A0A3Q0KD55_SCHMA Loading...

Low-density lipoprotein receptor (Ldl)

AlphaFold DB , UniProt , Accession A0A3Q0KD55, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 964 aa.

						>A0A3Q0KD55_SCHMA|A0A3Q0KD55
MTSFIKLFILQTILFIIVSCQNGRQTYHGNNYLRYHGIIQPTQPSQVRRWIVLLGRKVVLNCSVNLPPEVNPRQVQYRWEHPEGNILGYSKLYVIPNVTMNDAGVYTCHSSAYVGFGGEQWVDQHRLYLEVQDDISMAGGDRNSEPTIVLNPGDPGPLDVNFGELLYSRCSVLDSNQYSYRWIQRAPDGTIKEISSDARLYITNFGPEHLQYPIRCEVTRLSDDETFEKVLNLRLASSGDLSTDDEYKTLNLTIKPLPNEDFRQGTIMRQCLFENDPEINELFDFRWIDQNGRIVTNGDTLYLLIEDPSELSNYTCEATNRQTGVIYQAKYRVSMLNGQQAMQHIVNIRPITGDVIIGRPYEMVCEVEPPPEEPISFVWYHNAKVVHREASLRLTSLSYRDIGMYICRAEWTPRYSRTAISANATAELSLALTRETKIEMSPPPGSVMVSLPGETRELHCEFPVANPRDVRWYFENQLLENHPTINATGKVYRIDRLRVSIVTIRGIEQDHGGTYECRIGRDIKQTHLVVRAEEGLEINPKSDTVDEGEAVEFHCRVHGMNGNINRQLEWYYRPFYSSTRVRLDVDTPDGFMRHDDLVAQHTSFISKARARVADQGEYICRLPSQNEEIVGKLFVRAVRSYVLTITPQRLTVRPYQPVEFECFAASEDGQPASFTPRFQVRDSRISFETTRVSENRVRFVLQRGLGPDQNGTVVECLSDEPSRPASAIITVEDICPDGSRRCRSGQCLPAGRFCDGARDCDDGSDEDPKMCNICDPLSRKCEYYQGREPIKSTFMVHWTCDGESDCGNGFDESNCEARASERCQDRMFNCKRDGRQIPMAFVCDKDRDCSDGEDELTCAPPMIAEPRTTRYSVRRGDTVVLVCEVTGNPVPYVIWRFNWGCLPDEPSRFRISNVPRNCDSPMPTVVSTLTISNVRPGDDGIYNCEGLSGATRALSNDLVVMIGG
					

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	37.5	Very low	34.4	Very low	237 Å²	237	155.2 Å²	155.2	100%	1.167	78%	0.78	S	S	*	*				0	132.3	0	-72.6	156.7	152.7	0	0	107.9
2	T	31.3	Very low	34.1	Very low	126 Å²	126	151.3 Å²	151.3	77%	0.773	77%	0.77	S	S	*	*			cis	-172.1	153	-28.7	1.9	0	0	0	0	108.6
3	S	36.9	Very low	34.1	Very low	108 Å²	108	151.7 Å²	151.7	76%	0.755	77%	0.773	S	S	*	*			trans	79.8	112	179.9	-53.5	0	0	0	0	115.4
4	F	34.9	Very low	33.7	Very low	181 Å²	181	150 Å²	150	79%	0.794	77%	0.765	S	S	*	*				82.5	116.5	51.9	-77.1	-118.7	0	0	0	112.9
5	I	37.9	Very low	33.3	Very low	138 Å²	138	151.4 Å²	151.4	71%	0.708	76%	0.764	S	S	*	*				91.3	122.9	50.2	-69.6	162.1	0	0	0	113.4
6	K	33.8	Very low	33	Very low	190 Å²	190	150.2 Å²	150.2	83%	0.826	76%	0.759	S	S	*	*			trans	141.2	145.9	159	-81.9	165.6	-173.1	-178.8	0	110.1
7	L	36.7	Very low	32.6	Very low	136 Å²	136	150.2 Å²	150.2	71%	0.712	76%	0.759	S	S	*	*			cis	-146.6	153.1	5.7	-154.5	67.8	0	0	0	107.6	I9	L7-I9 HydrophobicContact CD2-CD1 4.49Å
8	F	32.1	Very low	32.4	Very low	185 Å²	185	149.4 Å²	149.4	81%	0.811	76%	0.763	S	S	*	*			cis	91.4	147	26	-121.3	-84.8	0	0	0	116.6
9	I	34.5	Very low	32.2	Very low	127 Å²	127	147.1 Å²	147.1	65%	0.651	76%	0.761	S	S	*	*			trans	100.2	98.2	168.2	-59.3	175.3	0	0	0	116.3	L7	L7-I9 HydrophobicContact CD2-CD1 4.49Å
10	L	31.1	Very low	31.8	Very low	132 Å²	132	146.3 Å²	146.3	69%	0.691	77%	0.768	S	S	*	*				82.9	149.8	83.1	-66.4	166.1	0	0	0	114
11	Q	31.9	Very low	31.6	Very low	147 Å²	147	147 Å²	147	69%	0.687	77%	0.767	S	S	*	*			cis	-165.1	139.3	4.4	-133.7	170.5	-37.4	0	0	116.5
12	T	30.2	Very low	31.1	Very low	108 Å²	108	143.1 Å²	143.1	66%	0.663	75%	0.751	S	S	*	*			trans	50.4	157.6	137.7	53.9	0	0	0	0	127.6
13	I	35.1	Very low	30.9	Very low	157 Å²	157	140.9 Å²	140.9	81%	0.805	75%	0.753	S	S	*	*			trans	94.9	147.9	154.9	-67.5	139.7	0	0	0	118
14	L	28.2	Very low	30.3	Very low	128 Å²	128	147 Å²	147	67%	0.67	76%	0.76	S	S	*	*			cis	-174.4	168.8	-49.8	-145.7	72.4	0	0	0	108.9
15	F	27.6	Very low	30.1	Very low	171 Å²	171	147 Å²	147	75%	0.75	76%	0.763	S	S	*	*			trans	85.5	131.9	150.8	-80.2	-46.1	0	0	0	124.4
16	I	27.9	Very low	29.4	Very low	132 Å²	132	145.8 Å²	145.8	68%	0.677	76%	0.761	S	S	*	*			trans	82.1	92.1	136.5	-65.3	165	0	0	0	120.4
17	I	27.3	Very low	29.2	Very low	150 Å²	150	147.1 Å²	147.1	77%	0.769	76%	0.763	S	S	*	*				23.7	124.4	112.2	-49.2	166.2	0	0	0	117.8
18	V	29	Very low	28.7	Very low	137 Å²	137	149.4 Å²	149.4	83%	0.83	77%	0.769	S	S	*	*				-172.4	144.7	124.2	140	0	0	0	0	110.4
19	S	27.5	Very low	28.4	Very low	104 Å²	104	143.8 Å²	143.8	73%	0.727	76%	0.764	S	S	*	*			trans	-93.6	148.4	175.7	179.4	0	0	0	0	111.3
20	C	25.6	Very low	28.2	Very low	131 Å²	131	145.4 Å²	145.4	89%	0.885	77%	0.774	S	S	*	*			trans	-143.7	148.4	164.5	-119.5	0	0	0	0	111.7
21	Q	26.5	Very low	28	Very low	163 Å²	163	146.4 Å²	146.4	76%	0.762	78%	0.78	S	S	*	*			trans	-109.5	168	-169.4	-53.5	171.8	-66.1	0	0	112.3
22	N	26.1	Very low	27.8	Very low	154 Å²	154	150.4 Å²	150.4	82%	0.824	79%	0.79	S	S	*	*			trans	65.3	120.8	151.2	-62.4	-34.9	0	0	0	118.8
23	G	27.9	Very low	27.6	Very low	80 Å²	80	153 Å²	153	83%	0.825	80%	0.799	S	S	*	*			trans	-156.2	64.4	173.1	0	0	0	0	0	112.9	Q25	G23-Q25 PolarHBondContact O-N 2.92Å
24	R	24.7	Very low	27.2	Very low	235 Å²	235	157 Å²	157	89%	0.887	80%	0.804	S	S	*	*			trans	-57	134.5	172.9	-83.3	176.1	164.6	168.8	-6.7	111
25	Q	30	Very low	27	Very low	183 Å²	183	161 Å²	161	86%	0.855	81%	0.812	S	S	*	*			trans	-135.4	117.2	135.3	-75.2	-156.9	-0.2	0	0	111.2	G23	G23-Q25 PolarHBondContact O-N 2.92Å
26	T	23.8	Very low	27	Very low	111 Å²	111	161.9 Å²	161.9	68%	0.681	82%	0.818	S	S	*	*			trans	-94.2	138.7	163.4	46.4	0	0	0	0	108.7
27	Y	29.1	Very low	26.9	Very low	219 Å²	219	159.4 Å²	159.4	86%	0.859	83%	0.825	S	S	*	*			trans	-135.5	142.3	158.9	-112.3	-84.4	0	0	0	111.8
28	H	26.5	Very low	26.9	Very low	183 Å²	183	159.5 Å²	159.5	85%	0.847	83%	0.825	S	S	*	*			trans	-83.1	159.2	-177.9	-69.3	-116.7	0	0	0	111.6
29	G	26.2	Very low	26.7	Very low	67 Å²	67	161 Å²	161	69%	0.691	83%	0.827	S	S	*	*			trans	171.1	79.9	158.5	0	0	0	0	0	118.4
30	N	30.3	Very low	26.7	Very low	161 Å²	161	164 Å²	164	86%	0.861	83%	0.829	S	S	*	*			trans	56.1	114.4	146.2	-58.5	-18.8	0	0	0	121.1
31	N	25.8	Very low	26.7	Very low	154 Å²	154	163.4 Å²	163.4	82%	0.824	82%	0.824	S	S	*	*			trans	-39.1	139.1	152.3	-53.9	-27.2	0	0	0	113.6
32	Y	28.9	Very low	26.7	Very low	230 Å²	230	162 Å²	162	90%	0.902	83%	0.826	S	S	*	*			trans	-146.9	123.7	134.5	-101.7	-72.6	0	0	0	110.8
33	L	24.7	Very low	26.9	Very low	162 Å²	162	163.2 Å²	163.2	85%	0.848	83%	0.828	S	S	*	*			trans	-75.2	127.4	170.1	-83	155.7	0	0	0	109.9
34	R	27	Very low	27	Very low	241 Å²	241	165.7 Å²	165.7	91%	0.909	83%	0.829	S	S	*	*			trans	-152.1	125.5	152	-122.4	176.6	-172.2	-174.5	0.9	111.9
35	Y	24.9	Very low	27.6	Very low	214 Å²	214	156.3 Å²	156.3	84%	0.839	80%	0.799	S	S	*	*			trans	-64.9	130.5	163	-83	-121.9	0	0	0	108.9
36	H	27.6	Very low	28.2	Very low	188 Å²	188	156.2 Å²	156.2	87%	0.87	80%	0.799	S	S	*	*			trans	-156.7	156.7	130.2	-102	-76.7	0	0	0	107.7
37	G	24.3	Very low	29.6	Very low	80 Å²	80	153.4 Å²	153.4	83%	0.825	78%	0.781	S	S	*	*			trans	-71.2	135.5	-163.3	0	0	0	0	0	114.1
38	I	28.1	Very low	30.9	Very low	153 Å²	153	151 Å²	151	79%	0.785	77%	0.771	S	S	*	*			trans	-106.4	118.1	161	-64.6	173.8	0	0	0	106.5	Q40	I38-Q40 PolarHBondContact O-N 2.87Å
39	I	25.8	Very low	32.6	Very low	167 Å²	167	149.3 Å²	149.3	86%	0.856	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-66	116.8	164.9	-63.2	173.9	0	0	0	105.9
40	Q	25.9	Very low	34.7	Very low	167 Å²	167	151.3 Å²	151.3	78%	0.78	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-60.4	134.5	174.9	-73.2	-178.5	-30.2	0	0	109.1	I38 T42	I38-Q40 PolarHBondContact O-N 2.87Å; Q40-T42 PolarHBondContact O-N 2.89Å
41	P	26.3	Very low	36.6	Very low	119 Å²	119	147.9 Å²	147.9	77%	0.773	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-59.4	129.4	169.1	26.4	-32.7	0	0	0	108.3
42	T	26.9	Very low	38.9	Very low	133 Å²	133	141.4 Å²	141.4	82%	0.816	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-54.2	146.2	171.6	45.9	0	0	0	0	110	Q40	Q40-T42 PolarHBondContact O-N 2.89Å
43	Q	29	Very low	40.9	Very low	181 Å²	181	133 Å²	133	85%	0.846	66%	0.661	S	S	*	*	S	Bend	trans	-31.8	135.5	-173.4	-66.3	171.3	-35.5	0	0	114.6	S45	Q43-S45 PolarHBondContact O-N 2.97Å
44	P	30.2	Very low	43.1	Very low	131 Å²	131	127.8 Å²	127.8	85%	0.851	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-54.8	130.2	-177.8	23.5	-33.8	0	0	0	111
45	S	37.2	Very low	45	Very low	38 Å²	38	118.7 Å²	118.7	27%	0.266	62%	0.615	S	S	.	*	P	Polyproline II helix	trans	-51.2	137.3	-167.5	64.6	0	0	0	0	113.3	Q43 V47	Q43-S45 PolarHBondContact O-N 2.97Å; S45-V47 PolarHBondContact O-N 3.28Å
46	Q	43.6	Very low	47.3	Very low	181 Å²	181	112 Å²	112	85%	0.846	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-47.5	124.2	164.7	-75.4	-172.4	-27.6	0	0	110.3	R48	Q46-R48 PolarHBondContact O-N 2.94Å
47	V	52.9	Low	49.5	Very low	52 Å²	52	105.6 Å²	105.6	32%	0.315	56%	0.558	S	S	.	*			trans	-65.5	106.7	175	-177.4	0	0	0	0	108.1	S45 R49 R126	S45-V47 PolarHBondContact O-N 3.28Å; V47-R49 PolarHBondContact O-N 3.01Å; V47-R126 HydrophobicContact CG2-CB 4.12Å
48	R	56.4	Low	52.1	Low	168 Å²	168	102.1 Å²	102.1	63%	0.634	52%	0.52	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.6	124.2	176.9	-71.5	-173.6	177	-170	-0	108.8	Q46 L127 Y128	Q46-R48 PolarHBondContact O-N 2.94Å; R48-L127 HydrophobicContact CB-CD1 3.84Å; R48-Y128 PolarHBondContact O-N 2.95Å
49	R	63.4	Low	54.8	Low	149 Å²	149	97.3 Å²	97.3	56%	0.562	50%	0.498	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.8	122.8	172.2	179	177.3	-177.8	-167.9	-0.9	109	V47 I51 Y128 E130	V47-R49 PolarHBondContact O-N 3.01Å; R49-I51 HydrophobicContact CG-CG1 4.42Å; R49-Y128 HydrophobicContact CG-CD1 4.25Å; R49-E130 IonicContact CZ-OE2 3.23Å; R49-E130 IonicContact NE-OE2 2.93Å; R49-E130 PolarHBondContact NE-OE2 2.83Å; R49-E130 VanDerWaalsContact NH2-CD 3.3Å; R49-E130 IonicContact NH2-OE1 3.38Å; R49-E130 PolarHBondContact NH2-OE1 3.42Å; R49-E130 VanDerWaalsContact NH2-OE1 3.07Å; R49-E130 IonicContact NH2-OE2 2.68Å; R49-E130 PolarHBondContact NH2-OE2 3.37Å
50	W	69.1	Low	57.6	Low	108 Å²	108	89.4 Å²	89.4	41%	0.409	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	114.5	175.5	-84.3	44	0	0	0	108.6	L127 Y128 L129 E130	W50-L127 HydrophobicContact CD2-CD1 4.39Å; W50-L127 HydrophobicContact CG-CD1 3.96Å; W50-Y128 PolarHBondContact N-O 3.47Å; W50-L129 HydrophobicContact CB-CD1 4.37Å; W50-E130 PolarHBondContact O-N 3.3Å
51	I	70.2	Confident	60.3	Low	90 Å²	90	85.1 Å²	85.1	46%	0.462	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	128.6	178.1	-60	176.8	0	0	0	108.6	R49 E130 Q132	R49-I51 HydrophobicContact CG-CG1 4.42Å; I51-E130 HydrophobicContact CG1-CB 4.44Å; I51-Q132 HydrophobicContact CG2-CG 3.95Å
52	V	73.8	Confident	62.9	Low	18 Å²	18	79.5 Å²	79.5	11%	0.109	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	134.2	-176	178.2	0	0	0	0	109.9	R56 V58 V98 L129 E130 V131 Q132	V52-R56 HydrophobicContact CG1-CB 3.86Å; V52-R56 HydrophobicContact CG1-CG 4.48Å; V52-V58 HydrophobicContact CB-CG2 4.11Å; V52-V58 HydrophobicContact CG1-CG2 3.5Å; V52-V58 VanDerWaalsContact CG1-CG2 3.5Å; V52-V58 HydrophobicContact CG2-CG2 3.67Å; V52-V98 HydrophobicContact CG1-CB 4.37Å; V52-V98 HydrophobicContact CG1-CG1 4.36Å; V52-V98 HydrophobicContact CG1-CG2 4.25Å; V52-L129 HydrophobicContact CB-CD1 4.05Å; V52-L129 HydrophobicContact CG2-CD1 3.53Å; V52-E130 PolarHBondContact N-O 3.15Å; V52-V131 CarbonylContact O-C 3.56Å; V52-V131 VanDerWaalsContact O-CA 3.31Å; V52-V131 WeakPolarHBondContact O-CA 3.46Å; V52-Q132 PolarHBondContact O-N 2.84Å
53	L	71.5	Confident	64.9	Low	54 Å²	54	76 Å²	76	28%	0.283	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	148.2	175.7	-60.9	167.8	0	0	0	110.5	R56 Q132 D134	L53-R56 HydrophobicContact CB-CG 3.84Å; L53-R56 WeakPolarHBondContact O-CB 3.48Å; L53-R56 WeakPolarHBondContact O-CG 3.5Å; L53-R56 PolarHBondContact O-N 2.74Å; L53-Q132 CarbonylContact C-O 3.54Å; L53-Q132 WeakPolarHBondContact CA-O 3.5Å; L53-Q132 HydrophobicContact CD2-CB 4.19Å; L53-D134 HydrophobicContact CB-CB 4.48Å; L53-D134 WeakPolarHBondContact CD1-OD2 3.33Å; L53-D134 HydrophobicContact CD2-CB 4.48Å
54	L	71.4	Confident	66.9	Low	51 Å²	51	68.6 Å²	68.6	27%	0.267	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	148.1	171.7	-78.2	172.7	0	0	0	111.9	R56 M100 V131 Q132 D133	L54-R56 PolarHBondContact O-N 2.73Å; L54-M100 HydrophobicContact CD1-CG 4.24Å; L54-M100 HydrophobicContact CD1-SD 4.14Å; L54-M100 HydrophobicContact CD2-CG 3.99Å; L54-M100 HydrophobicContact CD2-SD 4.04Å; L54-M100 HydrophobicContact CG-SD 4.28Å; L54-V131 HydrophobicContact CD2-CG1 3.4Å; L54-V131 HydrophobicContact CG-CG1 3.78Å; L54-Q132 PolarHBondContact N-O 3.06Å; L54-D133 VanDerWaalsContact CD1-OD1 3.27Å; L54-D133 WeakPolarHBondContact CD1-OD1 3.43Å
55	G	65.9	Low	68.5	Low	50 Å²	50	69 Å²	69	52%	0.515	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.4	-17.3	-179.2	0	0	0	0	0	115	N97 V98	G55-N97 WeakPolarHBondContact CA-OD1 3.32Å; G55-N97 PolarHBondContact O-OD1 3Å; G55-V98 PolarHBondContact N-O 3.26Å
56	R	73.4	Confident	69.9	Low	74 Å²	74	69.9 Å²	69.9	28%	0.279	35%	0.348	S	S	.	.			trans	-77.6	155.2	-176	-53.7	-65.5	174.5	134.8	2.5	111.8	V52 L53 L54 V98 D134	V52-R56 HydrophobicContact CG1-CB 3.86Å; V52-R56 HydrophobicContact CG1-CG 4.48Å; L53-R56 HydrophobicContact CB-CG 3.84Å; L53-R56 WeakPolarHBondContact O-CB 3.48Å; L53-R56 WeakPolarHBondContact O-CG 3.5Å; L53-R56 PolarHBondContact O-N 2.74Å; L54-R56 PolarHBondContact O-N 2.73Å; R56-V98 WeakPolarHBondContact O-CB 2.92Å; R56-V98 WeakPolarHBondContact O-CG2 3.26Å; R56-V98 PolarHBondContact O-N 2.8Å; R56-D134 IonicContact CZ-OD2 3.68Å; R56-D134 IonicContact NH2-OD2 3.34Å; R56-D134 PolarHBondContact NH2-OD2 3.33Å
57	K	74.1	Confident	71	Confident	53 Å²	53	63.1 Å²	63.1	23%	0.23	32%	0.32	C	S	.	.			trans	-86.4	142	169.8	179.7	-167.8	177.9	-161.3	0	109.6	V94 I95 N151	K57-V94 HydrophobicContact CG-CG1 4.35Å; K57-I95 WeakPolarHBondContact CA-O 3.37Å; K57-N151 HydrophobicContact CD-CB 3.77Å; K57-N151 VanDerWaalsContact NZ-C 3.34Å; K57-N151 PolarHBondContact NZ-O 3.49Å
58	V	79.9	Confident	71.9	Confident	7 Å²	7	67.2 Å²	67.2	4%	0.042	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	144.2	175	179.8	0	0	0	0	111.1	V52 L60 V94 I95 V98 L129	V52-V58 HydrophobicContact CB-CG2 4.11Å; V52-V58 HydrophobicContact CG1-CG2 3.5Å; V52-V58 VanDerWaalsContact CG1-CG2 3.5Å; V52-V58 HydrophobicContact CG2-CG2 3.67Å; V58-L60 HydrophobicContact CG1-CD2 3.43Å; V58-L60 VanDerWaalsContact CG1-CD2 3.43Å; V58-L60 HydrophobicContact CG1-CG 4.42Å; V58-V94 WeakPolarHBondContact O-CA 3.07Å; V58-I95 HydrophobicContact CB-CB 4.35Å; V58-I95 PolarHBondContact N-O 2.85Å; V58-I95 PolarHBondContact O-N 3.02Å; V58-V98 HydrophobicContact CB-CG2 4.18Å; V58-V98 HydrophobicContact CG2-CG2 3.49Å; V58-V98 VanDerWaalsContact CG2-CG2 3.49Å; V58-L129 HydrophobicContact CG1-CD1 4.35Å; V58-L129 HydrophobicContact CG2-CD1 4.36Å
59	V	84.1	Confident	72.5	Confident	53 Å²	53	66.5 Å²	66.5	32%	0.321	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	104.7	171.4	-175.7	0	0	0	0	108.5	L92 Y93 V94	V59-L92 HydrophobicContact CG1-CB 4.14Å; V59-L92 HydrophobicContact CG1-CD1 4.2Å; V59-L92 HydrophobicContact CG1-CD2 4.21Å; V59-L92 HydrophobicContact CG1-CG 4.41Å; V59-Y93 CarbonylContact C-O 3.08Å; V59-Y93 WeakPolarHBondContact CA-O 2.98Å; V59-V94 HydrophobicContact CG1-CG2 4.31Å; V59-V94 HydrophobicContact CG2-CG1 4.41Å; V59-V94 HydrophobicContact CG2-CG2 4.23Å
60	L	83.8	Confident	72.8	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	129.8	172.7	-40.8	-178.1	0	0	0	108.1	V58 W79 L92 Y93 Y106 L127	V58-L60 HydrophobicContact CG1-CD2 3.43Å; V58-L60 VanDerWaalsContact CG1-CD2 3.43Å; V58-L60 HydrophobicContact CG1-CG 4.42Å; L60-W79 HydrophobicContact CB-CH2 3.41Å; L60-W79 VanDerWaalsContact CB-CH2 3.41Å; L60-W79 HydrophobicContact CB-CZ2 3.88Å; L60-W79 HydrophobicContact CB-CZ3 3.78Å; L60-W79 HydrophobicContact CD1-CE3 4.21Å; L60-W79 HydrophobicContact CD1-CH2 4.41Å; L60-W79 HydrophobicContact CD1-CZ3 3.91Å; L60-L92 CarbonylContact O-C 3.59Å; L60-L92 VanDerWaalsContact O-CA 3.29Å; L60-L92 WeakPolarHBondContact O-CA 3.09Å; L60-Y93 HydrophobicContact CD1-CD1 3.78Å; L60-Y93 HydrophobicContact CG-CD1 4.25Å; L60-Y93 PolarHBondContact N-O 2.89Å; L60-Y93 PolarHBondContact O-N 2.82Å; L60-Y106 HydrophobicContact CD1-CD1 3.51Å; L60-Y106 HydrophobicContact CD1-CD2 3.96Å; L60-Y106 HydrophobicContact CD1-CE1 4.04Å; L60-Y106 HydrophobicContact CD1-CE2 4.44Å; L60-Y106 HydrophobicContact CD1-CG 3.47Å; L60-Y106 VanDerWaalsContact CD1-CG 3.47Å; L60-L127 HydrophobicContact CB-CD2 3.78Å; L60-L127 HydrophobicContact CD1-CD2 4.25Å; L60-L127 HydrophobicContact CD2-CD2 3.59Å; L60-L127 HydrophobicContact CG-CD2 4.06Å
61	N	82.6	Confident	72.9	Confident	77 Å²	77	58.2 Å²	58.2	41%	0.412	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	118.3	-177.1	-179.7	8.7	0	0	0	111.3	S63 L92	N61-S63 PolarHBondContact O-N 2.92Å; N61-L92 HydrophobicContact CB-CD2 3.62Å; N61-L92 VanDerWaalsContact CG-CD2 3.49Å; N61-L92 WeakPolarHBondContact OD1-CD2 3.4Å
62	C	82	Confident	72.9	Confident	2 Å²	2	58.1 Å²	58.1	1%	0.014	33%	0.332	C	S	.	.			trans	-77	91.5	177.4	-163.5	0	0	0	0	110	Y77 W79 K91 C108	C62-Y77 HydrophobicContact CB-CD1 3.95Å; C62-Y77 HydrophobicContact CB-CE1 4.19Å; C62-W79 HydrophobicContact CB-CH2 4.44Å; C62-W79 HydrophobicContact CB-CZ2 3.76Å; C62-K91 HydrophobicContact CB-CG 4.29Å; C62-K91 VanDerWaalsContact CB-O 3.28Å; C62-K91 WeakPolarHBondContact CB-O 3.43Å; C62-K91 PolarHBondContact N-O 2.73Å; C62-K91 WeakPolarHBondContact O-CE 3.44Å; C62-K91 WeakPolarHBondContact O-CG 3.33Å; C62-C108 HydrophobicContact CB-CB 3.85Å; C62-C108 WeakPolarHBondContact CB-SG 3.3Å; C62-C108 WeakPolarHBondContact SG-CB 3.02Å; C62-C108 CovalentContact SG-SG 2.03Å; C62-C108 PolarHBondContact SG-SG 3.34Å
63	S	69.5	Low	72.9	Confident	60 Å²	60	68.6 Å²	68.6	42%	0.42	37%	0.369	S	S	.	.			trans	-84.1	127.8	171.6	-56.4	0	0	0	0	108.5	N61 H125	N61-S63 PolarHBondContact O-N 2.92Å; S63-H125 PolarHBondContact O-CD2 2.78Å; S63-H125 PolarHBondContact O-NE2 2.02Å
64	V	69.3	Low	73.2	Confident	24 Å²	24	71.7 Å²	71.7	15%	0.145	38%	0.382	C	S	.	.			trans	-140.4	140	-171.8	-66.2	0	0	0	0	110.2	L66 Y77 S110 W121 D123	V64-L66 HydrophobicContact CG2-CD2 4.02Å; V64-L66 HydrophobicContact CG2-CG 4.23Å; V64-L66 PolarHBondContact O-N 2.91Å; V64-Y77 HydrophobicContact CG2-CE1 4.25Å; V64-S110 WeakPolarHBondContact CG1-OG 3.41Å; V64-W121 HydrophobicContact CB-CH2 4.21Å; V64-W121 HydrophobicContact CG2-CH2 4.48Å; V64-D123 WeakPolarHBondContact CB-OD2 3.45Å
65	N	65	Low	73.6	Confident	139 Å²	139	70 Å²	70	74%	0.743	37%	0.374	S	S	*	.			trans	-90.7	88.3	-177.2	-76.2	-25.9	0	0	0	109.9	P67	N65-P67 WeakPolarHBondContact O-CD 3.5Å
66	L	67	Low	74.5	Confident	57 Å²	57	73.5 Å²	73.5	30%	0.298	38%	0.377	S	S	.	.			trans	-69.5	127.3	-178.3	-61.8	176.2	0	0	0	111.7	V64 V70 P72 V75 W121	V64-L66 HydrophobicContact CG2-CD2 4.02Å; V64-L66 HydrophobicContact CG2-CG 4.23Å; V64-L66 PolarHBondContact O-N 2.91Å; L66-V70 HydrophobicContact CD2-CG1 4.09Å; L66-P72 HydrophobicContact CD1-CB 3.89Å; L66-P72 HydrophobicContact CD1-CG 3.91Å; L66-V75 HydrophobicContact CD1-CG2 4.19Å; L66-V75 HydrophobicContact CD2-CG2 3.59Å; L66-W121 HydrophobicContact CD2-CH2 3.61Å; L66-W121 HydrophobicContact CD2-CZ2 4.22Å; L66-W121 HydrophobicContact CD2-CZ3 3.82Å
67	P	66.9	Low	75.2	Confident	40 Å²	40	71.5 Å²	71.5	26%	0.26	37%	0.37	S	S	.	.			trans	-60.6	152.3	167.5	-21.6	32.7	0	0	0	111.7	N65 E69 V70 W121	N65-P67 WeakPolarHBondContact O-CD 3.5Å; P67-E69 PolarHBondContact O-N 2.91Å; P67-V70 HydrophobicContact CB-CG2 4.26Å; P67-V70 HydrophobicContact CG-CG2 4.15Å; P67-V70 PolarHBondContact O-N 2.81Å; P67-W121 HydrophobicContact CG-CG 4.47Å
68	P	70.2	Confident	75.8	Confident	137 Å²	137	73.8 Å²	73.8	89%	0.89	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-21.5	-178.8	-25.6	35.2	0	0	0	115.1
69	E	69.1	Low	76.2	Confident	154 Å²	154	73.7 Å²	73.7	72%	0.72	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-13.7	-179.4	-65.9	135.1	-161.9	0	0	113.7	P67 V114	P67-E69 PolarHBondContact O-N 2.91Å; E69-V114 HydrophobicContact CB-CG1 4.35Å
70	V	70.3	Confident	76.2	Confident	8 Å²	8	72.8 Å²	72.8	5%	0.048	37%	0.368	C	S	.	.	S	Bend	trans	-93.5	117.1	-174.7	177.1	0	0	0	0	110.8	L66 P67 P72 V75 A112 V114 W121	L66-V70 HydrophobicContact CD2-CG1 4.09Å; P67-V70 HydrophobicContact CB-CG2 4.26Å; P67-V70 HydrophobicContact CG-CG2 4.15Å; P67-V70 PolarHBondContact O-N 2.81Å; V70-P72 VanDerWaalsContact O-CD 3.29Å; V70-P72 WeakPolarHBondContact O-CD 3.5Å; V70-V75 HydrophobicContact CG1-CG2 3.99Å; V70-A112 HydrophobicContact CG1-CB 3.49Å; V70-A112 VanDerWaalsContact CG1-CB 3.49Å; V70-V114 HydrophobicContact CG2-CG2 4.17Å; V70-W121 HydrophobicContact CG2-CB 4.48Å; V70-W121 HydrophobicContact CG2-CG 4.41Å
71	N	70.9	Confident	75.9	Confident	75 Å²	75	74.2 Å²	74.2	40%	0.401	38%	0.375	S	S	.	.			trans	-66.8	119	173	-177.8	-18.1	0	0	0	110.5	R73 Q74	N71-R73 PolarHBondContact O-N 3.31Å; N71-R73 WeakPolarHBondContact OD1-CB 3.43Å; N71-R73 PolarHBondContact OD1-N 3.17Å; N71-Q74 HydrophobicContact CB-CB 4.38Å; N71-Q74 HydrophobicContact CB-CG 4.18Å; N71-Q74 PolarHBondContact O-N 2.9Å
72	P	71.1	Confident	75.3	Confident	87 Å²	87	73.7 Å²	73.7	57%	0.565	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-58.9	-22.8	-178.3	-25.5	35.1	0	0	0	114.6	L66 V70 Q74	L66-P72 HydrophobicContact CD1-CB 3.89Å; L66-P72 HydrophobicContact CD1-CG 3.91Å; V70-P72 VanDerWaalsContact O-CD 3.29Å; V70-P72 WeakPolarHBondContact O-CD 3.5Å; P72-Q74 VanDerWaalsContact C-N 3.3Å
