact CD2-CB 4.35Å; Y677-K697 HydrophobicContact CE2-CB 3.83Å; Y677-V833 HydrophobicContact CD1-CG1 4.43Å; Y677-V833 HydrophobicContact CG-CG1 4Å; Y677-D837 WeakPolarHBondContact CE1-OD2 3.45Å
678	A	76.3	Confident	71.1	Confident	24 Å²	24	63 Å²	63	20%	0.198	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	128.2	171.9	0	0	0	0	0	110.1	P643 T694	P643-A678 HydrophobicContact CB-CB 3.93Å; P643-A678 HydrophobicContact CG-CB 3.91Å; A678-T694 WeakPolarHBondContact CA-OG1 3.46Å; A678-T694 HydrophobicContact CB-CG2 4.39Å
679	R	65	Low	70.4	Confident	74 Å²	74	59.7 Å²	59.7	28%	0.279	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	76.7	170	-75.8	-67.5	-151.5	175.4	2.2	108.7	F681 M693 V833	R679-F681 VanDerWaalsContact O-CD1 3.23Å; R679-F681 WeakPolarHBondContact O-CD1 3.06Å; R679-F681 PolarHBondContact O-N 2.96Å; R679-F681 VanDerWaalsContact O-N 3.1Å; R679-M693 PolarHBondContact N-O 3Å; R679-V833 HydrophobicContact CG-CG1 4.27Å; R679-V833 HydrophobicContact CG-CG2 3.95Å
680	P	60.9	Low	70.1	Confident	26 Å²	26	63.3 Å²	63.3	17%	0.169	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	119.1	166.1	28.4	-34.7	0	0	0	106.9	Y682 E683 K689	P680-Y682 PolarHBondContact O-N 2.95Å; P680-E683 HydrophobicContact CG-CG 3.97Å; P680-K689 WeakPolarHBondContact CB-O 3.29Å
681	F	59.3	Low	69.6	Low	31 Å²	31	63.5 Å²	63.5	14%	0.136	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-13.6	-153.4	-76.4	-38	0	0	0	114.7	R206 R679 M693 V823 K829	R206-F681 VanDerWaalsContact NH1-CD1 3.33Å; R206-F681 VanDerWaalsContact NH2-CE2 3.32Å; R679-F681 VanDerWaalsContact O-CD1 3.23Å; R679-F681 WeakPolarHBondContact O-CD1 3.06Å; R679-F681 PolarHBondContact O-N 2.96Å; R679-F681 VanDerWaalsContact O-N 3.1Å; F681-M693 HydrophobicContact CE1-CB 4.31Å; F681-M693 HydrophobicContact CE1-CE 3.93Å; F681-M693 HydrophobicContact CE1-CG 3.77Å; F681-M693 HydrophobicContact CE1-SD 4.49Å; F681-M693 HydrophobicContact CZ-CB 4.07Å; F681-M693 HydrophobicContact CZ-CE 3.64Å; F681-M693 HydrophobicContact CZ-CG 3.97Å; F681-V823 HydrophobicContact CD2-CG1 4.02Å; F681-V823 HydrophobicContact CE2-CG1 3.38Å; F681-V823 HydrophobicContact CZ-CG1 4.24Å; F681-K829 HydrophobicContact CE1-CD 4.09Å; F681-K829 HydrophobicContact CZ-CD 3.84Å
682	Y	54.3	Low	69.2	Low	34 Å²	34	62 Å²	62	13%	0.133	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-144.1	62.9	-171.6	-55.8	-65.4	0	0	0	109.3	P181 R206 P680 G684 Y685 L688 V762	P181-Y682 HydrophobicContact CB-CD1 3.67Å; P181-Y682 HydrophobicContact CB-CD2 4.37Å; P181-Y682 HydrophobicContact CB-CE1 3.36Å; P181-Y682 HydrophobicContact CB-CE2 4.11Å; P181-Y682 HydrophobicContact CB-CG 4.18Å; P181-Y682 HydrophobicContact CG-CD1 3.52Å; P181-Y682 HydrophobicContact CG-CE1 3.25Å; P181-Y682 HydrophobicContact CG-CG 4.44Å; R206-Y682 PolarHBondContact NE-OH 2.94Å; R206-Y682 PolarHBondContact NH2-OH 3.28Å; R206-Y682 VanDerWaalsContact NH2-OH 3.07Å; P680-Y682 PolarHBondContact O-N 2.95Å; Y682-G684 PolarHBondContact O-N 3.12Å; Y682-Y685 PolarHBondContact O-N 3.25Å; Y682-L688 HydrophobicContact CD2-CD1 4.07Å; Y682-L688 HydrophobicContact CG-CD1 4.39Å; Y682-V762 HydrophobicContact CD2-CG1 4.29Å; Y682-V762 HydrophobicContact CE2-CB 3.93Å; Y682-V762 HydrophobicContact CE2-CG1 3.37Å
683	E	46.3	Very low	69	Low	116 Å²	116	58.7 Å²	58.7	54%	0.542	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-44.5	-34.9	-177.2	-71.3	160.9	-169.2	0	0	114.4	P680 Y685 K689	P680-E683 HydrophobicContact CG-CG 3.97Å; E683-Y685 VanDerWaalsContact C-N 3.29Å; E683-Y685 PolarHBondContact O-N 3.22Å; E683-K689 WeakPolarHBondContact O-CE 3.4Å
684	G	47	Very low	68.8	Low	71 Å²	71	57.8 Å²	57.8	73%	0.732	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	13.2	176.1	0	0	0	0	0	116.6	Y682	Y682-G684 PolarHBondContact O-N 3.12Å
685	Y	53.6	Low	68.9	Low	93 Å²	93	56 Å²	56	37%	0.365	29%	0.289	S	S	.	.			trans	-129.4	105.1	176.4	-67	-98.1	0	0	0	109.6	P180 S182 Y682 E683 E687 L688 K689	P180-Y685 WeakPolarHBondContact CB-OH 3.01Å; S182-Y685 WeakPolarHBondContact OG-CE1 3.26Å; Y682-Y685 PolarHBondContact O-N 3.25Å; E683-Y685 VanDerWaalsContact C-N 3.29Å; E683-Y685 PolarHBondContact O-N 3.22Å; Y685-E687 VanDerWaalsContact C-N 3.3Å; Y685-E687 PolarHBondContact O-N 3.5Å; Y685-L688 PolarHBondContact O-N 2.91Å; Y685-K689 PolarHBondContact O-N 3.17Å
686	D	53.9	Low	69.1	Low	123 Å²	123	52 Å²	52	66%	0.658	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-55	-41.9	-174.1	-66	-64.6	0	0	0	113.6	L688 K689	D686-L688 PolarHBondContact O-N 3.03Å; D686-K689 PolarHBondContact O-N 3.4Å; D686-K689 VanDerWaalsContact OD1-CE 3.3Å; D686-K689 WeakPolarHBondContact OD1-CE 3.27Å; D686-K689 IonicContact OD1-NZ 2.85Å; D686-K689 PolarHBondContact OD1-NZ 2.9Å
687	E	56.5	Low	69.2	Low	177 Å²	177	51.7 Å²	51.7	83%	0.827	26%	0.262	S	S	*	.	G	3₁₀ helix	trans	-59.6	-12.8	177.6	-58.1	-177.3	157.9	0	0	114.1	Y685	Y685-E687 VanDerWaalsContact C-N 3.3Å; Y685-E687 PolarHBondContact O-N 3.5Å
688	L	62.6	Low	69.5	Low	8 Å²	8	49.4 Å²	49.4	4%	0.042	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-121.1	6.3	-174.4	-56.1	178.2	0	0	0	114	Y682 Y685 D686 D690 I691 L759 M763	Y682-L688 HydrophobicContact CD2-CD1 4.07Å; Y682-L688 HydrophobicContact CG-CD1 4.39Å; Y685-L688 PolarHBondContact O-N 2.91Å; D686-L688 PolarHBondContact O-N 3.03Å; L688-D690 VanDerWaalsContact C-N 3.25Å; L688-D690 PolarHBondContact O-N 2.96Å; L688-I691 HydrophobicContact CD2-CD1 4.23Å; L688-I691 PolarHBondContact O-N 2.86Å; L688-L759 HydrophobicContact CD1-CD1 3.58Å; L688-L759 HydrophobicContact CD2-CD1 3.46Å; L688-L759 VanDerWaalsContact CD2-CD1 3.46Å; L688-L759 HydrophobicContact CG-CD1 4.06Å; L688-M763 HydrophobicContact CD2-CE 4.44Å
689	K	62.8	Low	70.1	Confident	103 Å²	103	53.7 Å²	53.7	45%	0.448	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-28.8	-179.5	-76	178.4	173.6	171.3	0	113.7	P680 E683 Y685 D686	P680-K689 WeakPolarHBondContact CB-O 3.29Å; E683-K689 WeakPolarHBondContact O-CE 3.4Å; Y685-K689 PolarHBondContact O-N 3.17Å; D686-K689 PolarHBondContact O-N 3.4Å; D686-K689 VanDerWaalsContact OD1-CE 3.3Å; D686-K689 WeakPolarHBondContact OD1-CE 3.27Å; D686-K689 IonicContact OD1-NZ 2.85Å; D686-K689 PolarHBondContact OD1-NZ 2.9Å
690	D	70.8	Confident	71	Confident	86 Å²	86	55.6 Å²	55.6	46%	0.46	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-20.3	172.5	-62.9	-3.8	0	0	0	113.5	S638 R639 L688	S638-D690 WeakPolarHBondContact CB-O 2.87Å; R639-D690 IonicContact CZ-OD2 2.66Å; R639-D690 VanDerWaalsContact CZ-OD2 3.25Å; R639-D690 PolarHBondContact N-O 2.89Å; R639-D690 IonicContact NH1-OD2 2.71Å; R639-D690 PolarHBondContact NH1-OD2 2.97Å; R639-D690 IonicContact NH2-OD2 2.94Å; R639-D690 PolarHBondContact NH2-OD2 3.12Å; L688-D690 VanDerWaalsContact C-N 3.25Å; L688-D690 PolarHBondContact O-N 2.96Å
691	I	75.1	Confident	72.1	Confident	19 Å²	19	60.8 Å²	60.8	10%	0.097	30%	0.296	C	S	.	.			trans	-104.8	97.5	-159.4	-54.4	-172.4	0	0	0	110.1	L688 M763 V823	L688-I691 HydrophobicContact CD2-CD1 4.23Å; L688-I691 PolarHBondContact O-N 2.86Å; I691-M763 HydrophobicContact CD1-CE 3.65Å; I691-M763 HydrophobicContact CG2-CE 3.96Å; I691-V823 HydrophobicContact CG2-CG2 3.69Å
692	G	80.4	Confident	73.1	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.9	-166.5	-176.4	0	0	0	0	0	112.9	S638	S638-G692 PolarHBondContact N-O 2.66Å; S638-G692 WeakPolarHBondContact OG-CA 3.29Å
693	M	84.3	Confident	74	Confident	1 Å²	1	62.3 Å²	62.3	1%	0.005	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	147.4	164	76.8	170.5	65	0	0	110	V635 T636 S638 R679 F681 I794 L825 K829 V830 V833	V635-M693 HydrophobicContact CG1-CB 4.48Å; T636-M693 WeakPolarHBondContact O-CA 3.37Å; S638-M693 PolarHBondContact OG-N 2.9Å; S638-M693 PolarHBondContact OG-O 3.01Å; R679-M693 PolarHBondContact N-O 3Å; F681-M693 HydrophobicContact CE1-CB 4.31Å; F681-M693 HydrophobicContact CE1-CE 3.93Å; F681-M693 HydrophobicContact CE1-CG 3.77Å; F681-M693 HydrophobicContact CE1-SD 4.49Å; F681-M693 HydrophobicContact CZ-CB 4.07Å; F681-M693 HydrophobicContact CZ-CE 3.64Å; F681-M693 HydrophobicContact CZ-CG 3.97Å; M693-I794 HydrophobicContact CB-CD1 4.02Å; M693-L825 HydrophobicContact CE-CD2 3.43Å; M693-L825 VanDerWaalsContact CE-CD2 3.43Å; M693-K829 HydrophobicContact CE-CB 3.52Å; M693-K829 HydrophobicContact CE-CD 3.65Å; M693-K829 HydrophobicContact CE-CG 4.21Å; M693-K829 HydrophobicContact SD-CB 4.35Å; M693-V830 HydrophobicContact SD-CG2 4.2Å; M693-V833 HydrophobicContact SD-CG2 4.33Å
694	T	87.7	Confident	75.1	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	131	160.6	-66.8	0	0	0	0	108.2	T636 S638 V641 V676 A678 L696	T636-T694 PolarHBondContact N-O 2.8Å; T636-T694 PolarHBondContact O-N 2.88Å; S638-T694 WeakPolarHBondContact CA-OG1 3.39Å; S638-T694 PolarHBondContact OG-OG1 2.94Å; V641-T694 HydrophobicContact CB-CG2 4.13Å; V641-T694 HydrophobicContact CG1-CG2 4.4Å; V641-T694 PolarHBondContact O-OG1 3.35Å; V676-T694 HydrophobicContact CG1-CG2 3.58Å; A678-T694 WeakPolarHBondContact CA-OG1 3.46Å; A678-T694 HydrophobicContact CB-CG2 4.39Å; T694-L696 HydrophobicContact CG2-CD2 3.76Å
695	M	89.7	Confident	75.7	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	118.4	169.4	-179.1	-166.8	74.9	0	0	108.3	E633 V634 Y677 V830 V833 Q834	E633-M695 HydrophobicContact CG-SD 4.37Å; V634-M695 CarbonylContact O-C 3.28Å; V634-M695 WeakPolarHBondContact O-CA 3.48Å; Y677-M695 WeakPolarHBondContact CB-O 3.41Å; Y677-M695 HydrophobicContact CD2-CE 3.3Å; Y677-M695 HydrophobicContact CE2-CE 3.84Å; Y677-M695 HydrophobicContact CG-CE 3.79Å; Y677-M695 PolarHBondContact N-O 2.99Å; Y677-M695 PolarHBondContact O-N 2.99Å; M695-V830 HydrophobicContact CG-CG1 4.49Å; M695-V830 HydrophobicContact SD-CG1 3.77Å; M695-V833 HydrophobicContact CB-CG1 4.16Å; M695-V833 HydrophobicContact CE-CB 4.29Å; M695-V833 HydrophobicContact CE-CG1 3.73Å; M695-V833 HydrophobicContact SD-CB 4.35Å; M695-V833 HydrophobicContact SD-CG1 4.26Å; M695-Q834 HydrophobicContact CE-CG 3.7Å; M695-Q834 HydrophobicContact SD-CG 4.16Å
696	L	91.6	Very high	75.4	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	131.3	171.6	-48.4	177.4	0	0	0	108.2	I606 V634 V641 V651 V673 V676 T694	I606-L696 HydrophobicContact CD1-CD1 3.85Å; I606-L696 HydrophobicContact CG1-CD1 4.19Å; I606-L696 HydrophobicContact CG2-CD1 4.44Å; V634-L696 HydrophobicContact CB-CB 4.26Å; V634-L696 HydrophobicContact CG1-CD1 4.27Å; V634-L696 PolarHBondContact N-O 3.44Å; V634-L696 PolarHBondContact O-N 3.2Å; V641-L696 HydrophobicContact CB-CD2 4.2Å; V641-L696 HydrophobicContact CG1-CD2 3.88Å; V641-L696 HydrophobicContact CG2-CD1 4.32Å; V641-L696 HydrophobicContact CG2-CD2 4.09Å; V651-L696 HydrophobicContact CG2-CD1 4.03Å; V673-L696 HydrophobicContact CG1-CB 4.09Å; V673-L696 HydrophobicContact CG1-CD2 4.35Å; V673-L696 HydrophobicContact CG2-CB 4.22Å; V673-L696 HydrophobicContact CG2-CD1 4.17Å; V676-L696 HydrophobicContact CB-CD2 4.48Å; V676-L696 HydrophobicContact CG1-CD2 4.11Å; V676-L696 HydrophobicContact CG2-CD2 4.06Å; T694-L696 HydrophobicContact CG2-CD2 3.76Å
697	K	91.2	Very high	75.3	Confident	45 Å²	45	51.4 Å²	51.4	20%	0.196	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	112.2	170.6	-167.8	68.9	168	176.6	0	108.2	D632 E633 G674 N675 Y677	D632-K697 HydrophobicContact CB-CD 4.36Å; D632-K697 VanDerWaalsContact CG-CE 3.47Å; D632-K697 CarbonylContact O-C 2.9Å; D632-K697 WeakPolarHBondContact O-CA 3.34Å; D632-K697 IonicContact OD1-NZ 3.88Å; D632-K697 PolarHBondContact OD1-NZ 3.28Å; D632-K697 WeakPolarHBondContact OD2-CE 3.24Å; D632-K697 IonicContact OD2-NZ 2.68Å; D632-K697 PolarHBondContact OD2-NZ 3.2Å; E633-K697 HydrophobicContact CG-CD 3.89Å; E633-K697 IonicContact OE1-NZ 3.25Å; E633-K697 PolarHBondContact OE1-NZ 3.17Å; G674-K697 PolarHBondContact N-O 3.07Å; N675-K697 HydrophobicContact CB-CB 4.26Å; N675-K697 PolarHBondContact N-O 2.81Å; N675-K697 PolarHBondContact O-N 2.79Å; Y677-K697 HydrophobicContact CD2-CB 4.35Å; Y677-K697 HydrophobicContact CE2-CB 3.83Å