73	R	73.8	Confident	74.9	Confident	238 Å²	238	80.5 Å²	80.5	90%	0.898	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-79.9	-6.7	176.6	-62.5	-174.5	176.3	-173.6	-1.2	114	N71	N71-R73 PolarHBondContact O-N 3.31Å; N71-R73 WeakPolarHBondContact OD1-CB 3.43Å; N71-R73 PolarHBondContact OD1-N 3.17Å
74	Q	76.3	Confident	75.1	Confident	120 Å²	120	79.9 Å²	79.9	56%	0.561	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-106.3	2.6	178.2	-66.1	-178.1	-56.4	0	0	113.1	N71 P72 Q76	N71-Q74 HydrophobicContact CB-CB 4.38Å; N71-Q74 HydrophobicContact CB-CG 4.18Å; N71-Q74 PolarHBondContact O-N 2.9Å; P72-Q74 VanDerWaalsContact C-N 3.3Å; Q74-Q76 PolarHBondContact O-N 3.11Å
75	V	80.6	Confident	75.6	Confident	15 Å²	15	83.1 Å²	83.1	9%	0.091	43%	0.427	C	S	.	.			trans	-77.4	120.6	177.4	-174.8	0	0	0	0	110	L66 V70 Y77 A112 W121	L66-V75 HydrophobicContact CD1-CG2 4.19Å; L66-V75 HydrophobicContact CD2-CG2 3.59Å; V70-V75 HydrophobicContact CG1-CG2 3.99Å; V75-Y77 HydrophobicContact CB-CE2 4.12Å; V75-Y77 HydrophobicContact CG1-CD2 4.45Å; V75-Y77 HydrophobicContact CG1-CE1 3.97Å; V75-Y77 HydrophobicContact CG1-CE2 3.84Å; V75-A112 HydrophobicContact CG2-CB 4.26Å; V75-W121 HydrophobicContact CG1-CZ3 4.33Å
76	Q	84.4	Confident	76.4	Confident	123 Å²	123	79.9 Å²	79.9	58%	0.575	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.6	144.6	169.8	-61.6	-176.3	-8.2	0	0	109.6	Q74 S110 S111	Q74-Q76 PolarHBondContact O-N 3.11Å; Q76-S110 CarbonylContact O-C 3.29Å; Q76-S110 VanDerWaalsContact O-CA 3.24Å; Q76-S110 WeakPolarHBondContact O-CA 3.46Å; Q76-S111 PolarHBondContact N-O 2.91Å; Q76-S111 PolarHBondContact O-N 2.81Å
77	Y	87.9	Confident	77.2	Confident	33 Å²	33	79.4 Å²	79.4	13%	0.129	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	152.8	177.8	-59.1	-90.1	0	0	0	110.2	C62 V64 V75 Y89 K91 H109	C62-Y77 HydrophobicContact CB-CD1 3.95Å; C62-Y77 HydrophobicContact CB-CE1 4.19Å; V64-Y77 HydrophobicContact CG2-CE1 4.25Å; V75-Y77 HydrophobicContact CB-CE2 4.12Å; V75-Y77 HydrophobicContact CG1-CD2 4.45Å; V75-Y77 HydrophobicContact CG1-CE1 3.97Å; V75-Y77 HydrophobicContact CG1-CE2 3.84Å; Y77-Y89 CarbonylContact O-C 3.51Å; Y77-Y89 WeakPolarHBondContact O-CA 3.26Å; Y77-Y89 WeakPolarHBondContact O-CD1 3.4Å; Y77-K91 HydrophobicContact CD1-CB 4.29Å; Y77-K91 HydrophobicContact CD1-CG 4.37Å; Y77-K91 HydrophobicContact CD2-CB 4.05Å; Y77-K91 HydrophobicContact CE1-CB 4.09Å; Y77-K91 HydrophobicContact CE1-CD 4.43Å; Y77-K91 HydrophobicContact CE1-CG 3.85Å; Y77-K91 HydrophobicContact CE2-CB 3.87Å; Y77-K91 HydrophobicContact CE2-CG 4.35Å; Y77-K91 HydrophobicContact CG-CB 4.26Å; Y77-H109 CarbonylContact C-O 3.59Å; Y77-H109 WeakPolarHBondContact CA-O 3.32Å
78	R	87.1	Confident	77.9	Confident	101 Å²	101	78.3 Å²	78.3	38%	0.381	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	121.7	173.6	165.2	180	168.4	158	-4.1	109.4	E80 I86 G88 Y89 H109	R78-E80 HydrophobicContact CG-CG 4.36Å; R78-E80 IonicContact CZ-OE1 3.57Å; R78-E80 IonicContact NE-OE1 2.7Å; R78-E80 PolarHBondContact NE-OE1 2.98Å; R78-E80 IonicContact NH2-OE1 3.13Å; R78-E80 PolarHBondContact NH2-OE1 2.83Å; R78-I86 HydrophobicContact CG-CG2 4.27Å; R78-G88 WeakPolarHBondContact CA-O 3.38Å; R78-Y89 HydrophobicContact CB-CD1 4.29Å; R78-Y89 HydrophobicContact CB-CE1 4.45Å; R78-Y89 HydrophobicContact CG-CE1 4.5Å; R78-H109 HydrophobicContact CB-CB 4.32Å; R78-H109 PolarHBondContact N-O 3.26Å; R78-H109 PolarHBondContact O-N 3.28Å
79	W	87.4	Confident	78.6	Confident	5 Å²	5	79.3 Å²	79.3	2%	0.019	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	141	173.3	-73.4	92.2	0	0	0	111.6	L60 C62 I86 L87 G88 S90 Y93 T107 C108	L60-W79 HydrophobicContact CB-CH2 3.41Å; L60-W79 VanDerWaalsContact CB-CH2 3.41Å; L60-W79 HydrophobicContact CB-CZ2 3.88Å; L60-W79 HydrophobicContact CB-CZ3 3.78Å; L60-W79 HydrophobicContact CD1-CE3 4.21Å; L60-W79 HydrophobicContact CD1-CH2 4.41Å; L60-W79 HydrophobicContact CD1-CZ3 3.91Å; C62-W79 HydrophobicContact CB-CH2 4.44Å; C62-W79 HydrophobicContact CB-CZ2 3.76Å; W79-I86 WeakPolarHBondContact O-CA 3.43Å; W79-L87 HydrophobicContact CB-CB 4Å; W79-L87 PolarHBondContact O-N 2.86Å; W79-G88 PolarHBondContact N-O 3.18Å; W79-S90 PolarHBondContact NE1-O 2.9Å; W79-Y93 HydrophobicContact CG-CG 4.48Å; W79-T107 WeakPolarHBondContact CA-O 3.42Å; W79-C108 HydrophobicContact CD2-CB 4.07Å; W79-C108 HydrophobicContact CE3-CB 3.95Å; W79-C108 HydrophobicContact CH2-CB 3.99Å; W79-C108 HydrophobicContact CZ2-CB 4.11Å; W79-C108 HydrophobicContact CZ3-CB 3.91Å
80	E	85.2	Confident	79.3	Confident	34 Å²	34	75 Å²	75	16%	0.159	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	137.6	176.5	-61.6	-174.3	154.8	0	0	111.4	R78 N85 Y106 T107 H109	R78-E80 HydrophobicContact CG-CG 4.36Å; R78-E80 IonicContact CZ-OE1 3.57Å; R78-E80 IonicContact NE-OE1 2.7Å; R78-E80 PolarHBondContact NE-OE1 2.98Å; R78-E80 IonicContact NH2-OE1 3.13Å; R78-E80 PolarHBondContact NH2-OE1 2.83Å; E80-N85 WeakPolarHBondContact CA-O 3.46Å; E80-Y106 WeakPolarHBondContact O-CA 3.43Å; E80-T107 PolarHBondContact N-O 3.26Å; E80-T107 PolarHBondContact O-N 2.74Å; E80-H109 IonicContact OE1-NE2 3.74Å; E80-H109 IonicContact OE2-CD2 3.98Å; E80-H109 IonicContact OE2-CE1 3.64Å; E80-H109 IonicContact OE2-NE2 2.73Å; E80-H109 PolarHBondContact OE2-NE2 3.24Å
81	H	77.8	Confident	79.9	Confident	30 Å²	30	79.1 Å²	79.1	14%	0.139	39%	0.393	C	S	.	.			trans	-69.7	154.4	170.1	-154.7	-124.7	0	0	0	110.1	E83 G84 N85 L87 Y106	H81-E83 IonicContact CE1-OE2 2.84Å; H81-E83 PolarHBondContact CE1-OE2 3.3Å; H81-E83 WeakPolarHBondContact ND1-CG 3.34Å; H81-E83 IonicContact ND1-OE2 2.68Å; H81-E83 PolarHBondContact ND1-OE2 2.57Å; H81-E83 PolarHBondContact O-N 3.28Å; H81-G84 PolarHBondContact O-N 2.82Å; H81-N85 HydrophobicContact CB-CB 4Å; H81-N85 PolarHBondContact N-O 3.04Å; H81-L87 HydrophobicContact CB-CD1 4.05Å; H81-L87 HydrophobicContact CB-CD2 4.04Å; H81-L87 HydrophobicContact CB-CG 4.1Å; H81-Y106 AromaticContact CD2-CE1 3.83Å
82	P	68.8	Low	80.5	Confident	65 Å²	65	79.4 Å²	79.4	42%	0.422	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-23.7	167.1	20.1	-35.4	0	0	0	114.5	G84 V105	P82-G84 VanDerWaalsContact C-N 3.31Å; P82-V105 WeakPolarHBondContact CD-O 3.31Å
83	E	74	Confident	81.2	Confident	145 Å²	145	77.7 Å²	77.7	68%	0.678	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	1.3	173.8	-60.4	175.4	139.4	0	0	114.4	H81 N85	H81-E83 IonicContact CE1-OE2 2.84Å; H81-E83 PolarHBondContact CE1-OE2 3.3Å; H81-E83 WeakPolarHBondContact ND1-CG 3.34Å; H81-E83 IonicContact ND1-OE2 2.68Å; H81-E83 PolarHBondContact ND1-OE2 2.57Å; H81-E83 PolarHBondContact O-N 3.28Å; E83-N85 VanDerWaalsContact C-N 3.32Å; E83-N85 PolarHBondContact O-N 3.05Å; E83-N85 PolarHBondContact OE2-ND2 2.83Å
84	G	73.6	Confident	81.7	Confident	48 Å²	48	69.5 Å²	69.5	50%	0.495	35%	0.353	S	S	.	.	S	Bend	trans	83	-1.4	-177.4	0	0	0	0	0	115.5	H81 P82	H81-G84 PolarHBondContact O-N 2.82Å; P82-G84 VanDerWaalsContact C-N 3.31Å
85	N	80.6	Confident	82.1	Confident	91 Å²	91	63.9 Å²	63.9	49%	0.487	33%	0.327	S	S	.	.			trans	-67.3	131.5	175.5	-70.3	-47.1	0	0	0	111.2	E80 H81 E83	E80-N85 WeakPolarHBondContact CA-O 3.46Å; H81-N85 HydrophobicContact CB-CB 4Å; H81-N85 PolarHBondContact N-O 3.04Å; E83-N85 VanDerWaalsContact C-N 3.32Å; E83-N85 PolarHBondContact O-N 3.05Å; E83-N85 PolarHBondContact OE2-ND2 2.83Å
86	I	82.3	Confident	81.8	Confident	72 Å²	72	67.9 Å²	67.9	37%	0.369	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	125	175	-57.5	173.7	0	0	0	109.2	R78 W79 Y89	R78-I86 HydrophobicContact CG-CG2 4.27Å; W79-I86 WeakPolarHBondContact O-CA 3.43Å; I86-Y89 HydrophobicContact CG2-CE1 4.3Å; I86-Y89 HydrophobicContact CG2-CE2 4.33Å
87	L	82.7	Confident	81.5	Confident	47 Å²	47	66.5 Å²	66.5	25%	0.246	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	-27.9	-171.1	-64	173.7	0	0	0	114	W79 H81 Y93 Y106	W79-L87 HydrophobicContact CB-CB 4Å; W79-L87 PolarHBondContact O-N 2.86Å; H81-L87 HydrophobicContact CB-CD1 4.05Å; H81-L87 HydrophobicContact CB-CD2 4.04Å; H81-L87 HydrophobicContact CB-CG 4.1Å; L87-Y93 HydrophobicContact CB-CD2 4.02Å; L87-Y93 HydrophobicContact CB-CE1 4.5Å; L87-Y93 HydrophobicContact CB-CE2 3.65Å; L87-Y93 HydrophobicContact CD1-CD1 4.42Å; L87-Y93 HydrophobicContact CD1-CE1 4.01Å; L87-Y106 HydrophobicContact CD1-CD1 3.47Å; L87-Y106 VanDerWaalsContact CD1-CD1 3.47Å; L87-Y106 HydrophobicContact CD1-CE1 3.44Å; L87-Y106 VanDerWaalsContact CD1-CE1 3.44Å
88	G	82.1	Confident	81.1	Confident	16 Å²	16	65 Å²	65	17%	0.165	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	169.3	170.8	-178.6	0	0	0	0	0	113.6	R78 W79	R78-G88 WeakPolarHBondContact CA-O 3.38Å; W79-G88 PolarHBondContact N-O 3.18Å
89	Y	85.5	Confident	80.9	Confident	159 Å²	159	63 Å²	63	62%	0.624	34%	0.343	S	S	*	.	S	Bend	trans	-119.1	14	-173.8	-60.6	-82.5	0	0	0	114	Y77 R78 I86	Y77-Y89 CarbonylContact O-C 3.51Å; Y77-Y89 WeakPolarHBondContact O-CA 3.26Å; Y77-Y89 WeakPolarHBondContact O-CD1 3.4Å; R78-Y89 HydrophobicContact CB-CD1 4.29Å; R78-Y89 HydrophobicContact CB-CE1 4.45Å; R78-Y89 HydrophobicContact CG-CE1 4.5Å; I86-Y89 HydrophobicContact CG2-CE1 4.3Å; I86-Y89 HydrophobicContact CG2-CE2 4.33Å
90	S	83	Confident	80.3	Confident	63 Å²	63	67.5 Å²	67.5	44%	0.441	37%	0.365	S	S	.	.	S	Bend	trans	-97.4	151.4	-179.7	42.5	0	0	0	0	111.7	W79 L92	W79-S90 PolarHBondContact NE1-O 2.9Å; S90-L92 WeakPolarHBondContact CB-O 3.33Å; S90-L92 PolarHBondContact O-N 2.86Å; S90-L92 PolarHBondContact OG-O 2.8Å
91	K	83.2	Confident	80.1	Confident	94 Å²	94	72.6 Å²	72.6	41%	0.409	39%	0.394	S	S	.	.	S	Bend	trans	-55.1	-34.1	174.1	-174.7	179.2	-179.7	-179.6	0	112.6	C62 Y77	C62-K91 HydrophobicContact CB-CG 4.29Å; C62-K91 VanDerWaalsContact CB-O 3.28Å; C62-K91 WeakPolarHBondContact CB-O 3.43Å; C62-K91 PolarHBondContact N-O 2.73Å; C62-K91 WeakPolarHBondContact O-CE 3.44Å; C62-K91 WeakPolarHBondContact O-CG 3.33Å; Y77-K91 HydrophobicContact CD1-CB 4.29Å; Y77-K91 HydrophobicContact CD1-CG 4.37Å; Y77-K91 HydrophobicContact CD2-CB 4.05Å; Y77-K91 HydrophobicContact CE1-CB 4.09Å; Y77-K91 HydrophobicContact CE1-CD 4.43Å; Y77-K91 HydrophobicContact CE1-CG 3.85Å; Y77-K91 HydrophobicContact CE2-CB 3.87Å; Y77-K91 HydrophobicContact CE2-CG 4.35Å; Y77-K91 HydrophobicContact CG-CB 4.26Å
92	L	83.8	Confident	80.3	Confident	81 Å²	81	72.7 Å²	72.7	42%	0.424	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	139.2	173.7	-53.9	-178.6	0	0	0	110.4	V59 L60 N61 S90	V59-L92 HydrophobicContact CG1-CB 4.14Å; V59-L92 HydrophobicContact CG1-CD1 4.2Å; V59-L92 HydrophobicContact CG1-CD2 4.21Å; V59-L92 HydrophobicContact CG1-CG 4.41Å; L60-L92 CarbonylContact O-C 3.59Å; L60-L92 VanDerWaalsContact O-CA 3.29Å; L60-L92 WeakPolarHBondContact O-CA 3.09Å; N61-L92 HydrophobicContact CB-CD2 3.62Å; N61-L92 VanDerWaalsContact CG-CD2 3.49Å; N61-L92 WeakPolarHBondContact OD1-CD2 3.4Å; S90-L92 WeakPolarHBondContact CB-O 3.33Å; S90-L92 PolarHBondContact O-N 2.86Å; S90-L92 PolarHBondContact OG-O 2.8Å
93	Y	85.6	Confident	80.9	Confident	52 Å²	52	71.6 Å²	71.6	20%	0.204	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	142	163.4	-179.6	-106	0	0	0	109.5	V59 L60 W79 L87 I95 Y106	V59-Y93 CarbonylContact C-O 3.08Å; V59-Y93 WeakPolarHBondContact CA-O 2.98Å; L60-Y93 HydrophobicContact CD1-CD1 3.78Å; L60-Y93 HydrophobicContact CG-CD1 4.25Å; L60-Y93 PolarHBondContact N-O 2.89Å; L60-Y93 PolarHBondContact O-N 2.82Å; W79-Y93 HydrophobicContact CG-CG 4.48Å; L87-Y93 HydrophobicContact CB-CD2 4.02Å; L87-Y93 HydrophobicContact CB-CE1 4.5Å; L87-Y93 HydrophobicContact CB-CE2 3.65Å; L87-Y93 HydrophobicContact CD1-CD1 4.42Å; L87-Y93 HydrophobicContact CD1-CE1 4.01Å; Y93-I95 HydrophobicContact CD1-CG1 4.15Å; Y93-I95 HydrophobicContact CE1-CD1 4.38Å; Y93-I95 HydrophobicContact CE1-CG1 3.64Å; Y93-Y106 HydrophobicContact CD1-CE1 4.44Å; Y93-Y106 HydrophobicContact CE1-CE1 4.08Å
94	V	84.5	Confident	81.3	Confident	65 Å²	65	65.2 Å²	65.2	39%	0.394	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	119.4	-171	-176.3	0	0	0	0	110.4	K57 V58 V59	K57-V94 HydrophobicContact CG-CG1 4.35Å; V58-V94 WeakPolarHBondContact O-CA 3.07Å; V59-V94 HydrophobicContact CG1-CG2 4.31Å; V59-V94 HydrophobicContact CG2-CG1 4.41Å; V59-V94 HydrophobicContact CG2-CG2 4.23Å
95	I	84.1	Confident	81.8	Confident	2 Å²	2	64.4 Å²	64.4	1%	0.01	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	110.8	169.8	-54.1	163.5	0	0	0	106	K57 V58 Y93 N97 V98 D102 Y106 L129	K57-I95 WeakPolarHBondContact CA-O 3.37Å; V58-I95 HydrophobicContact CB-CB 4.35Å; V58-I95 PolarHBondContact N-O 2.85Å; V58-I95 PolarHBondContact O-N 3.02Å; Y93-I95 HydrophobicContact CD1-CG1 4.15Å; Y93-I95 HydrophobicContact CE1-CD1 4.38Å; Y93-I95 HydrophobicContact CE1-CG1 3.64Å; I95-N97 VanDerWaalsContact C-N 3.34Å; I95-N97 PolarHBondContact O-N 3.21Å; I95-V98 HydrophobicContact CB-CG2 4.1Å; I95-V98 HydrophobicContact CG2-CG2 3.65Å; I95-D102 HydrophobicContact CD1-CB 4.45Å; I95-D102 HydrophobicContact CG2-CB 4.32Å; I95-D102 WeakPolarHBondContact CG2-OD1 3.44Å; I95-Y106 HydrophobicContact CD1-CE1 4.35Å; I95-Y106 HydrophobicContact CD1-CE2 4.3Å; I95-Y106 WeakPolarHBondContact CD1-OH 3.02Å; I95-L129 HydrophobicContact CD1-CD2 3.37Å
96	P	73.6	Confident	82.1	Confident	99 Å²	99	60.2 Å²	60.2	64%	0.643	33%	0.327	S	S	*	.	S	Bend	trans	-75.3	-23.8	-166.4	29.3	-35.6	0	0	0	113.8
97	N	78.3	Confident	82.3	Confident	94 Å²	94	57.4 Å²	57.4	50%	0.503	31%	0.314	S	S	.	.	S	Bend	trans	-157.7	109.9	178.9	174.9	6.7	0	0	0	106.5	G55 I95	G55-N97 WeakPolarHBondContact CA-OD1 3.32Å; G55-N97 PolarHBondContact O-OD1 3Å; I95-N97 VanDerWaalsContact C-N 3.34Å; I95-N97 PolarHBondContact O-N 3.21Å
98	V	80.7	Confident	82.5	Confident	1 Å²	1	55.3 Å²	55.3	1%	0.006	30%	0.303	C	S	.	.			trans	-78	127.9	-175.8	165.1	0	0	0	0	111.4	V52 G55 R56 V58 I95 D102 V131	V52-V98 HydrophobicContact CG1-CB 4.37Å; V52-V98 HydrophobicContact CG1-CG1 4.36Å; V52-V98 HydrophobicContact CG1-CG2 4.25Å; G55-V98 PolarHBondContact N-O 3.26Å; R56-V98 WeakPolarHBondContact O-CB 2.92Å; R56-V98 WeakPolarHBondContact O-CG2 3.26Å; R56-V98 PolarHBondContact O-N 2.8Å; V58-V98 HydrophobicContact CB-CG2 4.18Å; V58-V98 HydrophobicContact CG2-CG2 3.49Å; V58-V98 VanDerWaalsContact CG2-CG2 3.49Å; I95-V98 HydrophobicContact CB-CG2 4.1Å; I95-V98 HydrophobicContact CG2-CG2 3.65Å; V98-D102 HydrophobicContact CG1-CB 4.45Å; V98-V131 HydrophobicContact CG1-CB 4.18Å; V98-V131 HydrophobicContact CG1-CG1 3.66Å; V98-V131 HydrophobicContact CG1-CG2 3.42Å; V98-V131 VanDerWaalsContact CG1-CG2 3.42Å
99	T	82.4	Confident	82.7	Confident	59 Å²	59	56.4 Å²	56.4	36%	0.362	30%	0.304	S	S	.	.			trans	-109.8	168.3	171.8	74.4	0	0	0	0	110.4	N101 D102	T99-N101 PolarHBondContact O-N 2.82Å; T99-N101 VanDerWaalsContact O-N 3.09Å; T99-N101 PolarHBondContact OG1-N 2.86Å; T99-D102 WeakPolarHBondContact CA-OD2 3.34Å; T99-D102 WeakPolarHBondContact CB-OD2 3.48Å; T99-D102 PolarHBondContact N-OD2 3.19Å; T99-D102 PolarHBondContact O-N 2.9Å; T99-D102 PolarHBondContact OG1-OD2 3.47Å
100	M	75.3	Confident	82.6	Confident	100 Å²	100	48.9 Å²	48.9	49%	0.493	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-58.7	-21.2	173.1	-68	-58.8	-122.1	0	0	113.5	L54 D102 V131	L54-M100 HydrophobicContact CD1-CG 4.24Å; L54-M100 HydrophobicContact CD1-SD 4.14Å; L54-M100 HydrophobicContact CD2-CG 3.99Å; L54-M100 HydrophobicContact CD2-SD 4.04Å; L54-M100 HydrophobicContact CG-SD 4.28Å; M100-D102 VanDerWaalsContact C-N 3.35Å; M100-V131 HydrophobicContact SD-CB 4.15Å; M100-V131 HydrophobicContact SD-CG1 3.77Å
101	N	80.7	Confident	82.6	Confident	141 Å²	141	46.8 Å²	46.8	75%	0.754	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-80.4	-15.4	179.3	-61.8	-12.8	0	0	0	113	T99 A103	T99-N101 PolarHBondContact O-N 2.82Å; T99-N101 VanDerWaalsContact O-N 3.09Å; T99-N101 PolarHBondContact OG1-N 2.86Å; N101-A103 VanDerWaalsContact C-N 3.28Å
102	D	82.1	Confident	82.5	Confident	33 Å²	33	42.5 Å²	42.5	18%	0.176	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-83.9	-1.8	176.7	-59.3	-86.9	0	0	0	112.2	I95 V98 T99 M100 Y106	I95-D102 HydrophobicContact CD1-CB 4.45Å; I95-D102 HydrophobicContact CG2-CB 4.32Å; I95-D102 WeakPolarHBondContact CG2-OD1 3.44Å; V98-D102 HydrophobicContact CG1-CB 4.45Å; T99-D102 WeakPolarHBondContact CA-OD2 3.34Å; T99-D102 WeakPolarHBondContact CB-OD2 3.48Å; T99-D102 PolarHBondContact N-OD2 3.19Å; T99-D102 PolarHBondContact O-N 2.9Å; T99-D102 PolarHBondContact OG1-OD2 3.47Å; M100-D102 VanDerWaalsContact C-N 3.35Å; D102-Y106 WeakPolarHBondContact O-CE2 3.43Å; D102-Y106 PolarHBondContact O-OH 2.95Å
103	A	80.4	Confident	82	Confident	41 Å²	41	45.1 Å²	45.1	34%	0.339	25%	0.247	S	C	.	.			trans	-71.8	132.3	178.9	0	0	0	0	0	112	N101 L129 V131	N101-A103 VanDerWaalsContact C-N 3.28Å; A103-L129 WeakPolarHBondContact CA-O 3.45Å; A103-V131 HydrophobicContact CB-CB 4.28Å; A103-V131 HydrophobicContact CB-CG2 3.81Å
104	G	83.3	Confident	80.9	Confident	11 Å²	11	44.3 Å²	44.3	11%	0.113	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	149.5	-169.1	174.3	0	0	0	0	0	116	Y128 L129	G104-Y128 WeakPolarHBondContact O-CA 3.46Å; G104-L129 PolarHBondContact N-O 2.85Å; G104-L129 PolarHBondContact O-N 2.88Å
105	V	84	Confident	79.7	Confident	32 Å²	32	44.1 Å²	44.1	19%	0.194	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	100	-173.3	-175.7	0	0	0	0	111.2	P82 R126 L127 Y128	P82-V105 WeakPolarHBondContact CD-O 3.31Å; V105-R126 HydrophobicContact CG1-CB 4.32Å; V105-R126 HydrophobicContact CG1-CG 4.29Å; V105-L127 CarbonylContact C-O 3.51Å; V105-L127 WeakPolarHBondContact CA-O 3.24Å; V105-Y128 HydrophobicContact CG2-CD2 3.85Å
106	Y	86.9	Confident	78.3	Confident	2 Å²	2	55 Å²	55	1%	0.008	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	135.5	170.4	-66.8	-97.7	0	0	0	109.9	L60 E80 H81 L87 Y93 I95 D102 L127 L129	L60-Y106 HydrophobicContact CD1-CD1 3.51Å; L60-Y106 HydrophobicContact CD1-CD2 3.96Å; L60-Y106 HydrophobicContact CD1-CE1 4.04Å; L60-Y106 HydrophobicContact CD1-CE2 4.44Å; L60-Y106 HydrophobicContact CD1-CG 3.47Å; L60-Y106 VanDerWaalsContact CD1-CG 3.47Å; E80-Y106 WeakPolarHBondContact O-CA 3.43Å; H81-Y106 AromaticContact CD2-CE1 3.83Å; L87-Y106 HydrophobicContact CD1-CD1 3.47Å; L87-Y106 VanDerWaalsContact CD1-CD1 3.47Å; L87-Y106 HydrophobicContact CD1-CE1 3.44Å; L87-Y106 VanDerWaalsContact CD1-CE1 3.44Å; Y93-Y106 HydrophobicContact CD1-CE1 4.44Å; Y93-Y106 HydrophobicContact CE1-CE1 4.08Å; I95-Y106 HydrophobicContact CD1-CE1 4.35Å; I95-Y106 HydrophobicContact CD1-CE2 4.3Å; I95-Y106 WeakPolarHBondContact CD1-OH 3.02Å; D102-Y106 WeakPolarHBondContact O-CE2 3.43Å; D102-Y106 PolarHBondContact O-OH 2.95Å; Y106-L127 PolarHBondContact N-O 2.83Å; Y106-L127 PolarHBondContact O-N 2.89Å; Y106-L129 HydrophobicContact CD2-CB 4.07Å; Y106-L129 HydrophobicContact CE2-CB 3.84Å; Y106-L129 HydrophobicContact CE2-CD2 3.89Å
107	T	86.2	Confident	77.4	Confident	14 Å²	14	53.7 Å²	53.7	9%	0.086	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	124.7	173.9	-55.4	0	0	0	0	109.4	W79 E80 R126	W79-T107 WeakPolarHBondContact CA-O 3.42Å; E80-T107 PolarHBondContact N-O 3.26Å; E80-T107 PolarHBondContact O-N 2.74Å; T107-R126 HydrophobicContact CG2-CG 4.12Å; T107-R126 PolarHBondContact OG1-NE 3.35Å
108	C	86.8	Confident	76.5	Confident	2 Å²	2	51.4 Å²	51.4	1%	0.014	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	129	163.7	-179.3	0	0	0	0	109.4	C62 W79 Q124 H125	C62-C108 HydrophobicContact CB-CB 3.85Å; C62-C108 WeakPolarHBondContact CB-SG 3.3Å; C62-C108 WeakPolarHBondContact SG-CB 3.02Å; C62-C108 CovalentContact SG-SG 2.03Å; C62-C108 PolarHBondContact SG-SG 3.34Å; W79-C108 HydrophobicContact CD2-CB 4.07Å; W79-C108 HydrophobicContact CE3-CB 3.95Å; W79-C108 HydrophobicContact CH2-CB 3.99Å; W79-C108 HydrophobicContact CZ2-CB 4.11Å; W79-C108 HydrophobicContact CZ3-CB 3.91Å; C108-Q124 WeakPolarHBondContact O-CA 3.36Å; C108-H125 PolarHBondContact N-O 2.84Å; C108-H125 PolarHBondContact O-N 2.9Å
109	H	87.1	Confident	75.2	Confident	39 Å²	39	58.3 Å²	58.3	18%	0.181	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	140.1	163.8	-55.5	-111.1	0	0	0	108.4	Y77 R78 E80 Q124	Y77-H109 CarbonylContact C-O 3.59Å; Y77-H109 WeakPolarHBondContact CA-O 3.32Å; R78-H109 HydrophobicContact CB-CB 4.32Å; R78-H109 PolarHBondContact N-O 3.26Å; R78-H109 PolarHBondContact O-N 3.28Å; E80-H109 IonicContact OE1-NE2 3.74Å; E80-H109 IonicContact OE2-CD2 3.98Å; E80-H109 IonicContact OE2-CE1 3.64Å; E80-H109 IonicContact OE2-NE2 2.73Å; E80-H109 PolarHBondContact OE2-NE2 3.24Å; H109-Q124 PolarHBondContact CE1-NE2 3.21Å; H109-Q124 PolarHBondContact ND1-NE2 2.9Å
110	S	83.4	Confident	74.6	Confident	2 Å²	2	60.4 Å²	60.4	1%	0.014	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	146.8	171.1	68.2	0	0	0	0	110.2	V64 Q76 V122 D123	V64-S110 WeakPolarHBondContact CG1-OG 3.41Å; Q76-S110 CarbonylContact O-C 3.29Å; Q76-S110 VanDerWaalsContact O-CA 3.24Å; Q76-S110 WeakPolarHBondContact O-CA 3.46Å; S110-V122 WeakPolarHBondContact O-CA 3.24Å; S110-D123 PolarHBondContact N-O 3.09Å; S110-D123 PolarHBondContact O-N 2.87Å; S110-D123 PolarHBondContact OG-O 3.09Å; S110-D123 VanDerWaalsContact OG-O 3.11Å