698	L	90.4	Very high	75.8	Confident	7 Å²	7	43.1 Å²	43.1	4%	0.037	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	146.8	-179.8	-55.4	179.6	0	0	0	110.4	D632 V634 V651 I653 I671 V673 H700 V702	D632-L698 HydrophobicContact CB-CB 4.28Å; D632-L698 PolarHBondContact O-N 3.47Å; V634-L698 HydrophobicContact CG2-CD1 4.07Å; V634-L698 HydrophobicContact CG2-CG 4.4Å; V651-L698 HydrophobicContact CB-CD2 3.95Å; V651-L698 HydrophobicContact CG2-CD2 3.74Å; I653-L698 HydrophobicContact CD1-CD1 4.06Å; I671-L698 HydrophobicContact CG2-CB 4.07Å; I671-L698 HydrophobicContact CG2-CD1 4.22Å; I671-L698 HydrophobicContact CG2-CD2 4.38Å; I671-L698 HydrophobicContact CG2-CG 4.45Å; V673-L698 HydrophobicContact CG2-CD2 4.26Å; L698-H700 WeakPolarHBondContact CB-O 3.49Å; L698-H700 PolarHBondContact O-N 2.85Å; L698-V702 HydrophobicContact CD1-CG2 3.78Å
699	K	88	Confident	76.3	Confident	113 Å²	113	46.1 Å²	46.1	49%	0.491	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	-24.8	175.3	-66.3	-168.9	-173.3	174.3	0	113.1	E672	E672-K699 HydrophobicContact CB-CD 3.86Å; E672-K699 HydrophobicContact CB-CG 4.16Å; E672-K699 PolarHBondContact O-N 3.05Å; E672-K699 WeakPolarHBondContact OE2-CD 3.38Å; E672-K699 WeakPolarHBondContact OE2-CE 3.22Å; E672-K699 IonicContact OE2-NZ 2.8Å; E672-K699 PolarHBondContact OE2-NZ 3.47Å
700	H	85.5	Confident	77.1	Confident	114 Å²	114	42.8 Å²	42.8	53%	0.528	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	140.2	-179.7	-57.7	-56	0	0	0	110.7	I671 L698	I671-H700 HydrophobicContact CG2-CB 4.48Å; L698-H700 WeakPolarHBondContact CB-O 3.49Å; L698-H700 PolarHBondContact O-N 2.85Å
701	R	83.7	Confident	77.9	Confident	135 Å²	135	38.9 Å²	38.9	51%	0.509	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	124.1	179	-53.6	-169.9	67.4	-146.4	-5.4	109.4	Y630 D632	Y630-R701 PolarHBondContact O-NH2 2.94Å; D632-R701 HydrophobicContact CB-CB 4.44Å; D632-R701 HydrophobicContact CB-CG 3.97Å; D632-R701 IonicContact OD2-NE 3.76Å
702	V	79.5	Confident	78.3	Confident	23 Å²	23	41.4 Å²	41.4	14%	0.139	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	137	-176.9	-160.9	0	0	0	0	108.8	Y630 S631 I653 I671 L698	Y630-V702 CarbonylContact C-O 3.54Å; Y630-V702 VanDerWaalsContact CA-O 3.23Å; Y630-V702 WeakPolarHBondContact CA-O 3.46Å; S631-V702 PolarHBondContact N-O 3.3Å; S631-V702 PolarHBondContact O-N 2.91Å; I653-V702 HydrophobicContact CD1-CB 4.31Å; I653-V702 HydrophobicContact CD1-CG1 4.33Å; I653-V702 HydrophobicContact CD1-CG2 3.98Å; I653-V702 HydrophobicContact CG2-CG1 4.49Å; I671-V702 HydrophobicContact CD1-CG1 4.27Å; I671-V702 HydrophobicContact CD1-CG2 3.47Å; I671-V702 VanDerWaalsContact CD1-CG2 3.47Å; L698-V702 HydrophobicContact CD1-CG2 3.78Å
703	K	74.1	Confident	78.6	Confident	75 Å²	75	42.5 Å²	42.5	33%	0.326	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	141	170	-162.2	171.1	-175.5	174.8	0	108.1	E629 Y630 I705	E629-K703 CarbonylContact O-C 3.52Å; E629-K703 WeakPolarHBondContact O-CA 3.47Å; Y630-K703 HydrophobicContact CD1-CB 3.91Å; Y630-K703 HydrophobicContact CD1-CG 4.33Å; Y630-K703 HydrophobicContact CE1-CB 3.58Å; Y630-K703 HydrophobicContact CE1-CD 4.27Å; Y630-K703 HydrophobicContact CE1-CG 3.83Å; Y630-K703 HydrophobicContact CE2-CG 4.44Å; K703-I705 HydrophobicContact CB-CG2 4.3Å; K703-I705 PolarHBondContact O-N 2.89Å
704	V	68.7	Low	78.6	Confident	38 Å²	38	42.6 Å²	42.6	23%	0.23	21%	0.212	C	C	.	.			trans	-69.5	84.1	168.4	177.6	0	0	0	0	106.6	L622 A624 E629 N706 P710	L622-V704 HydrophobicContact CD2-CG2 4.28Å; A624-V704 HydrophobicContact CB-CG2 3.85Å; E629-V704 PolarHBondContact O-N 3.03Å; V704-N706 PolarHBondContact O-N 3.47Å; V704-P710 HydrophobicContact CG1-CG 3.64Å
705	I	60.7	Low	78.1	Confident	47 Å²	47	45.7 Å²	45.7	24%	0.241	22%	0.224	C	C	.	.			trans	-68.3	130.7	-178	59.8	175.5	0	0	0	109.2	K703 G707 V708	K703-I705 HydrophobicContact CB-CG2 4.3Å; K703-I705 PolarHBondContact O-N 2.89Å; I705-G707 PolarHBondContact O-N 3.39Å; I705-V708 HydrophobicContact CD1-CG2 3.82Å; I705-V708 HydrophobicContact CG1-CB 3.91Å; I705-V708 HydrophobicContact CG1-CG2 3.72Å; I705-V708 PolarHBondContact O-N 3.09Å
706	N	46.4	Very low	77.1	Confident	70 Å²	70	47.6 Å²	47.6	37%	0.374	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	119.9	175.6	-133.8	33.4	0	0	0	106.3	I534 A535 K536 V704	I534-N706 HydrophobicContact CB-CB 4.08Å; I534-N706 HydrophobicContact CG2-CB 3.58Å; I534-N706 WeakPolarHBondContact CG2-ND2 3.11Å; A535-N706 WeakPolarHBondContact CA-O 3.45Å; A535-N706 WeakPolarHBondContact CB-O 3.43Å; A535-N706 PolarHBondContact N-O 2.68Å; A535-N706 CarbonylContact O-C 3.57Å; A535-N706 WeakPolarHBondContact O-CA 3.2Å; A535-N706 WeakPolarHBondContact O-CB 3.29Å; A535-N706 PolarHBondContact O-ND2 3.26Å; K536-N706 VanDerWaalsContact CG-ND2 3.32Å; K536-N706 WeakPolarHBondContact CG-ND2 3.39Å; V704-N706 PolarHBondContact O-N 3.47Å
707	G	52.8	Low	76	Confident	18 Å²	18	48.2 Å²	48.2	19%	0.186	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	125.5	-30.7	-167	0	0	0	0	0	112.2	A535 I705	A535-G707 PolarHBondContact O-N 3.35Å; I705-G707 PolarHBondContact O-N 3.39Å
708	V	66.5	Low	75.4	Confident	3 Å²	3	46.4 Å²	46.4	2%	0.018	24%	0.236	C	C	.	.	S	Bend	trans	-108.9	108	171.3	176.9	0	0	0	0	107.9	S602 V604 I653 I705 P710	S602-V708 WeakPolarHBondContact O-CG1 3.37Å; V604-V708 HydrophobicContact CG2-CG1 4.33Å; I653-V708 HydrophobicContact CG2-CG1 4.08Å; I653-V708 HydrophobicContact CG2-CG2 4.19Å; I705-V708 HydrophobicContact CD1-CG2 3.82Å; I705-V708 HydrophobicContact CG1-CB 3.91Å; I705-V708 HydrophobicContact CG1-CG2 3.72Å; I705-V708 PolarHBondContact O-N 3.09Å; V708-P710 WeakPolarHBondContact O-CD 3.34Å
709	Q	72.1	Confident	75.2	Confident	71 Å²	71	46.3 Å²	46.3	33%	0.332	24%	0.237	S	C	.	.			trans	-91.6	111.2	-173.4	-175.4	171.9	9.2	0	0	111.8	A601 F711	A601-Q709 PolarHBondContact O-N 3.23Å; Q709-F711 HydrophobicContact CB-CE1 4.34Å; Q709-F711 HydrophobicContact CB-CE2 4.49Å; Q709-F711 HydrophobicContact CB-CZ 4.05Å; Q709-F711 VanDerWaalsContact CD-CE1 3.47Å; Q709-F711 HydrophobicContact CG-CD1 4.21Å; Q709-F711 HydrophobicContact CG-CE1 3.79Å; Q709-F711 HydrophobicContact CG-CZ 4.03Å; Q709-F711 WeakPolarHBondContact O-CD2 3Å; Q709-F711 WeakPolarHBondContact O-CE2 3.43Å
710	P	81	Confident	75.3	Confident	33 Å²	33	41 Å²	41	21%	0.214	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-71.6	130.6	166.4	31	-35	0	0	0	109.5	L622 A624 V704 V708	L622-P710 WeakPolarHBondContact O-CA 3.23Å; L622-P710 WeakPolarHBondContact O-CB 3.09Å; A624-P710 HydrophobicContact CB-CB 3.86Å; A624-P710 HydrophobicContact CB-CG 3.98Å; V704-P710 HydrophobicContact CG1-CG 3.64Å; V708-P710 WeakPolarHBondContact O-CD 3.34Å
711	F	85.8	Confident	75.4	Confident	5 Å²	5	37 Å²	37	2%	0.022	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-97.2	134.4	179.8	-64.2	-72.6	0	0	0	111.2	P599 T621 Q709 P780 V782 W789 Q791	P599-F711 HydrophobicContact CB-CE1 4.09Å; P599-F711 HydrophobicContact CB-CZ 4.31Å; T621-F711 HydrophobicContact CG2-CD2 4.05Å; Q709-F711 HydrophobicContact CB-CE1 4.34Å; Q709-F711 HydrophobicContact CB-CE2 4.49Å; Q709-F711 HydrophobicContact CB-CZ 4.05Å; Q709-F711 VanDerWaalsContact CD-CE1 3.47Å; Q709-F711 HydrophobicContact CG-CD1 4.21Å; Q709-F711 HydrophobicContact CG-CE1 3.79Å; Q709-F711 HydrophobicContact CG-CZ 4.03Å; Q709-F711 WeakPolarHBondContact O-CD2 3Å; Q709-F711 WeakPolarHBondContact O-CE2 3.43Å; F711-P780 HydrophobicContact CD2-CB 4.31Å; F711-P780 HydrophobicContact CD2-CG 4.21Å; F711-P780 HydrophobicContact CE2-CG 4.17Å; F711-V782 HydrophobicContact CD1-CB 4.47Å; F711-V782 HydrophobicContact CD1-CG1 3.53Å; F711-V782 HydrophobicContact CD1-CG2 4.02Å; F711-V782 HydrophobicContact CD2-CG2 3.76Å; F711-V782 HydrophobicContact CE1-CG1 3.74Å; F711-V782 HydrophobicContact CE1-CG2 4.08Å; F711-V782 HydrophobicContact CE2-CG2 3.83Å; F711-V782 HydrophobicContact CG-CG1 4.07Å; F711-V782 HydrophobicContact CG-CG2 3.87Å; F711-V782 HydrophobicContact CZ-CG1 4.43Å; F711-V782 HydrophobicContact CZ-CG2 3.99Å; F711-W789 HydrophobicContact CD1-CB 4.3Å; F711-W789 HydrophobicContact CE1-CB 4.41Å; F711-Q791 HydrophobicContact CB-CB 3.72Å
712	P	85.3	Confident	75.6	Confident	71 Å²	71	32 Å²	32	46%	0.461	19%	0.185	S	C	.	.	P	Polyproline II helix	trans	-68.6	142	175	29.2	-34.3	0	0	0	110.7	W789 V790 Q791	P712-W789 VanDerWaalsContact CD-O 3.27Å; P712-W789 WeakPolarHBondContact CD-O 3.47Å; P712-W789 WeakPolarHBondContact CG-O 3.47Å; P712-V790 HydrophobicContact CG-CG2 4.33Å; P712-V790 WeakPolarHBondContact O-CA 3.44Å; P712-V790 WeakPolarHBondContact O-CG1 3.45Å; P712-Q791 PolarHBondContact O-N 3Å
713	L	86.1	Confident	76	Confident	24 Å²	24	39.7 Å²	39.7	13%	0.126	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-76.7	150.4	175	-61.4	-176.3	0	0	0	112	Y623 Q791 L825 V830	Y623-L713 HydrophobicContact CD2-CD1 4Å; Y623-L713 HydrophobicContact CD2-CG 4.12Å; Y623-L713 HydrophobicContact CE2-CD1 3.52Å; Y623-L713 HydrophobicContact CE2-CG 3.79Å; L713-Q791 HydrophobicContact CD2-CB 4.41Å; L713-L825 HydrophobicContact CD2-CB 4.25Å; L713-L825 HydrophobicContact CD2-CD1 3.53Å; L713-L825 HydrophobicContact CD2-CG 4.46Å; L713-V830 HydrophobicContact CD1-CB 4.45Å; L713-V830 HydrophobicContact CD1-CG2 3.63Å
714	P	84.5	Confident	76.7	Confident	2 Å²	2	38 Å²	38	1%	0.013	21%	0.205	C	C	.	.	P	Polyproline II helix	trans	-63.2	150.4	173.6	27.8	-38.1	0	0	0	111.5	T718 V790 Q791 F792 L825 E826 G827	P714-T718 WeakPolarHBondContact CB-OG1 3.4Å; P714-V790 HydrophobicContact CB-CG1 3.96Å; P714-Q791 WeakPolarHBondContact CD-O 3.1Å; P714-F792 HydrophobicContact CB-CD1 3.6Å; P714-F792 HydrophobicContact CB-CE1 3.54Å; P714-F792 HydrophobicContact CB-CG 4.39Å; P714-F792 HydrophobicContact CB-CZ 4.29Å; P714-F792 HydrophobicContact CG-CD1 3.91Å; P714-F792 HydrophobicContact CG-CE1 4.36Å; P714-F792 HydrophobicContact CG-CG 4.45Å; P714-L825 HydrophobicContact CG-CB 4.34Å; P714-L825 VanDerWaalsContact CG-O 3.22Å; P714-L825 WeakPolarHBondContact CG-O 3.3Å; P714-E826 CarbonylContact O-C 3.53Å; P714-G827 VanDerWaalsContact O-CA 3.23Å; P714-G827 WeakPolarHBondContact O-CA 3.47Å; P714-G827 PolarHBondContact O-N 2.87Å
715	Y	75.9	Confident	77.8	Confident	65 Å²	65	41.3 Å²	41.3	26%	0.255	22%	0.218	S	C	.	.	P	Polyproline II helix	trans	-70	149	176.1	-58.5	-75.2	0	0	0	111.3	I262 L402 G717 T718	I262-Y715 HydrophobicContact CB-CD2 4.08Å; I262-Y715 HydrophobicContact CB-CE2 4.35Å; I262-Y715 HydrophobicContact CB-CG 4.36Å; I262-Y715 HydrophobicContact CG1-CD2 4.41Å; I262-Y715 HydrophobicContact CG2-CD1 3.71Å; I262-Y715 HydrophobicContact CG2-CD2 3.6Å; I262-Y715 HydrophobicContact CG2-CE1 3.92Å; I262-Y715 HydrophobicContact CG2-CE2 3.81Å; I262-Y715 HydrophobicContact CG2-CG 3.53Å; L402-Y715 HydrophobicContact CD1-CD1 3.64Å; L402-Y715 HydrophobicContact CD1-CE1 3.56Å; L402-Y715 HydrophobicContact CD2-CE1 3.98Å; L402-Y715 HydrophobicContact CG-CE1 4.46Å; Y715-G717 PolarHBondContact O-N 3.09Å; Y715-T718 PolarHBondContact N-OG1 2.72Å; Y715-T718 WeakPolarHBondContact O-CB 3.28Å; Y715-T718 PolarHBondContact O-N 2.95Å; Y715-T718 PolarHBondContact O-OG1 2.88Å
716	S	69.9	Low	79.5	Confident	41 Å²	41	39.1 Å²	39.1	29%	0.287	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55	126.1	177.2	-53.5	0	0	0	0	111.6	D828	S716-D828 WeakPolarHBondContact CB-OD2 3.23Å; S716-D828 PolarHBondContact OG-OD1 3.45Å; S716-D828 PolarHBondContact OG-OD2 3.15Å
717	G	68.1	Low	81.7	Confident	12 Å²	12	36.4 Å²	36.4	12%	0.124	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.8	14.8	-173.1	0	0	0	0	0	115.4	Q268 Y715	Q268-G717 WeakPolarHBondContact CG-O 3.42Å; Y715-G717 PolarHBondContact O-N 3.09Å
718	T	78.8	Confident	83.7	Confident	8 Å²	8	35.5 Å²	35.5	5%	0.049	18%	0.183	C	C	.	.			trans	-107.8	151.8	163.6	62	0	0	0	0	110.8	I262 Q268 P714 Y715	I262-T718 HydrophobicContact CD1-CG2 3.38Å; I262-T718 HydrophobicContact CG1-CG2 4.3Å; Q268-T718 HydrophobicContact CB-CG2 4.08Å; P714-T718 WeakPolarHBondContact CB-OG1 3.4Å; Y715-T718 PolarHBondContact N-OG1 2.72Å; Y715-T718 WeakPolarHBondContact O-CB 3.28Å; Y715-T718 PolarHBondContact O-N 2.95Å; Y715-T718 PolarHBondContact O-OG1 2.88Å
719	G	85.7	Confident	84.7	Confident	4 Å²	4	35.4 Å²	35.4	4%	0.041	18%	0.182	C	C	.	.			trans	-147.3	163.6	177.3	0	0	0	0	0	112	M724 Y764	G719-M724 WeakPolarHBondContact O-CE 3.49Å; G719-Y764 WeakPolarHBondContact CA-OH 3.48Å