111	S	83.3	Confident	74.3	Confident	19 Å²	19	57.8 Å²	57.8	13%	0.133	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	154.5	173.9	65.6	0	0	0	0	113.6	Q76 Q120 W121	Q76-S111 PolarHBondContact N-O 2.91Å; Q76-S111 PolarHBondContact O-N 2.81Å; S111-Q120 PolarHBondContact OG-NE2 2.82Å; S111-Q120 VanDerWaalsContact OG-NE2 3.13Å; S111-W121 CarbonylContact C-O 3.53Å; S111-W121 WeakPolarHBondContact CA-O 3.49Å; S111-W121 WeakPolarHBondContact CB-O 3.37Å
112	A	79.3	Confident	74	Confident	3 Å²	3	54.7 Å²	54.7	3%	0.025	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	155.3	178	0	0	0	0	0	110.5	V70 V75 Q120 W121	V70-A112 HydrophobicContact CG1-CB 3.49Å; V70-A112 VanDerWaalsContact CG1-CB 3.49Å; V75-A112 HydrophobicContact CG2-CB 4.26Å; A112-Q120 CarbonylContact O-C 3.58Å; A112-Q120 WeakPolarHBondContact O-CA 3.32Å; A112-W121 HydrophobicContact CB-CE3 4.05Å; A112-W121 PolarHBondContact N-O 2.93Å; A112-W121 PolarHBondContact O-N 2.71Å
113	Y	73.3	Confident	73.6	Confident	136 Å²	136	54.7 Å²	54.7	53%	0.533	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	135.5	173.3	-69	-74.4	0	0	0	111.1	E119 Q120	Y113-E119 CarbonylContact C-O 3.58Å; Y113-E119 WeakPolarHBondContact CA-O 3.15Å; Y113-Q120 HydrophobicContact CD1-CB 4.33Å; Y113-Q120 HydrophobicContact CE1-CB 4.21Å; Y113-Q120 HydrophobicContact CE1-CG 4.46Å
114	V	63.8	Low	73.5	Confident	35 Å²	35	58 Å²	58	21%	0.212	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	120.2	-178.9	-167.6	0	0	0	0	109.8	E69 V70 E119 W121	E69-V114 HydrophobicContact CB-CG1 4.35Å; V70-V114 HydrophobicContact CG2-CG2 4.17Å; V114-E119 PolarHBondContact N-O 2.74Å; V114-W121 HydrophobicContact CG2-CB 3.73Å
115	G	58.5	Low	73.1	Confident	62 Å²	62	60.3 Å²	60.3	64%	0.639	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	62.4	-170.6	176.2	0	0	0	0	0	115.7	G117	G115-G117 PolarHBondContact O-N 3.34Å
116	F	55.5	Low	72.8	Confident	231 Å²	231	65.7 Å²	65.7	100%	1.013	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-77.1	-1.3	178.4	-74.7	-88.6	0	0	0	113.9
117	G	55.2	Low	72.3	Confident	70 Å²	70	66.5 Å²	66.5	72%	0.722	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-84.9	-17.3	-177.2	0	0	0	0	0	115	G115 E119	G115-G117 PolarHBondContact O-N 3.34Å; G117-E119 VanDerWaalsContact C-N 3.33Å
118	G	58.4	Low	72.1	Confident	46 Å²	46	69.5 Å²	69.5	47%	0.474	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.8	15.6	-176.7	0	0	0	0	0	114.6
119	E	54.4	Low	71.9	Confident	147 Å²	147	69.4 Å²	69.4	69%	0.687	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.2	139.8	171.6	-64.2	-175.1	147.1	0	0	110	Y113 V114 G117	Y113-E119 CarbonylContact C-O 3.58Å; Y113-E119 WeakPolarHBondContact CA-O 3.15Å; V114-E119 PolarHBondContact N-O 2.74Å; G117-E119 VanDerWaalsContact C-N 3.33Å
120	Q	68.4	Low	71.5	Confident	103 Å²	103	69 Å²	69	48%	0.481	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	110.5	-174.7	-173	177.9	-8.6	0	0	110.2	S111 A112 Y113 V122	S111-Q120 PolarHBondContact OG-NE2 2.82Å; S111-Q120 VanDerWaalsContact OG-NE2 3.13Å; A112-Q120 CarbonylContact O-C 3.58Å; A112-Q120 WeakPolarHBondContact O-CA 3.32Å; Y113-Q120 HydrophobicContact CD1-CB 4.33Å; Y113-Q120 HydrophobicContact CE1-CB 4.21Å; Y113-Q120 HydrophobicContact CE1-CG 4.46Å; Q120-V122 HydrophobicContact CG-CG2 3.97Å
121	W	70.2	Confident	71.3	Confident	44 Å²	44	69.7 Å²	69.7	17%	0.167	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	138.2	165	171.9	86.1	0	0	0	109.2	V64 L66 P67 V70 V75 S111 A112 V114 D123	V64-W121 HydrophobicContact CB-CH2 4.21Å; V64-W121 HydrophobicContact CG2-CH2 4.48Å; L66-W121 HydrophobicContact CD2-CH2 3.61Å; L66-W121 HydrophobicContact CD2-CZ2 4.22Å; L66-W121 HydrophobicContact CD2-CZ3 3.82Å; P67-W121 HydrophobicContact CG-CG 4.47Å; V70-W121 HydrophobicContact CG2-CB 4.48Å; V70-W121 HydrophobicContact CG2-CG 4.41Å; V75-W121 HydrophobicContact CG1-CZ3 4.33Å; S111-W121 CarbonylContact C-O 3.53Å; S111-W121 WeakPolarHBondContact CA-O 3.49Å; S111-W121 WeakPolarHBondContact CB-O 3.37Å; A112-W121 HydrophobicContact CB-CE3 4.05Å; A112-W121 PolarHBondContact N-O 2.93Å; A112-W121 PolarHBondContact O-N 2.71Å; V114-W121 HydrophobicContact CG2-CB 3.73Å; W121-D123 HydrophobicContact CH2-CB 3.54Å; W121-D123 HydrophobicContact CZ2-CB 3.41Å; W121-D123 VanDerWaalsContact CZ2-CB 3.41Å; W121-D123 HydrophobicContact CZ3-CB 4.38Å
122	V	73.2	Confident	70.6	Confident	77 Å²	77	72.3 Å²	72.3	47%	0.467	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	134	-179.6	-173.9	0	0	0	0	109.6	S110 Q120	S110-V122 WeakPolarHBondContact O-CA 3.24Å; Q120-V122 HydrophobicContact CG-CG2 3.97Å
123	D	75.2	Confident	69.7	Low	33 Å²	33	76.7 Å²	76.7	18%	0.176	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	141.9	174.7	175.3	13.7	0	0	0	109.4	V64 S110 W121 H125	V64-D123 WeakPolarHBondContact CB-OD2 3.45Å; S110-D123 PolarHBondContact N-O 3.09Å; S110-D123 PolarHBondContact O-N 2.87Å; S110-D123 PolarHBondContact OG-O 3.09Å; S110-D123 VanDerWaalsContact OG-O 3.11Å; W121-D123 HydrophobicContact CH2-CB 3.54Å; W121-D123 HydrophobicContact CZ2-CB 3.41Å; W121-D123 VanDerWaalsContact CZ2-CB 3.41Å; W121-D123 HydrophobicContact CZ3-CB 4.38Å; D123-H125 IonicContact OD1-CE1 3.93Å; D123-H125 PolarHBondContact OD1-CE1 3.32Å; D123-H125 VanDerWaalsContact OD1-CE1 3.28Å; D123-H125 IonicContact OD1-ND1 3.48Å; D123-H125 PolarHBondContact OD1-ND1 2.83Å; D123-H125 IonicContact OD2-CE1 2.77Å; D123-H125 PolarHBondContact OD2-CE1 3.24Å; D123-H125 IonicContact OD2-ND1 2.66Å
124	Q	76.7	Confident	68.5	Low	111 Å²	111	72.3 Å²	72.3	52%	0.519	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	127.2	-175.3	-73.5	-179.8	-13.9	0	0	110.7	C108 H109	C108-Q124 WeakPolarHBondContact O-CA 3.36Å; H109-Q124 PolarHBondContact CE1-NE2 3.21Å; H109-Q124 PolarHBondContact ND1-NE2 2.9Å
125	H	74.7	Confident	67.4	Low	58 Å²	58	78.4 Å²	78.4	27%	0.269	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	137.5	-179.7	-85.1	63.5	0	0	0	111	S63 C108 D123	S63-H125 PolarHBondContact O-CD2 2.78Å; S63-H125 PolarHBondContact O-NE2 2.02Å; C108-H125 PolarHBondContact N-O 2.84Å; C108-H125 PolarHBondContact O-N 2.9Å; D123-H125 IonicContact OD1-CE1 3.93Å; D123-H125 PolarHBondContact OD1-CE1 3.32Å; D123-H125 VanDerWaalsContact OD1-CE1 3.28Å; D123-H125 IonicContact OD1-ND1 3.48Å; D123-H125 PolarHBondContact OD1-ND1 2.83Å; D123-H125 IonicContact OD2-CE1 2.77Å; D123-H125 PolarHBondContact OD2-CE1 3.24Å; D123-H125 IonicContact OD2-ND1 2.66Å
126	R	78.3	Confident	66.3	Low	146 Å²	146	79.7 Å²	79.7	55%	0.551	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.5	140.4	-179.4	-80.2	-178.2	163.8	173.7	-3.6	113	V47 V105 T107	V47-R126 HydrophobicContact CG2-CB 4.12Å; V105-R126 HydrophobicContact CG1-CB 4.32Å; V105-R126 HydrophobicContact CG1-CG 4.29Å; T107-R126 HydrophobicContact CG2-CG 4.12Å; T107-R126 PolarHBondContact OG1-NE 3.35Å
127	L	77.7	Confident	65	Low	18 Å²	18	75.2 Å²	75.2	9%	0.094	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	121.6	-171.7	-177.3	68.7	0	0	0	109	R48 W50 L60 V105 Y106	R48-L127 HydrophobicContact CB-CD1 3.84Å; W50-L127 HydrophobicContact CD2-CD1 4.39Å; W50-L127 HydrophobicContact CG-CD1 3.96Å; L60-L127 HydrophobicContact CB-CD2 3.78Å; L60-L127 HydrophobicContact CD1-CD2 4.25Å; L60-L127 HydrophobicContact CD2-CD2 3.59Å; L60-L127 HydrophobicContact CG-CD2 4.06Å; V105-L127 CarbonylContact C-O 3.51Å; V105-L127 WeakPolarHBondContact CA-O 3.24Å; Y106-L127 PolarHBondContact N-O 2.83Å; Y106-L127 PolarHBondContact O-N 2.89Å
128	Y	81.7	Confident	63.7	Low	78 Å²	78	76.6 Å²	76.6	31%	0.306	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	114.3	175.5	177.5	-115.4	0	0	0	109.7	R48 R49 W50 G104 V105 E130	R48-Y128 PolarHBondContact O-N 2.95Å; R49-Y128 HydrophobicContact CG-CD1 4.25Å; W50-Y128 PolarHBondContact N-O 3.47Å; G104-Y128 WeakPolarHBondContact O-CA 3.46Å; V105-Y128 HydrophobicContact CG2-CD2 3.85Å; Y128-E130 HydrophobicContact CD1-CB 4.45Å; Y128-E130 HydrophobicContact CE1-CB 3.9Å
129	L	82.9	Confident	62.4	Low	0 Å²	0	78.2 Å²	78.2	0%	0	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	117.3	172.4	-175.9	59.3	0	0	0	109.1	W50 V52 V58 I95 A103 G104 Y106	W50-L129 HydrophobicContact CB-CD1 4.37Å; V52-L129 HydrophobicContact CB-CD1 4.05Å; V52-L129 HydrophobicContact CG2-CD1 3.53Å; V58-L129 HydrophobicContact CG1-CD1 4.35Å; V58-L129 HydrophobicContact CG2-CD1 4.36Å; I95-L129 HydrophobicContact CD1-CD2 3.37Å; A103-L129 WeakPolarHBondContact CA-O 3.45Å; G104-L129 PolarHBondContact N-O 2.85Å; G104-L129 PolarHBondContact O-N 2.88Å; Y106-L129 HydrophobicContact CD2-CB 4.07Å; Y106-L129 HydrophobicContact CE2-CB 3.84Å; Y106-L129 HydrophobicContact CE2-CD2 3.89Å
130	E	77.6	Confident	61.2	Low	30 Å²	30	74.6 Å²	74.6	14%	0.14	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	133.7	172.8	178.3	178.1	162.5	0	0	109.4	R49 W50 I51 V52 Y128 Q132	R49-E130 IonicContact CZ-OE2 3.23Å; R49-E130 IonicContact NE-OE2 2.93Å; R49-E130 PolarHBondContact NE-OE2 2.83Å; R49-E130 VanDerWaalsContact NH2-CD 3.3Å; R49-E130 IonicContact NH2-OE1 3.38Å; R49-E130 PolarHBondContact NH2-OE1 3.42Å; R49-E130 VanDerWaalsContact NH2-OE1 3.07Å; R49-E130 IonicContact NH2-OE2 2.68Å; R49-E130 PolarHBondContact NH2-OE2 3.37Å; W50-E130 PolarHBondContact O-N 3.3Å; I51-E130 HydrophobicContact CG1-CB 4.44Å; V52-E130 PolarHBondContact N-O 3.15Å; Y128-E130 HydrophobicContact CD1-CB 4.45Å; Y128-E130 HydrophobicContact CE1-CB 3.9Å; E130-Q132 HydrophobicContact CG-CG 4.31Å; E130-Q132 PolarHBondContact OE1-NE2 3.49Å
131	V	79	Confident	59.8	Low	17 Å²	17	74.9 Å²	74.9	10%	0.103	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	127.8	-179.4	-174.7	0	0	0	0	108.7	V52 L54 V98 M100 A103	V52-V131 CarbonylContact O-C 3.56Å; V52-V131 VanDerWaalsContact O-CA 3.31Å; V52-V131 WeakPolarHBondContact O-CA 3.46Å; L54-V131 HydrophobicContact CD2-CG1 3.4Å; L54-V131 HydrophobicContact CG-CG1 3.78Å; V98-V131 HydrophobicContact CG1-CB 4.18Å; V98-V131 HydrophobicContact CG1-CG1 3.66Å; V98-V131 HydrophobicContact CG1-CG2 3.42Å; V98-V131 VanDerWaalsContact CG1-CG2 3.42Å; M100-V131 HydrophobicContact SD-CB 4.15Å; M100-V131 HydrophobicContact SD-CG1 3.77Å; A103-V131 HydrophobicContact CB-CB 4.28Å; A103-V131 HydrophobicContact CB-CG2 3.81Å
132	Q	68.8	Low	58.6	Low	74 Å²	74	83.5 Å²	83.5	35%	0.346	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	145.4	-179.7	-67.3	-174.7	-5.6	0	0	111.1	I51 V52 L53 L54 E130	I51-Q132 HydrophobicContact CG2-CG 3.95Å; V52-Q132 PolarHBondContact O-N 2.84Å; L53-Q132 CarbonylContact C-O 3.54Å; L53-Q132 WeakPolarHBondContact CA-O 3.5Å; L53-Q132 HydrophobicContact CD2-CB 4.19Å; L54-Q132 PolarHBondContact N-O 3.06Å; E130-Q132 HydrophobicContact CG-CG 4.31Å; E130-Q132 PolarHBondContact OE1-NE2 3.49Å
133	D	60.8	Low	57.7	Low	94 Å²	94	86 Å²	86	50%	0.503	47%	0.47	S	S	.	.			trans	-65.3	140.7	169.2	-70.5	-73.2	0	0	0	110.8	L54 I135	L54-D133 VanDerWaalsContact CD1-OD1 3.27Å; L54-D133 WeakPolarHBondContact CD1-OD1 3.43Å; D133-I135 HydrophobicContact CB-CG1 4.37Å; D133-I135 WeakPolarHBondContact O-CG1 3.3Å; D133-I135 PolarHBondContact O-N 3.09Å
134	D	47.7	Very low	56.9	Low	45 Å²	45	87 Å²	87	24%	0.241	48%	0.48	C	S	.	.			trans	-82.6	82.1	175.8	-156.5	-32.2	0	0	0	109.4	L53 R56 S136	L53-D134 HydrophobicContact CB-CB 4.48Å; L53-D134 WeakPolarHBondContact CD1-OD2 3.33Å; L53-D134 HydrophobicContact CD2-CB 4.48Å; R56-D134 IonicContact CZ-OD2 3.68Å; R56-D134 IonicContact NH2-OD2 3.34Å; R56-D134 PolarHBondContact NH2-OD2 3.33Å; D134-S136 PolarHBondContact O-N 3.23Å; D134-S136 WeakPolarHBondContact OD1-CB 3.42Å; D134-S136 PolarHBondContact OD1-OG 3.48Å
135	I	39.8	Very low	56.7	Low	162 Å²	162	88.4 Å²	88.4	83%	0.831	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	17.9	-174.9	-27.6	-178.2	0	0	0	112.9	D133	D133-I135 HydrophobicContact CB-CG1 4.37Å; D133-I135 WeakPolarHBondContact O-CG1 3.3Å; D133-I135 PolarHBondContact O-N 3.09Å
136	S	35.4	Very low	57	Low	90 Å²	90	86 Å²	86	63%	0.629	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-13.1	176	66.9	0	0	0	0	113.8	D134 A138	D134-S136 PolarHBondContact O-N 3.23Å; D134-S136 WeakPolarHBondContact OD1-CB 3.42Å; D134-S136 PolarHBondContact OD1-OG 3.48Å; S136-A138 PolarHBondContact O-N 2.8Å
137	M	29.2	Very low	57.2	Low	137 Å²	137	82.7 Å²	82.7	68%	0.675	47%	0.472	S	S	*	.			trans	-82.9	72.2	-176.6	-68.5	-164.6	176	0	0	113.9
138	A	28.8	Very low	57.6	Low	99 Å²	99	82.4 Å²	82.4	82%	0.818	47%	0.47	S	S	*	.	S	Bend	trans	-140	79.4	171.1	0	0	0	0	0	112.3	S136	S136-A138 PolarHBondContact O-N 2.8Å
139	G	29.4	Very low	57.9	Low	79 Å²	79	79.9 Å²	79.9	81%	0.814	46%	0.463	S	S	*	.			trans	107.4	47.1	171	0	0	0	0	0	116.1	D141	G139-D141 PolarHBondContact O-N 2.7Å
140	G	29	Very low	58.2	Low	72 Å²	72	79.9 Å²	79.9	74%	0.742	46%	0.463	S	S	*	.			trans	-64.8	126.3	165.4	0	0	0	0	0	111.1
141	D	40.8	Very low	58.5	Low	109 Å²	109	79.9 Å²	79.9	58%	0.583	46%	0.464	S	S	*	.			trans	-64.9	150.6	168.6	-176.9	24.5	0	0	0	110.1	G139 N143 S144	G139-D141 PolarHBondContact O-N 2.7Å; D141-N143 PolarHBondContact O-N 2.94Å; D141-N143 VanDerWaalsContact O-N 3.16Å; D141-S144 PolarHBondContact O-N 3.23Å; D141-S144 PolarHBondContact O-OG 3.44Å
142	R	43.7	Very low	58.8	Low	224 Å²	224	81.4 Å²	81.4	85%	0.845	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-16.5	-179.7	-74.9	-174.8	170	-170.4	-4.1	113.4
143	N	54.7	Low	59	Low	130 Å²	130	78.3 Å²	78.3	70%	0.695	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.9	10.3	-176	-58	-8.4	0	0	0	113.3	D141	D141-N143 PolarHBondContact O-N 2.94Å; D141-N143 VanDerWaalsContact O-N 3.16Å
144	S	58.9	Low	59.5	Low	53 Å²	53	76.2 Å²	76.2	37%	0.371	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-71.4	141.2	179.6	61.9	0	0	0	0	112.8	D141	D141-S144 PolarHBondContact O-N 3.23Å; D141-S144 PolarHBondContact O-OG 3.44Å
145	E	72.2	Confident	60.3	Low	142 Å²	142	80.5 Å²	80.5	66%	0.664	48%	0.481	S	S	*	.	P	Polyproline II helix	trans	-66.3	130.2	172.1	178.8	170.3	-158.1	0	0	111	F227	E145-F227 HydrophobicContact CB-CE1 4.37Å; E145-F227 HydrophobicContact CG-CD1 3.81Å; E145-F227 HydrophobicContact CG-CE1 4.15Å
146	P	80.3	Confident	61.1	Low	6 Å²	6	74.3 Å²	74.3	4%	0.039	46%	0.458	C	S	.	.	P	Polyproline II helix	trans	-72.4	143.3	-176.3	27.3	-34.8	0	0	0	113.8	I148 V172 D174 Y178 F227	P146-I148 PolarHBondContact O-N 2.8Å; P146-I148 VanDerWaalsContact O-N 3.1Å; P146-V172 HydrophobicContact CB-CG1 3.67Å; P146-D174 WeakPolarHBondContact CA-OD1 3.34Å; P146-D174 WeakPolarHBondContact CA-OD2 3.42Å; P146-D174 WeakPolarHBondContact CB-OD2 3.43Å; P146-Y178 HydrophobicContact CB-CE1 4.16Å; P146-Y178 WeakPolarHBondContact CB-OH 3.48Å; P146-Y178 HydrophobicContact CG-CE1 4.02Å; P146-F227 HydrophobicContact CG-CB 4.07Å; P146-F227 HydrophobicContact CG-CD1 4.16Å; P146-F227 HydrophobicContact CG-CD2 3.4Å; P146-F227 HydrophobicContact CG-CE1 4.49Å; P146-F227 HydrophobicContact CG-CE2 3.81Å; P146-F227 HydrophobicContact CG-CG 3.59Å; P146-F227 HydrophobicContact CG-CZ 4.33Å
147	T	82.5	Confident	63	Low	78 Å²	78	73.4 Å²	73.4	48%	0.479	45%	0.449	S	S	.	.			trans	-81.4	99.4	178.7	-58.3	0	0	0	0	111.2	V149 L173 D174	T147-V149 HydrophobicContact CG2-CG2 4.34Å; T147-L173 HydrophobicContact CG2-CD1 3.52Å; T147-L173 HydrophobicContact CG2-CG 4.17Å; T147-L173 PolarHBondContact O-N 2.89Å; T147-L173 VanDerWaalsContact O-N 3.1Å; T147-D174 PolarHBondContact N-OD1 2.83Å
148	I	87.6	Confident	65.5	Low	11 Å²	11	68.5 Å²	68.5	6%	0.056	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	135.9	175.2	-53.9	169.5	0	0	0	110.9	P146 L150 C170 V172 V218 F227 K229	P146-I148 PolarHBondContact O-N 2.8Å; P146-I148 VanDerWaalsContact O-N 3.1Å; I148-L150 HydrophobicContact CG2-CD2 4.13Å; I148-C170 VanDerWaalsContact CG2-SG 3.57Å; I148-V172 HydrophobicContact CG1-CG2 4.34Å; I148-V218 HydrophobicContact CD1-CG2 3.72Å; I148-V218 HydrophobicContact CG1-CG2 4Å; I148-F227 HydrophobicContact CD1-CB 3.97Å; I148-K229 HydrophobicContact CB-CB 4.08Å; I148-K229 HydrophobicContact CB-CD 3.96Å; I148-K229 HydrophobicContact CD1-CB 4.15Å; I148-K229 HydrophobicContact CG2-CB 3.76Å; I148-K229 HydrophobicContact CG2-CD 4Å; I148-K229 VanDerWaalsContact O-CD 3.32Å; I148-K229 WeakPolarHBondContact O-CD 3.43Å; I148-K229 PolarHBondContact O-NZ 2.98Å
149	V	87.8	Confident	67.9	Low	26 Å²	26	68 Å²	68	16%	0.158	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	127.4	179.4	-167.6	0	0	0	0	112.1	T147 N151 D154 S171 L173	T147-V149 HydrophobicContact CG2-CG2 4.34Å; V149-N151 WeakPolarHBondContact CG1-ND2 3.15Å; V149-N151 PolarHBondContact O-ND2 2.88Å; V149-D154 WeakPolarHBondContact CA-OD2 3.47Å; V149-D154 HydrophobicContact CG1-CB 3.96Å; V149-S171 PolarHBondContact N-O 3.06Å; V149-S171 PolarHBondContact O-N 2.89Å; V149-L173 HydrophobicContact CG2-CD1 4.1Å; V149-L173 HydrophobicContact CG2-CD2 4.03Å; V149-L173 HydrophobicContact CG2-CG 3.94Å
150	L	87.8	Confident	70.3	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	125.9	-176.4	-51.2	-175.6	0	0	0	111.8	I148 P152 G153 D154 R169 C170 W182 C216 K229 L231	I148-L150 HydrophobicContact CG2-CD2 4.13Å; L150-P152 VanDerWaalsContact C-C 3.49Å; L150-P152 CarbonylContact C-O 3.5Å; L150-P152 CarbonylContact O-C 3.56Å; L150-G153 CarbonylContact O-C 3.59Å; L150-G153 PolarHBondContact O-N 3.42Å; L150-G153 VanDerWaalsContact O-N 3.12Å; L150-D154 WeakPolarHBondContact CG-OD2 3.2Å; L150-D154 PolarHBondContact N-OD2 3.34Å; L150-D154 PolarHBondContact O-N 3Å; L150-R169 CarbonylContact C-O 3.56Å; L150-R169 WeakPolarHBondContact CA-O 3.5Å; L150-C170 HydrophobicContact CD2-CB 3.98Å; L150-W182 HydrophobicContact CD1-CH2 4.23Å; L150-W182 HydrophobicContact CD2-CH2 3.8Å; L150-W182 HydrophobicContact CD2-CZ2 4.25Å; L150-W182 HydrophobicContact CG-CH2 4.45Å; L150-C216 HydrophobicContact CD2-CB 3.86Å; L150-K229 HydrophobicContact CD1-CG 4.32Å; L150-K229 HydrophobicContact CG-CD 4.34Å; L150-L231 HydrophobicContact CB-CD1 4.4Å; L150-L231 HydrophobicContact CD1-CB 3.92Å; L150-L231 HydrophobicContact CD1-CD1 4.06Å
151	N	84.2	Confident	72.5	Confident	29 Å²	29	63.5 Å²	63.5	16%	0.155	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-131.9	84.4	-158.3	-86.6	-76.3	0	0	0	114.7	K57 V149 R169	K57-N151 HydrophobicContact CD-CB 3.77Å; K57-N151 VanDerWaalsContact NZ-C 3.34Å; K57-N151 PolarHBondContact NZ-O 3.49Å; V149-N151 WeakPolarHBondContact CG1-ND2 3.15Å; V149-N151 PolarHBondContact O-ND2 2.88Å; N151-R169 HydrophobicContact CB-CB 4.44Å; N151-R169 WeakPolarHBondContact CB-O 3.26Å; N151-R169 PolarHBondContact N-O 3.4Å; N151-R169 PolarHBondContact O-N 3.35Å
152	P	85.6	Confident	74.5	Confident	50 Å²	50	63.3 Å²	63.3	33%	0.325	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	cis	-81.1	165	4	35.2	-38	0	0	0	113.1	L150 L158 S168	L150-P152 VanDerWaalsContact C-C 3.49Å; L150-P152 CarbonylContact C-O 3.5Å; L150-P152 CarbonylContact O-C 3.56Å; P152-L158 HydrophobicContact CB-CD1 4.06Å; P152-L158 HydrophobicContact CG-CD1 3.92Å; P152-L158 HydrophobicContact CG-CD2 4.04Å; P152-S168 WeakPolarHBondContact O-CB 3.26Å; P152-S168 PolarHBondContact O-OG 3.29Å
153	G	72.2	Confident	76.1	Confident	8 Å²	8	54.9 Å²	54.9	8%	0.082	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	141.5	-22.9	-176.3	0	0	0	0	0	113.8	L150 G156 L231	L150-G153 CarbonylContact O-C 3.59Å; L150-G153 PolarHBondContact O-N 3.42Å; L150-G153 VanDerWaalsContact O-N 3.12Å; G153-G156 WeakPolarHBondContact O-CA 3.39Å; G153-G156 PolarHBondContact O-N 2.75Å; G153-L231 VanDerWaalsContact CA-CD1 3.47Å
154	D	72.6	Confident	77.3	Confident	51 Å²	51	53.8 Å²	53.8	27%	0.273	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.2	135.9	175.4	-86.5	-56.6	0	0	0	112.5	V149 L150 K229	V149-D154 WeakPolarHBondContact CA-OD2 3.47Å; V149-D154 HydrophobicContact CG1-CB 3.96Å; L150-D154 WeakPolarHBondContact CG-OD2 3.2Å; L150-D154 PolarHBondContact N-OD2 3.34Å; L150-D154 PolarHBondContact O-N 3Å; D154-K229 WeakPolarHBondContact OD1-CE 3.39Å; D154-K229 IonicContact OD1-NZ 2.69Å; D154-K229 PolarHBondContact OD1-NZ 3.14Å; D154-K229 WeakPolarHBondContact OD2-CE 3.42Å; D154-K229 IonicContact OD2-NZ 2.71Å; D154-K229 PolarHBondContact OD2-NZ 2.96Å
155	P	63.7	Low	78.4	Confident	134 Å²	134	55.3 Å²	55.3	87%	0.87	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	cis	-64.4	124.3	-23.1	28.8	-32.7	0	0	0	109.7
156	G	56.9	Low	79.2	Confident	33 Å²	33	48.7 Å²	48.7	34%	0.34	29%	0.29	S	S	.	.	S	Bend	trans	-84.6	-176.6	-179.6	0	0	0	0	0	113.8	G153	G153-G156 WeakPolarHBondContact O-CA 3.39Å; G153-G156 PolarHBondContact O-N 2.75Å
157	P	74.6	Confident	79.7	Confident	70 Å²	70	52.3 Å²	52.3	46%	0.455	30%	0.304	S	S	.	.	P	Polyproline II helix	cis	-78	156	8.9	31.3	-36.6	0	0	0	114.5	N232 R234	P157-N232 CarbonylContact C-O 3.57Å; P157-N232 VanDerWaalsContact CA-O 3.32Å; P157-N232 WeakPolarHBondContact CA-O 3.03Å; P157-N232 HydrophobicContact CB-CB 4.05Å; P157-R234 HydrophobicContact CB-CB 3.83Å; P157-R234 HydrophobicContact CG-CB 3.88Å
158	L	81.5	Confident	80.1	Confident	34 Å²	34	48.6 Å²	48.6	18%	0.178	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	117.9	169.6	172.2	59.6	0	0	0	109.9	P152 V160 L166 L231 N232 L233 R234	P152-L158 HydrophobicContact CB-CD1 4.06Å; P152-L158 HydrophobicContact CG-CD1 3.92Å; P152-L158 HydrophobicContact CG-CD2 4.04Å; L158-V160 HydrophobicContact CG-CG1 4.3Å; L158-L166 HydrophobicContact CD2-CD1 3.65Å; L158-L231 HydrophobicContact CD2-CD1 4.45Å; L158-N232 PolarHBondContact N-O 2.74Å; L158-L233 HydrophobicContact CB-CD2 4.12Å; L158-L233 HydrophobicContact CD2-CD2 4.22Å; L158-L233 HydrophobicContact CG-CD2 4.36Å; L158-L233 WeakPolarHBondContact O-CA 3.41Å; L158-R234 PolarHBondContact O-N 2.91Å