720	A	90.5	Very high	85.5	Confident	3 Å²	3	32.2 Å²	32.2	3%	0.025	17%	0.168	C	C	.	.			trans	-73.5	153.7	170.7	0	0	0	0	0	110	M724 L744 Y764 F792	A720-M724 HydrophobicContact CB-SD 4.18Å; A720-L744 HydrophobicContact CB-CD1 3.59Å; A720-Y764 HydrophobicContact CB-CE1 4.13Å; A720-Y764 HydrophobicContact CB-CE2 4.23Å; A720-Y764 PolarHBondContact N-OH 2.87Å; A720-F792 HydrophobicContact CB-CB 3.98Å; A720-F792 HydrophobicContact CB-CD1 4.05Å; A720-F792 HydrophobicContact CB-CD2 4.24Å; A720-F792 HydrophobicContact CB-CG 3.84Å; A720-F792 VanDerWaalsContact N-CD1 3.3Å
721	S	87.4	Confident	85.8	Confident	30 Å²	30	30.8 Å²	30.8	21%	0.21	16%	0.159	C	C	.	.			trans	-128.3	163	166.5	79.4	0	0	0	0	110.5	E228 R723 M724	E228-S721 WeakPolarHBondContact OE1-CB 3.4Å; E228-S721 PolarHBondContact OE1-OG 2.73Å; S721-R723 PolarHBondContact O-N 3.38Å; S721-M724 PolarHBondContact O-N 3.38Å
722	S	88.3	Confident	85.7	Confident	30 Å²	30	30.5 Å²	30.5	21%	0.21	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-5.7	179.7	50.8	0	0	0	0	114.8	Q743 L744	S722-Q743 PolarHBondContact O-NE2 3.1Å; S722-L744 WeakPolarHBondContact CA-O 3.35Å; S722-L744 WeakPolarHBondContact CB-O 3.32Å
723	R	86.9	Confident	85.6	Confident	183 Å²	183	32.6 Å²	32.6	69%	0.691	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.4	1.8	177.7	-57.8	-173.5	-64.7	176.6	2.7	113.7	E228 S721	E228-R723 IonicContact OE1-CZ 2.87Å; E228-R723 IonicContact OE1-NE 2.72Å; E228-R723 PolarHBondContact OE1-NE 3.39Å; E228-R723 VanDerWaalsContact OE1-NE 3.15Å; E228-R723 IonicContact OE1-NH2 3.08Å; E228-R723 PolarHBondContact OE1-NH2 2.89Å; E228-R723 IonicContact OE2-CZ 3.86Å; E228-R723 IonicContact OE2-NE 2.65Å; E228-R723 PolarHBondContact OE2-NE 3.2Å; E228-R723 IonicContact OE2-NH1 2.85Å; E228-R723 IonicContact OE2-NH2 3.39Å; E228-R723 PolarHBondContact OE2-NH2 2.92Å; S721-R723 PolarHBondContact O-N 3.38Å
724	M	90.1	Very high	85.1	Confident	41 Å²	41	33.6 Å²	33.6	20%	0.202	17%	0.165	C	C	.	.	S	Bend	trans	-87.3	138.3	169.9	-61.5	-172.7	-173.9	0	0	110	G719 A720 S721 C726 C783 F792	G719-M724 WeakPolarHBondContact O-CE 3.49Å; A720-M724 HydrophobicContact CB-SD 4.18Å; S721-M724 PolarHBondContact O-N 3.38Å; M724-C726 PolarHBondContact O-N 3.35Å; M724-C783 HydrophobicContact CB-CB 4.15Å; M724-C783 HydrophobicContact SD-CB 4.21Å; M724-F792 HydrophobicContact CE-CZ 4.37Å; M724-F792 HydrophobicContact SD-CE2 4.07Å; M724-F792 HydrophobicContact SD-CZ 4.17Å
725	Q	91.9	Very high	84.8	Confident	107 Å²	107	33.5 Å²	33.5	50%	0.5	17%	0.165	S	C	.	.			trans	-67.9	125.2	163.4	-70.1	178.1	-14.9	0	0	108.5	C783 Q784	Q725-C783 CarbonylContact O-C 3.56Å; Q725-C783 VanDerWaalsContact O-CA 3.28Å; Q725-C783 WeakPolarHBondContact O-CA 3.49Å; Q725-Q784 PolarHBondContact O-N 2.97Å
726	C	95.1	Very high	84.8	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	144	-179.3	-61.2	0	0	0	0	110.7	M724 Y742 L744 L781 V782 C783	M724-C726 PolarHBondContact O-N 3.35Å; C726-Y742 PolarHBondContact O-N 3.17Å; C726-L744 HydrophobicContact CB-CG 4.34Å; C726-L744 WeakPolarHBondContact SG-CD1 3.48Å; C726-L781 HydrophobicContact CB-CD1 4Å; C726-V782 CarbonylContact C-O 3.57Å; C726-V782 WeakPolarHBondContact CA-O 3.46Å; C726-C783 HydrophobicContact CB-CB 4.06Å; C726-C783 WeakPolarHBondContact CB-SG 3.28Å; C726-C783 WeakPolarHBondContact SG-CB 3.48Å; C726-C783 CovalentContact SG-SG 2.04Å; C726-C783 PolarHBondContact SG-SG 2.87Å
727	F	93.4	Very high	85.4	Confident	13 Å²	13	30.7 Å²	30.7	6%	0.057	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	150.9	178.4	-68.2	-96.7	0	0	0	110.3	L598 P599 R739 V740 Q741 V782 W789	L598-F727 HydrophobicContact CD2-CE2 4.29Å; L598-F727 HydrophobicContact CD2-CZ 4.05Å; P599-F727 HydrophobicContact CG-CB 4Å; P599-F727 HydrophobicContact CG-CD2 4.16Å; P599-F727 HydrophobicContact CG-CG 4.1Å; F727-R739 HydrophobicContact CD1-CB 4.14Å; F727-R739 HydrophobicContact CD1-CG 4.39Å; F727-V740 CarbonylContact C-O 3.53Å; F727-V740 VanDerWaalsContact CA-O 3.25Å; F727-V740 WeakPolarHBondContact CA-O 3.42Å; F727-Q741 HydrophobicContact CD1-CB 4.03Å; F727-Q741 HydrophobicContact CE1-CB 3.74Å; F727-Q741 HydrophobicContact CE1-CG 4.26Å; F727-Q741 HydrophobicContact CZ-CB 4.3Å; F727-Q741 HydrophobicContact CZ-CG 4.34Å; F727-V782 PolarHBondContact N-O 2.92Å; F727-V782 PolarHBondContact O-N 3.07Å; F727-W789 AromaticContact CD2-CH2 3.76Å; F727-W789 HydrophobicContact CD2-CH2 3.76Å; F727-W789 AromaticContact CD2-CZ3 3.82Å; F727-W789 HydrophobicContact CD2-CZ3 3.82Å; F727-W789 AromaticContact CE2-CH2 3.74Å; F727-W789 HydrophobicContact CE2-CH2 3.74Å; F727-W789 HydrophobicContact CE2-CZ3 4.26Å
728	I	93.5	Very high	86	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	127.7	161.2	-60.2	-66.5	0	0	0	107.8	R739 V740 Y742 L773 L781 Y795 F822	I728-R739 WeakPolarHBondContact O-CA 3.33Å; I728-V740 PolarHBondContact N-O 3.44Å; I728-V740 PolarHBondContact O-N 3.11Å; I728-Y742 HydrophobicContact CB-CD2 4.13Å; I728-Y742 HydrophobicContact CB-CE2 4.17Å; I728-Y742 HydrophobicContact CG1-CD2 3.43Å; I728-Y742 VanDerWaalsContact CG1-CD2 3.43Å; I728-Y742 HydrophobicContact CG1-CE2 3.63Å; I728-Y742 HydrophobicContact CG1-CG 4.07Å; I728-L773 HydrophobicContact CB-CD1 4.06Å; I728-L773 HydrophobicContact CG2-CD1 3.69Å; I728-L773 HydrophobicContact CG2-CD2 4.19Å; I728-L781 HydrophobicContact CD1-CB 3.95Å; I728-L781 HydrophobicContact CD1-CD1 3.96Å; I728-Y795 HydrophobicContact CD1-CD2 4.23Å; I728-Y795 HydrophobicContact CG1-CD2 4.39Å; I728-F822 HydrophobicContact CD1-CD1 4.12Å; I728-F822 HydrophobicContact CD1-CE1 3.42Å; I728-F822 VanDerWaalsContact CD1-CE1 3.42Å; I728-F822 HydrophobicContact CD1-CZ 4.16Å; I728-F822 HydrophobicContact CG1-CE1 4.17Å
729	S	88.9	Confident	86.4	Confident	1 Å²	1	30.5 Å²	30.5	1%	0.007	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	121.6	172.8	-174.4	0	0	0	0	108.6	G600 A601 S602 P780	G600-S729 PolarHBondContact O-OG 2.83Å; A601-S729 VanDerWaalsContact CA-OG 3.31Å; A601-S729 WeakPolarHBondContact CA-OG 3.39Å; S602-S729 PolarHBondContact N-OG 2.79Å; S729-P780 WeakPolarHBondContact O-CD 3.48Å
730	G	89	Confident	86.6	Confident	4 Å²	4	30.7 Å²	30.7	4%	0.041	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159	-155.4	-174.6	0	0	0	0	0	111.4	P737 V738	G730-P737 CarbonylContact O-C 3.58Å; G730-P737 VanDerWaalsContact O-CA 3.29Å; G730-P737 WeakPolarHBondContact O-CA 3.44Å; G730-V738 PolarHBondContact N-O 2.72Å; G730-V738 VanDerWaalsContact N-O 3.11Å; G730-V738 PolarHBondContact O-N 2.86Å
731	V	86.1	Confident	86.6	Confident	2 Å²	2	36 Å²	36	1%	0.012	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	153.6	174.2	-68.2	0	0	0	0	110.7	L657 M736 Q774	L657-V731 HydrophobicContact CB-CG1 4.25Å; L657-V731 HydrophobicContact CB-CG2 4.33Å; L657-V731 HydrophobicContact CD2-CG2 3.93Å; V731-M736 CarbonylContact C-O 3.6Å; V731-M736 WeakPolarHBondContact CA-O 3.39Å; V731-M736 WeakPolarHBondContact CB-O 3.38Å; V731-Q774 HydrophobicContact CG2-CB 4.42Å; V731-Q774 PolarHBondContact O-N 2.94Å
732	C	84.8	Confident	86.8	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	16%	0.16	C	C	.	.			trans	-93.9	-178.8	176.1	68.8	0	0	0	0	112.9	H519 H734 G735 M736 V738 V772	H519-C732 WeakPolarHBondContact NE2-CB 3.17Å; C732-H734 PolarHBondContact O-N 3.3Å; C732-G735 PolarHBondContact O-N 2.63Å; C732-M736 PolarHBondContact N-O 2.87Å; C732-V738 HydrophobicContact CB-CG1 3.7Å; C732-V738 HydrophobicContact CB-CG2 4.24Å; C732-V772 VanDerWaalsContact CA-O 3.27Å; C732-V772 WeakPolarHBondContact CA-O 3.4Å; C732-V772 WeakPolarHBondContact CB-O 3.38Å
733	Q	82.1	Confident	87.1	Confident	115 Å²	115	37.5 Å²	37.5	54%	0.537	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	4.9	175.3	68.3	154.5	36.8	0	0	115.1	R659	R659-Q733 PolarHBondContact NH1-O 3.4Å; R659-Q733 PolarHBondContact NH2-O 3.09Å
734	H	76.7	Confident	87.4	Confident	45 Å²	45	28.9 Å²	28.9	21%	0.208	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.4	-4.2	172.2	-50.3	122	0	0	0	112.7	C732 M736	C732-H734 PolarHBondContact O-N 3.3Å; H734-M736 HydrophobicContact CB-CG 4.21Å
735	G	76.9	Confident	87.5	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.136	C	C	.	.	S	Bend	trans	82.3	-3.2	-173.5	0	0	0	0	0	114.3	L657 C732	L657-G735 PolarHBondContact N-O 3.35Å; C732-G735 PolarHBondContact O-N 2.63Å
736	M	77.7	Confident	87.5	Confident	44 Å²	44	25 Å²	25	22%	0.217	12%	0.121	C	C	.	.			trans	-74.6	143.1	175.6	-57.4	-60.1	-70.9	0	0	110.9	Y509 L656 V731 C732 H734	Y509-M736 HydrophobicContact CD2-SD 4.11Å; Y509-M736 HydrophobicContact CE2-SD 4.32Å; Y509-M736 HydrophobicContact CG-SD 4.42Å; L656-M736 HydrophobicContact CD2-CE 3.78Å; L656-M736 HydrophobicContact CD2-SD 3.45Å; L656-M736 WeakPolarHBondContact CD2-SD 3.38Å; V731-M736 CarbonylContact C-O 3.6Å; V731-M736 WeakPolarHBondContact CA-O 3.39Å; V731-M736 WeakPolarHBondContact CB-O 3.38Å; C732-M736 PolarHBondContact N-O 2.87Å; H734-M736 HydrophobicContact CB-CG 4.21Å
737	P	81.1	Confident	87.3	Confident	3 Å²	3	25.9 Å²	25.9	2%	0.019	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	139	175.6	28.9	-33.9	0	0	0	111.2	I522 V524 A601 S655 G730	I522-P737 HydrophobicContact CB-CB 4.13Å; I522-P737 HydrophobicContact CB-CG 4.19Å; I522-P737 PolarHBondContact N-O 3.4Å; I522-P737 WeakPolarHBondContact O-CG 3.41Å; V524-P737 HydrophobicContact CG2-CG 4.27Å; A601-P737 HydrophobicContact CB-CB 3.73Å; A601-P737 HydrophobicContact CB-CG 4.41Å; S655-P737 WeakPolarHBondContact O-CB 3.09Å; S655-P737 VanDerWaalsContact O-CD 3.3Å; S655-P737 WeakPolarHBondContact O-CD 3.04Å; S655-P737 VanDerWaalsContact O-CG 3.32Å; S655-P737 WeakPolarHBondContact O-CG 3.35Å; G730-P737 CarbonylContact O-C 3.58Å; G730-P737 VanDerWaalsContact O-CA 3.29Å; G730-P737 WeakPolarHBondContact O-CA 3.44Å
738	V	82	Confident	87.1	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	150.8	-176.7	-65.2	0	0	0	0	111.4	G730 C732 V772 L773	G730-V738 PolarHBondContact N-O 2.72Å; G730-V738 VanDerWaalsContact N-O 3.11Å; G730-V738 PolarHBondContact O-N 2.86Å; C732-V738 HydrophobicContact CB-CG1 3.7Å; C732-V738 HydrophobicContact CB-CG2 4.24Å; V738-V772 HydrophobicContact CB-CG1 4.38Å; V738-V772 HydrophobicContact CG2-CG1 4.08Å; V738-L773 HydrophobicContact CG2-CD2 3.86Å
739	R	87.1	Confident	86.9	Confident	15 Å²	15	29.7 Å²	29.7	6%	0.057	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	126.7	167.7	62.3	176.5	68.8	92.7	1.7	108.6	E520 I522 P599 F727 I728	E520-R739 HydrophobicContact CB-CG 4.42Å; E520-R739 HydrophobicContact CG-CG 4.28Å; E520-R739 PolarHBondContact O-N 3.41Å; E520-R739 WeakPolarHBondContact OE1-CD 3.36Å; E520-R739 IonicContact OE1-CZ 3.84Å; E520-R739 IonicContact OE1-NE 2.77Å; E520-R739 IonicContact OE1-NH1 2.77Å; E520-R739 PolarHBondContact OE1-NH1 2.66Å; E520-R739 WeakPolarHBondContact OE2-CD 3.49Å; E520-R739 WeakPolarHBondContact OE2-CG 3.38Å; I522-R739 HydrophobicContact CD1-CB 4.08Å; I522-R739 HydrophobicContact CG1-CB 4.13Å; I522-R739 HydrophobicContact CG1-CG 4.32Å; P599-R739 PolarHBondContact O-NE 2.82Å; P599-R739 PolarHBondContact O-NH2 2.75Å; F727-R739 HydrophobicContact CD1-CB 4.14Å; F727-R739 HydrophobicContact CD1-CG 4.39Å; I728-R739 WeakPolarHBondContact O-CA 3.33Å
740	V	88.6	Confident	87.1	Confident	8 Å²	8	29.7 Å²	29.7	5%	0.048	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	122.1	176.4	-179.7	0	0	0	0	108.7	F727 I728 Y742 Q769 V772 L773	F727-V740 CarbonylContact C-O 3.53Å; F727-V740 VanDerWaalsContact CA-O 3.25Å; F727-V740 WeakPolarHBondContact CA-O 3.42Å; I728-V740 PolarHBondContact N-O 3.44Å; I728-V740 PolarHBondContact O-N 3.11Å; V740-Y742 HydrophobicContact CB-CD2 4.44Å; V740-Y742 HydrophobicContact CB-CE2 4.16Å; V740-Y742 HydrophobicContact CG1-CD2 4Å; V740-Y742 HydrophobicContact CG1-CE2 3.63Å; V740-Q769 HydrophobicContact CG1-CB 4.17Å; V740-Q769 WeakPolarHBondContact CG1-O 3.27Å; V740-V772 HydrophobicContact CG2-CB 3.83Å; V740-V772 HydrophobicContact CG2-CG1 3.45Å; V740-V772 VanDerWaalsContact CG2-CG1 3.45Å; V740-L773 HydrophobicContact CB-CD1 4.34Å; V740-L773 HydrophobicContact CB-CG 4.45Å; V740-L773 HydrophobicContact CG2-CD1 4.28Å; V740-L773 HydrophobicContact CG2-CD2 3.84Å; V740-L773 HydrophobicContact CG2-CG 3.85Å
741	Q	90.4	Very high	87	Confident	115 Å²	115	30.3 Å²	30.3	54%	0.537	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	134.6	175.6	-173.2	174.3	-29.5	0	0	110	F727	F727-Q741 HydrophobicContact CD1-CB 4.03Å; F727-Q741 HydrophobicContact CE1-CB 3.74Å; F727-Q741 HydrophobicContact CE1-CG 4.26Å; F727-Q741 HydrophobicContact CZ-CB 4.3Å; F727-Q741 HydrophobicContact CZ-CG 4.34Å
742	Y	92.8	Very high	87.1	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.008	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	122.5	173.7	-91.5	-101.3	0	0	0	109.9	C726 I728 V740 L744 V767 K770 L773 A820 F822	C726-Y742 PolarHBondContact O-N 3.17Å; I728-Y742 HydrophobicContact CB-CD2 4.13Å; I728-Y742 HydrophobicContact CB-CE2 4.17Å; I728-Y742 HydrophobicContact CG1-CD2 3.43Å; I728-Y742 VanDerWaalsContact CG1-CD2 3.43Å; I728-Y742 HydrophobicContact CG1-CE2 3.63Å; I728-Y742 HydrophobicContact CG1-CG 4.07Å; V740-Y742 HydrophobicContact CB-CD2 4.44Å; V740-Y742 HydrophobicContact CB-CE2 4.16Å; V740-Y742 HydrophobicContact CG1-CD2 4Å; V740-Y742 HydrophobicContact CG1-CE2 3.63Å; Y742-L744 PolarHBondContact O-N 2.94Å; Y742-V767 WeakPolarHBondContact CA-O 3.27Å; Y742-K770 PolarHBondContact OH-N 3.36Å; Y742-L773 HydrophobicContact CE2-CD1 4.12Å; Y742-A820 HydrophobicContact CD1-CB 4.39Å; Y742-A820 HydrophobicContact CE1-CB 3.71Å; Y742-F822 HydrophobicContact CD1-CE2 4.27Å; Y742-F822 AromaticContact CD1-CZ 3.68Å; Y742-F822 HydrophobicContact CD1-CZ 3.68Å; Y742-F822 HydrophobicContact CE1-CZ 4.01Å; Y742-F822 HydrophobicContact CG-CZ 4.2Å
743	Q	93.6	Very high	87.2	Confident	89 Å²	89	40.7 Å²	40.7	42%	0.416	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	109	171.9	179.1	53.3	61.9	0	0	108.6	S722 G766 V767	S722-Q743 PolarHBondContact O-NE2 3.1Å; Q743-G766 CarbonylContact O-C 3.55Å; Q743-G766 WeakPolarHBondContact O-CA 3.48Å; Q743-V767 HydrophobicContact CB-CG2 4.1Å; Q743-V767 PolarHBondContact N-O 3.24Å; Q743-V767 PolarHBondContact O-N 3.19Å
744	L	94.1	Very high	87.5	Confident	2 Å²	2	36 Å²	36	1%	0.01	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	137.3	173.8	-67.9	-174.3	0	0	0	110.5	A720 S722 C726 Y742 L781 F822	A720-L744 HydrophobicContact CB-CD1 3.59Å; S722-L744 WeakPolarHBondContact CA-O 3.35Å; S722-L744 WeakPolarHBondContact CB-O 3.32Å; C726-L744 HydrophobicContact CB-CG 4.34Å; C726-L744 WeakPolarHBondContact SG-CD1 3.48Å; Y742-L744 PolarHBondContact O-N 2.94Å; L744-L781 HydrophobicContact CD1-CD2 4.31Å; L744-L781 HydrophobicContact CD2-CD1 4.17Å; L744-L781 HydrophobicContact CD2-CD2 3.99Å; L744-F822 HydrophobicContact CD2-CD2 4.09Å; L744-F822 HydrophobicContact CD2-CE2 4.05Å
745	L	92.6	Very high	88	Confident	33 Å²	33	35.4 Å²	35.4	17%	0.173	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-94.8	158.6	176.4	-63.6	178.2	0	0	0	110.5	E749 C765 V767	L745-E749 HydrophobicContact CB-CB 4.03Å; L745-E749 HydrophobicContact CD1-CB 4.49Å; L745-C765 PolarHBondContact N-O 2.89Å; L745-V767 HydrophobicContact CD1-CG1 4.26Å
746	T	91	Very high	88.2	Confident	33 Å²	33	43.7 Å²	43.7	20%	0.202	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-68.6	158.8	171	64.8	0	0	0	0	111	T748 E749 C750	T746-T748 PolarHBondContact O-N 3.39Å; T746-T748 VanDerWaalsContact O-N 3.17Å; T746-E749 WeakPolarHBondContact CA-OE2 3.42Å; T746-E749 VanDerWaalsContact CB-OE2 3.23Å; T746-E749 WeakPolarHBondContact CB-OE2 3.47Å; T746-E749 VanDerWaalsContact CG2-OE2 3.29Å; T746-E749 WeakPolarHBondContact CG2-OE2 3.47Å; T746-E749 PolarHBondContact N-OE2 2.99Å; T746-E749 PolarHBondContact O-N 2.85Å; T746-E749 WeakPolarHBondContact OG1-CG 3.39Å; T746-E749 PolarHBondContact OG1-N 2.9Å; T746-E749 PolarHBondContact OG1-OE2 3.47Å; T746-C750 PolarHBondContact O-N 3.07Å; T746-C750 PolarHBondContact O-SG 3.4Å; T746-C750 VanDerWaalsContact O-SG 3.37Å
747	P	90.6	Very high	88.5	Confident	19 Å²	19	47.4 Å²	47.4	12%	0.123	23%	0.232	C	C	.	.	H	α-helix	trans	-57.4	-30.8	176.5	-25.8	35.4	0	0	0	114	I201 M203 K751 F758 P760	I201-P747 HydrophobicContact CB-CB 3.98Å; I201-P747 HydrophobicContact CG2-CB 3.6Å; M203-P747 HydrophobicContact CE-CG 4.27Å; M203-P747 HydrophobicContact CG-CB 4.43Å; M203-P747 HydrophobicContact CG-CG 3.6Å; M203-P747 HydrophobicContact SD-CG 3.9Å; P747-K751 WeakPolarHBondContact O-CB 3.43Å; P747-K751 PolarHBondContact O-N 2.86Å; P747-K751 VanDerWaalsContact O-N 3.09Å; P747-F758 HydrophobicContact CB-CE1 4.21Å; P747-F758 WeakPolarHBondContact O-CE1 3.27Å; P747-P760 HydrophobicContact CB-CB 4.26Å
748	T	89.2	Confident	88.8	Confident	19 Å²	19	47.4 Å²	47.4	12%	0.117	23%	0.232	C	C	.	.	H	α-helix	trans	-70.6	-47.9	177	-53.5	0	0	0	0	111.5	T49 I201 T746 K751 Q752	T49-T748 HydrophobicContact CG2-CG2 4.14Å; I201-T748 PolarHBondContact N-OG1 3.04Å; T746-T748 PolarHBondContact O-N 3.39Å; T746-T748 VanDerWaalsContact O-N 3.17Å; T748-K751 PolarHBondContact O-N 3.15Å; T748-Q752 WeakPolarHBondContact O-CG 3.23Å; T748-Q752 PolarHBondContact O-N 3.37Å
749	E	90.2	Very high	89	Confident	75 Å²	75	48.1 Å²	48.1	35%	0.35	24%	0.235	S	C	.	.	H	α-helix	trans	-62.2	-44.7	175.3	-69.9	154.3	156.4	0	0	111.2	L745 T746 K751 Q752 H753	L745-E749 HydrophobicContact CB-CB 4.03Å; L745-E749 HydrophobicContact CD1-CB 4.49Å; T746-E749 WeakPolarHBondContact CA-OE2 3.42Å; T746-E749 VanDerWaalsContact CB-OE2 3.23Å; T746-E749 WeakPolarHBondContact CB-OE2 3.47Å; T746-E749 VanDerWaalsContact CG2-OE2 3.29Å; T746-E749 WeakPolarHBondContact CG2-OE2 3.47Å; T746-E749 PolarHBondContact N-OE2 2.99Å; T746-E749 PolarHBondContact O-N 2.85Å; T746-E749 WeakPolarHBondContact OG1-CG 3.39Å; T746-E749 PolarHBondContact OG1-N 2.9Å; T746-E749 PolarHBondContact OG1-OE2 3.47Å; E749-K751 VanDerWaalsContact C-N 3.26Å; E749-K751 PolarHBondContact O-N 2.89Å; E749-Q752 WeakPolarHBondContact O-CB 3.46Å; E749-Q752 PolarHBondContact O-N 3.26Å; E749-H753 PolarHBondContact O-CD2 2.94Å; E749-H753 PolarHBondContact O-N 2.87Å
750	C	91.4	Very high	89.1	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.007	23%	0.232	C	C	.	.	H	α-helix	trans	-56.7	-38.7	173.5	-69.5	0	0	0	0	112.7	T746 L754 F758 C765	T746-C750 PolarHBondContact O-N 3.07Å; T746-C750 PolarHBondContact O-SG 3.4Å; T746-C750 VanDerWaalsContact O-SG 3.37Å; C750-L754 WeakPolarHBondContact O-CB 3.3Å; C750-L754 PolarHBondContact O-N 2.76Å; C750-F758 HydrophobicContact CB-CD1 3.41Å; C750-F758 VanDerWaalsContact CB-CD1 3.41Å; C750-F758 HydrophobicContact CB-CD2 3.93Å; C750-F758 HydrophobicContact CB-CE1 3.33Å; C750-F758 HydrophobicContact CB-CE2 3.85Å; C750-F758 HydrophobicContact CB-CG 3.72Å; C750-F758 HydrophobicContact CB-CZ 3.55Å; C750-C765 WeakPolarHBondContact CA-SG 3.45Å; C750-C765 HydrophobicContact CB-CB 3.97Å; C750-C765 WeakPolarHBondContact CB-SG 3.49Å; C750-C765 WeakPolarHBondContact SG-CB 3.31Å; C750-C765 CovalentContact SG-SG 2.03Å; C750-C765 PolarHBondContact SG-SG 3.22Å
751	K	88.4	Confident	88.9	Confident	16 Å²	16	47.9 Å²	47.9	7%	0.07	24%	0.236	C	C	.	.	H	α-helix	trans	-71.3	-32	175.9	-154.2	81	-174.2	-176.6	0	112.4	S184 I201 P747 T748 E749 G755 F758	S184-K751 PolarHBondContact OG-NZ 2.79Å; I201-K751 HydrophobicContact CD1-CB 3.48Å; I201-K751 VanDerWaalsContact CD1-CB 3.48Å; I201-K751 HydrophobicContact CD1-CD 4.13Å; I201-K751 HydrophobicContact CD1-CG 3.64Å; P747-K751 WeakPolarHBondContact O-CB 3.43Å; P747-K751 PolarHBondContact O-N 2.86Å; P747-K751 VanDerWaalsContact O-N 3.09Å; T748-K751 PolarHBondContact O-N 3.15Å; E749-K751 VanDerWaalsContact C-N 3.26Å; E749-K751 PolarHBondContact O-N 2.89Å; K751-G755 WeakPolarHBondContact CD-O 3.33Å; K751-G755 WeakPolarHBondContact CE-O 3.33Å; K751-G755 PolarHBondContact NZ-O 3.42Å; K751-G755 WeakPolarHBondContact O-CA 3.32Å; K751-G755 PolarHBondContact O-N 3.24Å; K751-F758 HydrophobicContact CB-CD1 4.49Å; K751-F758 HydrophobicContact CD-CD1 4.22Å; K751-F758 PolarHBondContact NZ-O 2.79Å
752	Q	87.1	Confident	88.6	Confident	108 Å²	108	42.9 Å²	42.9	51%	0.505	21%	0.213	S	C	.	.	H	α-helix	trans	-66.3	-45	174	-70	171.2	11.9	0	0	111.8	T49 T748 E749	T49-Q752 HydrophobicContact CG2-CG 3.6Å; T748-Q752 WeakPolarHBondContact O-CG 3.23Å; T748-Q752 PolarHBondContact O-N 3.37Å; E749-Q752 WeakPolarHBondContact O-CB 3.46Å; E749-Q752 PolarHBondContact O-N 3.26Å
753	H	87.6	Confident	88.4	Confident	112 Å²	112	43 Å²	43	52%	0.519	21%	0.214	S	C	.	.	H	α-helix	trans	-74.9	-38.7	179.9	-68.6	-70.4	0	0	0	113.9	E749 V819	E749-H753 PolarHBondContact O-CD2 2.94Å; E749-H753 PolarHBondContact O-N 2.87Å; H753-V819 HydrophobicContact CB-CG2 4.33Å
754	L	88.5	Confident	88.4	Confident	17 Å²	17	39.5 Å²	39.5	9%	0.089	20%	0.197	C	C	.	.	H	α-helix	trans	-111.7	-9.5	-168.6	-57.4	-178.7	0	0	0	114.4	C750 K756 K757 F758 C765 F799 V819 L821	C750-L754 WeakPolarHBondContact O-CB 3.3Å; C750-L754 PolarHBondContact O-N 2.76Å; L754-K756 PolarHBondContact O-N 3.24Å; L754-K757 HydrophobicContact CB-CB 4.45Å; L754-K757 WeakPolarHBondContact O-CB 3.39Å; L754-K757 PolarHBondContact O-N 2.94Å; L754-K757 VanDerWaalsContact O-N 3.17Å; L754-F758 HydrophobicContact CB-CB 3.85Å; L754-F758 HydrophobicContact CD1-CB 4.19Å; L754-C765 HydrophobicContact CD1-CB 4.16Å; L754-F799 HydrophobicContact CD1-CD2 4.47Å; L754-F799 HydrophobicContact CD2-CB 3.99Å; L754-F799 HydrophobicContact CD2-CD2 3.58Å; L754-F799 HydrophobicContact CD2-CE2 4.47Å; L754-F799 HydrophobicContact CD2-CG 4.13Å; L754-V819 HydrophobicContact CD1-CG1 3.97Å; L754-V819 HydrophobicContact CD2-CB 4.19Å; L754-V819 HydrophobicContact CD2-CG1 4.16Å; L754-V819 HydrophobicContact CG-CG1 4.17Å; L754-L821 HydrophobicContact CD1-CD1 4.3Å; L754-L821 HydrophobicContact CD1-CD2 3.53Å; L754-L821 HydrophobicContact CD1-CG 3.88Å
755	G	86.4	Confident	88.4	Confident	32 Å²	32	39.4 Å²	39.4	33%	0.33	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	56.6	-129.4	178.8	0	0	0	0	0	112.6	K751 K757 F758	K751-G755 WeakPolarHBondContact CD-O 3.33Å; K751-G755 WeakPolarHBondContact CE-O 3.33Å; K751-G755 PolarHBondContact NZ-O 3.42Å; K751-G755 WeakPolarHBondContact O-CA 3.32Å; K751-G755 PolarHBondContact O-N 3.24Å; G755-K757 PolarHBondContact O-N 3.07Å; G755-F758 PolarHBondContact O-N 2.96Å
756	K	81.1	Confident	88.5	Confident	174 Å²	174	37.8 Å²	37.8	76%	0.757	19%	0.189	S	C	*	.	G	3₁₀ helix	trans	-65	-24.1	-179.7	-67.3	-171.1	176.7	-174.7	0	113.8	L754 F758	L754-K756 PolarHBondContact O-N 3.24Å; K756-F758 PolarHBondContact O-N 2.87Å
757	K	83.6	Confident	88.5	Confident	123 Å²	123	37.8 Å²	37.8	54%	0.535	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-65.5	-23.7	-178.6	-59.4	177.5	168	-171.9	0	113.6	L754 G755 F799	L754-K757 HydrophobicContact CB-CB 4.45Å; L754-K757 WeakPolarHBondContact O-CB 3.39Å; L754-K757 PolarHBondContact O-N 2.94Å; L754-K757 VanDerWaalsContact O-N 3.17Å; G755-K757 PolarHBondContact O-N 3.07Å; K757-F799 HydrophobicContact CB-CE2 4.43Å; K757-F799 HydrophobicContact CD-CD1 4.48Å; K757-F799 HydrophobicContact CD-CD2 4.47Å; K757-F799 HydrophobicContact CD-CE1 3.97Å; K757-F799 HydrophobicContact CD-CE2 3.91Å; K757-F799 HydrophobicContact CD-CZ 3.64Å
758	F	87.6	Confident	88.4	Confident	3 Å²	3	37.4 Å²	37.4	1%	0.013	19%	0.187	C	C	.	.			trans	-94.1	127.8	177.7	175.1	-111.3	0	0	0	111.8	P747 C750 K751 L754 G755 K756 P760 M763 C765 L821	P747-F758 HydrophobicContact CB-CE1 4.21Å; P747-F758 WeakPolarHBondContact O-CE1 3.27Å; C750-F758 HydrophobicContact CB-CD1 3.41Å; C750-F758 VanDerWaalsContact CB-CD1 3.41Å; C750-F758 HydrophobicContact CB-CD2 3.93Å; C750-F758 HydrophobicContact CB-CE1 3.33Å; C750-F758 HydrophobicContact CB-CE2 3.85Å; C750-F758 HydrophobicContact CB-CG 3.72Å; C750-F758 HydrophobicContact CB-CZ 3.55Å; K751-F758 HydrophobicContact CB-CD1 4.49Å; K751-F758 HydrophobicContact CD-CD1 4.22Å; K751-F758 PolarHBondContact NZ-O 2.79Å; L754-F758 HydrophobicContact CB-CB 3.85Å; L754-F758 HydrophobicContact CD1-CB 4.19Å; G755-F758 PolarHBondContact O-N 2.96Å; K756-F758 PolarHBondContact O-N 2.87Å; F758-P760 HydrophobicContact CD1-CG 4.11Å; F758-P760 HydrophobicContact CE1-CB 4.07Å; F758-P760 HydrophobicContact CE1-CG 3.74Å; F758-P760 HydrophobicContact CZ-CB 4.47Å; F758-M763 HydrophobicContact CD2-CB 3.95Å; F758-M763 HydrophobicContact CD2-SD 4.3Å; F758-M763 HydrophobicContact CE2-CB 3.75Å; F758-M763 WeakPolarHBondContact CE2-O 3.2Å; F758-C765 HydrophobicContact CD2-CB 4.42Å; F758-C765 HydrophobicContact CE2-CB 4.36Å; F758-L821 HydrophobicContact CD2-CD2 3.71Å; F758-L821 HydrophobicContact CE2-CD2 4.4Å