159	D	80.6	Confident	80.3	Confident	90 Å²	90	52.9 Å²	52.9	48%	0.481	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	131.8	173.1	-71.4	-46.5	0	0	0	111.3	R234 A236	D159-R234 CarbonylContact C-O 3.58Å; D159-R234 WeakPolarHBondContact CA-O 3.42Å; D159-R234 VanDerWaalsContact OD1-CD 3.25Å; D159-R234 WeakPolarHBondContact OD1-CD 3.11Å; D159-R234 WeakPolarHBondContact OD1-CG 3.46Å; D159-R234 IonicContact OD1-NE 3.96Å; D159-A236 HydrophobicContact CB-CB 4.32Å
160	V	78.5	Confident	80.5	Confident	12 Å²	12	51.6 Å²	51.6	7%	0.073	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	149.5	-178.4	-71.3	0	0	0	0	112	L158 L166 F205 L233 R234 L235 A236	L158-V160 HydrophobicContact CG-CG1 4.3Å; V160-L166 HydrophobicContact CG1-CD1 4Å; V160-F205 HydrophobicContact CB-CD1 4.21Å; V160-F205 HydrophobicContact CB-CE1 4.11Å; V160-F205 HydrophobicContact CG2-CD1 4.19Å; V160-F205 HydrophobicContact CG2-CE1 3.57Å; V160-F205 HydrophobicContact CG2-CZ 3.97Å; V160-L233 HydrophobicContact CG1-CD2 4.14Å; V160-L233 HydrophobicContact CG2-CB 4.28Å; V160-R234 VanDerWaalsContact CG2-O 3.31Å; V160-R234 WeakPolarHBondContact CG2-O 3.29Å; V160-R234 PolarHBondContact N-O 3.46Å; V160-L235 WeakPolarHBondContact O-CA 3.08Å; V160-A236 PolarHBondContact O-N 2.92Å
161	N	76.9	Confident	80.5	Confident	43 Å²	43	53.1 Å²	53.1	23%	0.23	30%	0.3	C	S	.	.			trans	-113	149.5	170.8	-69.6	-35	0	0	0	110.5	E164 A236	N161-E164 HydrophobicContact CB-CB 4.17Å; N161-E164 HydrophobicContact CB-CG 3.9Å; N161-E164 PolarHBondContact ND2-OE1 3.36Å; N161-E164 PolarHBondContact O-N 2.88Å; N161-A236 PolarHBondContact OD1-O 3.33Å
162	F	82.7	Confident	80.6	Confident	105 Å²	105	52.7 Å²	52.7	46%	0.461	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	137.3	166.9	-65.3	-52.1	0	0	0	110.7	E164 F205 P207 L210 L235	F162-E164 VanDerWaalsContact C-N 3.3Å; F162-F205 CarbonylContact C-O 3.29Å; F162-F205 WeakPolarHBondContact CA-O 3.42Å; F162-F205 HydrophobicContact CD1-CD1 4.03Å; F162-F205 HydrophobicContact CD1-CE1 4.19Å; F162-F205 HydrophobicContact CE1-CD1 4.45Å; F162-F205 HydrophobicContact CE1-CE1 4.17Å; F162-P207 HydrophobicContact CD1-CG 4.44Å; F162-P207 HydrophobicContact CE1-CB 4.43Å; F162-P207 HydrophobicContact CE1-CG 3.93Å; F162-P207 HydrophobicContact CZ-CG 4.03Å; F162-L210 HydrophobicContact CE1-CD1 3.82Å; F162-L210 HydrophobicContact CZ-CD1 3.88Å; F162-L235 HydrophobicContact CD1-CD2 4.24Å; F162-L235 HydrophobicContact CD2-CD2 4.05Å; F162-L235 HydrophobicContact CE1-CD2 3.95Å; F162-L235 HydrophobicContact CE2-CD1 4.02Å; F162-L235 HydrophobicContact CE2-CD2 3.75Å; F162-L235 HydrophobicContact CG-CD2 4.3Å; F162-L235 HydrophobicContact CZ-CD1 3.78Å; F162-L235 HydrophobicContact CZ-CD2 3.7Å; F162-L235 HydrophobicContact CZ-CG 4.37Å
163	G	75.9	Confident	80.2	Confident	47 Å²	47	53 Å²	53	49%	0.485	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.3	-4	-174.9	0	0	0	0	0	115.3	F205	G163-F205 PolarHBondContact N-O 3.33Å
164	E	79.4	Confident	80.3	Confident	108 Å²	108	54.5 Å²	54.5	51%	0.505	30%	0.303	S	S	.	.	S	Bend	trans	-93	169.1	174.3	-76.1	-172.2	-155.6	0	0	113.1	N161 F162 L166 F205	N161-E164 HydrophobicContact CB-CB 4.17Å; N161-E164 HydrophobicContact CB-CG 3.9Å; N161-E164 PolarHBondContact ND2-OE1 3.36Å; N161-E164 PolarHBondContact O-N 2.88Å; F162-E164 VanDerWaalsContact C-N 3.3Å; E164-L166 PolarHBondContact O-N 2.93Å; E164-F205 VanDerWaalsContact O-CB 3.31Å; E164-F205 WeakPolarHBondContact O-CB 3.19Å; E164-F205 PolarHBondContact O-N 3.32Å
165	L	83	Confident	80.1	Confident	85 Å²	85	57.6 Å²	57.6	45%	0.445	33%	0.328	S	S	.	.			trans	-78.2	109.4	176.1	171.3	66.3	0	0	0	110.3	Y167 Y201 I202	L165-Y167 PolarHBondContact O-N 2.87Å; L165-Y201 HydrophobicContact CD1-CD1 4.11Å; L165-Y201 HydrophobicContact CD1-CD2 3.96Å; L165-Y201 HydrophobicContact CD1-CE1 3.82Å; L165-Y201 HydrophobicContact CD1-CE2 3.65Å; L165-Y201 HydrophobicContact CD1-CG 4.17Å; L165-Y201 HydrophobicContact CD2-CE2 3.82Å; L165-Y201 HydrophobicContact CG-CE2 4.3Å; L165-I202 WeakPolarHBondContact CA-O 3.37Å
166	L	88.9	Confident	80.5	Confident	2 Å²	2	55.1 Å²	55.1	1%	0.01	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	112.1	165.1	166.7	55.6	0	0	0	109.3	L158 V160 E164 L200 I202 F205 I214 L231 L233	L158-L166 HydrophobicContact CD2-CD1 3.65Å; V160-L166 HydrophobicContact CG1-CD1 4Å; E164-L166 PolarHBondContact O-N 2.93Å; L166-L200 HydrophobicContact CD1-CD2 4.28Å; L166-L200 HydrophobicContact CD2-CD2 4.01Å; L166-L200 HydrophobicContact CG-CD2 3.94Å; L166-I202 HydrophobicContact CB-CB 4.22Å; L166-I202 HydrophobicContact CD2-CD1 3.85Å; L166-I202 HydrophobicContact CG-CD1 4.27Å; L166-I202 PolarHBondContact N-O 2.79Å; L166-I202 PolarHBondContact O-N 2.82Å; L166-F205 HydrophobicContact CB-CB 4.21Å; L166-F205 HydrophobicContact CB-CD2 3.86Å; L166-F205 HydrophobicContact CB-CG 4.24Å; L166-F205 HydrophobicContact CD2-CD2 3.52Å; L166-F205 HydrophobicContact CD2-CE2 3.46Å; L166-F205 VanDerWaalsContact CD2-CE2 3.46Å; L166-F205 HydrophobicContact CD2-CZ 4.46Å; L166-F205 HydrophobicContact CG-CD2 4.34Å; L166-I214 HydrophobicContact CD2-CD1 4.06Å; L166-L231 HydrophobicContact CD1-CD2 4.26Å; L166-L233 HydrophobicContact CD1-CD2 3.89Å; L166-L233 HydrophobicContact CD2-CD1 3.75Å; L166-L233 HydrophobicContact CD2-CD2 4.14Å
167	Y	90.9	Very high	81.7	Confident	82 Å²	82	60.9 Å²	60.9	32%	0.322	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	132.5	172.8	170.1	-109.9	0	0	0	111.9	L165 L200 Y201	L165-Y167 PolarHBondContact O-N 2.87Å; Y167-L200 WeakPolarHBondContact CA-O 3.39Å; Y167-L200 VanDerWaalsContact CD2-O 3.26Å; Y167-L200 WeakPolarHBondContact CD2-O 3.37Å; Y167-Y201 AromaticContact CD2-CD2 3.93Å; Y167-Y201 HydrophobicContact CD2-CD2 3.93Å
168	S	90.5	Very high	82.3	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	163.2	165.1	-170.7	0	0	0	0	110.2	P152 L200	P152-S168 WeakPolarHBondContact O-CB 3.26Å; P152-S168 PolarHBondContact O-OG 3.29Å; S168-L200 PolarHBondContact N-O 3.23Å; S168-L200 PolarHBondContact O-N 3.29Å
169	R	91.7	Very high	82.8	Confident	101 Å²	101	59.1 Å²	59.1	38%	0.381	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	124.8	170.1	177.2	175.8	174.5	177.8	-1.3	110.1	L150 N151 A198	L150-R169 CarbonylContact C-O 3.56Å; L150-R169 WeakPolarHBondContact CA-O 3.5Å; N151-R169 HydrophobicContact CB-CB 4.44Å; N151-R169 WeakPolarHBondContact CB-O 3.26Å; N151-R169 PolarHBondContact N-O 3.4Å; N151-R169 PolarHBondContact O-N 3.35Å; R169-A198 CarbonylContact C-O 3.51Å; R169-A198 WeakPolarHBondContact CA-O 3.13Å
170	C	91.3	Very high	83.5	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	141.4	170.9	-165.3	0	0	0	0	110.2	I148 L150 Y180 W182 A198 C216	I148-C170 VanDerWaalsContact CG2-SG 3.57Å; L150-C170 HydrophobicContact CD2-CB 3.98Å; C170-Y180 HydrophobicContact CB-CD1 4.12Å; C170-W182 HydrophobicContact CB-CZ2 3.86Å; C170-A198 PolarHBondContact N-O 2.6Å; C170-C216 HydrophobicContact CB-CB 3.7Å; C170-C216 WeakPolarHBondContact CB-SG 3.24Å; C170-C216 WeakPolarHBondContact SG-CB 3.26Å; C170-C216 CovalentContact SG-SG 2.03Å; C170-C216 PolarHBondContact SG-SG 3.1Å
171	S	89.1	Confident	84.2	Confident	32 Å²	32	61 Å²	61	22%	0.224	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	143.7	175.4	-65.8	0	0	0	0	108.7	V149	V149-S171 PolarHBondContact N-O 3.06Å; V149-S171 PolarHBondContact O-N 2.89Å
172	V	86.6	Confident	85.1	Confident	20 Å²	20	58.9 Å²	58.9	12%	0.121	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	145.7	167.5	177.9	0	0	0	0	108.9	P146 I148 D174 Y178 Y180 V218	P146-V172 HydrophobicContact CB-CG1 3.67Å; I148-V172 HydrophobicContact CG1-CG2 4.34Å; V172-D174 HydrophobicContact CG1-CB 3.73Å; V172-D174 WeakPolarHBondContact CG1-OD1 3.37Å; V172-Y178 HydrophobicContact CB-CD2 3.94Å; V172-Y178 HydrophobicContact CB-CE2 4.04Å; V172-Y178 HydrophobicContact CB-CG 4.49Å; V172-Y178 HydrophobicContact CG1-CD2 3.92Å; V172-Y178 HydrophobicContact CG1-CE2 3.48Å; V172-Y178 VanDerWaalsContact CG1-CE2 3.48Å; V172-Y178 HydrophobicContact CG2-CD1 4.42Å; V172-Y178 HydrophobicContact CG2-CD2 4.08Å; V172-Y178 HydrophobicContact CG2-CE2 4.39Å; V172-Y178 HydrophobicContact CG2-CG 4.13Å; V172-Y180 HydrophobicContact CG2-CE1 4.23Å; V172-V218 HydrophobicContact CG2-CB 4.33Å; V172-V218 HydrophobicContact CG2-CG1 4.11Å; V172-V218 HydrophobicContact CG2-CG2 4.03Å
173	L	76.2	Confident	85.7	Confident	56 Å²	56	53.9 Å²	53.9	29%	0.293	28%	0.282	S	S	.	.			trans	-86.1	-26.8	178.1	-60	-178.6	0	0	0	113.5	T147 V149	T147-L173 HydrophobicContact CG2-CD1 3.52Å; T147-L173 HydrophobicContact CG2-CG 4.17Å; T147-L173 PolarHBondContact O-N 2.89Å; T147-L173 VanDerWaalsContact O-N 3.1Å; V149-L173 HydrophobicContact CG2-CD1 4.1Å; V149-L173 HydrophobicContact CG2-CD2 4.03Å; V149-L173 HydrophobicContact CG2-CG 3.94Å
174	D	74.3	Confident	86.5	Confident	40 Å²	40	51.8 Å²	51.8	21%	0.214	26%	0.259	C	S	.	.	S	Bend	trans	-61	151.7	177.9	-53.3	41.4	0	0	0	112.9	P146 T147 V172 N176 Y178	P146-D174 WeakPolarHBondContact CA-OD1 3.34Å; P146-D174 WeakPolarHBondContact CA-OD2 3.42Å; P146-D174 WeakPolarHBondContact CB-OD2 3.43Å; T147-D174 PolarHBondContact N-OD1 2.83Å; V172-D174 HydrophobicContact CG1-CB 3.73Å; V172-D174 WeakPolarHBondContact CG1-OD1 3.37Å; D174-N176 VanDerWaalsContact C-N 3.31Å; D174-N176 PolarHBondContact O-N 2.85Å; D174-Y178 HydrophobicContact CB-CE2 4.06Å; D174-Y178 PolarHBondContact OD2-OH 2.57Å
175	S	68.5	Low	87	Confident	115 Å²	115	51.4 Å²	51.4	80%	0.804	25%	0.253	S	S	*	.	S	Bend	trans	-80	-3.6	-179	55.8	0	0	0	0	115.4
176	N	72.9	Confident	87	Confident	83 Å²	83	47.8 Å²	47.8	44%	0.444	24%	0.236	S	C	.	.	S	Bend	trans	-72.1	161.6	177.6	-71.4	-36.3	0	0	0	112.1	D174 Y178 R220	D174-N176 VanDerWaalsContact C-N 3.31Å; D174-N176 PolarHBondContact O-N 2.85Å; N176-Y178 HydrophobicContact CB-CD2 4.45Å; N176-Y178 HydrophobicContact CB-CE2 3.61Å; N176-Y178 VanDerWaalsContact O-CD2 3.22Å; N176-Y178 WeakPolarHBondContact O-CD2 3.47Å; N176-Y178 WeakPolarHBondContact O-CE2 3.5Å; N176-R220 HydrophobicContact CB-CG 4.31Å
177	Q	81.8	Confident	86.5	Confident	153 Å²	153	53.5 Å²	53.5	72%	0.715	27%	0.273	S	S	*	.			trans	-87.5	134.3	173.6	-61	-171.9	7.8	0	0	110.6	L221	Q177-L221 HydrophobicContact CB-CB 4.32Å; Q177-L221 HydrophobicContact CB-CD1 3.98Å; Q177-L221 HydrophobicContact CB-CG 4.39Å; Q177-L221 PolarHBondContact O-N 3.29Å
178	Y	87.8	Confident	86.2	Confident	19 Å²	19	55.4 Å²	55.4	8%	0.075	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	143.6	-178.9	-63.2	-89.9	0	0	0	111	P146 V172 D174 N176 Y180 V218 T219 R220	P146-Y178 HydrophobicContact CB-CE1 4.16Å; P146-Y178 WeakPolarHBondContact CB-OH 3.48Å; P146-Y178 HydrophobicContact CG-CE1 4.02Å; V172-Y178 HydrophobicContact CB-CD2 3.94Å; V172-Y178 HydrophobicContact CB-CE2 4.04Å; V172-Y178 HydrophobicContact CB-CG 4.49Å; V172-Y178 HydrophobicContact CG1-CD2 3.92Å; V172-Y178 HydrophobicContact CG1-CE2 3.48Å; V172-Y178 VanDerWaalsContact CG1-CE2 3.48Å; V172-Y178 HydrophobicContact CG2-CD1 4.42Å; V172-Y178 HydrophobicContact CG2-CD2 4.08Å; V172-Y178 HydrophobicContact CG2-CE2 4.39Å; V172-Y178 HydrophobicContact CG2-CG 4.13Å; D174-Y178 HydrophobicContact CB-CE2 4.06Å; D174-Y178 PolarHBondContact OD2-OH 2.57Å; N176-Y178 HydrophobicContact CB-CD2 4.45Å; N176-Y178 HydrophobicContact CB-CE2 3.61Å; N176-Y178 VanDerWaalsContact O-CD2 3.22Å; N176-Y178 WeakPolarHBondContact O-CD2 3.47Å; N176-Y178 WeakPolarHBondContact O-CE2 3.5Å; Y178-Y180 VanDerWaalsContact O-CE2 3.29Å; Y178-Y180 WeakPolarHBondContact O-CE2 3.29Å; Y178-V218 HydrophobicContact CD1-CB 4.38Å; Y178-V218 HydrophobicContact CD1-CG2 4.27Å; Y178-T219 CarbonylContact C-O 3.51Å; Y178-T219 VanDerWaalsContact CA-O 3.22Å; Y178-T219 WeakPolarHBondContact CA-O 3.5Å; Y178-R220 HydrophobicContact CD1-CB 3.84Å; Y178-R220 HydrophobicContact CD1-CG 4.12Å; Y178-R220 HydrophobicContact CE1-CB 3.51Å; Y178-R220 HydrophobicContact CE1-CG 3.51Å; Y178-R220 WeakPolarHBondContact OH-CD 3.36Å
179	S	91.8	Very high	85.6	Confident	49 Å²	49	57.4 Å²	57.4	34%	0.343	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	164.2	156.1	74	0	0	0	0	109.8	V218 T219	S179-V218 VanDerWaalsContact O-CA 3.3Å; S179-V218 WeakPolarHBondContact O-CA 3.35Å; S179-T219 PolarHBondContact N-O 3.23Å; S179-T219 PolarHBondContact O-N 2.71Å; S179-T219 VanDerWaalsContact OG-CB 3.23Å; S179-T219 WeakPolarHBondContact OG-CB 3.41Å; S179-T219 PolarHBondContact OG-OG1 2.68Å
180	Y	94.1	Very high	85.4	Confident	64 Å²	64	56.6 Å²	56.6	25%	0.251	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	138.3	-176.3	-60.9	-102.3	0	0	0	110.1	C170 V172 Y178 S196 A198 V218	C170-Y180 HydrophobicContact CB-CD1 4.12Å; V172-Y180 HydrophobicContact CG2-CE1 4.23Å; Y178-Y180 VanDerWaalsContact O-CE2 3.29Å; Y178-Y180 WeakPolarHBondContact O-CE2 3.29Å; Y180-S196 CarbonylContact O-C 3.58Å; Y180-A198 HydrophobicContact CD1-CB 3.92Å; Y180-A198 HydrophobicContact CD2-CB 4.24Å; Y180-A198 HydrophobicContact CE1-CB 4.48Å; Y180-A198 HydrophobicContact CG-CB 3.79Å; Y180-V218 HydrophobicContact CD1-CG1 3.54Å; Y180-V218 HydrophobicContact CE1-CG1 3.84Å; Y180-V218 HydrophobicContact CG-CG1 4.3Å
181	R	94.6	Very high	85.2	Confident	76 Å²	76	60.2 Å²	60.2	29%	0.287	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	163.2	164	59.8	176.3	178.3	160.2	2.8	111.5	I183 E193 S195 E217	R181-I183 HydrophobicContact CG-CG2 4.19Å; R181-E193 VanDerWaalsContact CD-OE2 3.31Å; R181-E193 WeakPolarHBondContact CD-OE2 3.29Å; R181-E193 IonicContact NH1-OE2 2.78Å; R181-S195 CarbonylContact C-O 3.52Å; R181-S195 WeakPolarHBondContact CA-O 3.25Å; R181-S195 WeakPolarHBondContact CB-O 3.24Å; R181-E217 HydrophobicContact CG-CB 4.12Å; R181-E217 IonicContact CZ-OE1 3.4Å; R181-E217 IonicContact CZ-OE2 3.65Å; R181-E217 PolarHBondContact N-O 3.34Å; R181-E217 IonicContact NE-OE1 3.9Å; R181-E217 PolarHBondContact NE-OE1 2.93Å; R181-E217 IonicContact NE-OE2 3.23Å; R181-E217 IonicContact NH2-OE1 3.23Å; R181-E217 PolarHBondContact NH2-OE1 3.07Å; R181-E217 IonicContact NH2-OE2 3.71Å; R181-E217 PolarHBondContact NH2-OE2 3.39Å; R181-E217 PolarHBondContact O-N 3.06Å
182	W	96	Very high	85.2	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	127.3	175.8	-73.1	90.6	0	0	0	110.2	L150 C170 I194 S195 D197 A198 L200 I214 R215 C216 L231	L150-W182 HydrophobicContact CD1-CH2 4.23Å; L150-W182 HydrophobicContact CD2-CH2 3.8Å; L150-W182 HydrophobicContact CD2-CZ2 4.25Å; L150-W182 HydrophobicContact CG-CH2 4.45Å; C170-W182 HydrophobicContact CB-CZ2 3.86Å; W182-I194 HydrophobicContact CB-CB 4.33Å; W182-I194 PolarHBondContact O-N 2.85Å; W182-S195 PolarHBondContact N-O 2.72Å; W182-S195 PolarHBondContact O-N 3.33Å; W182-D197 VanDerWaalsContact CD1-O 3.26Å; W182-A198 PolarHBondContact NE1-O 3.16Å; W182-A198 VanDerWaalsContact NE1-O 3.1Å; W182-L200 HydrophobicContact CB-CD1 4.12Å; W182-L200 HydrophobicContact CD2-CB 3.8Å; W182-L200 HydrophobicContact CD2-CD1 4.24Å; W182-L200 HydrophobicContact CD2-CG 4.45Å; W182-L200 HydrophobicContact CE3-CB 4.24Å; W182-L200 HydrophobicContact CE3-CD1 4.36Å; W182-L200 HydrophobicContact CE3-CD2 4.27Å; W182-L200 HydrophobicContact CG-CB 4.12Å; W182-L200 HydrophobicContact CG-CD1 4.16Å; W182-L200 HydrophobicContact CH2-CB 4.35Å; W182-L200 HydrophobicContact CZ2-CB 3.96Å; W182-L200 HydrophobicContact CZ3-CD2 4.24Å; W182-I214 HydrophobicContact CE3-CG2 3.63Å; W182-I214 HydrophobicContact CZ3-CG2 3.96Å; W182-R215 CarbonylContact C-O 3.59Å; W182-R215 WeakPolarHBondContact CA-O 3.5Å; W182-C216 HydrophobicContact CD2-CB 4.26Å; W182-C216 HydrophobicContact CE3-CB 4.13Å; W182-C216 HydrophobicContact CH2-CB 4.19Å; W182-C216 HydrophobicContact CZ2-CB 4.27Å; W182-C216 HydrophobicContact CZ3-CB 4.08Å; W182-L231 HydrophobicContact CH2-CB 4.36Å; W182-L231 HydrophobicContact CH2-CD2 4.19Å; W182-L231 HydrophobicContact CZ3-CB 3.89Å; W182-L231 HydrophobicContact CZ3-CD2 4.05Å
183	I	94.2	Very high	85.5	Confident	0 Å²	0	67 Å²	67	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	156.4	-173.2	63.5	168.9	0	0	0	113.2	R181 I191 K192 R215 E217	R181-I183 HydrophobicContact CG-CG2 4.19Å; I183-I191 HydrophobicContact CB-CG2 3.83Å; I183-I191 HydrophobicContact CD1-CG2 4.06Å; I183-I191 HydrophobicContact CG2-CG2 3.77Å; I183-K192 CarbonylContact C-O 3.59Å; I183-K192 WeakPolarHBondContact CA-O 3.37Å; I183-R215 HydrophobicContact CG1-CB 4.14Å; I183-R215 PolarHBondContact N-O 3.33Å; I183-R215 PolarHBondContact O-N 2.83Å; I183-E217 HydrophobicContact CD1-CB 4.26Å; I183-E217 WeakPolarHBondContact CD1-OE2 3.19Å; I183-E217 HydrophobicContact CG1-CB 4.49Å
184	Q	92.7	Very high	86.2	Confident	2 Å²	2	66.5 Å²	66.5	1%	0.009	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	131	158.5	-86.8	172.7	-41.7	0	0	108.2	I191 K192 I194 H209 Y212 I214	Q184-I191 WeakPolarHBondContact O-CA 3.39Å; Q184-K192 HydrophobicContact CB-CB 4.36Å; Q184-K192 PolarHBondContact N-O 2.76Å; Q184-K192 PolarHBondContact O-N 3.35Å; Q184-I194 HydrophobicContact CB-CD1 4.46Å; Q184-I194 HydrophobicContact CG-CD1 3.78Å; Q184-H209 PolarHBondContact NE2-O 2.82Å; Q184-Y212 PolarHBondContact NE2-O 2.83Å; Q184-I214 HydrophobicContact CG-CG1 4.07Å
185	R	89.2	Confident	87	Confident	100 Å²	100	65.9 Å²	65.9	38%	0.377	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	120.5	174.6	-167.6	-172.6	-58.8	-101.9	5.5	109	T190 I191	R185-T190 WeakPolarHBondContact CA-O 3.34Å; R185-I191 HydrophobicContact CG-CG1 4.35Å
186	A	83.2	Confident	88.1	Confident	10 Å²	10	64.8 Å²	64.8	8%	0.083	35%	0.348	C	S	.	.			trans	-82.3	162.7	177	0	0	0	0	0	111.5	D188 G189 T190 Y212	A186-D188 WeakPolarHBondContact CB-OD1 3.41Å; A186-D188 PolarHBondContact O-N 2.94Å; A186-D188 VanDerWaalsContact O-N 3.16Å; A186-G189 PolarHBondContact O-N 3.45Å; A186-T190 WeakPolarHBondContact CB-OG1 3.23Å; A186-T190 PolarHBondContact N-O 2.95Å; A186-Y212 HydrophobicContact CB-CD2 3.99Å; A186-Y212 HydrophobicContact CB-CE1 4.22Å; A186-Y212 HydrophobicContact CB-CE2 3.52Å
187	P	78.9	Confident	88.9	Confident	122 Å²	122	64 Å²	64	79%	0.792	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-20.3	-179.9	-27.4	35.3	0	0	0	115.8	Y212	P187-Y212 HydrophobicContact CG-CE1 4.1Å
188	D	84.7	Confident	89.3	Confident	121 Å²	121	57.5 Å²	57.5	65%	0.647	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	1.2	173.4	66.6	-2.6	0	0	0	113.4	A186 T190	A186-D188 WeakPolarHBondContact CB-OD1 3.41Å; A186-D188 PolarHBondContact O-N 2.94Å; A186-D188 VanDerWaalsContact O-N 3.16Å; D188-T190 VanDerWaalsContact C-N 3.35Å; D188-T190 WeakPolarHBondContact OD1-CB 3.37Å; D188-T190 WeakPolarHBondContact OD1-CG2 3.43Å; D188-T190 PolarHBondContact OD1-N 3.15Å; D188-T190 PolarHBondContact OD1-OG1 3.46Å
189	G	78.9	Confident	89.6	Confident	43 Å²	43	63 Å²	63	44%	0.443	34%	0.337	S	S	.	.	S	Bend	trans	85.7	-3.5	-177.2	0	0	0	0	0	114.6	A186	A186-G189 PolarHBondContact O-N 3.45Å
190	T	85.9	Confident	89.6	Confident	83 Å²	83	60.7 Å²	60.7	51%	0.509	32%	0.321	S	S	.	.			trans	-65.9	136.6	178.1	58.7	0	0	0	0	111.3	R185 A186 D188	R185-T190 WeakPolarHBondContact CA-O 3.34Å; A186-T190 WeakPolarHBondContact CB-OG1 3.23Å; A186-T190 PolarHBondContact N-O 2.95Å; D188-T190 VanDerWaalsContact C-N 3.35Å; D188-T190 WeakPolarHBondContact OD1-CB 3.37Å; D188-T190 WeakPolarHBondContact OD1-CG2 3.43Å; D188-T190 PolarHBondContact OD1-N 3.15Å; D188-T190 PolarHBondContact OD1-OG1 3.46Å
191	I	87.8	Confident	89.4	Confident	76 Å²	76	64.6 Å²	64.6	39%	0.39	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	121	-177.4	-55.6	179.9	0	0	0	109	I183 Q184 R185	I183-I191 HydrophobicContact CB-CG2 3.83Å; I183-I191 HydrophobicContact CD1-CG2 4.06Å; I183-I191 HydrophobicContact CG2-CG2 3.77Å; Q184-I191 WeakPolarHBondContact O-CA 3.39Å; R185-I191 HydrophobicContact CG-CG1 4.35Å
192	K	90.1	Very high	89.2	Confident	97 Å²	97	61.6 Å²	61.6	42%	0.422	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	113.5	172.1	173	-170.5	165.8	-155.5	0	108.4	I183 Q184	I183-K192 CarbonylContact C-O 3.59Å; I183-K192 WeakPolarHBondContact CA-O 3.37Å; Q184-K192 HydrophobicContact CB-CB 4.36Å; Q184-K192 PolarHBondContact N-O 2.76Å; Q184-K192 PolarHBondContact O-N 3.35Å
193	E	91.2	Very high	88.7	Confident	98 Å²	98	66.5 Å²	66.5	46%	0.458	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	140	172.5	-162.6	167.4	106.8	0	0	110.7	R181 S196	R181-E193 VanDerWaalsContact CD-OE2 3.31Å; R181-E193 WeakPolarHBondContact CD-OE2 3.29Å; R181-E193 IonicContact NH1-OE2 2.78Å; E193-S196 WeakPolarHBondContact OE1-CB 3.42Å
194	I	91.3	Very high	88.2	Confident	45 Å²	45	71.6 Å²	71.6	23%	0.231	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	-36	-179.4	-52.8	166.3	0	0	0	110.6	W182 Q184 L200 I202 I214	W182-I194 HydrophobicContact CB-CB 4.33Å; W182-I194 PolarHBondContact O-N 2.85Å; Q184-I194 HydrophobicContact CB-CD1 4.46Å; Q184-I194 HydrophobicContact CG-CD1 3.78Å; I194-L200 HydrophobicContact CB-CD1 4.24Å; I194-L200 HydrophobicContact CG2-CD1 3.64Å; I194-I202 HydrophobicContact CG2-CD1 4.13Å; I194-I202 HydrophobicContact CG2-CG1 4.09Å; I194-I214 HydrophobicContact CD1-CB 4.37Å; I194-I214 HydrophobicContact CD1-CD1 4.18Å; I194-I214 HydrophobicContact CD1-CG1 3.86Å; I194-I214 HydrophobicContact CD1-CG2 3.9Å