759	L	87.5	Confident	88.1	Confident	14 Å²	14	39.9 Å²	39.9	7%	0.073	20%	0.198	C	C	.	.			trans	-113	101.9	176.9	-64.4	-171.8	0	0	0	111.4	S182 L688 S761 V762 M763	S182-L759 WeakPolarHBondContact O-CD2 3.09Å; L688-L759 HydrophobicContact CD1-CD1 3.58Å; L688-L759 HydrophobicContact CD2-CD1 3.46Å; L688-L759 VanDerWaalsContact CD2-CD1 3.46Å; L688-L759 HydrophobicContact CG-CD1 4.06Å; L759-S761 VanDerWaalsContact C-N 3.28Å; L759-S761 PolarHBondContact O-N 2.79Å; L759-S761 VanDerWaalsContact O-N 3.1Å; L759-V762 HydrophobicContact CB-CG2 3.53Å; L759-V762 HydrophobicContact CD1-CG2 4.07Å; L759-V762 HydrophobicContact CG-CG2 4.47Å; L759-V762 PolarHBondContact O-N 2.89Å; L759-V762 VanDerWaalsContact O-N 3.07Å; L759-M763 HydrophobicContact CB-SD 4.01Å; L759-M763 PolarHBondContact N-SD 3.48Å; L759-M763 VanDerWaalsContact N-SD 3.41Å; L759-M763 PolarHBondContact O-N 3.2Å
760	P	87.9	Confident	87.9	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-35	-170.7	-29.9	34.8	0	0	0	116.1	I201 M203 P747 F758 K824	I201-P760 HydrophobicContact CG2-CB 3.65Å; I201-P760 HydrophobicContact CG2-CG 3.33Å; M203-P760 WeakPolarHBondContact CG-O 3.4Å; P747-P760 HydrophobicContact CB-CB 4.26Å; F758-P760 HydrophobicContact CD1-CG 4.11Å; F758-P760 HydrophobicContact CE1-CB 4.07Å; F758-P760 HydrophobicContact CE1-CG 3.74Å; F758-P760 HydrophobicContact CZ-CB 4.47Å; P760-K824 PolarHBondContact O-NZ 2.97Å
761	S	85.1	Confident	87.6	Confident	19 Å²	19	43.5 Å²	43.5	13%	0.133	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-25.8	-176.5	-59.3	0	0	0	0	112.7	L759 K824	L759-S761 VanDerWaalsContact C-N 3.28Å; L759-S761 PolarHBondContact O-N 2.79Å; L759-S761 VanDerWaalsContact O-N 3.1Å; S761-K824 PolarHBondContact O-NZ 3.4Å
762	V	83.9	Confident	87.5	Confident	9 Å²	9	43.1 Å²	43.1	6%	0.055	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.2	-15	-165.2	-50.9	0	0	0	0	114.6	P181 Y682 L759 K824	P181-V762 HydrophobicContact CB-CG1 3.92Å; Y682-V762 HydrophobicContact CD2-CG1 4.29Å; Y682-V762 HydrophobicContact CE2-CB 3.93Å; Y682-V762 HydrophobicContact CE2-CG1 3.37Å; L759-V762 HydrophobicContact CB-CG2 3.53Å; L759-V762 HydrophobicContact CD1-CG2 4.07Å; L759-V762 HydrophobicContact CG-CG2 4.47Å; L759-V762 PolarHBondContact O-N 2.89Å; L759-V762 VanDerWaalsContact O-N 3.07Å; V762-K824 WeakPolarHBondContact O-CG 3.47Å; V762-K824 PolarHBondContact O-N 3.35Å; V762-K824 VanDerWaalsContact O-N 3.14Å
763	M	89.8	Confident	87.6	Confident	5 Å²	5	38.7 Å²	38.7	3%	0.025	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	149.6	176.6	-64.6	152.2	180	0	0	112.3	L688 I691 F758 L759 L821 F822 K824	L688-M763 HydrophobicContact CD2-CE 4.44Å; I691-M763 HydrophobicContact CD1-CE 3.65Å; I691-M763 HydrophobicContact CG2-CE 3.96Å; F758-M763 HydrophobicContact CD2-CB 3.95Å; F758-M763 HydrophobicContact CD2-SD 4.3Å; F758-M763 HydrophobicContact CE2-CB 3.75Å; F758-M763 WeakPolarHBondContact CE2-O 3.2Å; L759-M763 HydrophobicContact CB-SD 4.01Å; L759-M763 PolarHBondContact N-SD 3.48Å; L759-M763 VanDerWaalsContact N-SD 3.41Å; L759-M763 PolarHBondContact O-N 3.2Å; M763-L821 HydrophobicContact CB-CD2 4.25Å; M763-L821 HydrophobicContact CE-CD1 4.43Å; M763-L821 HydrophobicContact CG-CD2 4.5Å; M763-L821 HydrophobicContact SD-CD1 4.06Å; M763-L821 HydrophobicContact SD-CD2 4.18Å; M763-F822 CarbonylContact C-O 3.53Å; M763-F822 VanDerWaalsContact CA-O 3.26Å; M763-F822 WeakPolarHBondContact CA-O 3.35Å; M763-K824 WeakPolarHBondContact O-CE 3.45Å
764	Y	93.7	Very high	87.6	Confident	15 Å²	15	35.8 Å²	35.8	6%	0.059	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	162.4	148.9	-54	-70.3	0	0	0	109	M203 G719 A720 L781 F792 F822 K824	M203-Y764 HydrophobicContact SD-CD1 4.42Å; M203-Y764 HydrophobicContact SD-CE1 4.14Å; G719-Y764 WeakPolarHBondContact CA-OH 3.48Å; A720-Y764 HydrophobicContact CB-CE1 4.13Å; A720-Y764 HydrophobicContact CB-CE2 4.23Å; A720-Y764 PolarHBondContact N-OH 2.87Å; Y764-L781 HydrophobicContact CD2-CD2 4.08Å; Y764-F792 HydrophobicContact CE2-CB 4.07Å; Y764-F822 PolarHBondContact N-O 2.98Å; Y764-F822 PolarHBondContact O-N 3.37Å; Y764-K824 HydrophobicContact CD1-CD 4.47Å; Y764-K824 HydrophobicContact CD2-CD 4.42Å; Y764-K824 HydrophobicContact CD2-CG 3.78Å; Y764-K824 HydrophobicContact CE1-CD 4.01Å; Y764-K824 HydrophobicContact CE1-CG 4.4Å; Y764-K824 HydrophobicContact CE2-CB 4.24Å; Y764-K824 HydrophobicContact CE2-CD 3.96Å; Y764-K824 HydrophobicContact CE2-CG 3.53Å; Y764-K824 HydrophobicContact CG-CG 4.29Å
765	C	94.2	Very high	87.8	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	160.6	160.7	92.9	0	0	0	0	110.6	L745 C750 L754 F758 V819 A820 L821	L745-C765 PolarHBondContact N-O 2.89Å; C750-C765 WeakPolarHBondContact CA-SG 3.45Å; C750-C765 HydrophobicContact CB-CB 3.97Å; C750-C765 WeakPolarHBondContact CB-SG 3.49Å; C750-C765 WeakPolarHBondContact SG-CB 3.31Å; C750-C765 CovalentContact SG-SG 2.03Å; C750-C765 PolarHBondContact SG-SG 3.22Å; L754-C765 HydrophobicContact CD1-CB 4.16Å; F758-C765 HydrophobicContact CD2-CB 4.42Å; F758-C765 HydrophobicContact CE2-CB 4.36Å; C765-V819 HydrophobicContact CB-CG1 4.15Å; C765-A820 WeakPolarHBondContact CA-O 3.23Å; C765-A820 WeakPolarHBondContact CB-O 3.41Å; C765-L821 HydrophobicContact CB-CD2 3.75Å
766	G	94.2	Very high	88.1	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.2	165.4	177	0	0	0	0	0	112.3	Q743 A820	Q743-G766 CarbonylContact O-C 3.55Å; Q743-G766 WeakPolarHBondContact O-CA 3.48Å; G766-A820 PolarHBondContact N-O 3.27Å; G766-A820 VanDerWaalsContact N-O 3.08Å; G766-A820 PolarHBondContact O-N 3.4Å
767	V	91.7	Very high	88.7	Confident	33 Å²	33	32 Å²	32	20%	0.2	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	145.2	177.4	-67.8	0	0	0	0	110.6	Y742 Q743 L745 P816 V819	Y742-V767 WeakPolarHBondContact CA-O 3.27Å; Q743-V767 HydrophobicContact CB-CG2 4.1Å; Q743-V767 PolarHBondContact N-O 3.24Å; Q743-V767 PolarHBondContact O-N 3.19Å; L745-V767 HydrophobicContact CD1-CG1 4.26Å; V767-P816 HydrophobicContact CB-CB 4.15Å; V767-V819 HydrophobicContact CG1-CG2 4.13Å
768	G	87.5	Confident	89.2	Confident	10 Å²	10	26.1 Å²	26.1	10%	0.103	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177.5	169.7	-178.3	0	0	0	0	0	111.7	K770	G768-K770 PolarHBondContact O-N 2.66Å
769	Q	83.5	Confident	89.5	Confident	72 Å²	72	26 Å²	26	34%	0.336	14%	0.138	S	C	.	.			trans	-78.4	87.5	-175.7	-67.9	167.5	-11.2	0	0	111	V740 S771 V772	V740-Q769 HydrophobicContact CG1-CB 4.17Å; V740-Q769 WeakPolarHBondContact CG1-O 3.27Å; Q769-S771 VanDerWaalsContact C-N 3.28Å; Q769-S771 PolarHBondContact O-N 2.84Å; Q769-V772 HydrophobicContact CB-CG2 4.01Å
770	K	86.3	Confident	89.9	Confident	64 Å²	64	25.3 Å²	25.3	28%	0.278	14%	0.135	S	C	.	.	G	3₁₀ helix	trans	-64.3	-33.3	174.6	174.9	-163.5	174.7	175.4	0	112.4	Y742 G768 V772 L773 S798 D818	Y742-K770 PolarHBondContact OH-N 3.36Å; G768-K770 PolarHBondContact O-N 2.66Å; K770-V772 PolarHBondContact O-N 3.32Å; K770-V772 VanDerWaalsContact O-N 3.11Å; K770-L773 PolarHBondContact O-N 3.3Å; K770-S798 WeakPolarHBondContact CD-OG 3.47Å; K770-S798 WeakPolarHBondContact CE-OG 3.12Å; K770-S798 PolarHBondContact NZ-OG 2.9Å; K770-D818 HydrophobicContact CB-CB 4.33Å; K770-D818 HydrophobicContact CD-CB 3.99Å; K770-D818 WeakPolarHBondContact CD-OD2 3.38Å; K770-D818 WeakPolarHBondContact CE-OD2 3.36Å; K770-D818 IonicContact NZ-OD1 2.76Å; K770-D818 IonicContact NZ-OD2 2.69Å; K770-D818 PolarHBondContact NZ-OD2 3.37Å
771	S	84.6	Confident	90.3	Very high	88 Å²	88	25.3 Å²	25.3	62%	0.615	14%	0.135	S	C	*	.	G	3₁₀ helix	trans	-48.8	-32.3	176.9	33.9	0	0	0	0	113.9	Q769 D817	Q769-S771 VanDerWaalsContact C-N 3.28Å; Q769-S771 PolarHBondContact O-N 2.84Å; S771-D817 WeakPolarHBondContact CB-OD2 3.42Å; S771-D817 PolarHBondContact OG-OD2 2.95Å
772	V	85.1	Confident	90.7	Very high	8 Å²	8	24.4 Å²	24.4	5%	0.048	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-71	-24.7	175.5	173.2	0	0	0	0	113.6	H519 C732 V738 V740 Q769 K770	H519-V772 HydrophobicContact CB-CB 4.37Å; H519-V772 HydrophobicContact CB-CG1 3.77Å; H519-V772 HydrophobicContact CB-CG2 3.63Å; H519-V772 VanDerWaalsContact CD2-CG1 3.43Å; H519-V772 WeakPolarHBondContact CD2-CG1 3.5Å; H519-V772 VanDerWaalsContact CG-CG1 3.46Å; C732-V772 VanDerWaalsContact CA-O 3.27Å; C732-V772 WeakPolarHBondContact CA-O 3.4Å; C732-V772 WeakPolarHBondContact CB-O 3.38Å; V738-V772 HydrophobicContact CB-CG1 4.38Å; V738-V772 HydrophobicContact CG2-CG1 4.08Å; V740-V772 HydrophobicContact CG2-CB 3.83Å; V740-V772 HydrophobicContact CG2-CG1 3.45Å; V740-V772 VanDerWaalsContact CG2-CG1 3.45Å; Q769-V772 HydrophobicContact CB-CG2 4.01Å; K770-V772 PolarHBondContact O-N 3.32Å; K770-V772 VanDerWaalsContact O-N 3.11Å
773	L	89.5	Confident	91.2	Very high	14 Å²	14	24 Å²	24	7%	0.073	13%	0.126	C	C	.	.			trans	-100.7	116.6	-169.4	-65.6	166.5	0	0	0	112.8	I728 V738 V740 Y742 K770 P776	I728-L773 HydrophobicContact CB-CD1 4.06Å; I728-L773 HydrophobicContact CG2-CD1 3.69Å; I728-L773 HydrophobicContact CG2-CD2 4.19Å; V738-L773 HydrophobicContact CG2-CD2 3.86Å; V740-L773 HydrophobicContact CB-CD1 4.34Å; V740-L773 HydrophobicContact CB-CG 4.45Å; V740-L773 HydrophobicContact CG2-CD1 4.28Å; V740-L773 HydrophobicContact CG2-CD2 3.84Å; V740-L773 HydrophobicContact CG2-CG 3.85Å; Y742-L773 HydrophobicContact CE2-CD1 4.12Å; K770-L773 PolarHBondContact O-N 3.3Å; L773-P776 HydrophobicContact CB-CB 3.94Å; L773-P776 HydrophobicContact CB-CG 4.5Å; L773-P776 HydrophobicContact CD1-CB 4.27Å
774	Q	88.7	Confident	91.2	Very high	51 Å²	51	27.5 Å²	27.5	24%	0.238	14%	0.142	C	C	.	.	B	Isolated β-bridge	trans	-82.3	134.1	166.9	-172	75.3	62.2	0	0	109.7	V731	V731-Q774 HydrophobicContact CG2-CB 4.42Å; V731-Q774 PolarHBondContact O-N 2.94Å
775	Y	91.3	Very high	90.8	Very high	74 Å²	74	27.7 Å²	27.7	29%	0.29	15%	0.146	S	C	.	.	S	Bend	trans	47.7	54.2	-178.6	-47.2	-55.5	0	0	0	114.5	P616 T619 L657 I777	P616-Y775 HydrophobicContact CB-CD2 4.1Å; P616-Y775 HydrophobicContact CB-CE2 3.63Å; P616-Y775 HydrophobicContact CG-CE1 4.45Å; P616-Y775 HydrophobicContact CG-CE2 3.69Å; P616-Y775 WeakPolarHBondContact CG-OH 3.23Å; T619-Y775 PolarHBondContact N-O 2.71Å; T619-Y775 PolarHBondContact OG1-O 2.85Å; L657-Y775 HydrophobicContact CD2-CD2 4.34Å; L657-Y775 HydrophobicContact CD2-CE2 4.36Å; Y775-I777 VanDerWaalsContact C-N 3.26Å; Y775-I777 PolarHBondContact O-N 2.88Å
776	P	93.3	Very high	90.1	Very high	18 Å²	18	30 Å²	30	12%	0.117	16%	0.163	C	C	.	.			trans	-68.7	-18.8	-172.5	27.8	-35.4	0	0	0	114.4	L773 G778 S779 Y795	L773-P776 HydrophobicContact CB-CB 3.94Å; L773-P776 HydrophobicContact CB-CG 4.5Å; L773-P776 HydrophobicContact CD1-CB 4.27Å; P776-G778 PolarHBondContact O-N 3.33Å; P776-S779 VanDerWaalsContact O-CB 3.23Å; P776-S779 WeakPolarHBondContact O-CB 3.34Å; P776-S779 PolarHBondContact O-N 3.21Å; P776-S779 PolarHBondContact O-OG 2.72Å; P776-S779 VanDerWaalsContact O-OG 3.09Å; P776-Y795 HydrophobicContact CB-CD1 4.15Å; P776-Y795 HydrophobicContact CB-CD2 4.18Å; P776-Y795 HydrophobicContact CB-CE1 4.03Å; P776-Y795 HydrophobicContact CB-CE2 4.07Å; P776-Y795 HydrophobicContact CB-CG 4.26Å; P776-Y795 HydrophobicContact CG-CE1 4.12Å; P776-Y795 VanDerWaalsContact O-CB 3.25Å; P776-Y795 WeakPolarHBondContact O-CB 3.48Å
777	I	94.1	Very high	89.4	Confident	51 Å²	51	32.8 Å²	32.8	26%	0.262	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	130.3	178	-53.1	-176.6	0	0	0	108.6	C618 T619 A637 C640 Y775 S779 D796	C618-I777 HydrophobicContact CB-CB 4.38Å; C618-I777 VanDerWaalsContact CB-O 3.26Å; C618-I777 WeakPolarHBondContact CB-O 3.1Å; T619-I777 PolarHBondContact N-O 3.21Å; A637-I777 HydrophobicContact CB-CG2 4.17Å; C640-I777 HydrophobicContact CB-CG2 3.91Å; Y775-I777 VanDerWaalsContact C-N 3.26Å; Y775-I777 PolarHBondContact O-N 2.88Å; I777-S779 VanDerWaalsContact C-N 3.33Å; I777-D796 WeakPolarHBondContact CG1-O 3.43Å
778	G	94	Very high	89	Confident	0 Å²	0	36 Å²	36	0%	0	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.5	-9.2	-176.7	0	0	0	0	0	115.4	T619 T636 P776 I794 Y795	T619-G778 CarbonylContact O-C 3.57Å; T619-G778 VanDerWaalsContact O-CA 3.29Å; T619-G778 WeakPolarHBondContact O-CA 3.32Å; T636-G778 VanDerWaalsContact OG1-CA 3.27Å; T636-G778 WeakPolarHBondContact OG1-CA 3.11Å; P776-G778 PolarHBondContact O-N 3.33Å; G778-I794 VanDerWaalsContact CA-CG2 3.47Å; G778-I794 WeakPolarHBondContact O-CG2 3.44Å; G778-Y795 PolarHBondContact N-O 3.07Å
779	S	94.6	Very high	89	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.206	C	C	.	.			trans	-65.7	143.2	177.7	-62.8	0	0	0	0	112.6	T619 P776 I777 Y795	T619-S779 VanDerWaalsContact CB-OG 3.24Å; T619-S779 WeakPolarHBondContact CB-OG 3Å; T619-S779 WeakPolarHBondContact CG2-OG 3.04Å; T619-S779 PolarHBondContact OG1-OG 3.07Å; P776-S779 VanDerWaalsContact O-CB 3.23Å; P776-S779 WeakPolarHBondContact O-CB 3.34Å; P776-S779 PolarHBondContact O-N 3.21Å; P776-S779 PolarHBondContact O-OG 2.72Å; P776-S779 VanDerWaalsContact O-OG 3.09Å; I777-S779 VanDerWaalsContact C-N 3.33Å; S779-Y795 PolarHBondContact O-N 3.21Å
780	P	95.3	Very high	89.3	Confident	0 Å²	0	34 Å²	34	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	129.3	-179.8	29	-36	0	0	0	112.6	S602 T621 F711 S729 V782 Q791	S602-P780 WeakPolarHBondContact OG-CD 3.41Å; S602-P780 WeakPolarHBondContact OG-CG 3.4Å; T621-P780 HydrophobicContact CG2-CB 4.48Å; T621-P780 WeakPolarHBondContact OG1-CB 3.41Å; T621-P780 WeakPolarHBondContact OG1-CD 3.25Å; F711-P780 HydrophobicContact CD2-CB 4.31Å; F711-P780 HydrophobicContact CD2-CG 4.21Å; F711-P780 HydrophobicContact CE2-CG 4.17Å; S729-P780 WeakPolarHBondContact O-CD 3.48Å; P780-V782 HydrophobicContact CB-CG2 3.74Å; P780-V782 HydrophobicContact CG-CG2 4.06Å; P780-V782 PolarHBondContact O-N 2.64Å; P780-Q791 HydrophobicContact CB-CG 3.7Å
781	L	96	Very high	89.6	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	104.5	160.9	176.3	73.7	0	0	0	108.7	C726 I728 L744 Y764 Q791 F792 G793 F822	C726-L781 HydrophobicContact CB-CD1 4Å; I728-L781 HydrophobicContact CD1-CB 3.95Å; I728-L781 HydrophobicContact CD1-CD1 3.96Å; L744-L781 HydrophobicContact CD1-CD2 4.31Å; L744-L781 HydrophobicContact CD2-CD1 4.17Å; L744-L781 HydrophobicContact CD2-CD2 3.99Å; Y764-L781 HydrophobicContact CD2-CD2 4.08Å; L781-Q791 CarbonylContact O-C 3.56Å; L781-Q791 WeakPolarHBondContact O-CA 3.35Å; L781-F792 PolarHBondContact O-N 3.18Å; L781-G793 PolarHBondContact N-O 3.22Å; L781-G793 PolarHBondContact O-N 2.83Å; L781-F822 HydrophobicContact CB-CD1 3.92Å; L781-F822 HydrophobicContact CB-CE1 4.43Å; L781-F822 HydrophobicContact CB-CG 4.3Å; L781-F822 HydrophobicContact CD1-CD1 4.32Å; L781-F822 HydrophobicContact CD1-CE1 4.22Å; L781-F822 HydrophobicContact CD1-CE2 4.38Å; L781-F822 HydrophobicContact CD1-CG 4.47Å; L781-F822 HydrophobicContact CD1-CZ 4.24Å; L781-F822 HydrophobicContact CD2-CB 3.87Å; L781-F822 HydrophobicContact CD2-CD1 4.21Å; L781-F822 HydrophobicContact CD2-CD2 4Å; L781-F822 HydrophobicContact CD2-CG 3.75Å; L781-F822 HydrophobicContact CG-CD1 4.37Å; L781-F822 HydrophobicContact CG-CG 4.39Å
782	V	94.2	Very high	89.9	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	119.3	-175.5	-165.8	0	0	0	0	109.6	F711 C726 F727 P780 W789 V790	F711-V782 HydrophobicContact CD1-CB 4.47Å; F711-V782 HydrophobicContact CD1-CG1 3.53Å; F711-V782 HydrophobicContact CD1-CG2 4.02Å; F711-V782 HydrophobicContact CD2-CG2 3.76Å; F711-V782 HydrophobicContact CE1-CG1 3.74Å; F711-V782 HydrophobicContact CE1-CG2 4.08Å; F711-V782 HydrophobicContact CE2-CG2 3.83Å; F711-V782 HydrophobicContact CG-CG1 4.07Å; F711-V782 HydrophobicContact CG-CG2 3.87Å; F711-V782 HydrophobicContact CZ-CG1 4.43Å; F711-V782 HydrophobicContact CZ-CG2 3.99Å; C726-V782 CarbonylContact C-O 3.57Å; C726-V782 WeakPolarHBondContact CA-O 3.46Å; F727-V782 PolarHBondContact N-O 2.92Å; F727-V782 PolarHBondContact O-N 3.07Å; P780-V782 HydrophobicContact CB-CG2 3.74Å; P780-V782 HydrophobicContact CG-CG2 4.06Å; P780-V782 PolarHBondContact O-N 2.64Å; V782-W789 HydrophobicContact CG1-CB 3.67Å; V782-W789 HydrophobicContact CG1-CD2 4.44Å; V782-W789 HydrophobicContact CG1-CE3 4.02Å; V782-W789 HydrophobicContact CG1-CG 4.35Å; V782-V790 WeakPolarHBondContact CA-O 3.17Å
783	C	94.1	Very high	90.4	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	151.5	179.8	-53.8	0	0	0	0	112.4	M724 Q725 C726 S785 W789 V790 F792	M724-C783 HydrophobicContact CB-CB 4.15Å; M724-C783 HydrophobicContact SD-CB 4.21Å; Q725-C783 CarbonylContact O-C 3.56Å; Q725-C783 VanDerWaalsContact O-CA 3.28Å; Q725-C783 WeakPolarHBondContact O-CA 3.49Å; C726-C783 HydrophobicContact CB-CB 4.06Å; C726-C783 WeakPolarHBondContact CB-SG 3.28Å; C726-C783 WeakPolarHBondContact SG-CB 3.48Å; C726-C783 CovalentContact SG-SG 2.04Å; C726-C783 PolarHBondContact SG-SG 2.87Å; C783-S785 PolarHBondContact O-N 2.76Å; C783-W789 VanDerWaalsContact C-CE3 3.47Å; C783-V790 PolarHBondContact N-O 3.17Å; C783-V790 PolarHBondContact O-N 2.8Å; C783-F792 HydrophobicContact CB-CD2 3.67Å; C783-F792 HydrophobicContact CB-CE2 3.98Å
784	Q	89.9	Confident	90.6	Very high	79 Å²	79	26 Å²	26	37%	0.369	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	113.2	177.5	-156.3	-168	74.8	0	0	110.1	Q725 W789	Q725-Q784 PolarHBondContact O-N 2.97Å; Q784-W789 HydrophobicContact CB-CE3 4.1Å; Q784-W789 HydrophobicContact CB-CH2 3.73Å; Q784-W789 HydrophobicContact CB-CZ2 4.26Å; Q784-W789 HydrophobicContact CB-CZ3 3.65Å; Q784-W789 HydrophobicContact CG-CH2 4.17Å; Q784-W789 HydrophobicContact CG-CZ2 4.2Å; Q784-W789 HydrophobicContact CG-CZ3 4.4Å; Q784-W789 VanDerWaalsContact N-CZ3 3.3Å
785	S	85.7	Confident	90.9	Very high	19 Å²	19	23.7 Å²	23.7	13%	0.133	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	108.5	179.2	173.5	0	0	0	0	110.1	C783 G787 N788	C783-S785 PolarHBondContact O-N 2.76Å; S785-G787 PolarHBondContact O-N 3.32Å; S785-N788 PolarHBondContact N-O 2.92Å; S785-N788 PolarHBondContact O-N 3.37Å; S785-N788 VanDerWaalsContact O-N 3.17Å
786	S	79.2	Confident	90.9	Very high	50 Å²	50	20.2 Å²	20.2	35%	0.35	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.4	49.1	178.2	-58.4	0	0	0	0	113.8	N265 V266 N788	N265-S786 VanDerWaalsContact C-OG 3.29Å; N265-S786 PolarHBondContact O-OG 3.06Å; V266-S786 WeakPolarHBondContact CA-OG 3.41Å; V266-S786 WeakPolarHBondContact CG2-OG 3.39Å; S786-N788 VanDerWaalsContact C-N 3.31Å; S786-N788 PolarHBondContact O-N 2.96Å; S786-N788 PolarHBondContact O-ND2 3.11Å; S786-N788 VanDerWaalsContact O-ND2 3.11Å
787	G	78.8	Confident	90.8	Very high	58 Å²	58	21.3 Å²	21.3	60%	0.598	13%	0.127	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.6	13.8	178.4	0	0	0	0	0	115.1	S785	S785-G787 PolarHBondContact O-N 3.32Å
788	N	82.8	Confident	90.6	Very high	100 Å²	100	19.9 Å²	19.9	54%	0.535	12%	0.122	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	148	176.5	-65.9	-105.8	0	0	0	109.4	S785 S786	S785-N788 PolarHBondContact N-O 2.92Å; S785-N788 PolarHBondContact O-N 3.37Å; S785-N788 VanDerWaalsContact O-N 3.17Å; S786-N788 VanDerWaalsContact C-N 3.31Å; S786-N788 PolarHBondContact O-N 2.96Å; S786-N788 PolarHBondContact O-ND2 3.11Å; S786-N788 VanDerWaalsContact O-ND2 3.11Å
789	W	87.3	Confident	90.3	Very high	23 Å²	23	22.1 Å²	22.1	9%	0.087	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	131.8	171.4	-69	109.2	0	0	0	110.4	H597 P599 F711 P712 F727 V782 C783 Q784	H597-W789 WeakPolarHBondContact O-CZ2 3.45Å; H597-W789 PolarHBondContact O-NE1 3.1Å; P599-W789 HydrophobicContact CB-CD2 4Å; P599-W789 HydrophobicContact CB-CE3 4.41Å; P599-W789 HydrophobicContact CB-CG 4.07Å; P599-W789 HydrophobicContact CG-CD2 4.25Å; P599-W789 HydrophobicContact CG-CE3 4.36Å; F711-W789 HydrophobicContact CD1-CB 4.3Å; F711-W789 HydrophobicContact CE1-CB 4.41Å; P712-W789 VanDerWaalsContact CD-O 3.27Å; P712-W789 WeakPolarHBondContact CD-O 3.47Å; P712-W789 WeakPolarHBondContact CG-O 3.47Å; F727-W789 AromaticContact CD2-CH2 3.76Å; F727-W789 HydrophobicContact CD2-CH2 3.76Å; F727-W789 AromaticContact CD2-CZ3 3.82Å; F727-W789 HydrophobicContact CD2-CZ3 3.82Å; F727-W789 AromaticContact CE2-CH2 3.74Å; F727-W789 HydrophobicContact CE2-CH2 3.74Å; F727-W789 HydrophobicContact CE2-CZ3 4.26Å; V782-W789 HydrophobicContact CG1-CB 3.67Å; V782-W789 HydrophobicContact CG1-CD2 4.44Å; V782-W789 HydrophobicContact CG1-CE3 4.02Å; V782-W789 HydrophobicContact CG1-CG 4.35Å; C783-W789 VanDerWaalsContact C-CE3 3.47Å; Q784-W789 HydrophobicContact CB-CE3 4.1Å; Q784-W789 HydrophobicContact CB-CH2 3.73Å; Q784-W789 HydrophobicContact CB-CZ2 4.26Å; Q784-W789 HydrophobicContact CB-CZ3 3.65Å; Q784-W789 HydrophobicContact CG-CH2 4.17Å; Q784-W789 HydrophobicContact CG-CZ2 4.2Å; Q784-W789 HydrophobicContact CG-CZ3 4.4Å; Q784-W789 VanDerWaalsContact N-CZ3 3.3Å
790	V	89.5	Confident	89.6	Confident	17 Å²	17	26.9 Å²	26.9	10%	0.103	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	131.3	-174.2	174.2	0	0	0	0	109.4	P712 P714 V782 C783 F792	P712-V790 HydrophobicContact CG-CG2 4.33Å; P712-V790 WeakPolarHBondContact O-CA 3.44Å; P712-V790 WeakPolarHBondContact O-CG1 3.45Å; P714-V790 HydrophobicContact CB-CG1 3.96Å; V782-V790 WeakPolarHBondContact CA-O 3.17Å; C783-V790 PolarHBondContact N-O 3.17Å; C783-V790 PolarHBondContact O-N 2.8Å; V790-F792 HydrophobicContact CB-CD2 4.07Å; V790-F792 HydrophobicContact CB-CE2 3.68Å; V790-F792 HydrophobicContact CB-CZ 4.36Å; V790-F792 HydrophobicContact CG1-CD2 3.88Å; V790-F792 HydrophobicContact CG1-CE1 4.49Å; V790-F792 HydrophobicContact CG1-CE2 3.63Å; V790-F792 HydrophobicContact CG1-CG 4.44Å; V790-F792 HydrophobicContact CG1-CZ 3.97Å; V790-F792 WeakPolarHBondContact O-CD2 3.32Å; V790-F792 PolarHBondContact O-N 2.85Å
791	Q	92.8	Very high	88.3	Confident	4 Å²	4	29.1 Å²	29.1	2%	0.019	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	92.8	179.1	-175.3	-173	2.3	0	0	110.5	T621 F711 P712 L713 P714 P780 L781 G793 L825	T621-Q791 PolarHBondContact OG1-NE2 3.38Å; F711-Q791 HydrophobicContact CB-CB 3.72Å; P712-Q791 PolarHBondContact O-N 3Å; L713-Q791 HydrophobicContact CD2-CB 4.41Å; P714-Q791 WeakPolarHBondContact CD-O 3.1Å; P780-Q791 HydrophobicContact CB-CG 3.7Å; L781-Q791 CarbonylContact O-C 3.56Å; L781-Q791 WeakPolarHBondContact O-CA 3.35Å; Q791-G793 WeakPolarHBondContact CG-O 3.23Å; Q791-L825 HydrophobicContact CG-CD1 3.75Å
792	F	92.6	Very high	86.3	Confident	3 Å²	3	41 Å²	41	1%	0.013	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	-18.9	180	-77.6	-87.8	0	0	0	113.8	P714 A720 M724 Y764 L781 C783 V790 L825	P714-F792 HydrophobicContact CB-CD1 3.6Å; P714-F792 HydrophobicContact CB-CE1 3.54Å; P714-F792 HydrophobicContact CB-CG 4.39Å; P714-F792 HydrophobicContact CB-CZ 4.29Å; P714-F792 HydrophobicContact CG-CD1 3.91Å; P714-F792 HydrophobicContact CG-CE1 4.36Å; P714-F792 HydrophobicContact CG-CG 4.45Å; A720-F792 HydrophobicContact CB-CB 3.98Å; A720-F792 HydrophobicContact CB-CD1 4.05Å; A720-F792 HydrophobicContact CB-CD2 4.24Å; A720-F792 HydrophobicContact CB-CG 3.84Å; A720-F792 VanDerWaalsContact N-CD1 3.3Å; M724-F792 HydrophobicContact CE-CZ 4.37Å; M724-F792 HydrophobicContact SD-CE2 4.07Å; M724-F792 HydrophobicContact SD-CZ 4.17Å; Y764-F792 HydrophobicContact CE2-CB 4.07Å; L781-F792 PolarHBondContact O-N 3.18Å; C783-F792 HydrophobicContact CB-CD2 3.67Å; C783-F792 HydrophobicContact CB-CE2 3.98Å; V790-F792 HydrophobicContact CB-CD2 4.07Å; V790-F792 HydrophobicContact CB-CE2 3.68Å; V790-F792 HydrophobicContact CB-CZ 4.36Å; V790-F792 HydrophobicContact CG1-CD2 3.88Å; V790-F792 HydrophobicContact CG1-CE1 4.49Å; V790-F792 HydrophobicContact CG1-CE2 3.63Å; V790-F792 HydrophobicContact CG1-CG 4.44Å; V790-F792 HydrophobicContact CG1-CZ 3.97Å; V790-F792 WeakPolarHBondContact O-CD2 3.32Å; V790-F792 PolarHBondContact O-N 2.85Å; F792-L825 PolarHBondContact O-N 3.01Å
793	G	93.8	Very high	84.1	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	178.2	-179	0	0	0	0	0	115.3	L781 Q791 V823	L781-G793 PolarHBondContact N-O 3.22Å; L781-G793 PolarHBondContact O-N 2.83Å; Q791-G793 WeakPolarHBondContact CG-O 3.23Å; G793-V823 CarbonylContact C-O 3.16Å; G793-V823 WeakPolarHBondContact CA-O 3.32Å
794	I	94.1	Very high	81.5	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	132.3	172.6	-48.3	178.6	0	0	0	107.6	V635 T636 A637 M693 G778 D796 F822 V823 L825	V635-I794 HydrophobicContact CG1-CD1 3.67Å; T636-I794 WeakPolarHBondContact O-CD1 3.42Å; A637-I794 HydrophobicContact CB-CG2 4.02Å; M693-I794 HydrophobicContact CB-CD1 4.02Å; G778-I794 VanDerWaalsContact CA-CG2 3.47Å; G778-I794 WeakPolarHBondContact O-CG2 3.44Å; I794-D796 PolarHBondContact O-N 2.98Å; I794-F822 CarbonylContact O-C 3.54Å; I794-F822 WeakPolarHBondContact O-CA 3.13Å; I794-V823 PolarHBondContact N-O 3.43Å; I794-V823 PolarHBondContact O-N 3.42Å; I794-L825 HydrophobicContact CD1-CD2 3.97Å; I794-L825 HydrophobicContact CG1-CD1 3.99Å; I794-L825 HydrophobicContact CG1-CD2 3.99Å; I794-L825 HydrophobicContact CG1-CG 4.19Å