195	S	92	Very high	87.8	Confident	27 Å²	27	71.6 Å²	71.6	19%	0.189	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	142.1	171.8	-177.1	0	0	0	0	110.1	R181 W182 D197 R199	R181-S195 CarbonylContact C-O 3.52Å; R181-S195 WeakPolarHBondContact CA-O 3.25Å; R181-S195 WeakPolarHBondContact CB-O 3.24Å; W182-S195 PolarHBondContact N-O 2.72Å; W182-S195 PolarHBondContact O-N 3.33Å; S195-D197 VanDerWaalsContact C-N 3.34Å; S195-D197 PolarHBondContact OG-N 2.96Å; S195-D197 PolarHBondContact OG-OD1 2.79Å; S195-D197 VanDerWaalsContact OG-OD1 3.11Å; S195-R199 WeakPolarHBondContact CB-O 3.37Å; S195-R199 PolarHBondContact OG-O 3.07Å
196	S	90.9	Very high	87.5	Confident	93 Å²	93	67.1 Å²	67.1	65%	0.65	37%	0.368	S	S	*	.	S	Bend	trans	-95.3	18.2	178.1	74	0	0	0	0	112.8	Y180 E193	Y180-S196 CarbonylContact O-C 3.58Å; E193-S196 WeakPolarHBondContact OE1-CB 3.42Å
197	D	90.3	Very high	87.4	Confident	66 Å²	66	70.7 Å²	70.7	35%	0.353	39%	0.39	S	S	.	.	S	Bend	trans	-138.7	-176.4	176.3	92.9	-22.7	0	0	0	111.6	W182 S195 R199	W182-D197 VanDerWaalsContact CD1-O 3.26Å; S195-D197 VanDerWaalsContact C-N 3.34Å; S195-D197 PolarHBondContact OG-N 2.96Å; S195-D197 PolarHBondContact OG-OD1 2.79Å; S195-D197 VanDerWaalsContact OG-OD1 3.11Å; D197-R199 PolarHBondContact O-N 2.99Å; D197-R199 VanDerWaalsContact O-N 3.08Å; D197-R199 WeakPolarHBondContact OD1-CA 3.2Å; D197-R199 VanDerWaalsContact OD1-CB 3.29Å; D197-R199 WeakPolarHBondContact OD1-CB 3.24Å; D197-R199 PolarHBondContact OD1-N 3.17Å; D197-R199 IonicContact OD2-NE 2.7Å
198	A	90.8	Very high	87.5	Confident	16 Å²	16	69.2 Å²	69.2	13%	0.132	37%	0.373	C	S	.	.	S	Bend	trans	-65.2	-6.7	-179.9	0	0	0	0	0	114.8	R169 C170 Y180 W182	R169-A198 CarbonylContact C-O 3.51Å; R169-A198 WeakPolarHBondContact CA-O 3.13Å; C170-A198 PolarHBondContact N-O 2.6Å; Y180-A198 HydrophobicContact CD1-CB 3.92Å; Y180-A198 HydrophobicContact CD2-CB 4.24Å; Y180-A198 HydrophobicContact CE1-CB 4.48Å; Y180-A198 HydrophobicContact CG-CB 3.79Å; W182-A198 PolarHBondContact NE1-O 3.16Å; W182-A198 VanDerWaalsContact NE1-O 3.1Å
199	R	92.4	Very high	87.5	Confident	135 Å²	135	64.9 Å²	64.9	51%	0.509	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	125.6	-169.7	-53	170.3	-175.9	-177.1	2.4	110.9	S195 D197	S195-R199 WeakPolarHBondContact CB-O 3.37Å; S195-R199 PolarHBondContact OG-O 3.07Å; D197-R199 PolarHBondContact O-N 2.99Å; D197-R199 VanDerWaalsContact O-N 3.08Å; D197-R199 WeakPolarHBondContact OD1-CA 3.2Å; D197-R199 VanDerWaalsContact OD1-CB 3.29Å; D197-R199 WeakPolarHBondContact OD1-CB 3.24Å; D197-R199 PolarHBondContact OD1-N 3.17Å; D197-R199 IonicContact OD2-NE 2.7Å
200	L	92.6	Very high	87.6	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	126.1	164.9	-174.8	68.4	0	0	0	108	L166 Y167 S168 W182 I194 I202 I214 L231	L166-L200 HydrophobicContact CD1-CD2 4.28Å; L166-L200 HydrophobicContact CD2-CD2 4.01Å; L166-L200 HydrophobicContact CG-CD2 3.94Å; Y167-L200 WeakPolarHBondContact CA-O 3.39Å; Y167-L200 VanDerWaalsContact CD2-O 3.26Å; Y167-L200 WeakPolarHBondContact CD2-O 3.37Å; S168-L200 PolarHBondContact N-O 3.23Å; S168-L200 PolarHBondContact O-N 3.29Å; W182-L200 HydrophobicContact CB-CD1 4.12Å; W182-L200 HydrophobicContact CD2-CB 3.8Å; W182-L200 HydrophobicContact CD2-CD1 4.24Å; W182-L200 HydrophobicContact CD2-CG 4.45Å; W182-L200 HydrophobicContact CE3-CB 4.24Å; W182-L200 HydrophobicContact CE3-CD1 4.36Å; W182-L200 HydrophobicContact CE3-CD2 4.27Å; W182-L200 HydrophobicContact CG-CB 4.12Å; W182-L200 HydrophobicContact CG-CD1 4.16Å; W182-L200 HydrophobicContact CH2-CB 4.35Å; W182-L200 HydrophobicContact CZ2-CB 3.96Å; W182-L200 HydrophobicContact CZ3-CD2 4.24Å; I194-L200 HydrophobicContact CB-CD1 4.24Å; I194-L200 HydrophobicContact CG2-CD1 3.64Å; L200-I202 HydrophobicContact CD1-CD1 3.81Å; L200-I202 HydrophobicContact CD1-CG1 4.26Å; L200-I202 HydrophobicContact CD2-CD1 4.35Å; L200-I202 HydrophobicContact CG-CD1 4.12Å; L200-I214 HydrophobicContact CD1-CG2 4.15Å; L200-I214 HydrophobicContact CD2-CD1 4.4Å; L200-I214 HydrophobicContact CD2-CG2 3.89Å; L200-L231 HydrophobicContact CD2-CD2 3.4Å
201	Y	90.4	Very high	87.4	Confident	146 Å²	146	68.2 Å²	68.2	57%	0.573	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.7	85.1	-179.7	-163.5	-92.1	0	0	0	110.9	L165 Y167 T203	L165-Y201 HydrophobicContact CD1-CD1 4.11Å; L165-Y201 HydrophobicContact CD1-CD2 3.96Å; L165-Y201 HydrophobicContact CD1-CE1 3.82Å; L165-Y201 HydrophobicContact CD1-CE2 3.65Å; L165-Y201 HydrophobicContact CD1-CG 4.17Å; L165-Y201 HydrophobicContact CD2-CE2 3.82Å; L165-Y201 HydrophobicContact CG-CE2 4.3Å; Y167-Y201 AromaticContact CD2-CD2 3.93Å; Y167-Y201 HydrophobicContact CD2-CD2 3.93Å; Y201-T203 HydrophobicContact CD1-CG2 3.89Å; Y201-T203 HydrophobicContact CE1-CG2 3.52Å
202	I	89.8	Confident	87.3	Confident	13 Å²	13	68 Å²	68	7%	0.067	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	105.3	179.2	-66	154.6	0	0	0	108	L165 L166 I194 L200 N204 F205 H209 I214	L165-I202 WeakPolarHBondContact CA-O 3.37Å; L166-I202 HydrophobicContact CB-CB 4.22Å; L166-I202 HydrophobicContact CD2-CD1 3.85Å; L166-I202 HydrophobicContact CG-CD1 4.27Å; L166-I202 PolarHBondContact N-O 2.79Å; L166-I202 PolarHBondContact O-N 2.82Å; I194-I202 HydrophobicContact CG2-CD1 4.13Å; I194-I202 HydrophobicContact CG2-CG1 4.09Å; L200-I202 HydrophobicContact CD1-CD1 3.81Å; L200-I202 HydrophobicContact CD1-CG1 4.26Å; L200-I202 HydrophobicContact CD2-CD1 4.35Å; L200-I202 HydrophobicContact CG-CD1 4.12Å; I202-N204 VanDerWaalsContact C-N 3.26Å; I202-N204 PolarHBondContact O-N 2.99Å; I202-F205 HydrophobicContact CG2-CB 4.44Å; I202-H209 VanDerWaalsContact CD1-CD2 3.46Å; I202-H209 WeakPolarHBondContact CD1-CD2 3.49Å; I202-H209 WeakPolarHBondContact CG2-NE2 3.49Å; I202-I214 HydrophobicContact CD1-CD1 3.97Å
203	T	84.7	Confident	87.3	Confident	104 Å²	104	66.7 Å²	66.7	64%	0.638	35%	0.345	S	S	*	.	S	Bend	trans	-69.6	-16.1	-172.4	46.4	0	0	0	0	115.5	Y201	Y201-T203 HydrophobicContact CD1-CG2 3.89Å; Y201-T203 HydrophobicContact CE1-CG2 3.52Å
204	N	83.8	Confident	87.3	Confident	106 Å²	106	62.2 Å²	62.2	57%	0.567	32%	0.324	S	S	*	.	S	Bend	trans	-148.6	86.6	-179.2	178.8	61.4	0	0	0	108	I202	I202-N204 VanDerWaalsContact C-N 3.26Å; I202-N204 PolarHBondContact O-N 2.99Å
205	F	85.8	Confident	87.5	Confident	2 Å²	2	63.1 Å²	63.1	1%	0.009	33%	0.325	C	S	.	.			trans	-68.7	133.6	-177.3	-176.4	-106.2	0	0	0	111.4	V160 F162 G163 E164 L166 I202 H209 L210 L233	V160-F205 HydrophobicContact CB-CD1 4.21Å; V160-F205 HydrophobicContact CB-CE1 4.11Å; V160-F205 HydrophobicContact CG2-CD1 4.19Å; V160-F205 HydrophobicContact CG2-CE1 3.57Å; V160-F205 HydrophobicContact CG2-CZ 3.97Å; F162-F205 CarbonylContact C-O 3.29Å; F162-F205 WeakPolarHBondContact CA-O 3.42Å; F162-F205 HydrophobicContact CD1-CD1 4.03Å; F162-F205 HydrophobicContact CD1-CE1 4.19Å; F162-F205 HydrophobicContact CE1-CD1 4.45Å; F162-F205 HydrophobicContact CE1-CE1 4.17Å; G163-F205 PolarHBondContact N-O 3.33Å; E164-F205 VanDerWaalsContact O-CB 3.31Å; E164-F205 WeakPolarHBondContact O-CB 3.19Å; E164-F205 PolarHBondContact O-N 3.32Å; L166-F205 HydrophobicContact CB-CB 4.21Å; L166-F205 HydrophobicContact CB-CD2 3.86Å; L166-F205 HydrophobicContact CB-CG 4.24Å; L166-F205 HydrophobicContact CD2-CD2 3.52Å; L166-F205 HydrophobicContact CD2-CE2 3.46Å; L166-F205 VanDerWaalsContact CD2-CE2 3.46Å; L166-F205 HydrophobicContact CD2-CZ 4.46Å; L166-F205 HydrophobicContact CG-CD2 4.34Å; I202-F205 HydrophobicContact CG2-CB 4.44Å; F205-H209 HydrophobicContact CD2-CB 3.72Å; F205-H209 HydrophobicContact CE2-CB 3.46Å; F205-H209 VanDerWaalsContact CE2-CB 3.46Å; F205-H209 HydrophobicContact CZ-CB 4.34Å; F205-L210 HydrophobicContact CE1-CD1 4.29Å; F205-L210 HydrophobicContact CE1-CD2 4.49Å; F205-L210 HydrophobicContact CE1-CG 4.23Å; F205-L210 HydrophobicContact CZ-CD1 4.24Å; F205-L210 HydrophobicContact CZ-CD2 3.76Å; F205-L210 HydrophobicContact CZ-CG 3.7Å; F205-L233 HydrophobicContact CE2-CD1 3.81Å; F205-L233 HydrophobicContact CZ-CD1 3.79Å
206	G	82.9	Confident	87.6	Confident	6 Å²	6	61.8 Å²	61.8	6%	0.062	32%	0.316	C	S	.	.			trans	-147.3	170.8	-173.4	0	0	0	0	0	113.1	E208 H209	G206-E208 WeakPolarHBondContact CA-OE1 3.38Å; G206-E208 PolarHBondContact N-OE1 2.99Å; G206-E208 PolarHBondContact O-N 3Å; G206-E208 VanDerWaalsContact O-N 3.16Å; G206-H209 WeakPolarHBondContact O-CB 3.22Å; G206-H209 PolarHBondContact O-N 3.04Å
207	P	79.7	Confident	87.8	Confident	85 Å²	85	58 Å²	58	55%	0.552	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-56.3	-32.4	-174.1	-26.5	35.7	0	0	0	114.5	F162 H209 L210 Q211	F162-P207 HydrophobicContact CD1-CG 4.44Å; F162-P207 HydrophobicContact CE1-CB 4.43Å; F162-P207 HydrophobicContact CE1-CG 3.93Å; F162-P207 HydrophobicContact CZ-CG 4.03Å; P207-H209 PolarHBondContact O-N 3.27Å; P207-L210 PolarHBondContact O-N 3.17Å; P207-Q211 PolarHBondContact O-N 3.46Å
208	E	82	Confident	87.9	Confident	91 Å²	91	54.9 Å²	54.9	43%	0.425	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-62.6	-18.1	174.5	68.7	-63	143.5	0	0	114.3	G206	G206-E208 WeakPolarHBondContact CA-OE1 3.38Å; G206-E208 PolarHBondContact N-OE1 2.99Å; G206-E208 PolarHBondContact O-N 3Å; G206-E208 VanDerWaalsContact O-N 3.16Å
209	H	84.6	Confident	87.9	Confident	31 Å²	31	55.1 Å²	55.1	14%	0.144	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-85.4	-14.8	172.1	-64.3	92.7	0	0	0	113.1	Q184 I202 F205 G206 P207	Q184-H209 PolarHBondContact NE2-O 2.82Å; I202-H209 VanDerWaalsContact CD1-CD2 3.46Å; I202-H209 WeakPolarHBondContact CD1-CD2 3.49Å; I202-H209 WeakPolarHBondContact CG2-NE2 3.49Å; F205-H209 HydrophobicContact CD2-CB 3.72Å; F205-H209 HydrophobicContact CE2-CB 3.46Å; F205-H209 VanDerWaalsContact CE2-CB 3.46Å; F205-H209 HydrophobicContact CZ-CB 4.34Å; G206-H209 WeakPolarHBondContact O-CB 3.22Å; G206-H209 PolarHBondContact O-N 3.04Å; P207-H209 PolarHBondContact O-N 3.27Å
210	L	81.9	Confident	87.8	Confident	71 Å²	71	49 Å²	49	37%	0.372	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-8.9	173.9	-70.8	172.1	0	0	0	113.4	F162 F205 P207 Y212 L233 L235	F162-L210 HydrophobicContact CE1-CD1 3.82Å; F162-L210 HydrophobicContact CZ-CD1 3.88Å; F205-L210 HydrophobicContact CE1-CD1 4.29Å; F205-L210 HydrophobicContact CE1-CD2 4.49Å; F205-L210 HydrophobicContact CE1-CG 4.23Å; F205-L210 HydrophobicContact CZ-CD1 4.24Å; F205-L210 HydrophobicContact CZ-CD2 3.76Å; F205-L210 HydrophobicContact CZ-CG 3.7Å; P207-L210 PolarHBondContact O-N 3.17Å; L210-Y212 VanDerWaalsContact C-N 3.26Å; L210-Y212 PolarHBondContact O-N 3.1Å; L210-L233 HydrophobicContact CD2-CB 4.45Å; L210-L233 HydrophobicContact CD2-CD1 4.23Å; L210-L235 HydrophobicContact CD1-CD1 3.75Å; L210-L235 HydrophobicContact CD1-CD2 4.42Å; L210-L235 HydrophobicContact CD1-CG 4.1Å
211	Q	80.6	Confident	87.5	Confident	125 Å²	125	53.6 Å²	53.6	58%	0.584	27%	0.272	S	S	*	.	S	Bend	trans	-56.6	-38.3	-176.6	-171.9	179.7	7.2	0	0	113.2	P207	P207-Q211 PolarHBondContact O-N 3.46Å
212	Y	86.5	Confident	87.1	Confident	70 Å²	70	50.6 Å²	50.6	28%	0.275	27%	0.272	S	S	.	.	S	Bend	trans	-137.2	149.1	175.4	-53.2	-55.2	0	0	0	110	Q184 A186 P187 L210 I214	Q184-Y212 PolarHBondContact NE2-O 2.83Å; A186-Y212 HydrophobicContact CB-CD2 3.99Å; A186-Y212 HydrophobicContact CB-CE1 4.22Å; A186-Y212 HydrophobicContact CB-CE2 3.52Å; P187-Y212 HydrophobicContact CG-CE1 4.1Å; L210-Y212 VanDerWaalsContact C-N 3.26Å; L210-Y212 PolarHBondContact O-N 3.1Å; Y212-I214 PolarHBondContact O-N 3.45Å
213	P	88.8	Confident	86.9	Confident	71 Å²	71	53.5 Å²	53.5	46%	0.461	29%	0.288	S	S	.	.			trans	-58.1	130.1	178.9	-23.7	33.6	0	0	0	112.1	V230	P213-V230 HydrophobicContact CB-CG1 3.86Å
214	I	92.5	Very high	86.9	Confident	3 Å²	3	54.5 Å²	54.5	2%	0.015	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	129.3	173.1	-62.1	179.3	0	0	0	108.2	L166 W182 Q184 I194 L200 I202 Y212 L231 L233	L166-I214 HydrophobicContact CD2-CD1 4.06Å; W182-I214 HydrophobicContact CE3-CG2 3.63Å; W182-I214 HydrophobicContact CZ3-CG2 3.96Å; Q184-I214 HydrophobicContact CG-CG1 4.07Å; I194-I214 HydrophobicContact CD1-CB 4.37Å; I194-I214 HydrophobicContact CD1-CD1 4.18Å; I194-I214 HydrophobicContact CD1-CG1 3.86Å; I194-I214 HydrophobicContact CD1-CG2 3.9Å; L200-I214 HydrophobicContact CD1-CG2 4.15Å; L200-I214 HydrophobicContact CD2-CD1 4.4Å; L200-I214 HydrophobicContact CD2-CG2 3.89Å; I202-I214 HydrophobicContact CD1-CD1 3.97Å; Y212-I214 PolarHBondContact O-N 3.45Å; I214-L231 PolarHBondContact O-N 2.83Å; I214-L233 HydrophobicContact CD1-CD1 4.33Å
215	R	94.1	Very high	87	Confident	64 Å²	64	53.8 Å²	53.8	24%	0.242	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	140.7	-179	-52.1	-170.3	173.6	-161.1	-10.9	110.6	W182 I183 E228 K229 V230	W182-R215 CarbonylContact C-O 3.59Å; W182-R215 WeakPolarHBondContact CA-O 3.5Å; I183-R215 HydrophobicContact CG1-CB 4.14Å; I183-R215 PolarHBondContact N-O 3.33Å; I183-R215 PolarHBondContact O-N 2.83Å; R215-E228 WeakPolarHBondContact CD-OE2 3.3Å; R215-E228 IonicContact CZ-OE1 2.99Å; R215-E228 IonicContact CZ-OE2 2.86Å; R215-E228 IonicContact NE-OE2 3.14Å; R215-E228 IonicContact NH1-OE1 3.17Å; R215-E228 PolarHBondContact NH1-OE1 2.85Å; R215-E228 IonicContact NH1-OE2 3.08Å; R215-E228 PolarHBondContact NH1-OE2 2.82Å; R215-K229 CarbonylContact C-O 3.51Å; R215-K229 WeakPolarHBondContact CA-O 3.33Å; R215-V230 HydrophobicContact CG-CG2 4.19Å
216	C	95	Very high	87.1	Confident	0 Å²	0	58 Å²	58	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	133.2	155.6	176.8	0	0	0	0	108	L150 C170 W182 V218 E228 K229	L150-C216 HydrophobicContact CD2-CB 3.86Å; C170-C216 HydrophobicContact CB-CB 3.7Å; C170-C216 WeakPolarHBondContact CB-SG 3.24Å; C170-C216 WeakPolarHBondContact SG-CB 3.26Å; C170-C216 CovalentContact SG-SG 2.03Å; C170-C216 PolarHBondContact SG-SG 3.1Å; W182-C216 HydrophobicContact CD2-CB 4.26Å; W182-C216 HydrophobicContact CE3-CB 4.13Å; W182-C216 HydrophobicContact CH2-CB 4.19Å; W182-C216 HydrophobicContact CZ2-CB 4.27Å; W182-C216 HydrophobicContact CZ3-CB 4.08Å; C216-V218 VanDerWaalsContact SG-CG1 3.59Å; C216-E228 CarbonylContact O-C 3.29Å; C216-E228 VanDerWaalsContact O-CA 3.23Å; C216-E228 WeakPolarHBondContact O-CA 3.27Å; C216-K229 PolarHBondContact N-O 2.83Å; C216-K229 PolarHBondContact O-N 2.92Å
217	E	94.5	Very high	87.5	Confident	13 Å²	13	59 Å²	59	6%	0.061	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	130.7	167.1	-165.5	-161.8	91.3	0	0	107.4	R181 I183 F227	R181-E217 HydrophobicContact CG-CB 4.12Å; R181-E217 IonicContact CZ-OE1 3.4Å; R181-E217 IonicContact CZ-OE2 3.65Å; R181-E217 PolarHBondContact N-O 3.34Å; R181-E217 IonicContact NE-OE1 3.9Å; R181-E217 PolarHBondContact NE-OE1 2.93Å; R181-E217 IonicContact NE-OE2 3.23Å; R181-E217 IonicContact NH2-OE1 3.23Å; R181-E217 PolarHBondContact NH2-OE1 3.07Å; R181-E217 IonicContact NH2-OE2 3.71Å; R181-E217 PolarHBondContact NH2-OE2 3.39Å; R181-E217 PolarHBondContact O-N 3.06Å; I183-E217 HydrophobicContact CD1-CB 4.26Å; I183-E217 WeakPolarHBondContact CD1-OE2 3.19Å; I183-E217 HydrophobicContact CG1-CB 4.49Å; E217-F227 WeakPolarHBondContact CA-O 3.46Å
218	V	92.9	Very high	88.1	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	135	175.6	-57.5	0	0	0	0	109.8	I148 V172 Y178 S179 Y180 C216 T226 F227	I148-V218 HydrophobicContact CD1-CG2 3.72Å; I148-V218 HydrophobicContact CG1-CG2 4Å; V172-V218 HydrophobicContact CG2-CB 4.33Å; V172-V218 HydrophobicContact CG2-CG1 4.11Å; V172-V218 HydrophobicContact CG2-CG2 4.03Å; Y178-V218 HydrophobicContact CD1-CB 4.38Å; Y178-V218 HydrophobicContact CD1-CG2 4.27Å; S179-V218 VanDerWaalsContact O-CA 3.3Å; S179-V218 WeakPolarHBondContact O-CA 3.35Å; Y180-V218 HydrophobicContact CD1-CG1 3.54Å; Y180-V218 HydrophobicContact CE1-CG1 3.84Å; Y180-V218 HydrophobicContact CG-CG1 4.3Å; C216-V218 VanDerWaalsContact SG-CG1 3.59Å; V218-T226 WeakPolarHBondContact O-CA 3.45Å; V218-F227 HydrophobicContact CG2-CB 3.97Å; V218-F227 PolarHBondContact N-O 3.03Å; V218-F227 PolarHBondContact O-N 3.25Å
219	T	91.4	Very high	88.5	Confident	22 Å²	22	57.5 Å²	57.5	14%	0.135	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	127.6	177.2	-39.7	0	0	0	0	109.5	Y178 S179 D224 E225 T226	Y178-T219 CarbonylContact C-O 3.51Å; Y178-T219 VanDerWaalsContact CA-O 3.22Å; Y178-T219 WeakPolarHBondContact CA-O 3.5Å; S179-T219 PolarHBondContact N-O 3.23Å; S179-T219 PolarHBondContact O-N 2.71Å; S179-T219 VanDerWaalsContact OG-CB 3.23Å; S179-T219 WeakPolarHBondContact OG-CB 3.41Å; S179-T219 PolarHBondContact OG-OG1 2.68Å; T219-D224 HydrophobicContact CG2-CB 4.38Å; T219-D224 WeakPolarHBondContact CG2-O 3.4Å; T219-E225 CarbonylContact C-O 3.57Å; T219-E225 WeakPolarHBondContact CA-O 3.32Å; T219-T226 HydrophobicContact CG2-CG2 3.85Å
220	R	89.6	Confident	88.8	Confident	6 Å²	6	58.5 Å²	58.5	2%	0.023	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	120.2	-179.2	-165.9	167.9	67.1	-147.7	1	110.3	N176 Y178 S222 D223 D224 E225 F227	N176-R220 HydrophobicContact CB-CG 4.31Å; Y178-R220 HydrophobicContact CD1-CB 3.84Å; Y178-R220 HydrophobicContact CD1-CG 4.12Å; Y178-R220 HydrophobicContact CE1-CB 3.51Å; Y178-R220 HydrophobicContact CE1-CG 3.51Å; Y178-R220 WeakPolarHBondContact OH-CD 3.36Å; R220-S222 PolarHBondContact O-N 2.89Å; R220-D223 WeakPolarHBondContact CB-OD1 3.3Å; R220-D223 IonicContact CZ-OD1 2.8Å; R220-D223 IonicContact CZ-OD2 2.72Å; R220-D223 VanDerWaalsContact CZ-OD2 3.31Å; R220-D223 IonicContact NE-OD1 2.69Å; R220-D223 PolarHBondContact NE-OD1 3.31Å; R220-D223 IonicContact NE-OD2 3.65Å; R220-D223 PolarHBondContact NE-OD2 3.46Å; R220-D223 VanDerWaalsContact NH2-CG 3.3Å; R220-D223 IonicContact NH2-OD1 3.3Å; R220-D223 PolarHBondContact NH2-OD1 3.33Å; R220-D223 IonicContact NH2-OD2 3.6Å; R220-D223 PolarHBondContact NH2-OD2 2.66Å; R220-D223 PolarHBondContact O-N 2.99Å; R220-D224 WeakPolarHBondContact O-CA 3.32Å; R220-D224 PolarHBondContact O-N 2.77Å; R220-E225 IonicContact CZ-OE2 3.46Å; R220-E225 PolarHBondContact N-O 3.1Å; R220-E225 IonicContact NH1-OE2 2.76Å; R220-E225 IonicContact NH2-OE2 3.42Å; R220-E225 PolarHBondContact NH2-OE2 3.48Å; R220-F227 HydrophobicContact CB-CE2 4.35Å
221	L	86.7	Confident	89.3	Confident	97 Å²	97	55.4 Å²	55.4	51%	0.508	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	6	-169.7	-59	-175.7	0	0	0	114.8	Q177	Q177-L221 HydrophobicContact CB-CB 4.32Å; Q177-L221 HydrophobicContact CB-CD1 3.98Å; Q177-L221 HydrophobicContact CB-CG 4.39Å; Q177-L221 PolarHBondContact O-N 3.29Å
222	S	82.5	Confident	89.5	Confident	83 Å²	83	53.7 Å²	53.7	58%	0.58	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-24.5	176.3	46.1	0	0	0	0	114.1	R220	R220-S222 PolarHBondContact O-N 2.89Å
223	D	84.1	Confident	89.4	Confident	73 Å²	73	52.2 Å²	52.2	39%	0.39	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-153	-0.9	-164.2	39.4	46.3	0	0	0	113.4	R220 E225	R220-D223 WeakPolarHBondContact CB-OD1 3.3Å; R220-D223 IonicContact CZ-OD1 2.8Å; R220-D223 IonicContact CZ-OD2 2.72Å; R220-D223 VanDerWaalsContact CZ-OD2 3.31Å; R220-D223 IonicContact NE-OD1 2.69Å; R220-D223 PolarHBondContact NE-OD1 3.31Å; R220-D223 IonicContact NE-OD2 3.65Å; R220-D223 PolarHBondContact NE-OD2 3.46Å; R220-D223 VanDerWaalsContact NH2-CG 3.3Å; R220-D223 IonicContact NH2-OD1 3.3Å; R220-D223 PolarHBondContact NH2-OD1 3.33Å; R220-D223 IonicContact NH2-OD2 3.6Å; R220-D223 PolarHBondContact NH2-OD2 2.66Å; R220-D223 PolarHBondContact O-N 2.99Å; D223-E225 HydrophobicContact CB-CG 4.46Å; D223-E225 PolarHBondContact O-N 3.43Å; D223-E225 PolarHBondContact OD1-N 3.45Å
224	D	84.9	Confident	89	Confident	125 Å²	125	55.8 Å²	55.8	67%	0.668	28%	0.284	S	S	*	.			trans	59.8	20	-176	-65.2	-44.8	0	0	0	114.8	T219 R220 T226	T219-D224 HydrophobicContact CG2-CB 4.38Å; T219-D224 WeakPolarHBondContact CG2-O 3.4Å; R220-D224 WeakPolarHBondContact O-CA 3.32Å; R220-D224 PolarHBondContact O-N 2.77Å; D224-T226 PolarHBondContact O-N 3.01Å
225	E	85.9	Confident	88.1	Confident	91 Å²	91	59.6 Å²	59.6	43%	0.425	30%	0.304	S	S	.	.			trans	-67.6	132.4	174.1	-71.1	-163	150.4	0	0	111.7	T219 R220 D223 F227	T219-E225 CarbonylContact C-O 3.57Å; T219-E225 WeakPolarHBondContact CA-O 3.32Å; R220-E225 IonicContact CZ-OE2 3.46Å; R220-E225 PolarHBondContact N-O 3.1Å; R220-E225 IonicContact NH1-OE2 2.76Å; R220-E225 IonicContact NH2-OE2 3.42Å; R220-E225 PolarHBondContact NH2-OE2 3.48Å; D223-E225 HydrophobicContact CB-CG 4.46Å; D223-E225 PolarHBondContact O-N 3.43Å; D223-E225 PolarHBondContact OD1-N 3.45Å; E225-F227 HydrophobicContact CB-CE2 3.7Å; E225-F227 HydrophobicContact CB-CZ 3.75Å; E225-F227 WeakPolarHBondContact OE2-CZ 3.27Å
226	T	87.9	Confident	86.5	Confident	91 Å²	91	58.3 Å²	58.3	56%	0.558	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.5	127.4	-177	57.4	0	0	0	0	112.3	V218 T219 D224	V218-T226 WeakPolarHBondContact O-CA 3.45Å; T219-T226 HydrophobicContact CG2-CG2 3.85Å; D224-T226 PolarHBondContact O-N 3.01Å