795	Y	95	Very high	79	Confident	1 Å²	1	59.4 Å²	59.4	0%	0.004	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	125.9	171.7	-167.7	-60.8	0	0	0	109.9	I728 P776 G778 S779 S798 A820 F822	I728-Y795 HydrophobicContact CD1-CD2 4.23Å; I728-Y795 HydrophobicContact CG1-CD2 4.39Å; P776-Y795 HydrophobicContact CB-CD1 4.15Å; P776-Y795 HydrophobicContact CB-CD2 4.18Å; P776-Y795 HydrophobicContact CB-CE1 4.03Å; P776-Y795 HydrophobicContact CB-CE2 4.07Å; P776-Y795 HydrophobicContact CB-CG 4.26Å; P776-Y795 HydrophobicContact CG-CE1 4.12Å; P776-Y795 VanDerWaalsContact O-CB 3.25Å; P776-Y795 WeakPolarHBondContact O-CB 3.48Å; G778-Y795 PolarHBondContact N-O 3.07Å; S779-Y795 PolarHBondContact O-N 3.21Å; Y795-S798 WeakPolarHBondContact OH-CB 3.18Å; Y795-S798 PolarHBondContact OH-OG 3.01Å; Y795-A820 HydrophobicContact CD2-CB 4.42Å; Y795-A820 HydrophobicContact CE2-CB 3.73Å; Y795-F822 HydrophobicContact CD2-CD1 4.42Å; Y795-F822 AromaticContact CD2-CE1 3.6Å; Y795-F822 HydrophobicContact CD2-CE1 3.6Å; Y795-F822 HydrophobicContact CD2-CZ 4.35Å; Y795-F822 HydrophobicContact CE2-CE1 4.3Å; Y795-F822 HydrophobicContact CG-CD1 4.5Å; Y795-F822 HydrophobicContact CG-CE1 4.09Å
796	D	91.9	Very high	76.7	Confident	2 Å²	2	63 Å²	63	1%	0.011	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	-56.2	178.6	-167.2	85.4	0	0	0	112.1	R639 I777 I794 L821 V823	R639-D796 IonicContact CZ-OD2 2.81Å; R639-D796 IonicContact NE-OD2 3.42Å; R639-D796 PolarHBondContact NE-OD2 2.82Å; R639-D796 IonicContact NH2-OD2 2.75Å; I777-D796 WeakPolarHBondContact CG1-O 3.43Å; I794-D796 PolarHBondContact O-N 2.98Å; D796-L821 PolarHBondContact N-O 3.1Å; D796-V823 HydrophobicContact CB-CG2 3.95Å
797	H	90.6	Very high	74.6	Confident	41 Å²	41	65 Å²	65	19%	0.19	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	-178.6	176.7	62.5	-84.5	0	0	0	111.2	F799 L821	H797-F799 AromaticContact CD2-CE2 3.47Å; H797-F799 VanDerWaalsContact CD2-CE2 3.47Å; H797-F799 WeakPolarHBondContact CD2-CE2 3.2Å; H797-F799 AromaticContact CD2-CZ 3.36Å; H797-F799 WeakPolarHBondContact CD2-CZ 3.44Å; H797-F799 AromaticContact NE2-CE2 3.22Å; H797-F799 WeakPolarHBondContact NE2-CE2 3.35Å; H797-F799 AromaticContact NE2-CZ 3.13Å; H797-F799 WeakPolarHBondContact NE2-CZ 3.22Å; H797-L821 PolarHBondContact O-N 2.87Å
798	S	90.6	Very high	72.7	Confident	21 Å²	21	65.9 Å²	65.9	15%	0.147	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	158.4	-176.4	23.4	0	0	0	0	111.9	K770 Y795 V819	K770-S798 WeakPolarHBondContact CD-OG 3.47Å; K770-S798 WeakPolarHBondContact CE-OG 3.12Å; K770-S798 PolarHBondContact NZ-OG 2.9Å; Y795-S798 WeakPolarHBondContact OH-CB 3.18Å; Y795-S798 PolarHBondContact OH-OG 3.01Å; S798-V819 CarbonylContact C-O 3.59Å; S798-V819 VanDerWaalsContact CA-O 3.32Å; S798-V819 WeakPolarHBondContact CA-O 3.47Å
799	F	87.5	Confident	70.4	Confident	47 Å²	47	69.8 Å²	69.8	21%	0.206	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	132.7	174.1	-62.8	-71.4	0	0	0	111.7	L754 K757 H797 T801 D818 V819 L821	L754-F799 HydrophobicContact CD1-CD2 4.47Å; L754-F799 HydrophobicContact CD2-CB 3.99Å; L754-F799 HydrophobicContact CD2-CD2 3.58Å; L754-F799 HydrophobicContact CD2-CE2 4.47Å; L754-F799 HydrophobicContact CD2-CG 4.13Å; K757-F799 HydrophobicContact CB-CE2 4.43Å; K757-F799 HydrophobicContact CD-CD1 4.48Å; K757-F799 HydrophobicContact CD-CD2 4.47Å; K757-F799 HydrophobicContact CD-CE1 3.97Å; K757-F799 HydrophobicContact CD-CE2 3.91Å; K757-F799 HydrophobicContact CD-CZ 3.64Å; H797-F799 AromaticContact CD2-CE2 3.47Å; H797-F799 VanDerWaalsContact CD2-CE2 3.47Å; H797-F799 WeakPolarHBondContact CD2-CE2 3.2Å; H797-F799 AromaticContact CD2-CZ 3.36Å; H797-F799 WeakPolarHBondContact CD2-CZ 3.44Å; H797-F799 AromaticContact NE2-CE2 3.22Å; H797-F799 WeakPolarHBondContact NE2-CE2 3.35Å; H797-F799 AromaticContact NE2-CZ 3.13Å; H797-F799 WeakPolarHBondContact NE2-CZ 3.22Å; F799-T801 PolarHBondContact O-N 2.89Å; F799-D818 WeakPolarHBondContact CA-OD1 3.39Å; F799-D818 PolarHBondContact N-OD1 3.15Å; F799-D818 VanDerWaalsContact O-OD1 3.04Å; F799-V819 PolarHBondContact N-O 2.94Å; F799-V819 PolarHBondContact O-N 2.78Å; F799-L821 HydrophobicContact CE2-CD1 3.92Å
800	P	80.5	Confident	68.2	Low	99 Å²	99	72.4 Å²	72.4	64%	0.643	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.1	138.2	-177.2	23.8	-33.7	0	0	0	110.1	R802 D818	P800-R802 PolarHBondContact O-N 3.4Å; P800-R802 VanDerWaalsContact O-N 3.1Å; P800-D818 WeakPolarHBondContact CA-OD1 3.45Å
801	T	67.5	Low	65.7	Low	47 Å²	47	80.7 Å²	80.7	29%	0.288	44%	0.438	S	S	.	.			trans	-63.2	111.8	177.4	43.4	0	0	0	0	109.5	F799 R803 P816 V819	F799-T801 PolarHBondContact O-N 2.89Å; T801-R803 PolarHBondContact O-N 3.13Å; T801-P816 WeakPolarHBondContact CG2-O 3.22Å; T801-P816 PolarHBondContact OG1-O 3.44Å; T801-P816 VanDerWaalsContact OG1-O 3.13Å; T801-V819 HydrophobicContact CG2-CG2 3.79Å
802	R	54.8	Low	63.1	Low	250 Å²	250	87.8 Å²	87.8	94%	0.943	48%	0.477	S	S	*	.			trans	-63.6	108	175.1	-84.1	-170.6	171	-165.9	-3.4	109.2	P800 S804	P800-R802 PolarHBondContact O-N 3.4Å; P800-R802 VanDerWaalsContact O-N 3.1Å; R802-S804 PolarHBondContact O-N 2.97Å
803	R	47.9	Very low	60.6	Low	161 Å²	161	94.9 Å²	94.9	61%	0.608	51%	0.51	S	S	*	.			trans	-50.3	110.6	171.5	-75.6	-174.2	175	-165.7	-3.4	110.4	T801 Y805	T801-R803 PolarHBondContact O-N 3.13Å; R803-Y805 HydrophobicContact CB-CD2 4.04Å; R803-Y805 HydrophobicContact CB-CE2 3.81Å; R803-Y805 WeakPolarHBondContact O-CD2 3.29Å; R803-Y805 PolarHBondContact O-N 3.27Å
804	S	39.2	Very low	58.2	Low	104 Å²	104	101.2 Å²	101.2	73%	0.727	54%	0.542	S	S	*	.			trans	-77.4	100.7	156.2	49.6	0	0	0	0	107.4	R802 A806	R802-S804 PolarHBondContact O-N 2.97Å; S804-A806 PolarHBondContact O-N 3.05Å
805	Y	36.8	Very low	55.7	Low	200 Å²	200	105.6 Å²	105.6	78%	0.784	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	66.6	-179	-71.5	-95	0	0	0	111.9	R803	R803-Y805 HydrophobicContact CB-CD2 4.04Å; R803-Y805 HydrophobicContact CB-CE2 3.81Å; R803-Y805 WeakPolarHBondContact O-CD2 3.29Å; R803-Y805 PolarHBondContact O-N 3.27Å
806	A	38	Very low	53.8	Low	95 Å²	95	108.4 Å²	108.4	79%	0.785	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-143.3	0.4	-172.5	0	0	0	0	0	114.2	S804	S804-A806 PolarHBondContact O-N 3.05Å
807	A	35.1	Very low	52.5	Low	91 Å²	91	111.7 Å²	111.7	75%	0.752	60%	0.6	S	S	*	*	S	Bend	trans	-115.4	136.8	167.7	0	0	0	0	0	108.3
808	G	38.7	Very low	52.2	Low	77 Å²	77	110.5 Å²	110.5	79%	0.794	60%	0.595	S	S	*	*			trans	-69.1	152.7	179.9	0	0	0	0	0	112	S810	G808-S810 PolarHBondContact O-N 3.4Å
809	E	34.3	Very low	52.2	Low	183 Å²	183	109.6 Å²	109.6	86%	0.855	59%	0.589	S	S	*	*			trans	-66.8	125.3	-178.3	-67.5	170.3	137.6	0	0	110.7
810	S	41.2	Very low	52.5	Low	78 Å²	78	107.4 Å²	107.4	55%	0.545	58%	0.58	S	S	.	*			trans	-123	116.5	163.7	97.6	0	0	0	0	107.5	G808 N812	G808-S810 PolarHBondContact O-N 3.4Å; S810-N812 PolarHBondContact O-N 3.32Å
811	E	37	Very low	53.1	Low	190 Å²	190	102.8 Å²	102.8	89%	0.888	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	10.5	-162.7	-60.1	-179.6	116.8	0	0	114.7
812	N	38.8	Very low	54.4	Low	154 Å²	154	100.5 Å²	100.5	82%	0.824	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130	5.9	-174.5	-74.1	-83.7	0	0	0	114.4	S810	S810-N812 PolarHBondContact O-N 3.32Å
813	E	38.4	Very low	56.1	Low	152 Å²	152	88.7 Å²	88.7	71%	0.71	49%	0.491	S	S	*	.			trans	-84.6	118.7	174	-169.1	166.8	-154.2	0	0	110.6	I815	E813-I815 WeakPolarHBondContact O-CG1 3.47Å; E813-I815 PolarHBondContact O-N 3.01Å
814	I	43.3	Very low	58	Low	132 Å²	132	81.5 Å²	81.5	68%	0.677	46%	0.464	S	S	*	.			trans	-73.3	95.6	-179.6	-56	175.6	0	0	0	108.9
815	I	43.2	Very low	60.2	Low	92 Å²	92	76.6 Å²	76.6	47%	0.472	43%	0.43	S	S	.	.			trans	-62.7	133.6	-173.2	-51.7	-177.5	0	0	0	110.5	E813 D817	E813-I815 WeakPolarHBondContact O-CG1 3.47Å; E813-I815 PolarHBondContact O-N 3.01Å; I815-D817 PolarHBondContact O-N 2.97Å
816	P	55.1	Low	61.7	Low	61 Å²	61	68.3 Å²	68.3	40%	0.396	40%	0.398	S	S	.	.			trans	-71.9	98.9	170.3	28.3	-32.9	0	0	0	110.6	V767 T801 D818	V767-P816 HydrophobicContact CB-CB 4.15Å; T801-P816 WeakPolarHBondContact CG2-O 3.22Å; T801-P816 PolarHBondContact OG1-O 3.44Å; T801-P816 VanDerWaalsContact OG1-O 3.13Å; P816-D818 VanDerWaalsContact C-N 3.31Å; P816-D818 PolarHBondContact O-N 3.47Å
817	D	64.6	Low	62.6	Low	70 Å²	70	65 Å²	65	37%	0.374	37%	0.374	S	S	.	.			trans	-49	-43.4	-173.5	-68.3	-40.2	0	0	0	114.8	S771 I815	S771-D817 WeakPolarHBondContact CB-OD2 3.42Å; S771-D817 PolarHBondContact OG-OD2 2.95Å; I815-D817 PolarHBondContact O-N 2.97Å
818	D	83	Confident	63.6	Low	16 Å²	16	63.7 Å²	63.7	9%	0.086	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	143.4	-165.5	-102.1	-56.7	0	0	0	112.2	K770 F799 P800 P816	K770-D818 HydrophobicContact CB-CB 4.33Å; K770-D818 HydrophobicContact CD-CB 3.99Å; K770-D818 WeakPolarHBondContact CD-OD2 3.38Å; K770-D818 WeakPolarHBondContact CE-OD2 3.36Å; K770-D818 IonicContact NZ-OD1 2.76Å; K770-D818 IonicContact NZ-OD2 2.69Å; K770-D818 PolarHBondContact NZ-OD2 3.37Å; F799-D818 WeakPolarHBondContact CA-OD1 3.39Å; F799-D818 PolarHBondContact N-OD1 3.15Å; F799-D818 VanDerWaalsContact O-OD1 3.04Å; P800-D818 WeakPolarHBondContact CA-OD1 3.45Å; P816-D818 VanDerWaalsContact C-N 3.31Å; P816-D818 PolarHBondContact O-N 3.47Å
819	V	91.2	Very high	64.3	Low	3 Å²	3	60.7 Å²	60.7	2%	0.018	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	110.3	163.1	-174.4	0	0	0	0	108.1	H753 L754 C765 V767 S798 F799 T801	H753-V819 HydrophobicContact CB-CG2 4.33Å; L754-V819 HydrophobicContact CD1-CG1 3.97Å; L754-V819 HydrophobicContact CD2-CB 4.19Å; L754-V819 HydrophobicContact CD2-CG1 4.16Å; L754-V819 HydrophobicContact CG-CG1 4.17Å; C765-V819 HydrophobicContact CB-CG1 4.15Å; V767-V819 HydrophobicContact CG1-CG2 4.13Å; S798-V819 CarbonylContact C-O 3.59Å; S798-V819 VanDerWaalsContact CA-O 3.32Å; S798-V819 WeakPolarHBondContact CA-O 3.47Å; F799-V819 PolarHBondContact N-O 2.94Å; F799-V819 PolarHBondContact O-N 2.78Å; T801-V819 HydrophobicContact CG2-CG2 3.79Å
820	A	94	Very high	65	Low	0 Å²	0	52 Å²	52	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	144.9	178.6	0	0	0	0	0	112	Y742 C765 G766 Y795 F822	Y742-A820 HydrophobicContact CD1-CB 4.39Å; Y742-A820 HydrophobicContact CE1-CB 3.71Å; C765-A820 WeakPolarHBondContact CA-O 3.23Å; C765-A820 WeakPolarHBondContact CB-O 3.41Å; G766-A820 PolarHBondContact N-O 3.27Å; G766-A820 VanDerWaalsContact N-O 3.08Å; G766-A820 PolarHBondContact O-N 3.4Å; Y795-A820 HydrophobicContact CD2-CB 4.42Å; Y795-A820 HydrophobicContact CE2-CB 3.73Å; A820-F822 HydrophobicContact CB-CE1 4.16Å; A820-F822 HydrophobicContact CB-CE2 3.92Å; A820-F822 HydrophobicContact CB-CZ 3.53Å
821	L	94	Very high	65.3	Low	2 Å²	2	49.7 Å²	49.7	1%	0.01	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	136.5	170.2	-77.9	-177.9	0	0	0	111.3	L754 F758 M763 C765 D796 H797 F799	L754-L821 HydrophobicContact CD1-CD1 4.3Å; L754-L821 HydrophobicContact CD1-CD2 3.53Å; L754-L821 HydrophobicContact CD1-CG 3.88Å; F758-L821 HydrophobicContact CD2-CD2 3.71Å; F758-L821 HydrophobicContact CE2-CD2 4.4Å; M763-L821 HydrophobicContact CB-CD2 4.25Å; M763-L821 HydrophobicContact CE-CD1 4.43Å; M763-L821 HydrophobicContact CG-CD2 4.5Å; M763-L821 HydrophobicContact SD-CD1 4.06Å; M763-L821 HydrophobicContact SD-CD2 4.18Å; C765-L821 HydrophobicContact CB-CD2 3.75Å; D796-L821 PolarHBondContact N-O 3.1Å; H797-L821 PolarHBondContact O-N 2.87Å; F799-L821 HydrophobicContact CE2-CD1 3.92Å