227	F	91.4	Very high	84.3	Confident	27 Å²	27	64.1 Å²	64.1	12%	0.118	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	147.2	177.6	-51.6	-84.8	0	0	0	109.7	E145 P146 I148 E217 V218 R220 E225	E145-F227 HydrophobicContact CB-CE1 4.37Å; E145-F227 HydrophobicContact CG-CD1 3.81Å; E145-F227 HydrophobicContact CG-CE1 4.15Å; P146-F227 HydrophobicContact CG-CB 4.07Å; P146-F227 HydrophobicContact CG-CD1 4.16Å; P146-F227 HydrophobicContact CG-CD2 3.4Å; P146-F227 HydrophobicContact CG-CE1 4.49Å; P146-F227 HydrophobicContact CG-CE2 3.81Å; P146-F227 HydrophobicContact CG-CG 3.59Å; P146-F227 HydrophobicContact CG-CZ 4.33Å; I148-F227 HydrophobicContact CD1-CB 3.97Å; E217-F227 WeakPolarHBondContact CA-O 3.46Å; V218-F227 HydrophobicContact CG2-CB 3.97Å; V218-F227 PolarHBondContact N-O 3.03Å; V218-F227 PolarHBondContact O-N 3.25Å; R220-F227 HydrophobicContact CB-CE2 4.35Å; E225-F227 HydrophobicContact CB-CE2 3.7Å; E225-F227 HydrophobicContact CB-CZ 3.75Å; E225-F227 WeakPolarHBondContact OE2-CZ 3.27Å
228	E	91.5	Very high	81.7	Confident	82 Å²	82	67.8 Å²	67.8	38%	0.383	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	145.4	-175.6	60.2	171.9	176	0	0	113.7	R215 C216	R215-E228 WeakPolarHBondContact CD-OE2 3.3Å; R215-E228 IonicContact CZ-OE1 2.99Å; R215-E228 IonicContact CZ-OE2 2.86Å; R215-E228 IonicContact NE-OE2 3.14Å; R215-E228 IonicContact NH1-OE1 3.17Å; R215-E228 PolarHBondContact NH1-OE1 2.85Å; R215-E228 IonicContact NH1-OE2 3.08Å; R215-E228 PolarHBondContact NH1-OE2 2.82Å; C216-E228 CarbonylContact O-C 3.29Å; C216-E228 VanDerWaalsContact O-CA 3.23Å; C216-E228 WeakPolarHBondContact O-CA 3.27Å
229	K	90.9	Very high	78.7	Confident	63 Å²	63	70.9 Å²	70.9	27%	0.274	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	131	174.1	-163.7	171.2	-169.1	-173.3	0	112.2	I148 L150 D154 R215 C216	I148-K229 HydrophobicContact CB-CB 4.08Å; I148-K229 HydrophobicContact CB-CD 3.96Å; I148-K229 HydrophobicContact CD1-CB 4.15Å; I148-K229 HydrophobicContact CG2-CB 3.76Å; I148-K229 HydrophobicContact CG2-CD 4Å; I148-K229 VanDerWaalsContact O-CD 3.32Å; I148-K229 WeakPolarHBondContact O-CD 3.43Å; I148-K229 PolarHBondContact O-NZ 2.98Å; L150-K229 HydrophobicContact CD1-CG 4.32Å; L150-K229 HydrophobicContact CG-CD 4.34Å; D154-K229 WeakPolarHBondContact OD1-CE 3.39Å; D154-K229 IonicContact OD1-NZ 2.69Å; D154-K229 PolarHBondContact OD1-NZ 3.14Å; D154-K229 WeakPolarHBondContact OD2-CE 3.42Å; D154-K229 IonicContact OD2-NZ 2.71Å; D154-K229 PolarHBondContact OD2-NZ 2.96Å; R215-K229 CarbonylContact C-O 3.51Å; R215-K229 WeakPolarHBondContact CA-O 3.33Å; C216-K229 PolarHBondContact N-O 2.83Å; C216-K229 PolarHBondContact O-N 2.92Å
230	V	92.1	Very high	75.6	Confident	52 Å²	52	77.5 Å²	77.5	32%	0.315	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	132.5	179.8	-173.7	0	0	0	0	110.5	P213 R215 N232	P213-V230 HydrophobicContact CB-CG1 3.86Å; R215-V230 HydrophobicContact CG-CG2 4.19Å; V230-N232 PolarHBondContact O-N 3.49Å
231	L	91.1	Very high	72.9	Confident	5 Å²	5	85.5 Å²	85.5	3%	0.026	48%	0.483	C	S	.	.			trans	-84.3	102.9	167.5	178.6	62.4	0	0	0	109.3	L150 G153 L158 L166 W182 L200 I214 L233	L150-L231 HydrophobicContact CB-CD1 4.4Å; L150-L231 HydrophobicContact CD1-CB 3.92Å; L150-L231 HydrophobicContact CD1-CD1 4.06Å; G153-L231 VanDerWaalsContact CA-CD1 3.47Å; L158-L231 HydrophobicContact CD2-CD1 4.45Å; L166-L231 HydrophobicContact CD1-CD2 4.26Å; W182-L231 HydrophobicContact CH2-CB 4.36Å; W182-L231 HydrophobicContact CH2-CD2 4.19Å; W182-L231 HydrophobicContact CZ3-CB 3.89Å; W182-L231 HydrophobicContact CZ3-CD2 4.05Å; L200-L231 HydrophobicContact CD2-CD2 3.4Å; I214-L231 PolarHBondContact O-N 2.83Å; L231-L233 HydrophobicContact CD2-CD2 3.93Å; L231-L233 HydrophobicContact CG-CD2 3.83Å; L231-L233 HydrophobicContact CG-CG 4.32Å; L231-L233 PolarHBondContact O-N 3.13Å
232	N	85.4	Confident	70.2	Confident	89 Å²	89	85.3 Å²	85.3	48%	0.476	49%	0.49	S	S	.	.			trans	-69.3	123.7	173.9	-65.5	-26.6	0	0	0	109.5	P157 L158 V230	P157-N232 CarbonylContact C-O 3.57Å; P157-N232 VanDerWaalsContact CA-O 3.32Å; P157-N232 WeakPolarHBondContact CA-O 3.03Å; P157-N232 HydrophobicContact CB-CB 4.05Å; L158-N232 PolarHBondContact N-O 2.74Å; V230-N232 PolarHBondContact O-N 3.49Å
233	L	83.5	Confident	67.7	Low	40 Å²	40	87 Å²	87	21%	0.209	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	148.2	179	-63	180	0	0	0	110.3	L158 V160 L166 F205 L210 I214 L231	L158-L233 HydrophobicContact CB-CD2 4.12Å; L158-L233 HydrophobicContact CD2-CD2 4.22Å; L158-L233 HydrophobicContact CG-CD2 4.36Å; L158-L233 WeakPolarHBondContact O-CA 3.41Å; V160-L233 HydrophobicContact CG1-CD2 4.14Å; V160-L233 HydrophobicContact CG2-CB 4.28Å; L166-L233 HydrophobicContact CD1-CD2 3.89Å; L166-L233 HydrophobicContact CD2-CD1 3.75Å; L166-L233 HydrophobicContact CD2-CD2 4.14Å; F205-L233 HydrophobicContact CE2-CD1 3.81Å; F205-L233 HydrophobicContact CZ-CD1 3.79Å; L210-L233 HydrophobicContact CD2-CB 4.45Å; L210-L233 HydrophobicContact CD2-CD1 4.23Å; I214-L233 HydrophobicContact CD1-CD1 4.33Å; L231-L233 HydrophobicContact CD2-CD2 3.93Å; L231-L233 HydrophobicContact CG-CD2 3.83Å; L231-L233 HydrophobicContact CG-CG 4.32Å; L231-L233 PolarHBondContact O-N 3.13Å
234	R	81.2	Confident	65.3	Low	146 Å²	146	89.7 Å²	89.7	55%	0.551	51%	0.511	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.2	128.9	173.8	175.9	171.4	-176.7	-162.5	10.1	109.6	P157 L158 D159 V160 A236	P157-R234 HydrophobicContact CB-CB 3.83Å; P157-R234 HydrophobicContact CG-CB 3.88Å; L158-R234 PolarHBondContact O-N 2.91Å; D159-R234 CarbonylContact C-O 3.58Å; D159-R234 WeakPolarHBondContact CA-O 3.42Å; D159-R234 VanDerWaalsContact OD1-CD 3.25Å; D159-R234 WeakPolarHBondContact OD1-CD 3.11Å; D159-R234 WeakPolarHBondContact OD1-CG 3.46Å; D159-R234 IonicContact OD1-NE 3.96Å; V160-R234 VanDerWaalsContact CG2-O 3.31Å; V160-R234 WeakPolarHBondContact CG2-O 3.29Å; V160-R234 PolarHBondContact N-O 3.46Å; R234-A236 PolarHBondContact O-N 2.85Å
235	L	74.4	Confident	63	Low	83 Å²	83	89.1 Å²	89.1	44%	0.435	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	116.1	169.5	-81.7	164.3	0	0	0	109.2	V160 F162 L210 S237	V160-L235 WeakPolarHBondContact O-CA 3.08Å; F162-L235 HydrophobicContact CD1-CD2 4.24Å; F162-L235 HydrophobicContact CD2-CD2 4.05Å; F162-L235 HydrophobicContact CE1-CD2 3.95Å; F162-L235 HydrophobicContact CE2-CD1 4.02Å; F162-L235 HydrophobicContact CE2-CD2 3.75Å; F162-L235 HydrophobicContact CG-CD2 4.3Å; F162-L235 HydrophobicContact CZ-CD1 3.78Å; F162-L235 HydrophobicContact CZ-CD2 3.7Å; F162-L235 HydrophobicContact CZ-CG 4.37Å; L210-L235 HydrophobicContact CD1-CD1 3.75Å; L210-L235 HydrophobicContact CD1-CD2 4.42Å; L210-L235 HydrophobicContact CD1-CG 4.1Å; L235-S237 PolarHBondContact O-N 2.83Å
236	A	60.2	Low	61.1	Low	36 Å²	36	92.7 Å²	92.7	30%	0.298	53%	0.525	S	S	.	.			trans	-76.7	112.8	170.3	0	0	0	0	0	108.1	D159 V160 N161 R234 S238	D159-A236 HydrophobicContact CB-CB 4.32Å; V160-A236 PolarHBondContact O-N 2.92Å; N161-A236 PolarHBondContact OD1-O 3.33Å; R234-A236 PolarHBondContact O-N 2.85Å; A236-S238 PolarHBondContact O-N 2.9Å
237	S	48.8	Very low	59.1	Low	122 Å²	122	92.7 Å²	92.7	85%	0.853	52%	0.515	S	S	*	.			trans	-70.7	102.3	178	-165.1	0	0	0	0	109.7	L235	L235-S237 PolarHBondContact O-N 2.83Å
238	S	39.4	Very low	56.8	Low	91 Å²	91	98.2 Å²	98.2	64%	0.636	54%	0.539	S	S	*	.			trans	-58.4	157.6	148.5	45.5	0	0	0	0	109.7	A236	A236-S238 PolarHBondContact O-N 2.9Å
239	G	29.5	Very low	55	Low	65 Å²	65	99.9 Å²	99.9	67%	0.67	56%	0.555	S	S	*	*	S	Bend	trans	-69.8	161.6	176.1	0	0	0	0	0	112.4
240	D	27.2	Very low	53.8	Low	161 Å²	161	98.2 Å²	98.2	86%	0.861	55%	0.549	S	S	*	.			trans	61.2	83.8	173.8	-57.2	-25.8	0	0	0	116.5
241	L	32.3	Very low	52.9	Low	173 Å²	173	101.7 Å²	101.7	91%	0.906	57%	0.566	S	S	*	*				-163.7	159.3	123.7	-101.6	159.4	0	0	0	111
242	S	29.7	Very low	52.6	Low	93 Å²	93	102.5 Å²	102.5	65%	0.65	57%	0.57	S	S	*	*			trans	-107.6	127.6	-159.6	57.6	0	0	0	0	115.2
243	T	29.9	Very low	52.6	Low	119 Å²	119	99.6 Å²	99.6	73%	0.73	56%	0.556	S	S	*	*	S	Bend	trans	-161.4	157.6	130.4	35.1	0	0	0	0	109.3
244	D	34.7	Very low	53	Low	129 Å²	129	99.5 Å²	99.5	69%	0.69	56%	0.555	S	S	*	*			trans	55.1	77.5	172.5	-53.6	-13.7	0	0	0	116.6	E246	D244-E246 VanDerWaalsContact C-N 3.31Å; D244-E246 PolarHBondContact O-N 2.94Å
245	D	35.2	Very low	53.2	Low	114 Å²	114	96.1 Å²	96.1	61%	0.61	54%	0.544	S	S	*	.			trans	-78	-4.9	176.4	-82.2	-44.9	0	0	0	114.9	Y247 K248	D245-Y247 PolarHBondContact O-N 2.93Å; D245-K248 WeakPolarHBondContact OD1-CD 3.29Å; D245-K248 WeakPolarHBondContact OD1-CE 3.44Å; D245-K248 IonicContact OD1-NZ 2.79Å; D245-K248 PolarHBondContact OD1-NZ 3.18Å
246	E	47.1	Very low	53.7	Low	165 Å²	165	95.9 Å²	95.9	77%	0.771	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-29.3	-170.4	-165.8	155.6	-146.7	0	0	114	D244	D244-E246 VanDerWaalsContact C-N 3.31Å; D244-E246 PolarHBondContact O-N 2.94Å
247	Y	45.9	Very low	54.6	Low	92 Å²	92	96 Å²	96	36%	0.361	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-3.1	-176.1	-65.2	-72.6	0	0	0	115.2	D245 T249 L250 Y327	D245-Y247 PolarHBondContact O-N 2.93Å; Y247-T249 PolarHBondContact O-N 2.02Å; Y247-L250 HydrophobicContact CD1-CD1 3.86Å; Y247-Y327 PolarHBondContact O-OH 2.9Å
248	K	43.7	Very low	55.8	Low	143 Å²	143	96.1 Å²	96.1	62%	0.622	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-5.5	-172.1	-75.3	179.1	-175.1	164.9	0	115.4	D245	D245-K248 WeakPolarHBondContact OD1-CD 3.29Å; D245-K248 WeakPolarHBondContact OD1-CE 3.44Å; D245-K248 IonicContact OD1-NZ 2.79Å; D245-K248 PolarHBondContact OD1-NZ 3.18Å
249	T	52.2	Low	57.2	Low	117 Å²	117	97.8 Å²	97.8	72%	0.718	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.7	10.2	-177.3	52.5	0	0	0	0	114.1	Y247 N251	Y247-T249 PolarHBondContact O-N 2.02Å; T249-N251 PolarHBondContact O-N 2.89Å; T249-N251 VanDerWaalsContact O-N 3.08Å
250	L	65.9	Low	59.1	Low	27 Å²	27	96.4 Å²	96.4	14%	0.141	52%	0.519	C	S	.	.			trans	-70.6	101.3	177.4	-72	-170.9	0	0	0	112.6	Y247 F273 I279 F283 Y327	Y247-L250 HydrophobicContact CD1-CD1 3.86Å; L250-F273 HydrophobicContact CB-CD1 3.76Å; L250-F273 HydrophobicContact CB-CE1 3.76Å; L250-F273 HydrophobicContact CD1-CD1 4.36Å; L250-F273 HydrophobicContact CD1-CE1 4.31Å; L250-F273 HydrophobicContact CD2-CD1 4.42Å; L250-F273 HydrophobicContact CG-CD1 4.41Å; L250-I279 HydrophobicContact CD1-CG2 3.87Å; L250-I279 HydrophobicContact CD2-CD1 3.97Å; L250-I279 HydrophobicContact CD2-CG2 4.01Å; L250-F283 HydrophobicContact CD1-CE2 4.3Å; L250-F283 HydrophobicContact CD1-CZ 4.02Å; L250-Y327 HydrophobicContact CB-CE1 3.85Å; L250-Y327 WeakPolarHBondContact O-CE1 3.49Å
251	N	73.3	Confident	61.2	Low	125 Å²	125	91 Å²	91	67%	0.668	49%	0.49	S	S	*	.			trans	-83.2	111.8	169.7	-77.4	-25.7	0	0	0	110.6	T249 T253	T249-N251 PolarHBondContact O-N 2.89Å; T249-N251 VanDerWaalsContact O-N 3.08Å; N251-T253 HydrophobicContact CB-CG2 4.5Å; N251-T253 PolarHBondContact O-N 2.88Å
252	L	85.5	Confident	62.8	Low	23 Å²	23	88.4 Å²	88.4	12%	0.12	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	117.8	168.8	-174.7	63.4	0	0	0	109.3	C271 F273 F285 A318 A329	L252-C271 VanDerWaalsContact CD1-SG 3.55Å; L252-F273 HydrophobicContact CB-CD1 4.21Å; L252-F273 HydrophobicContact CB-CE1 3.76Å; L252-F273 HydrophobicContact CB-CZ 4.29Å; L252-F273 HydrophobicContact CD1-CD1 4.3Å; L252-F273 HydrophobicContact CD1-CD2 4.31Å; L252-F273 HydrophobicContact CD1-CE1 4.05Å; L252-F273 HydrophobicContact CD1-CE2 4.04Å; L252-F273 HydrophobicContact CD1-CG 4.44Å; L252-F273 HydrophobicContact CD1-CZ 3.92Å; L252-F273 HydrophobicContact CG-CE1 4.48Å; L252-F285 HydrophobicContact CD1-CE1 3.9Å; L252-A318 HydrophobicContact CD1-CB 3.93Å; L252-A318 HydrophobicContact CD2-CB 3.91Å; L252-A329 HydrophobicContact CB-CB 4.43Å; L252-A329 HydrophobicContact CD2-CB 4.06Å; L252-A329 HydrophobicContact CG-CB 4.03Å
253	T	85.8	Confident	64.2	Low	28 Å²	28	95 Å²	95	17%	0.172	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	158.1	-175.2	70.3	0	0	0	0	112.3	N251 C271 L272 E274	N251-T253 HydrophobicContact CB-CG2 4.5Å; N251-T253 PolarHBondContact O-N 2.88Å; T253-C271 CarbonylContact O-C 3.53Å; T253-C271 VanDerWaalsContact O-CA 3.29Å; T253-C271 WeakPolarHBondContact O-CA 3.01Å; T253-L272 PolarHBondContact N-O 2.96Å; T253-L272 PolarHBondContact O-N 2.77Å; T253-L272 PolarHBondContact OG1-O 3.11Å; T253-E274 HydrophobicContact CG2-CG 3.69Å; T253-E274 WeakPolarHBondContact OG1-CG 3.35Å
254	I	90.5	Very high	65.9	Low	37 Å²	37	96.2 Å²	96.2	19%	0.19	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	113	178.5	-67.6	168.7	0	0	0	108.7	R269 Q270 C271 W287 C316 A329 Y331	I254-R269 HydrophobicContact CG2-CB 4.06Å; I254-R269 HydrophobicContact CG2-CG 4.36Å; I254-Q270 CarbonylContact C-O 3.5Å; I254-Q270 WeakPolarHBondContact CA-O 3.48Å; I254-C271 HydrophobicContact CG1-CB 4.46Å; I254-W287 HydrophobicContact CB-CH2 4.42Å; I254-W287 HydrophobicContact CD1-CH2 3.61Å; I254-W287 HydrophobicContact CD1-CZ3 4.01Å; I254-W287 HydrophobicContact CG1-CH2 3.81Å; I254-W287 HydrophobicContact CG1-CZ2 4.31Å; I254-W287 HydrophobicContact CG2-CH2 3.73Å; I254-W287 HydrophobicContact CG2-CZ2 4.33Å; I254-C316 HydrophobicContact CD1-CB 4.18Å; I254-C316 HydrophobicContact CG1-CB 4.44Å; I254-A329 HydrophobicContact CD1-CB 3.54Å; I254-A329 HydrophobicContact CG1-CB 3.91Å; I254-Y331 HydrophobicContact CG2-CD2 4.26Å
255	K	85.8	Confident	67.3	Low	76 Å²	76	90.7 Å²	90.7	33%	0.33	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	143	-175.3	-62	-166.4	179.4	-176.6	0	112.3	R269 Q270 L272 E274	K255-R269 CarbonylContact O-C 3.52Å; K255-R269 VanDerWaalsContact O-CA 3.31Å; K255-R269 WeakPolarHBondContact O-CA 3.37Å; K255-R269 WeakPolarHBondContact O-CD 3.24Å; K255-Q270 PolarHBondContact N-O 2.96Å; K255-Q270 PolarHBondContact O-N 2.9Å; K255-L272 HydrophobicContact CD-CD1 4.37Å; K255-L272 HydrophobicContact CD-CD2 4.25Å; K255-E274 WeakPolarHBondContact CE-OE1 3.3Å; K255-E274 IonicContact NZ-OE1 2.65Å; K255-E274 PolarHBondContact NZ-OE1 2.97Å
256	P	85.2	Confident	69.1	Low	77 Å²	77	86.3 Å²	86.3	50%	0.5	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	142.2	167.5	30	-33.7	0	0	0	110.6	E260	P256-E260 WeakPolarHBondContact CB-OE1 2.97Å
257	L	79.9	Confident	70.7	Confident	39 Å²	39	78.5 Å²	78.5	20%	0.204	39%	0.394	C	S	.	.			trans	-94.3	156.1	171.1	-71.8	170.6	0	0	0	111	N259 E260 M268 Q270 T300	L257-N259 PolarHBondContact O-N 2.87Å; L257-E260 WeakPolarHBondContact O-CB 3.32Å; L257-E260 PolarHBondContact O-N 2.83Å; L257-M268 HydrophobicContact CB-CB 3.88Å; L257-M268 HydrophobicContact CD1-CB 4.25Å; L257-M268 HydrophobicContact CD1-CE 4.23Å; L257-M268 PolarHBondContact N-O 3.28Å; L257-Q270 HydrophobicContact CD1-CB 4.22Å; L257-Q270 HydrophobicContact CD2-CB 3.99Å; L257-Q270 HydrophobicContact CG-CB 4.09Å; L257-T300 HydrophobicContact CD1-CG2 3.73Å
258	P	74	Confident	72.4	Confident	124 Å²	124	75.9 Å²	75.9	81%	0.805	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-16.3	-169.6	-26.6	36.1	0	0	0	116.9
259	N	67.7	Low	74.6	Confident	127 Å²	127	70.9 Å²	70.9	68%	0.679	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	10.5	-176.2	-69.5	17.5	0	0	0	113.5	L257 D261 M268	L257-N259 PolarHBondContact O-N 2.87Å; N259-D261 PolarHBondContact O-N 3.16Å; N259-M268 HydrophobicContact CB-SD 3.74Å
260	E	70.5	Confident	76.4	Confident	36 Å²	36	68.2 Å²	68.2	17%	0.168	34%	0.342	C	S	.	.			trans	-70.9	111.1	175.6	178.7	168.1	86.4	0	0	111.7	P256 L257 F262 M268 R269	P256-E260 WeakPolarHBondContact CB-OE1 2.97Å; L257-E260 WeakPolarHBondContact O-CB 3.32Å; L257-E260 PolarHBondContact O-N 2.83Å; E260-F262 HydrophobicContact CG-CD2 4.05Å; E260-F262 HydrophobicContact CG-CE2 3.79Å; E260-F262 HydrophobicContact CG-CZ 4.23Å; E260-F262 WeakPolarHBondContact OE1-CE2 3.49Å; E260-F262 WeakPolarHBondContact OE1-CZ 3.03Å; E260-M268 HydrophobicContact CB-CB 4.27Å; E260-M268 PolarHBondContact OE2-N 3.43Å; E260-M268 VanDerWaalsContact OE2-N 3.09Å; E260-R269 IonicContact OE1-CZ 3.36Å; E260-R269 VanDerWaalsContact OE1-CZ 3.3Å; E260-R269 IonicContact OE1-NE 2.66Å; E260-R269 PolarHBondContact OE1-NE 3.41Å; E260-R269 IonicContact OE1-NH2 2.63Å; E260-R269 PolarHBondContact OE1-NH2 2.74Å; E260-R269 IonicContact OE2-CZ 3.92Å; E260-R269 IonicContact OE2-NE 2.88Å; E260-R269 PolarHBondContact OE2-NE 3.08Å; E260-R269 IonicContact OE2-NH2 2.88Å
261	D	70	Confident	77.5	Confident	47 Å²	47	66.9 Å²	66.9	25%	0.251	34%	0.335	S	S	.	.			trans	-121.9	91	169.5	-173.8	11.1	0	0	0	111.6	N259 R263 Q264 G265 T266	N259-D261 PolarHBondContact O-N 3.16Å; D261-R263 PolarHBondContact O-N 2.91Å; D261-R263 VanDerWaalsContact OD1-CB 3.23Å; D261-R263 WeakPolarHBondContact OD1-CB 3.44Å; D261-R263 VanDerWaalsContact OD1-CG 3.25Å; D261-R263 WeakPolarHBondContact OD1-CG 3.34Å; D261-R263 PolarHBondContact OD1-N 2.93Å; D261-R263 IonicContact OD1-NE 3.3Å; D261-Q264 PolarHBondContact O-N 2.85Å; D261-Q264 WeakPolarHBondContact OD2-CG 3.28Å; D261-Q264 PolarHBondContact OD2-NE2 3.07Å; D261-G265 PolarHBondContact O-N 3.16Å; D261-T266 CarbonylContact C-O 3.58Å; D261-T266 VanDerWaalsContact C-O 3.29Å; D261-T266 PolarHBondContact N-O 3.14Å; D261-T266 PolarHBondContact N-OG1 3.2Å; D261-T266 PolarHBondContact O-N 2.93Å; D261-T266 PolarHBondContact O-OG1 3.43Å; D261-T266 VanDerWaalsContact O-OG1 3.08Å
262	F	66.6	Low	78.3	Confident	118 Å²	118	62.3 Å²	62.3	52%	0.518	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-47.9	-23.4	171.1	-70	-81.4	0	0	0	114.6	E260 Q264 G265 T266 I267	E260-F262 HydrophobicContact CG-CD2 4.05Å; E260-F262 HydrophobicContact CG-CE2 3.79Å; E260-F262 HydrophobicContact CG-CZ 4.23Å; E260-F262 WeakPolarHBondContact OE1-CE2 3.49Å; E260-F262 WeakPolarHBondContact OE1-CZ 3.03Å; F262-Q264 VanDerWaalsContact C-N 3.32Å; F262-G265 PolarHBondContact O-N 3.03Å; F262-T266 PolarHBondContact N-O 2.99Å; F262-I267 HydrophobicContact CD1-CD1 3.96Å; F262-I267 HydrophobicContact CD1-CG1 3.9Å; F262-I267 HydrophobicContact CE1-CD1 3.61Å; F262-I267 HydrophobicContact CE1-CG1 3.76Å
263	R	59.2	Low	78.4	Confident	233 Å²	233	61.4 Å²	61.4	88%	0.879	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-75.1	-23	177.8	-52.4	177.8	-151.1	-121.4	2.6	113.1	D261	D261-R263 PolarHBondContact O-N 2.91Å; D261-R263 VanDerWaalsContact OD1-CB 3.23Å; D261-R263 WeakPolarHBondContact OD1-CB 3.44Å; D261-R263 VanDerWaalsContact OD1-CG 3.25Å; D261-R263 WeakPolarHBondContact OD1-CG 3.34Å; D261-R263 PolarHBondContact OD1-N 2.93Å; D261-R263 IonicContact OD1-NE 3.3Å
264	Q	64.7	Low	77.7	Confident	143 Å²	143	64.2 Å²	64.2	67%	0.668	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-103	9.1	176.8	-65.7	179.2	52.9	0	0	111.7	D261 F262 T266	D261-Q264 PolarHBondContact O-N 2.85Å; D261-Q264 WeakPolarHBondContact OD2-CG 3.28Å; D261-Q264 PolarHBondContact OD2-NE2 3.07Å; F262-Q264 VanDerWaalsContact C-N 3.32Å; Q264-T266 PolarHBondContact O-N 3.3Å
265	G	65	Low	76.4	Confident	14 Å²	14	70.3 Å²	70.3	14%	0.144	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.5	1.5	-175.1	0	0	0	0	0	114.5	D261 F262 I305	D261-G265 PolarHBondContact O-N 3.16Å; F262-G265 PolarHBondContact O-N 3.03Å; G265-I305 WeakPolarHBondContact O-CG1 3.4Å; G265-I305 PolarHBondContact O-N 2.81Å
266	T	72.4	Confident	75.3	Confident	21 Å²	21	69.7 Å²	69.7	13%	0.129	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	123.9	179.1	52.4	0	0	0	0	110.9	D261 F262 Q264 L304	D261-T266 CarbonylContact C-O 3.58Å; D261-T266 VanDerWaalsContact C-O 3.29Å; D261-T266 PolarHBondContact N-O 3.14Å; D261-T266 PolarHBondContact N-OG1 3.2Å; D261-T266 PolarHBondContact O-N 2.93Å; D261-T266 PolarHBondContact O-OG1 3.43Å; D261-T266 VanDerWaalsContact O-OG1 3.08Å; F262-T266 PolarHBondContact N-O 2.99Å; Q264-T266 PolarHBondContact O-N 3.3Å; T266-L304 HydrophobicContact CG2-CD1 3.6Å
267	I	80.1	Confident	74.5	Confident	2 Å²	2	71 Å²	71	1%	0.01	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	129.6	172.5	-71.6	-174.5	0	0	0	108.5	F262 R269 Y302 L303 I305 Y331 V333	F262-I267 HydrophobicContact CD1-CD1 3.96Å; F262-I267 HydrophobicContact CD1-CG1 3.9Å; F262-I267 HydrophobicContact CE1-CD1 3.61Å; F262-I267 HydrophobicContact CE1-CG1 3.76Å; I267-R269 HydrophobicContact CG2-CG 3.99Å; I267-Y302 WeakPolarHBondContact O-CA 3.39Å; I267-L303 HydrophobicContact CB-CB 4.25Å; I267-L303 HydrophobicContact CG2-CD1 4.48Å; I267-L303 PolarHBondContact N-O 3.38Å; I267-L303 PolarHBondContact O-N 3.36Å; I267-I305 HydrophobicContact CD1-CD1 3.74Å; I267-I305 HydrophobicContact CG1-CD1 4.24Å; I267-Y331 HydrophobicContact CG2-CE1 3.77Å; I267-V333 HydrophobicContact CD1-CB 4.37Å; I267-V333 HydrophobicContact CD1-CG1 3.73Å; I267-V333 HydrophobicContact CD1-CG2 3.78Å
268	M	82.5	Confident	74.2	Confident	36 Å²	36	76.5 Å²	76.5	18%	0.177	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	109.2	-177.1	-65.5	-165.7	63	0	0	109.8	L257 N259 E260 L301 Y302	L257-M268 HydrophobicContact CB-CB 3.88Å; L257-M268 HydrophobicContact CD1-CB 4.25Å; L257-M268 HydrophobicContact CD1-CE 4.23Å; L257-M268 PolarHBondContact N-O 3.28Å; N259-M268 HydrophobicContact CB-SD 3.74Å; E260-M268 HydrophobicContact CB-CB 4.27Å; E260-M268 PolarHBondContact OE2-N 3.43Å; E260-M268 VanDerWaalsContact OE2-N 3.09Å; M268-L301 WeakPolarHBondContact CA-O 3.43Å; M268-Y302 HydrophobicContact CE-CD2 4.05Å; M268-Y302 HydrophobicContact CG-CD2 3.78Å; M268-Y302 HydrophobicContact CG-CE2 4.14Å; M268-Y302 HydrophobicContact SD-CD2 3.97Å; M268-Y302 HydrophobicContact SD-CE2 4.01Å