822	F	94.3	Very high	65.6	Low	0 Å²	0	46 Å²	46	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	120.3	-178.9	-51.9	-77.9	0	0	0	111.3	I728 Y742 L744 M763 Y764 L781 I794 Y795 A820 K824	I728-F822 HydrophobicContact CD1-CD1 4.12Å; I728-F822 HydrophobicContact CD1-CE1 3.42Å; I728-F822 VanDerWaalsContact CD1-CE1 3.42Å; I728-F822 HydrophobicContact CD1-CZ 4.16Å; I728-F822 HydrophobicContact CG1-CE1 4.17Å; Y742-F822 HydrophobicContact CD1-CE2 4.27Å; Y742-F822 AromaticContact CD1-CZ 3.68Å; Y742-F822 HydrophobicContact CD1-CZ 3.68Å; Y742-F822 HydrophobicContact CE1-CZ 4.01Å; Y742-F822 HydrophobicContact CG-CZ 4.2Å; L744-F822 HydrophobicContact CD2-CD2 4.09Å; L744-F822 HydrophobicContact CD2-CE2 4.05Å; M763-F822 CarbonylContact C-O 3.53Å; M763-F822 VanDerWaalsContact CA-O 3.26Å; M763-F822 WeakPolarHBondContact CA-O 3.35Å; Y764-F822 PolarHBondContact N-O 2.98Å; Y764-F822 PolarHBondContact O-N 3.37Å; L781-F822 HydrophobicContact CB-CD1 3.92Å; L781-F822 HydrophobicContact CB-CE1 4.43Å; L781-F822 HydrophobicContact CB-CG 4.3Å; L781-F822 HydrophobicContact CD1-CD1 4.32Å; L781-F822 HydrophobicContact CD1-CE1 4.22Å; L781-F822 HydrophobicContact CD1-CE2 4.38Å; L781-F822 HydrophobicContact CD1-CG 4.47Å; L781-F822 HydrophobicContact CD1-CZ 4.24Å; L781-F822 HydrophobicContact CD2-CB 3.87Å; L781-F822 HydrophobicContact CD2-CD1 4.21Å; L781-F822 HydrophobicContact CD2-CD2 4Å; L781-F822 HydrophobicContact CD2-CG 3.75Å; L781-F822 HydrophobicContact CG-CD1 4.37Å; L781-F822 HydrophobicContact CG-CG 4.39Å; I794-F822 CarbonylContact O-C 3.54Å; I794-F822 WeakPolarHBondContact O-CA 3.13Å; Y795-F822 HydrophobicContact CD2-CD1 4.42Å; Y795-F822 AromaticContact CD2-CE1 3.6Å; Y795-F822 HydrophobicContact CD2-CE1 3.6Å; Y795-F822 HydrophobicContact CD2-CZ 4.35Å; Y795-F822 HydrophobicContact CE2-CE1 4.3Å; Y795-F822 HydrophobicContact CG-CD1 4.5Å; Y795-F822 HydrophobicContact CG-CE1 4.09Å; A820-F822 HydrophobicContact CB-CE1 4.16Å; A820-F822 HydrophobicContact CB-CE2 3.92Å; A820-F822 HydrophobicContact CB-CZ 3.53Å; F822-K824 PolarHBondContact O-N 3.15Å
823	V	90.3	Very high	66.1	Low	2 Å²	2	39 Å²	39	1%	0.012	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	124.1	173.9	169.9	0	0	0	0	109.5	F681 I691 G793 I794 D796	F681-V823 HydrophobicContact CD2-CG1 4.02Å; F681-V823 HydrophobicContact CE2-CG1 3.38Å; F681-V823 HydrophobicContact CZ-CG1 4.24Å; I691-V823 HydrophobicContact CG2-CG2 3.69Å; G793-V823 CarbonylContact C-O 3.16Å; G793-V823 WeakPolarHBondContact CA-O 3.32Å; I794-V823 PolarHBondContact N-O 3.43Å; I794-V823 PolarHBondContact O-N 3.42Å; D796-V823 HydrophobicContact CB-CG2 3.95Å
824	K	88.4	Confident	66.1	Low	10 Å²	10	34.1 Å²	34.1	4%	0.043	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	140.2	-174.6	-64.2	-169.4	-168.7	178.4	0	113.8	M203 P760 S761 V762 M763 Y764 F822 K829	M203-K824 PolarHBondContact SD-NZ 2.92Å; P760-K824 PolarHBondContact O-NZ 2.97Å; S761-K824 PolarHBondContact O-NZ 3.4Å; V762-K824 WeakPolarHBondContact O-CG 3.47Å; V762-K824 PolarHBondContact O-N 3.35Å; V762-K824 VanDerWaalsContact O-N 3.14Å; M763-K824 WeakPolarHBondContact O-CE 3.45Å; Y764-K824 HydrophobicContact CD1-CD 4.47Å; Y764-K824 HydrophobicContact CD2-CD 4.42Å; Y764-K824 HydrophobicContact CD2-CG 3.78Å; Y764-K824 HydrophobicContact CE1-CD 4.01Å; Y764-K824 HydrophobicContact CE1-CG 4.4Å; Y764-K824 HydrophobicContact CE2-CB 4.24Å; Y764-K824 HydrophobicContact CE2-CD 3.96Å; Y764-K824 HydrophobicContact CE2-CG 3.53Å; Y764-K824 HydrophobicContact CG-CG 4.29Å; F822-K824 PolarHBondContact O-N 3.15Å; K824-K829 PolarHBondContact O-NZ 3.3Å
825	L	83.9	Confident	65.6	Low	1 Å²	1	33 Å²	33	1%	0.005	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-103.8	152.9	170.4	-58.6	-175.9	0	0	0	112.3	M693 L713 P714 Q791 F792 I794	M693-L825 HydrophobicContact CE-CD2 3.43Å; M693-L825 VanDerWaalsContact CE-CD2 3.43Å; L713-L825 HydrophobicContact CD2-CB 4.25Å; L713-L825 HydrophobicContact CD2-CD1 3.53Å; L713-L825 HydrophobicContact CD2-CG 4.46Å; P714-L825 HydrophobicContact CG-CB 4.34Å; P714-L825 VanDerWaalsContact CG-O 3.22Å; P714-L825 WeakPolarHBondContact CG-O 3.3Å; Q791-L825 HydrophobicContact CG-CD1 3.75Å; F792-L825 PolarHBondContact O-N 3.01Å; I794-L825 HydrophobicContact CD1-CD2 3.97Å; I794-L825 HydrophobicContact CG1-CD1 3.99Å; I794-L825 HydrophobicContact CG1-CD2 3.99Å; I794-L825 HydrophobicContact CG1-CG 4.19Å
826	E	69.2	Low	65.3	Low	25 Å²	25	31.2 Å²	31.2	12%	0.117	18%	0.179	C	C	.	.			trans	-147.2	149	169.6	-60.8	163.2	119.2	0	0	107.7	R206 P714 D828 K829	R206-E826 WeakPolarHBondContact CB-OE1 3.32Å; R206-E826 WeakPolarHBondContact CB-OE2 3.47Å; R206-E826 VanDerWaalsContact CD-OE2 3.31Å; R206-E826 WeakPolarHBondContact CD-OE2 3.42Å; R206-E826 PolarHBondContact N-OE1 2.81Å; R206-E826 IonicContact NE-OE2 3.97Å; P714-E826 CarbonylContact O-C 3.53Å; E826-D828 VanDerWaalsContact C-N 3.34Å; E826-D828 PolarHBondContact O-N 2.89Å; E826-K829 HydrophobicContact CB-CD 4.33Å; E826-K829 HydrophobicContact CB-CG 4.28Å; E826-K829 WeakPolarHBondContact O-CB 3.37Å; E826-K829 VanDerWaalsContact O-CG 3.29Å; E826-K829 WeakPolarHBondContact O-CG 3.42Å; E826-K829 PolarHBondContact O-N 3.42Å; E826-K829 VanDerWaalsContact O-N 3.09Å; E826-K829 WeakPolarHBondContact OE2-CE 3.37Å; E826-K829 IonicContact OE2-NZ 2.68Å; E826-K829 PolarHBondContact OE2-NZ 3.05Å
827	G	56.4	Low	64.2	Low	26 Å²	26	32.1 Å²	32.1	27%	0.268	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-27.9	-164.2	0	0	0	0	0	116.2	P714 K829	P714-G827 VanDerWaalsContact O-CA 3.23Å; P714-G827 WeakPolarHBondContact O-CA 3.47Å; P714-G827 PolarHBondContact O-N 2.87Å; G827-K829 VanDerWaalsContact C-N 3.25Å; G827-K829 PolarHBondContact O-N 3.34Å
828	D	56.4	Low	62.6	Low	63 Å²	63	33.6 Å²	33.6	34%	0.337	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-21.6	177.2	-63.3	-32.7	0	0	0	112.8	K207 S716 E826 V830 Q832	K207-D828 IonicContact NZ-OD2 3.69Å; K207-D828 PolarHBondContact NZ-OD2 3.37Å; S716-D828 WeakPolarHBondContact CB-OD2 3.23Å; S716-D828 PolarHBondContact OG-OD1 3.45Å; S716-D828 PolarHBondContact OG-OD2 3.15Å; E826-D828 VanDerWaalsContact C-N 3.34Å; E826-D828 PolarHBondContact O-N 2.89Å; D828-V830 PolarHBondContact O-N 2.93Å; D828-Q832 WeakPolarHBondContact O-CG 3.03Å; D828-Q832 PolarHBondContact O-N 2.94Å
829	K	52.9	Low	60	Low	14 Å²	14	38 Å²	38	6%	0.061	21%	0.214	C	C	.	.	H	α-helix	trans	-62.7	-49.6	-163.3	-65.5	-176.5	-168	-169.4	0	113.4	R206 F681 M693 K824 E826 G827 G831 Q832 V833	R206-K829 VanDerWaalsContact CZ-CE 3.47Å; R206-K829 VanDerWaalsContact CZ-NZ 3.27Å; F681-K829 HydrophobicContact CE1-CD 4.09Å; F681-K829 HydrophobicContact CZ-CD 3.84Å; M693-K829 HydrophobicContact CE-CB 3.52Å; M693-K829 HydrophobicContact CE-CD 3.65Å; M693-K829 HydrophobicContact CE-CG 4.21Å; M693-K829 HydrophobicContact SD-CB 4.35Å; K824-K829 PolarHBondContact O-NZ 3.3Å; E826-K829 HydrophobicContact CB-CD 4.33Å; E826-K829 HydrophobicContact CB-CG 4.28Å; E826-K829 WeakPolarHBondContact O-CB 3.37Å; E826-K829 VanDerWaalsContact O-CG 3.29Å; E826-K829 WeakPolarHBondContact O-CG 3.42Å; E826-K829 PolarHBondContact O-N 3.42Å; E826-K829 VanDerWaalsContact O-N 3.09Å; E826-K829 WeakPolarHBondContact OE2-CE 3.37Å; E826-K829 IonicContact OE2-NZ 2.68Å; E826-K829 PolarHBondContact OE2-NZ 3.05Å; G827-K829 VanDerWaalsContact C-N 3.25Å; G827-K829 PolarHBondContact O-N 3.34Å; K829-G831 PolarHBondContact O-N 3.15Å; K829-Q832 PolarHBondContact O-N 3.44Å; K829-V833 VanDerWaalsContact O-CG2 3.32Å; K829-V833 WeakPolarHBondContact O-CG2 3.3Å; K829-V833 PolarHBondContact O-N 2.8Å
830	V	49.6	Very low	57	Low	0 Å²	0	41.3 Å²	41.3	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-67.9	-38	-173.4	-177.5	0	0	0	0	111.9	Y623 V635 M693 M695 L713 D828 Q832 V833	Y623-V830 HydrophobicContact CD1-CB 4.37Å; Y623-V830 HydrophobicContact CD1-CG1 3.62Å; Y623-V830 HydrophobicContact CD2-CG2 4.43Å; Y623-V830 HydrophobicContact CE1-CB 4.03Å; Y623-V830 HydrophobicContact CE1-CG1 3.61Å; Y623-V830 HydrophobicContact CE2-CB 4.44Å; Y623-V830 HydrophobicContact CE2-CG2 4.41Å; Y623-V830 HydrophobicContact CG-CG1 4.15Å; V635-V830 HydrophobicContact CG2-CG2 4.03Å; M693-V830 HydrophobicContact SD-CG2 4.2Å; M695-V830 HydrophobicContact CG-CG1 4.49Å; M695-V830 HydrophobicContact SD-CG1 3.77Å; L713-V830 HydrophobicContact CD1-CB 4.45Å; L713-V830 HydrophobicContact CD1-CG2 3.63Å; D828-V830 PolarHBondContact O-N 2.93Å; V830-Q832 VanDerWaalsContact C-N 3.34Å; V830-Q832 PolarHBondContact O-N 3.49Å; V830-V833 WeakPolarHBondContact O-CB 3.03Å; V830-V833 PolarHBondContact O-N 3.39Å
831	G	46.4	Very low	53.8	Low	30 Å²	30	47.6 Å²	47.6	31%	0.309	27%	0.271	S	S	.	.	H	α-helix	trans	-66.1	-33.8	173.7	0	0	0	0	0	113.4	K829 V833 Q834	K829-G831 PolarHBondContact O-N 3.15Å; G831-V833 VanDerWaalsContact C-N 3.28Å; G831-V833 PolarHBondContact O-N 2.75Å; G831-Q834 PolarHBondContact O-N 3.25Å
832	Q	45.2	Very low	50.6	Low	113 Å²	113	54.4 Å²	54.4	53%	0.528	31%	0.307	S	S	.	.	H	α-helix	trans	-76.4	-11.5	176.8	-71.6	-173.3	-31.8	0	0	114.2	D828 K829 V830	D828-Q832 WeakPolarHBondContact O-CG 3.03Å; D828-Q832 PolarHBondContact O-N 2.94Å; K829-Q832 PolarHBondContact O-N 3.44Å; V830-Q832 VanDerWaalsContact C-N 3.34Å; V830-Q832 PolarHBondContact O-N 3.49Å
833	V	48	Very low	47.3	Very low	6 Å²	6	60.9 Å²	60.9	4%	0.036	34%	0.341	C	S	.	.	H	α-helix	trans	-71	-36.5	171.5	178.9	0	0	0	0	110.5	Y677 R679 M693 M695 K829 V830 G831	Y677-V833 HydrophobicContact CD1-CG1 4.43Å; Y677-V833 HydrophobicContact CG-CG1 4Å; R679-V833 HydrophobicContact CG-CG1 4.27Å; R679-V833 HydrophobicContact CG-CG2 3.95Å; M693-V833 HydrophobicContact SD-CG2 4.33Å; M695-V833 HydrophobicContact CB-CG1 4.16Å; M695-V833 HydrophobicContact CE-CB 4.29Å; M695-V833 HydrophobicContact CE-CG1 3.73Å; M695-V833 HydrophobicContact SD-CB 4.35Å; M695-V833 HydrophobicContact SD-CG1 4.26Å; K829-V833 VanDerWaalsContact O-CG2 3.32Å; K829-V833 WeakPolarHBondContact O-CG2 3.3Å; K829-V833 PolarHBondContact O-N 2.8Å; V830-V833 WeakPolarHBondContact O-CB 3.03Å; V830-V833 PolarHBondContact O-N 3.39Å; G831-V833 VanDerWaalsContact C-N 3.28Å; G831-V833 PolarHBondContact O-N 2.75Å
834	Q	39.7	Very low	44.2	Very low	50 Å²	50	70.6 Å²	70.6	23%	0.234	40%	0.4	C	S	.	.	H	α-helix	trans	-79.5	-26.5	-173.3	-64.9	-179.3	-23.2	0	0	114.6	K625 E633 M695 G831	K625-Q834 VanDerWaalsContact NZ-OE1 3.14Å; E633-Q834 PolarHBondContact OE1-NE2 3.39Å; M695-Q834 HydrophobicContact CE-CG 3.7Å; M695-Q834 HydrophobicContact SD-CG 4.16Å; G831-Q834 PolarHBondContact O-N 3.25Å
835	N	32.3	Very low	42	Very low	108 Å²	108	73.7 Å²	73.7	58%	0.578	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	3.6	-163.5	-75.5	18.3	0	0	0	116
836	V	36.5	Very low	39.8	Very low	56 Å²	56	77.5 Å²	77.5	34%	0.339	44%	0.439	S	S	.	.	S	Bend	trans	-96.9	-34.8	-175.3	173.5	0	0	0	0	112.8	T838 I839 S840	V836-T838 PolarHBondContact O-N 3.22Å; V836-T838 VanDerWaalsContact O-N 3.15Å; V836-I839 WeakPolarHBondContact O-CA 3.49Å; V836-I839 PolarHBondContact O-N 2.04Å; V836-S840 PolarHBondContact O-N 3.33Å; V836-S840 PolarHBondContact O-OG 3.45Å
837	D	32.7	Very low	38.2	Very low	80 Å²	80	80.4 Å²	80.4	43%	0.428	46%	0.457	S	S	.	.	H	α-helix	trans	-61.2	-24.8	175.5	-58.7	19.2	0	0	0	112.1	Y677 I839	Y677-D837 WeakPolarHBondContact CE1-OD2 3.45Å; D837-I839 PolarHBondContact O-N 3.2Å
838	T	30.3	Very low	37.1	Very low	101 Å²	101	83.6 Å²	83.6	62%	0.62	47%	0.468	S	S	*	.	H	α-helix	trans	-73.6	-10.5	172.8	-24.5	0	0	0	0	113.9	V836	V836-T838 PolarHBondContact O-N 3.22Å; V836-T838 VanDerWaalsContact O-N 3.15Å
839	I	28.6	Very low	35.9	Very low	108 Å²	108	84.9 Å²	84.9	55%	0.554	48%	0.476	S	S	*	.	H	α-helix	trans	-109.5	-29.6	179	-60.1	172.1	0	0	0	110.1	V836 D837 N841	V836-I839 WeakPolarHBondContact O-CA 3.49Å; V836-I839 PolarHBondContact O-N 2.04Å; D837-I839 PolarHBondContact O-N 3.2Å; I839-N841 VanDerWaalsContact C-N 3.32Å; I839-N841 PolarHBondContact O-N 3.09Å
840	S	27.5	Very low	34.8	Very low	72 Å²	72	89.6 Å²	89.6	50%	0.503	50%	0.504	S	S	.	.	H	α-helix	trans	-72.5	-19	177.7	-65	0	0	0	0	114.7	V836	V836-S840 PolarHBondContact O-N 3.33Å; V836-S840 PolarHBondContact O-OG 3.45Å
841	N	26.8	Very low	33.7	Very low	133 Å²	133	96 Å²	96	71%	0.711	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-9	178.3	-73	-2.6	0	0	0	114.4	I839 I843	I839-N841 VanDerWaalsContact C-N 3.32Å; I839-N841 PolarHBondContact O-N 3.09Å; N841-I843 VanDerWaalsContact C-N 3.34Å
842	D	27.6	Very low	32.8	Very low	144 Å²	144	101.1 Å²	101.1	77%	0.77	56%	0.558	S	S	*	*	S	Bend	trans	-94	13.4	175.7	-74.6	-14.3	0	0	0	112.3
843	I	25	Very low	31.7	Very low	137 Å²	137	100.1 Å²	100.1	70%	0.703	56%	0.56	S	S	*	*			trans	-136.5	65.4	-179.8	-44.1	179.7	0	0	0	110.7	N841	N841-I843 VanDerWaalsContact C-N 3.34Å
844	V	25.8	Very low	30.2	Very low	206 Å²	206	108.6 Å²	108.6	100%	1.248	61%	0.608	S	S	*	*			trans	-136.7	0	163.1	-179.2	0	0	0	0	108.4

Retrieved 844 of 844 residues in 248.4 ms (Link to these results)

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