269	R	89.7	Confident	74.5	Confident	38 Å²	38	72.3 Å²	72.3	14%	0.143	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	128.3	-171.3	-67.6	-73.1	163.8	147	-3.1	111	I254 K255 E260 I267 W287 T300 L301 Y331	I254-R269 HydrophobicContact CG2-CB 4.06Å; I254-R269 HydrophobicContact CG2-CG 4.36Å; K255-R269 CarbonylContact O-C 3.52Å; K255-R269 VanDerWaalsContact O-CA 3.31Å; K255-R269 WeakPolarHBondContact O-CA 3.37Å; K255-R269 WeakPolarHBondContact O-CD 3.24Å; E260-R269 IonicContact OE1-CZ 3.36Å; E260-R269 VanDerWaalsContact OE1-CZ 3.3Å; E260-R269 IonicContact OE1-NE 2.66Å; E260-R269 PolarHBondContact OE1-NE 3.41Å; E260-R269 IonicContact OE1-NH2 2.63Å; E260-R269 PolarHBondContact OE1-NH2 2.74Å; E260-R269 IonicContact OE2-CZ 3.92Å; E260-R269 IonicContact OE2-NE 2.88Å; E260-R269 PolarHBondContact OE2-NE 3.08Å; E260-R269 IonicContact OE2-NH2 2.88Å; I267-R269 HydrophobicContact CG2-CG 3.99Å; R269-W287 HydrophobicContact CB-CH2 4.29Å; R269-W287 HydrophobicContact CB-CZ2 4.29Å; R269-T300 CarbonylContact O-C 3.6Å; R269-T300 WeakPolarHBondContact O-CA 3.29Å; R269-L301 HydrophobicContact CB-CB 4.29Å; R269-L301 PolarHBondContact N-O 3.26Å; R269-L301 PolarHBondContact O-N 2.9Å; R269-Y331 HydrophobicContact CG-CD1 4.42Å; R269-Y331 HydrophobicContact CG-CE1 3.95Å; R269-Y331 HydrophobicContact CG-CE2 4.23Å; R269-Y331 PolarHBondContact NE-OH 2.68Å
270	Q	90.4	Very high	75.3	Confident	61 Å²	61	67.8 Å²	67.8	29%	0.285	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	136	174.2	-164.5	-176.5	14	0	0	109.8	I254 K255 L257 L272 D299	I254-Q270 CarbonylContact C-O 3.5Å; I254-Q270 WeakPolarHBondContact CA-O 3.48Å; K255-Q270 PolarHBondContact N-O 2.96Å; K255-Q270 PolarHBondContact O-N 2.9Å; L257-Q270 HydrophobicContact CD1-CB 4.22Å; L257-Q270 HydrophobicContact CD2-CB 3.99Å; L257-Q270 HydrophobicContact CG-CB 4.09Å; Q270-L272 HydrophobicContact CB-CD2 4.32Å; Q270-L272 HydrophobicContact CG-CD2 4Å; Q270-D299 HydrophobicContact CG-CB 4.41Å; Q270-D299 WeakPolarHBondContact CG-OD2 3.48Å; Q270-D299 PolarHBondContact NE2-OD2 2.99Å
271	C	89.6	Confident	75.9	Confident	0 Å²	0	73.2 Å²	73.2	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	125.4	176.9	-166.8	0	0	0	0	110.2	L252 T253 I254 F285 W287 D299 C316	L252-C271 VanDerWaalsContact CD1-SG 3.55Å; T253-C271 CarbonylContact O-C 3.53Å; T253-C271 VanDerWaalsContact O-CA 3.29Å; T253-C271 WeakPolarHBondContact O-CA 3.01Å; I254-C271 HydrophobicContact CG1-CB 4.46Å; C271-F285 HydrophobicContact CB-CD1 4.48Å; C271-W287 HydrophobicContact CB-CZ2 3.75Å; C271-D299 WeakPolarHBondContact CB-O 3.42Å; C271-D299 PolarHBondContact N-O 3.32Å; C271-C316 HydrophobicContact CB-CB 3.74Å; C271-C316 WeakPolarHBondContact CB-SG 3.4Å; C271-C316 WeakPolarHBondContact SG-CB 3.27Å; C271-C316 CovalentContact SG-SG 2.01Å; C271-C316 PolarHBondContact SG-SG 3.37Å
272	L	89.8	Confident	76.5	Confident	29 Å²	29	73.5 Å²	73.5	15%	0.152	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	150.3	-173.3	60	101.3	0	0	0	113	T253 K255 Q270 E274 N280	T253-L272 PolarHBondContact N-O 2.96Å; T253-L272 PolarHBondContact O-N 2.77Å; T253-L272 PolarHBondContact OG1-O 3.11Å; K255-L272 HydrophobicContact CD-CD1 4.37Å; K255-L272 HydrophobicContact CD-CD2 4.25Å; Q270-L272 HydrophobicContact CB-CD2 4.32Å; Q270-L272 HydrophobicContact CG-CD2 4Å; L272-E274 HydrophobicContact CD1-CG 4.13Å; L272-N280 WeakPolarHBondContact CA-OD1 3.48Å
273	F	86.7	Confident	77.5	Confident	4 Å²	4	68.1 Å²	68.1	2%	0.018	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	127.8	163.4	-61.8	-75.5	0	0	0	109.2	L250 L252 I279 N280 F283 F285 A318 Y327	L250-F273 HydrophobicContact CB-CD1 3.76Å; L250-F273 HydrophobicContact CB-CE1 3.76Å; L250-F273 HydrophobicContact CD1-CD1 4.36Å; L250-F273 HydrophobicContact CD1-CE1 4.31Å; L250-F273 HydrophobicContact CD2-CD1 4.42Å; L250-F273 HydrophobicContact CG-CD1 4.41Å; L252-F273 HydrophobicContact CB-CD1 4.21Å; L252-F273 HydrophobicContact CB-CE1 3.76Å; L252-F273 HydrophobicContact CB-CZ 4.29Å; L252-F273 HydrophobicContact CD1-CD1 4.3Å; L252-F273 HydrophobicContact CD1-CD2 4.31Å; L252-F273 HydrophobicContact CD1-CE1 4.05Å; L252-F273 HydrophobicContact CD1-CE2 4.04Å; L252-F273 HydrophobicContact CD1-CG 4.44Å; L252-F273 HydrophobicContact CD1-CZ 3.92Å; L252-F273 HydrophobicContact CG-CE1 4.48Å; F273-I279 HydrophobicContact CB-CG2 4.3Å; F273-I279 HydrophobicContact CD2-CG2 4.27Å; F273-I279 HydrophobicContact CG-CG2 4.37Å; F273-N280 PolarHBondContact N-OD1 2.84Å; F273-N280 PolarHBondContact O-ND2 3.3Å; F273-N280 VanDerWaalsContact O-ND2 3.08Å; F273-F283 HydrophobicContact CD2-CD2 4.28Å; F273-F283 HydrophobicContact CD2-CE2 4.33Å; F273-F283 HydrophobicContact CE2-CB 4.44Å; F273-F283 AromaticContact CE2-CD1 3.77Å; F273-F283 HydrophobicContact CE2-CD1 3.77Å; F273-F283 AromaticContact CE2-CD2 3.72Å; F273-F283 HydrophobicContact CE2-CD2 3.72Å; F273-F283 AromaticContact CE2-CE1 3.84Å; F273-F283 HydrophobicContact CE2-CE1 3.84Å; F273-F283 AromaticContact CE2-CE2 3.79Å; F273-F283 HydrophobicContact CE2-CE2 3.79Å; F273-F283 AromaticContact CE2-CG 3.73Å; F273-F283 HydrophobicContact CE2-CG 3.73Å; F273-F283 AromaticContact CE2-CZ 3.84Å; F273-F283 HydrophobicContact CE2-CZ 3.84Å; F273-F283 HydrophobicContact CZ-CD1 4.07Å; F273-F283 AromaticContact CZ-CE1 3.78Å; F273-F283 HydrophobicContact CZ-CE1 3.78Å; F273-F283 HydrophobicContact CZ-CE2 4.32Å; F273-F283 HydrophobicContact CZ-CG 4.47Å; F273-F283 AromaticContact CZ-CZ 3.91Å; F273-F283 HydrophobicContact CZ-CZ 3.91Å; F273-F285 HydrophobicContact CD2-CZ 4.28Å; F273-F285 HydrophobicContact CE2-CE1 4.49Å; F273-F285 HydrophobicContact CE2-CZ 4.28Å; F273-A318 HydrophobicContact CE2-CB 4Å; F273-A318 HydrophobicContact CZ-CB 4.1Å; F273-Y327 AromaticContact CE1-CD1 3.91Å; F273-Y327 HydrophobicContact CE1-CD1 3.91Å; F273-Y327 HydrophobicContact CE1-CD2 4.47Å; F273-Y327 HydrophobicContact CE1-CE1 4.34Å; F273-Y327 AromaticContact CE1-CG 3.99Å; F273-Y327 HydrophobicContact CE1-CG 3.99Å; F273-Y327 HydrophobicContact CZ-CD1 4.24Å; F273-Y327 HydrophobicContact CZ-CD2 4.01Å; F273-Y327 AromaticContact CZ-CG 3.84Å; F273-Y327 HydrophobicContact CZ-CG 3.84Å
274	E	72	Confident	78.9	Confident	87 Å²	87	60.8 Å²	60.8	41%	0.407	31%	0.311	S	S	.	.	S	Bend	trans	-76.6	156.5	-179	-68.2	-166.9	115.1	0	0	113.1	T253 K255 L272 D276	T253-E274 HydrophobicContact CG2-CG 3.69Å; T253-E274 WeakPolarHBondContact OG1-CG 3.35Å; K255-E274 WeakPolarHBondContact CE-OE1 3.3Å; K255-E274 IonicContact NZ-OE1 2.65Å; K255-E274 PolarHBondContact NZ-OE1 2.97Å; L272-E274 HydrophobicContact CD1-CG 4.13Å; E274-D276 VanDerWaalsContact C-N 3.27Å; E274-D276 PolarHBondContact O-N 3.44Å
275	N	63.1	Low	80.2	Confident	165 Å²	165	55.3 Å²	55.3	88%	0.882	29%	0.285	S	S	*	.	S	Bend	trans	76.3	-15.9	171	-44.9	-69.8	0	0	0	116.9
276	D	62.1	Low	81.4	Confident	63 Å²	63	59 Å²	59	34%	0.337	29%	0.294	S	S	.	.			trans	-136.9	115.6	175.8	-162.5	-41.8	0	0	0	112.5	E274 E278 I279 N280	E274-D276 VanDerWaalsContact C-N 3.27Å; E274-D276 PolarHBondContact O-N 3.44Å; D276-E278 WeakPolarHBondContact OD1-CB 3.32Å; D276-E278 PolarHBondContact OD1-N 2.83Å; D276-I279 HydrophobicContact CB-CB 4.17Å; D276-I279 HydrophobicContact CB-CD1 3.7Å; D276-I279 HydrophobicContact CB-CG1 3.8Å; D276-I279 PolarHBondContact OD1-N 2.94Å; D276-N280 PolarHBondContact O-ND2 2.87Å
277	P	68	Low	82.2	Confident	104 Å²	104	58 Å²	58	68%	0.675	29%	0.288	S	S	*	.	H	α-helix	trans	-67.1	-38.8	174.8	-19.3	32.9	0	0	0	113.8	I279 N280	P277-I279 VanDerWaalsContact C-N 3.29Å; P277-I279 PolarHBondContact O-N 3.43Å; P277-N280 WeakPolarHBondContact O-CB 3.47Å; P277-N280 PolarHBondContact O-N 3.28Å
278	E	74.6	Confident	82.6	Confident	154 Å²	154	59 Å²	59	72%	0.72	29%	0.294	S	S	*	.	H	α-helix	trans	-67.5	-33.6	-172.6	-60.7	-175.2	-169.7	0	0	110.8	D276 N280 E281	D276-E278 WeakPolarHBondContact OD1-CB 3.32Å; D276-E278 PolarHBondContact OD1-N 2.83Å; E278-N280 PolarHBondContact O-N 2.81Å; E278-E281 PolarHBondContact O-N 2.87Å; E278-E281 VanDerWaalsContact O-N 3.11Å
279	I	79.9	Confident	82.7	Confident	37 Å²	37	58.4 Å²	58.4	19%	0.19	29%	0.291	C	S	.	.	H	α-helix	trans	-58.2	-33.7	173.1	-65.9	-176.4	0	0	0	111.8	L250 F273 D276 P277 E281 L282 F283	L250-I279 HydrophobicContact CD1-CG2 3.87Å; L250-I279 HydrophobicContact CD2-CD1 3.97Å; L250-I279 HydrophobicContact CD2-CG2 4.01Å; F273-I279 HydrophobicContact CB-CG2 4.3Å; F273-I279 HydrophobicContact CD2-CG2 4.27Å; F273-I279 HydrophobicContact CG-CG2 4.37Å; D276-I279 HydrophobicContact CB-CB 4.17Å; D276-I279 HydrophobicContact CB-CD1 3.7Å; D276-I279 HydrophobicContact CB-CG1 3.8Å; D276-I279 PolarHBondContact OD1-N 2.94Å; P277-I279 VanDerWaalsContact C-N 3.29Å; P277-I279 PolarHBondContact O-N 3.43Å; I279-E281 VanDerWaalsContact C-N 3.33Å; I279-E281 PolarHBondContact O-N 3.11Å; I279-L282 WeakPolarHBondContact O-CB 3.4Å; I279-L282 PolarHBondContact O-N 3.1Å; I279-F283 HydrophobicContact CG2-CE2 4.1Å; I279-F283 VanDerWaalsContact O-CD2 3.22Å; I279-F283 WeakPolarHBondContact O-CD2 3.47Å
280	N	83.8	Confident	82.1	Confident	32 Å²	32	62.2 Å²	62.2	17%	0.171	31%	0.31	C	S	.	.	H	α-helix	trans	-71.2	-27.1	179.9	-67.3	-85.5	0	0	0	112.2	L272 F273 D276 P277 E278 L282 F283 F285	L272-N280 WeakPolarHBondContact CA-OD1 3.48Å; F273-N280 PolarHBondContact N-OD1 2.84Å; F273-N280 PolarHBondContact O-ND2 3.3Å; F273-N280 VanDerWaalsContact O-ND2 3.08Å; D276-N280 PolarHBondContact O-ND2 2.87Å; P277-N280 WeakPolarHBondContact O-CB 3.47Å; P277-N280 PolarHBondContact O-N 3.28Å; E278-N280 PolarHBondContact O-N 2.81Å; N280-L282 PolarHBondContact O-N 2.94Å; N280-F283 PolarHBondContact O-N 2.98Å; N280-F285 HydrophobicContact CB-CE2 4.41Å; N280-F285 HydrophobicContact CB-CZ 4.27Å; N280-F285 WeakPolarHBondContact O-CE2 3.28Å
281	E	83.5	Confident	81.3	Confident	150 Å²	150	64.5 Å²	64.5	70%	0.701	33%	0.325	S	S	*	.	H	α-helix	trans	-69.3	-15.4	175.9	-58.6	-165.9	172.1	0	0	113.3	E278 I279 F283 R321	E278-E281 PolarHBondContact O-N 2.87Å; E278-E281 VanDerWaalsContact O-N 3.11Å; I279-E281 VanDerWaalsContact C-N 3.33Å; I279-E281 PolarHBondContact O-N 3.11Å; E281-F283 VanDerWaalsContact C-N 3.32Å; E281-R321 PolarHBondContact O-NH1 3.23Å
282	L	83.5	Confident	80.5	Confident	53 Å²	53	67.1 Å²	67.1	28%	0.277	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-3.3	177.6	-57.6	176.6	0	0	0	113.9	I279 N280 R321	I279-L282 WeakPolarHBondContact O-CB 3.4Å; I279-L282 PolarHBondContact O-N 3.1Å; N280-L282 PolarHBondContact O-N 2.94Å; L282-R321 WeakPolarHBondContact O-CB 3.34Å; L282-R321 PolarHBondContact O-N 2.89Å
283	F	87.7	Confident	79.7	Confident	5 Å²	5	74.3 Å²	74.3	2%	0.022	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	142.9	-174.4	-67.3	-107.1	0	0	0	112.6	L250 F273 I279 N280 E281 F285 A318 T319 N320 Y327	L250-F283 HydrophobicContact CD1-CE2 4.3Å; L250-F283 HydrophobicContact CD1-CZ 4.02Å; F273-F283 HydrophobicContact CD2-CD2 4.28Å; F273-F283 HydrophobicContact CD2-CE2 4.33Å; F273-F283 HydrophobicContact CE2-CB 4.44Å; F273-F283 AromaticContact CE2-CD1 3.77Å; F273-F283 HydrophobicContact CE2-CD1 3.77Å; F273-F283 AromaticContact CE2-CD2 3.72Å; F273-F283 HydrophobicContact CE2-CD2 3.72Å; F273-F283 AromaticContact CE2-CE1 3.84Å; F273-F283 HydrophobicContact CE2-CE1 3.84Å; F273-F283 AromaticContact CE2-CE2 3.79Å; F273-F283 HydrophobicContact CE2-CE2 3.79Å; F273-F283 AromaticContact CE2-CG 3.73Å; F273-F283 HydrophobicContact CE2-CG 3.73Å; F273-F283 AromaticContact CE2-CZ 3.84Å; F273-F283 HydrophobicContact CE2-CZ 3.84Å; F273-F283 HydrophobicContact CZ-CD1 4.07Å; F273-F283 AromaticContact CZ-CE1 3.78Å; F273-F283 HydrophobicContact CZ-CE1 3.78Å; F273-F283 HydrophobicContact CZ-CE2 4.32Å; F273-F283 HydrophobicContact CZ-CG 4.47Å; F273-F283 AromaticContact CZ-CZ 3.91Å; F273-F283 HydrophobicContact CZ-CZ 3.91Å; I279-F283 HydrophobicContact CG2-CE2 4.1Å; I279-F283 VanDerWaalsContact O-CD2 3.22Å; I279-F283 WeakPolarHBondContact O-CD2 3.47Å; N280-F283 PolarHBondContact O-N 2.98Å; E281-F283 VanDerWaalsContact C-N 3.32Å; F283-F285 HydrophobicContact CB-CD2 4.34Å; F283-F285 HydrophobicContact CB-CE2 3.79Å; F283-F285 HydrophobicContact CB-CZ 4.09Å; F283-F285 WeakPolarHBondContact O-CD2 3.15Å; F283-A318 HydrophobicContact CB-CB 4.31Å; F283-A318 HydrophobicContact CD1-CB 4.03Å; F283-A318 HydrophobicContact CG-CB 4.47Å; F283-T319 CarbonylContact C-O 3.52Å; F283-T319 VanDerWaalsContact CA-O 3.26Å; F283-T319 WeakPolarHBondContact CA-O 3.24Å; F283-N320 HydrophobicContact CD1-CB 3.89Å; F283-N320 VanDerWaalsContact CD1-N 3.32Å; F283-N320 HydrophobicContact CE1-CB 3.56Å; F283-N320 HydrophobicContact CZ-CB 3.98Å; F283-N320 WeakPolarHBondContact CZ-ND2 3.31Å; F283-Y327 AromaticContact CE1-CD2 3.63Å; F283-Y327 HydrophobicContact CE1-CD2 3.63Å; F283-Y327 AromaticContact CE1-CE2 3.72Å; F283-Y327 HydrophobicContact CE1-CE2 3.72Å; F283-Y327 HydrophobicContact CZ-CD2 4.33Å; F283-Y327 HydrophobicContact CZ-CE2 4.02Å
284	D	87.9	Confident	79.4	Confident	78 Å²	78	78 Å²	78	42%	0.417	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	124.9	164.6	-67.5	-55.3	0	0	0	109.4	A318 T319 R321	D284-A318 WeakPolarHBondContact O-CA 2.97Å; D284-T319 PolarHBondContact N-O 3.26Å; D284-T319 PolarHBondContact O-N 2.96Å; D284-R321 VanDerWaalsContact CG-NE 3.31Å; D284-R321 IonicContact OD1-CZ 3.68Å; D284-R321 IonicContact OD1-NE 3.19Å; D284-R321 PolarHBondContact OD1-NE 2.82Å; D284-R321 IonicContact OD1-NH2 3.35Å; D284-R321 PolarHBondContact OD1-NH2 2.94Å; D284-R321 WeakPolarHBondContact OD2-CG 3.4Å; D284-R321 IonicContact OD2-NE 3.33Å; D284-R321 PolarHBondContact OD2-NE 2.92Å
285	F	91.3	Very high	79.7	Confident	29 Å²	29	76.3 Å²	76.3	13%	0.127	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	142.5	-176.9	-65.5	-100.6	0	0	0	111.5	L252 C271 F273 N280 F283 G298 D299 E317 A318	L252-F285 HydrophobicContact CD1-CE1 3.9Å; C271-F285 HydrophobicContact CB-CD1 4.48Å; F273-F285 HydrophobicContact CD2-CZ 4.28Å; F273-F285 HydrophobicContact CE2-CE1 4.49Å; F273-F285 HydrophobicContact CE2-CZ 4.28Å; N280-F285 HydrophobicContact CB-CE2 4.41Å; N280-F285 HydrophobicContact CB-CZ 4.27Å; N280-F285 WeakPolarHBondContact O-CE2 3.28Å; F283-F285 HydrophobicContact CB-CD2 4.34Å; F283-F285 HydrophobicContact CB-CE2 3.79Å; F283-F285 HydrophobicContact CB-CZ 4.09Å; F283-F285 WeakPolarHBondContact O-CD2 3.15Å; F285-G298 CarbonylContact C-O 3.58Å; F285-G298 CarbonylContact O-C 3.58Å; F285-G298 WeakPolarHBondContact O-CA 3.47Å; F285-G298 PolarHBondContact O-N 3.17Å; F285-D299 HydrophobicContact CB-CB 4.27Å; F285-D299 HydrophobicContact CD1-CB 4.44Å; F285-D299 HydrophobicContact CD2-CB 4.48Å; F285-D299 HydrophobicContact CG-CB 4.17Å; F285-E317 CarbonylContact C-O 3.54Å; F285-E317 WeakPolarHBondContact CA-O 3.31Å; F285-A318 HydrophobicContact CD1-CB 3.67Å; F285-A318 HydrophobicContact CE1-CB 3.58Å; F285-A318 HydrophobicContact CG-CB 4.38Å; F285-A318 HydrophobicContact CZ-CB 4.22Å
286	R	90.6	Very high	80.4	Confident	90 Å²	90	69.6 Å²	69.6	34%	0.34	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	151.2	168.6	60.8	-177	177.4	-179.8	-0.8	111.7	I288 I294 T296 E317	R286-I288 HydrophobicContact CG-CD1 4.37Å; R286-I288 HydrophobicContact CG-CG1 4.29Å; R286-I294 HydrophobicContact CB-CG2 4.32Å; R286-T296 CarbonylContact C-O 3.53Å; R286-T296 WeakPolarHBondContact CA-O 3.2Å; R286-E317 HydrophobicContact CG-CB 4.09Å; R286-E317 IonicContact CZ-OE1 2.78Å; R286-E317 PolarHBondContact N-O 3.02Å; R286-E317 IonicContact NE-OE1 2.71Å; R286-E317 PolarHBondContact NE-OE1 3.36Å; R286-E317 IonicContact NH2-OE1 3.68Å; R286-E317 PolarHBondContact NH2-OE1 3.28Å; R286-E317 PolarHBondContact O-N 3.37Å
287	W	90.3	Very high	81.2	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	137	171.3	-74.4	87.2	0	0	0	110.6	I254 R269 C271 I294 V295 T296 D299 L301 T315 C316	I254-W287 HydrophobicContact CB-CH2 4.42Å; I254-W287 HydrophobicContact CD1-CH2 3.61Å; I254-W287 HydrophobicContact CD1-CZ3 4.01Å; I254-W287 HydrophobicContact CG1-CH2 3.81Å; I254-W287 HydrophobicContact CG1-CZ2 4.31Å; I254-W287 HydrophobicContact CG2-CH2 3.73Å; I254-W287 HydrophobicContact CG2-CZ2 4.33Å; R269-W287 HydrophobicContact CB-CH2 4.29Å; R269-W287 HydrophobicContact CB-CZ2 4.29Å; C271-W287 HydrophobicContact CB-CZ2 3.75Å; W287-I294 CarbonylContact O-C 3.56Å; W287-I294 WeakPolarHBondContact O-CA 3.4Å; W287-V295 HydrophobicContact CB-CB 4.41Å; W287-V295 PolarHBondContact O-N 2.92Å; W287-T296 PolarHBondContact N-O 2.87Å; W287-D299 PolarHBondContact NE1-O 2.99Å; W287-L301 HydrophobicContact CB-CD1 4.34Å; W287-L301 HydrophobicContact CD2-CB 3.65Å; W287-L301 HydrophobicContact CD2-CD1 4.5Å; W287-L301 HydrophobicContact CD2-CD2 4.27Å; W287-L301 HydrophobicContact CD2-CG 4.37Å; W287-L301 HydrophobicContact CE3-CB 4.12Å; W287-L301 HydrophobicContact CE3-CD2 3.86Å; W287-L301 HydrophobicContact CE3-CG 4.43Å; W287-L301 HydrophobicContact CG-CB 3.94Å; W287-L301 HydrophobicContact CG-CD1 4.42Å; W287-L301 HydrophobicContact CH2-CB 4.24Å; W287-L301 HydrophobicContact CH2-CD2 4.14Å; W287-L301 HydrophobicContact CZ2-CB 3.84Å; W287-L301 HydrophobicContact CZ3-CB 4.4Å; W287-L301 HydrophobicContact CZ3-CD2 3.8Å; W287-T315 CarbonylContact C-O 3.41Å; W287-T315 WeakPolarHBondContact CA-O 3.47Å; W287-C316 HydrophobicContact CD2-CB 3.83Å; W287-C316 HydrophobicContact CE3-CB 3.83Å; W287-C316 HydrophobicContact CH2-CB 3.93Å; W287-C316 HydrophobicContact CZ2-CB 3.89Å; W287-C316 HydrophobicContact CZ3-CB 3.87Å
288	I	88.2	Confident	82	Confident	24 Å²	24	69.3 Å²	69.3	12%	0.123	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	134.6	-172.4	-46.6	178.6	0	0	0	109.2	R286 G292 R293 Y314 T315 E317	R286-I288 HydrophobicContact CG-CD1 4.37Å; R286-I288 HydrophobicContact CG-CG1 4.29Å; I288-G292 VanDerWaalsContact CG2-C 3.49Å; I288-R293 CarbonylContact C-O 3.52Å; I288-R293 VanDerWaalsContact CA-O 3.3Å; I288-R293 WeakPolarHBondContact CA-O 3.36Å; I288-Y314 CarbonylContact O-C 3.59Å; I288-Y314 WeakPolarHBondContact O-CA 3.38Å; I288-T315 PolarHBondContact N-O 2.81Å; I288-T315 PolarHBondContact O-N 2.96Å; I288-E317 HydrophobicContact CD1-CB 4.23Å
289	D	83.1	Confident	82.6	Confident	24 Å²	24	64.6 Å²	64.6	13%	0.128	34%	0.335	C	S	.	.			trans	-78.4	177.8	175.7	84	-13.6	0	0	0	112.8	N291 G292 R293 V295 N313	D289-N291 PolarHBondContact O-N 3.32Å; D289-N291 VanDerWaalsContact O-N 3.13Å; D289-N291 VanDerWaalsContact OD1-C 3.31Å; D289-N291 VanDerWaalsContact OD1-CA 3.26Å; D289-N291 WeakPolarHBondContact OD1-CA 3.49Å; D289-N291 VanDerWaalsContact OD1-CB 3.31Å; D289-N291 WeakPolarHBondContact OD1-CB 3.37Å; D289-N291 PolarHBondContact OD1-N 3.43Å; D289-N291 PolarHBondContact OD2-ND2 2.93Å; D289-G292 PolarHBondContact O-N 3.36Å; D289-G292 VanDerWaalsContact O-N 3.17Å; D289-G292 PolarHBondContact OD1-N 2.83Å; D289-R293 PolarHBondContact N-O 2.84Å; D289-R293 WeakPolarHBondContact OD1-CB 3.18Å; D289-R293 PolarHBondContact OD1-N 2.87Å; D289-V295 HydrophobicContact CB-CG2 3.83Å; D289-N313 CarbonylContact C-O 3.57Å
290	Q	79.1	Confident	83	Confident	117 Å²	117	64.2 Å²	64.2	55%	0.547	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-13.4	176.8	73.5	-170.1	-16.8	0	0	114.8	S312 N313	Q290-S312 VanDerWaalsContact CG-OG 3.22Å; Q290-S312 WeakPolarHBondContact CG-OG 3.47Å; Q290-S312 PolarHBondContact NE2-OG 2.95Å; Q290-S312 PolarHBondContact OE1-OG 3.04Å; Q290-N313 PolarHBondContact N-O 3.08Å; Q290-N313 VanDerWaalsContact N-O 3.17Å
291	N	73	Confident	83.1	Confident	110 Å²	110	62.7 Å²	62.7	59%	0.588	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	-2	179.9	-50.5	-64.8	0	0	0	112.4	D289 R293	D289-N291 PolarHBondContact O-N 3.32Å; D289-N291 VanDerWaalsContact O-N 3.13Å; D289-N291 VanDerWaalsContact OD1-C 3.31Å; D289-N291 VanDerWaalsContact OD1-CA 3.26Å; D289-N291 WeakPolarHBondContact OD1-CA 3.49Å; D289-N291 VanDerWaalsContact OD1-CB 3.31Å; D289-N291 WeakPolarHBondContact OD1-CB 3.37Å; D289-N291 PolarHBondContact OD1-N 3.43Å; D289-N291 PolarHBondContact OD2-ND2 2.93Å; N291-R293 HydrophobicContact CB-CG 4.41Å
292	G	72.5	Confident	83.1	Confident	55 Å²	55	58.6 Å²	58.6	57%	0.567	31%	0.305	S	S	*	.	S	Bend	trans	84.6	7.5	-175.3	0	0	0	0	0	114.7	I288 D289	I288-G292 VanDerWaalsContact CG2-C 3.49Å; D289-G292 PolarHBondContact O-N 3.36Å; D289-G292 VanDerWaalsContact O-N 3.17Å; D289-G292 PolarHBondContact OD1-N 2.83Å
293	R	72	Confident	82.9	Confident	180 Å²	180	56.4 Å²	56.4	68%	0.679	29%	0.293	S	S	*	.			trans	-79.1	136.1	176.3	-62	176.4	171.2	-176.1	-3.9	109.9	I288 D289 N291 V295	I288-R293 CarbonylContact C-O 3.52Å; I288-R293 VanDerWaalsContact CA-O 3.3Å; I288-R293 WeakPolarHBondContact CA-O 3.36Å; D289-R293 PolarHBondContact N-O 2.84Å; D289-R293 WeakPolarHBondContact OD1-CB 3.18Å; D289-R293 PolarHBondContact OD1-N 2.87Å; N291-R293 HydrophobicContact CB-CG 4.41Å; R293-V295 PolarHBondContact O-N 3.39Å
294	I	80.8	Confident	82.1	Confident	80 Å²	80	59.4 Å²	59.4	41%	0.41	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	124.5	173.3	-58.9	174.1	0	0	0	108.7	R286 W287 N297	R286-I294 HydrophobicContact CB-CG2 4.32Å; W287-I294 CarbonylContact O-C 3.56Å; W287-I294 WeakPolarHBondContact O-CA 3.4Å; I294-N297 WeakPolarHBondContact CG2-OD1 3.48Å
295	V	78.6	Confident	81.1	Confident	53 Å²	53	57.6 Å²	57.6	32%	0.321	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	-41.8	-178.1	-176.1	0	0	0	0	110.6	W287 D289 R293 L301 L303 Y314	W287-V295 HydrophobicContact CB-CB 4.41Å; W287-V295 PolarHBondContact O-N 2.92Å; D289-V295 HydrophobicContact CB-CG2 3.83Å; R293-V295 PolarHBondContact O-N 3.39Å; V295-L301 HydrophobicContact CB-CD1 4.43Å; V295-L301 HydrophobicContact CG1-CD1 3.77Å; V295-L303 HydrophobicContact CG1-CD2 4.17Å; V295-Y314 HydrophobicContact CG1-CE1 4.18Å; V295-Y314 HydrophobicContact CG2-CD1 3.99Å; V295-Y314 HydrophobicContact CG2-CE1 3.91Å
296	T	78.8	Confident	79.8	Confident	23 Å²	23	64.2 Å²	64.2	14%	0.141	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	137.7	168	57.6	0	0	0	0	110.5	R286 W287 G298 T300	R286-T296 CarbonylContact C-O 3.53Å; R286-T296 WeakPolarHBondContact CA-O 3.2Å; W287-T296 PolarHBondContact N-O 2.87Å; T296-G298 PolarHBondContact O-N 3.48Å; T296-T300 WeakPolarHBondContact CB-O 3.43Å; T296-T300 WeakPolarHBondContact CG2-O 3.41Å; T296-T300 PolarHBondContact OG1-O 2.02Å
297	N	79	Confident	78.1	Confident	137 Å²	137	63.7 Å²	63.7	73%	0.733	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87	94.4	162.5	-78.8	-37.6	0	0	0	107.4	I294	I294-N297 WeakPolarHBondContact CG2-OD1 3.48Å
298	G	83.5	Confident	76.6	Confident	24 Å²	24	67.8 Å²	67.8	25%	0.247	36%	0.361	C	S	.	.	S	Bend	trans	159.8	174.2	-176.9	0	0	0	0	0	112.5	F285 T296 T300	F285-G298 CarbonylContact C-O 3.58Å; F285-G298 CarbonylContact O-C 3.58Å; F285-G298 WeakPolarHBondContact O-CA 3.47Å; F285-G298 PolarHBondContact O-N 3.17Å; T296-G298 PolarHBondContact O-N 3.48Å; G298-T300 VanDerWaalsContact C-N 3.25Å; G298-T300 PolarHBondContact O-N 2.83Å
299	D	88.4	Confident	75	Confident	55 Å²	55	70.4 Å²	70.4	29%	0.294	38%	0.381	S	S	.	.	S	Bend	trans	-68.7	-23.5	177.6	70.3	-20.1	0	0	0	113.1	Q270 C271 F285 W287	Q270-D299 HydrophobicContact CG-CB 4.41Å; Q270-D299 WeakPolarHBondContact CG-OD2 3.48Å; Q270-D299 PolarHBondContact NE2-OD2 2.99Å; C271-D299 WeakPolarHBondContact CB-O 3.42Å; C271-D299 PolarHBondContact N-O 3.32Å; F285-D299 HydrophobicContact CB-CB 4.27Å; F285-D299 HydrophobicContact CD1-CB 4.44Å; F285-D299 HydrophobicContact CD2-CB 4.48Å; F285-D299 HydrophobicContact CG-CB 4.17Å; W287-D299 PolarHBondContact NE1-O 2.99Å
300	T	86.7	Confident	74	Confident	30 Å²	30	71.9 Å²	71.9	18%	0.184	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	123.8	-166.8	-61	0	0	0	0	112.3	L257 R269 T296 G298	L257-T300 HydrophobicContact CD1-CG2 3.73Å; R269-T300 CarbonylContact O-C 3.6Å; R269-T300 WeakPolarHBondContact O-CA 3.29Å; T296-T300 WeakPolarHBondContact CB-O 3.43Å; T296-T300 WeakPolarHBondContact CG2-O 3.41Å; T296-T300 PolarHBondContact OG1-O 2.02Å; G298-T300 VanDerWaalsContact C-N 3.25Å; G298-T300 PolarHBondContact O-N 2.83Å
301	L	87.8	Confident	73.4	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	131.6	165	177.9	65.8	0	0	0	109.4	M268 R269 W287 V295 L303 Y314 Y331	M268-L301 WeakPolarHBondContact CA-O 3.43Å; R269-L301 HydrophobicContact CB-CB 4.29Å; R269-L301 PolarHBondContact N-O 3.26Å; R269-L301 PolarHBondContact O-N 2.9Å; W287-L301 HydrophobicContact CB-CD1 4.34Å; W287-L301 HydrophobicContact CD2-CB 3.65Å; W287-L301 HydrophobicContact CD2-CD1 4.5Å; W287-L301 HydrophobicContact CD2-CD2 4.27Å; W287-L301 HydrophobicContact CD2-CG 4.37Å; W287-L301 HydrophobicContact CE3-CB 4.12Å; W287-L301 HydrophobicContact CE3-CD2 3.86Å; W287-L301 HydrophobicContact CE3-CG 4.43Å; W287-L301 HydrophobicContact CG-CB 3.94Å; W287-L301 HydrophobicContact CG-CD1 4.42Å; W287-L301 HydrophobicContact CH2-CB 4.24Å; W287-L301 HydrophobicContact CH2-CD2 4.14Å; W287-L301 HydrophobicContact CZ2-CB 3.84Å; W287-L301 HydrophobicContact CZ3-CB 4.4Å; W287-L301 HydrophobicContact CZ3-CD2 3.8Å; V295-L301 HydrophobicContact CB-CD1 4.43Å; V295-L301 HydrophobicContact CG1-CD1 3.77Å; L301-L303 HydrophobicContact CD1-CD1 4.17Å; L301-L303 HydrophobicContact CD1-CD2 4.02Å; L301-L303 HydrophobicContact CD1-CG 3.86Å; L301-L303 HydrophobicContact CD2-CD1 4.01Å; L301-L303 HydrophobicContact CD2-CG 4.45Å; L301-L303 HydrophobicContact CG-CD1 4.19Å; L301-L303 HydrophobicContact CG-CG 4.07Å; L301-Y314 HydrophobicContact CD1-CD1 4Å; L301-Y314 HydrophobicContact CD1-CE1 4.35Å; L301-Y314 HydrophobicContact CD2-CD1 4.29Å; L301-Y314 HydrophobicContact CD2-CG 4.06Å; L301-Y331 HydrophobicContact CD2-CD1 4.14Å
302	Y	82.3	Confident	73.4	Confident	64 Å²	64	63.8 Å²	63.8	25%	0.251	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	126.2	170	177.8	-84.9	0	0	0	107.5	I267 M268 L304 M961	I267-Y302 WeakPolarHBondContact O-CA 3.39Å; M268-Y302 HydrophobicContact CE-CD2 4.05Å; M268-Y302 HydrophobicContact CG-CD2 3.78Å; M268-Y302 HydrophobicContact CG-CE2 4.14Å; M268-Y302 HydrophobicContact SD-CD2 3.97Å; M268-Y302 HydrophobicContact SD-CE2 4.01Å; Y302-L304 HydrophobicContact CE1-CB 4.28Å; Y302-M961 HydrophobicContact CE2-SD 4.27Å
303	L	79	Confident	73.8	Confident	6 Å²	6	64.2 Å²	64.2	3%	0.031	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	148	175.1	-61	168.4	0	0	0	109.2	I267 V295 L301 Y314 V333	I267-L303 HydrophobicContact CB-CB 4.25Å; I267-L303 HydrophobicContact CG2-CD1 4.48Å; I267-L303 PolarHBondContact N-O 3.38Å; I267-L303 PolarHBondContact O-N 3.36Å; V295-L303 HydrophobicContact CG1-CD2 4.17Å; L301-L303 HydrophobicContact CD1-CD1 4.17Å; L301-L303 HydrophobicContact CD1-CD2 4.02Å; L301-L303 HydrophobicContact CD1-CG 3.86Å; L301-L303 HydrophobicContact CD2-CD1 4.01Å; L301-L303 HydrophobicContact CD2-CG 4.45Å; L301-L303 HydrophobicContact CG-CD1 4.19Å; L301-L303 HydrophobicContact CG-CG 4.07Å; L303-Y314 HydrophobicContact CD1-CD1 4.42Å; L303-Y314 HydrophobicContact CD1-CD2 4.08Å; L303-Y314 HydrophobicContact CD1-CE1 3.89Å; L303-Y314 HydrophobicContact CD1-CE2 3.51Å; L303-Y314 VanDerWaalsContact CD1-CZ 3.41Å; L303-Y314 HydrophobicContact CD2-CE1 3.8Å; L303-Y314 HydrophobicContact CG-CE1 4.44Å; L303-V333 HydrophobicContact CD1-CG2 3.94Å
304	L	71	Confident	74.5	Confident	68 Å²	68	56.1 Å²	56.1	36%	0.356	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	93.5	176.5	178.5	69	0	0	0	106.4	T266 Y302 E306 E310	T266-L304 HydrophobicContact CG2-CD1 3.6Å; Y302-L304 HydrophobicContact CE1-CB 4.28Å; L304-E306 VanDerWaalsContact C-N 3.28Å; L304-E306 HydrophobicContact CD2-CG 4.4Å; L304-E306 HydrophobicContact CG-CG 4.16Å; L304-E306 PolarHBondContact O-N 2.87Å; L304-E310 PolarHBondContact N-OE2 2.83Å
305	I	68.2	Low	74.9	Confident	40 Å²	40	53.2 Å²	53.2	21%	0.205	29%	0.293	C	S	.	.			trans	-72.2	82.8	-168.6	-55.1	164.7	0	0	0	110.3	G265 I267 E310 L311 V333	G265-I305 WeakPolarHBondContact O-CG1 3.4Å; G265-I305 PolarHBondContact O-N 2.81Å; I267-I305 HydrophobicContact CD1-CD1 3.74Å; I267-I305 HydrophobicContact CG1-CD1 4.24Å; I305-E310 WeakPolarHBondContact CA-OE2 3.44Å; I305-E310 HydrophobicContact CG1-CB 4.39Å; I305-E310 PolarHBondContact N-OE2 2.98Å; I305-L311 HydrophobicContact CD1-CD2 4.24Å; I305-L311 HydrophobicContact CG2-CD2 3.9Å; I305-V333 HydrophobicContact CD1-CG1 3.58Å; I305-V333 HydrophobicContact CG1-CG1 4.45Å
306	E	63.1	Low	75.5	Confident	168 Å²	168	50.7 Å²	50.7	79%	0.785	28%	0.277	S	S	*	.	S	Bend	trans	-89.9	-31.8	167.9	-59.3	-169	163	0	0	111.1	L304	L304-E306 VanDerWaalsContact C-N 3.28Å; L304-E306 HydrophobicContact CD2-CG 4.4Å; L304-E306 HydrophobicContact CG-CG 4.16Å; L304-E306 PolarHBondContact O-N 2.87Å
307	D	55.4	Low	76.1	Confident	80 Å²	80	50 Å²	50	43%	0.428	27%	0.273	S	S	.	.	S	Bend	trans	-112.3	129.4	177.3	-177.6	3.3	0	0	0	111.6	S309 E310	D307-S309 PolarHBondContact O-N 3Å; D307-S309 PolarHBondContact OD1-N 3.18Å; D307-S309 VanDerWaalsContact OD2-CB 3.24Å; D307-S309 WeakPolarHBondContact OD2-CB 3.29Å; D307-S309 PolarHBondContact OD2-OG 2.85Å; D307-E310 PolarHBondContact O-N 2.81Å
308	P	57.9	Low	76.6	Confident	85 Å²	85	43.5 Å²	43.5	55%	0.552	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-49.6	-15.1	165.1	-30.4	37.2	0	0	0	116.8	E310 L311	P308-E310 PolarHBondContact O-N 3.37Å; P308-L311 HydrophobicContact CB-CD1 4.03Å; P308-L311 VanDerWaalsContact O-CB 3.29Å; P308-L311 WeakPolarHBondContact O-CB 3.25Å; P308-L311 VanDerWaalsContact O-CG 3.25Å; P308-L311 WeakPolarHBondContact O-CG 3.4Å; P308-L311 PolarHBondContact O-N 2.73Å
309	S	56	Low	76.7	Confident	79 Å²	79	44.1 Å²	44.1	55%	0.552	24%	0.237	S	C	*	.	G	3₁₀ helix	trans	-65.6	-23.2	171.7	74.9	0	0	0	0	113.9	D307 L311	D307-S309 PolarHBondContact O-N 3Å; D307-S309 PolarHBondContact OD1-N 3.18Å; D307-S309 VanDerWaalsContact OD2-CB 3.24Å; D307-S309 WeakPolarHBondContact OD2-CB 3.29Å; D307-S309 PolarHBondContact OD2-OG 2.85Å; S309-L311 PolarHBondContact O-N 2.96Å
310	E	60.3	Low	76.4	Confident	55 Å²	55	42 Å²	42	26%	0.257	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-74	-2.9	172.6	-60.2	-157.4	154.5	0	0	113.6	L304 I305 D307 P308 S312 Y314	L304-E310 PolarHBondContact N-OE2 2.83Å; I305-E310 WeakPolarHBondContact CA-OE2 3.44Å; I305-E310 HydrophobicContact CG1-CB 4.39Å; I305-E310 PolarHBondContact N-OE2 2.98Å; D307-E310 PolarHBondContact O-N 2.81Å; P308-E310 PolarHBondContact O-N 3.37Å; E310-S312 PolarHBondContact O-N 3.41Å; E310-Y314 WeakPolarHBondContact O-CE2 3.32Å; E310-Y314 PolarHBondContact O-OH 3.26Å; E310-Y314 VanDerWaalsContact O-OH 3.1Å
311	L	67.9	Low	76.2	Confident	52 Å²	52	47.7 Å²	47.7	27%	0.272	24%	0.243	S	C	.	.			trans	-80.1	64.4	178.4	-54	178.1	0	0	0	110.8	I305 P308 S309 V333 M335	I305-L311 HydrophobicContact CD1-CD2 4.24Å; I305-L311 HydrophobicContact CG2-CD2 3.9Å; P308-L311 HydrophobicContact CB-CD1 4.03Å; P308-L311 VanDerWaalsContact O-CB 3.29Å; P308-L311 WeakPolarHBondContact O-CB 3.25Å; P308-L311 VanDerWaalsContact O-CG 3.25Å; P308-L311 WeakPolarHBondContact O-CG 3.4Å; P308-L311 PolarHBondContact O-N 2.73Å; S309-L311 PolarHBondContact O-N 2.96Å; L311-V333 CarbonylContact C-O 3.55Å; L311-V333 VanDerWaalsContact C-O 3.29Å; L311-V333 HydrophobicContact CD2-CG1 3.78Å; L311-M335 HydrophobicContact CD1-CB 3.9Å; L311-M335 HydrophobicContact CD1-CG 3.44Å; L311-M335 VanDerWaalsContact CD1-CG 3.44Å; L311-M335 HydrophobicContact CD2-CG 3.87Å; L311-M335 HydrophobicContact CG-CG 4.31Å
312	S	71.5	Confident	75.4	Confident	5 Å²	5	55 Å²	55	4%	0.035	28%	0.278	C	S	.	.	S	Bend	trans	-118.8	170.7	-163.6	-160.4	0	0	0	0	113.3	Q290 E310 V333	Q290-S312 VanDerWaalsContact CG-OG 3.22Å; Q290-S312 WeakPolarHBondContact CG-OG 3.47Å; Q290-S312 PolarHBondContact NE2-OG 2.95Å; Q290-S312 PolarHBondContact OE1-OG 3.04Å; E310-S312 PolarHBondContact O-N 3.41Å; S312-V333 PolarHBondContact O-N 2.96Å
313	N	82	Confident	75	Confident	64 Å²	64	56.3 Å²	56.3	34%	0.342	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	121.5	163.3	-58.8	-42.6	0	0	0	108.6	D289 Q290 Y331 R332	D289-N313 CarbonylContact C-O 3.57Å; Q290-N313 PolarHBondContact N-O 3.08Å; Q290-N313 VanDerWaalsContact N-O 3.17Å; N313-Y331 CarbonylContact C-O 3.6Å; N313-Y331 WeakPolarHBondContact CA-O 3.33Å; N313-R332 PolarHBondContact OD1-NE 2.98Å
314	Y	85.8	Confident	74.5	Confident	11 Å²	11	58.1 Å²	58.1	4%	0.043	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	134.4	175.4	-64.2	-95.3	0	0	0	109.4	I288 V295 L301 L303 E310 Y331 V333	I288-Y314 CarbonylContact O-C 3.59Å; I288-Y314 WeakPolarHBondContact O-CA 3.38Å; V295-Y314 HydrophobicContact CG1-CE1 4.18Å; V295-Y314 HydrophobicContact CG2-CD1 3.99Å; V295-Y314 HydrophobicContact CG2-CE1 3.91Å; L301-Y314 HydrophobicContact CD1-CD1 4Å; L301-Y314 HydrophobicContact CD1-CE1 4.35Å; L301-Y314 HydrophobicContact CD2-CD1 4.29Å; L301-Y314 HydrophobicContact CD2-CG 4.06Å; L303-Y314 HydrophobicContact CD1-CD1 4.42Å; L303-Y314 HydrophobicContact CD1-CD2 4.08Å; L303-Y314 HydrophobicContact CD1-CE1 3.89Å; L303-Y314 HydrophobicContact CD1-CE2 3.51Å; L303-Y314 VanDerWaalsContact CD1-CZ 3.41Å; L303-Y314 HydrophobicContact CD2-CE1 3.8Å; L303-Y314 HydrophobicContact CG-CE1 4.44Å; E310-Y314 WeakPolarHBondContact O-CE2 3.32Å; E310-Y314 PolarHBondContact O-OH 3.26Å; E310-Y314 VanDerWaalsContact O-OH 3.1Å; Y314-Y331 PolarHBondContact N-O 3.48Å; Y314-Y331 PolarHBondContact O-N 2.83Å; Y314-Y331 VanDerWaalsContact O-O 3.1Å; Y314-V333 HydrophobicContact CD2-CG2 3.81Å; Y314-V333 HydrophobicContact CE2-CB 4.16Å; Y314-V333 HydrophobicContact CE2-CG2 3.68Å
315	T	90	Very high	74.5	Confident	19 Å²	19	58.2 Å²	58.2	12%	0.117	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	114.5	176	-54	0	0	0	0	108.5	W287 I288 Q328 A329 K330	W287-T315 CarbonylContact C-O 3.41Å; W287-T315 WeakPolarHBondContact CA-O 3.47Å; I288-T315 PolarHBondContact N-O 2.81Å; I288-T315 PolarHBondContact O-N 2.96Å; T315-Q328 HydrophobicContact CG2-CB 3.99Å; T315-Q328 HydrophobicContact CG2-CG 3.97Å; T315-A329 CarbonylContact C-O 3.41Å; T315-A329 WeakPolarHBondContact CA-O 3.1Å; T315-K330 HydrophobicContact CG2-CG 4.07Å
316	C	91.6	Very high	74.9	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	137.8	159.9	167.9	0	0	0	0	108.5	I254 C271 W287 Q328 A329	I254-C316 HydrophobicContact CD1-CB 4.18Å; I254-C316 HydrophobicContact CG1-CB 4.44Å; C271-C316 HydrophobicContact CB-CB 3.74Å; C271-C316 WeakPolarHBondContact CB-SG 3.4Å; C271-C316 WeakPolarHBondContact SG-CB 3.27Å; C271-C316 CovalentContact SG-SG 2.01Å; C271-C316 PolarHBondContact SG-SG 3.37Å; W287-C316 HydrophobicContact CD2-CB 3.83Å; W287-C316 HydrophobicContact CE3-CB 3.83Å; W287-C316 HydrophobicContact CH2-CB 3.93Å; W287-C316 HydrophobicContact CZ2-CB 3.89Å; W287-C316 HydrophobicContact CZ3-CB 3.87Å; C316-Q328 CarbonylContact O-C 3.49Å; C316-Q328 VanDerWaalsContact O-CA 3.28Å; C316-Q328 WeakPolarHBondContact O-CA 3.45Å; C316-A329 PolarHBondContact N-O 2.64Å; C316-A329 PolarHBondContact O-N 2.73Å
317	E	90.9	Very high	76	Confident	9 Å²	9	54.9 Å²	54.9	4%	0.042	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	130	173.5	-171.6	174.1	88	0	0	109.8	F285 R286 I288 I326 Y327 Q328	F285-E317 CarbonylContact C-O 3.54Å; F285-E317 WeakPolarHBondContact CA-O 3.31Å; R286-E317 HydrophobicContact CG-CB 4.09Å; R286-E317 IonicContact CZ-OE1 2.78Å; R286-E317 PolarHBondContact N-O 3.02Å; R286-E317 IonicContact NE-OE1 2.71Å; R286-E317 PolarHBondContact NE-OE1 3.36Å; R286-E317 IonicContact NH2-OE1 3.68Å; R286-E317 PolarHBondContact NH2-OE1 3.28Å; R286-E317 PolarHBondContact O-N 3.37Å; I288-E317 HydrophobicContact CD1-CB 4.23Å; E317-I326 VanDerWaalsContact CD-CG2 3.48Å; E317-I326 HydrophobicContact CG-CG2 3.3Å; E317-Y327 CarbonylContact C-O 3.55Å; E317-Y327 WeakPolarHBondContact CA-O 3.27Å; E317-Q328 HydrophobicContact CB-CG 4.21Å; E317-Q328 HydrophobicContact CG-CG 3.95Å; E317-Q328 PolarHBondContact OE2-NE2 3.05Å
318	A	88.9	Confident	77.6	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	116.5	175.3	0	0	0	0	0	109.1	L252 F273 F283 D284 F285 Y327	L252-A318 HydrophobicContact CD1-CB 3.93Å; L252-A318 HydrophobicContact CD2-CB 3.91Å; F273-A318 HydrophobicContact CE2-CB 4Å; F273-A318 HydrophobicContact CZ-CB 4.1Å; F283-A318 HydrophobicContact CB-CB 4.31Å; F283-A318 HydrophobicContact CD1-CB 4.03Å; F283-A318 HydrophobicContact CG-CB 4.47Å; D284-A318 WeakPolarHBondContact O-CA 2.97Å; F285-A318 HydrophobicContact CD1-CB 3.67Å; F285-A318 HydrophobicContact CE1-CB 3.58Å; F285-A318 HydrophobicContact CG-CB 4.38Å; F285-A318 HydrophobicContact CZ-CB 4.22Å; A318-Y327 PolarHBondContact N-O 2.86Å; A318-Y327 PolarHBondContact O-N 3.37Å
319	T	86.1	Confident	78.9	Confident	36 Å²	36	52.9 Å²	52.9	22%	0.221	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	121.5	-177.4	-57.9	0	0	0	0	110.1	F283 D284 R321 I326	F283-T319 CarbonylContact C-O 3.52Å; F283-T319 VanDerWaalsContact CA-O 3.26Å; F283-T319 WeakPolarHBondContact CA-O 3.24Å; D284-T319 PolarHBondContact N-O 3.26Å; D284-T319 PolarHBondContact O-N 2.96Å; T319-R321 PolarHBondContact O-N 2.03Å; T319-I326 HydrophobicContact CG2-CG1 4.11Å
320	N	82.5	Confident	80.4	Confident	10 Å²	10	56.6 Å²	56.6	5%	0.053	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	125.9	179.3	-173.6	-78.8	0	0	0	111.2	F283 Q322 T323 G324 V325	F283-N320 HydrophobicContact CD1-CB 3.89Å; F283-N320 VanDerWaalsContact CD1-N 3.32Å; F283-N320 HydrophobicContact CE1-CB 3.56Å; F283-N320 HydrophobicContact CZ-CB 3.98Å; F283-N320 WeakPolarHBondContact CZ-ND2 3.31Å; N320-Q322 PolarHBondContact O-N 2.99Å; N320-Q322 PolarHBondContact OD1-N 3.44Å; N320-T323 VanDerWaalsContact CB-OG1 3.32Å; N320-T323 WeakPolarHBondContact CB-OG1 3.46Å; N320-T323 VanDerWaalsContact CG-OG1 3.27Å; N320-T323 PolarHBondContact OD1-N 3.2Å; N320-T323 PolarHBondContact OD1-OG1 2.91Å; N320-T323 VanDerWaalsContact OD1-OG1 3.13Å; N320-G324 VanDerWaalsContact O-CA 3.32Å; N320-G324 WeakPolarHBondContact O-CA 3.19Å; N320-G324 PolarHBondContact O-N 2.85Å; N320-V325 HydrophobicContact CB-CB 4.45Å; N320-V325 PolarHBondContact N-O 3.16Å
321	R	81.4	Confident	81.7	Confident	151 Å²	151	55.4 Å²	55.4	57%	0.57	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-23.5	-175.6	-76.3	170.1	168.6	171.2	-5.6	114.8	E281 L282 D284 T319	E281-R321 PolarHBondContact O-NH1 3.23Å; L282-R321 WeakPolarHBondContact O-CB 3.34Å; L282-R321 PolarHBondContact O-N 2.89Å; D284-R321 VanDerWaalsContact CG-NE 3.31Å; D284-R321 IonicContact OD1-CZ 3.68Å; D284-R321 IonicContact OD1-NE 3.19Å; D284-R321 PolarHBondContact OD1-NE 2.82Å; D284-R321 IonicContact OD1-NH2 3.35Å; D284-R321 PolarHBondContact OD1-NH2 2.94Å; D284-R321 WeakPolarHBondContact OD2-CG 3.4Å; D284-R321 IonicContact OD2-NE 3.33Å; D284-R321 PolarHBondContact OD2-NE 2.92Å; T319-R321 PolarHBondContact O-N 2.03Å
322	Q	72.7	Confident	82.5	Confident	154 Å²	154	61.3 Å²	61.3	72%	0.72	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	-40.3	-176.1	-59.6	-177.1	10.3	0	0	112.4	N320	N320-Q322 PolarHBondContact O-N 2.99Å; N320-Q322 PolarHBondContact OD1-N 3.44Å
323	T	73.1	Confident	82.5	Confident	90 Å²	90	61.4 Å²	61.4	55%	0.552	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	-12.1	-173.4	64.2	0	0	0	0	113.9	N320 V325	N320-T323 VanDerWaalsContact CB-OG1 3.32Å; N320-T323 WeakPolarHBondContact CB-OG1 3.46Å; N320-T323 VanDerWaalsContact CG-OG1 3.27Å; N320-T323 PolarHBondContact OD1-N 3.2Å; N320-T323 PolarHBondContact OD1-OG1 2.91Å; N320-T323 VanDerWaalsContact OD1-OG1 3.13Å; T323-V325 PolarHBondContact O-N 3.19Å; T323-V325 WeakPolarHBondContact OG1-CG2 3.38Å; T323-V325 PolarHBondContact OG1-N 2.91Å
324	G	67.4	Low	81.7	Confident	45 Å²	45	61.9 Å²	61.9	46%	0.464	31%	0.31	S	S	.	.			trans	66.2	8.7	-173.1	0	0	0	0	0	114.1	N320 I326	N320-G324 VanDerWaalsContact O-CA 3.32Å; N320-G324 WeakPolarHBondContact O-CA 3.19Å; N320-G324 PolarHBondContact O-N 2.85Å; G324-I326 PolarHBondContact O-N 2.82Å
325	V	71.7	Confident	80.2	Confident	70 Å²	70	68.1 Å²	68.1	42%	0.424	34%	0.341	S	S	.	.			trans	-69.9	125	-179.5	175.8	0	0	0	0	109.8	N320 T323 Y327	N320-V325 HydrophobicContact CB-CB 4.45Å; N320-V325 PolarHBondContact N-O 3.16Å; T323-V325 PolarHBondContact O-N 3.19Å; T323-V325 WeakPolarHBondContact OG1-CG2 3.38Å; T323-V325 PolarHBondContact OG1-N 2.91Å; V325-Y327 HydrophobicContact CB-CE2 4.42Å; V325-Y327 HydrophobicContact CG1-CD2 4.12Å; V325-Y327 HydrophobicContact CG1-CE2 3.58Å
326	I	77.3	Confident	78.3	Confident	86 Å²	86	72 Å²	72	44%	0.441	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	123.7	-176.9	-58	-177.3	0	0	0	110.3	E317 T319 G324 Q328	E317-I326 VanDerWaalsContact CD-CG2 3.48Å; E317-I326 HydrophobicContact CG-CG2 3.3Å; T319-I326 HydrophobicContact CG2-CG1 4.11Å; G324-I326 PolarHBondContact O-N 2.82Å; I326-Q328 HydrophobicContact CG2-CG 4.21Å
327	Y	85.1	Confident	75.7	Confident	52 Å²	52	80.2 Å²	80.2	20%	0.204	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	143	167.9	-65.7	-108.7	0	0	0	108.8	Y247 L250 F273 F283 E317 A318 V325	Y247-Y327 PolarHBondContact O-OH 2.9Å; L250-Y327 HydrophobicContact CB-CE1 3.85Å; L250-Y327 WeakPolarHBondContact O-CE1 3.49Å; F273-Y327 AromaticContact CE1-CD1 3.91Å; F273-Y327 HydrophobicContact CE1-CD1 3.91Å; F273-Y327 HydrophobicContact CE1-CD2 4.47Å; F273-Y327 HydrophobicContact CE1-CE1 4.34Å; F273-Y327 AromaticContact CE1-CG 3.99Å; F273-Y327 HydrophobicContact CE1-CG 3.99Å; F273-Y327 HydrophobicContact CZ-CD1 4.24Å; F273-Y327 HydrophobicContact CZ-CD2 4.01Å; F273-Y327 AromaticContact CZ-CG 3.84Å; F273-Y327 HydrophobicContact CZ-CG 3.84Å; F283-Y327 AromaticContact CE1-CD2 3.63Å; F283-Y327 HydrophobicContact CE1-CD2 3.63Å; F283-Y327 AromaticContact CE1-CE2 3.72Å; F283-Y327 HydrophobicContact CE1-CE2 3.72Å; F283-Y327 HydrophobicContact CZ-CD2 4.33Å; F283-Y327 HydrophobicContact CZ-CE2 4.02Å; E317-Y327 CarbonylContact C-O 3.55Å; E317-Y327 WeakPolarHBondContact CA-O 3.27Å; A318-Y327 PolarHBondContact N-O 2.86Å; A318-Y327 PolarHBondContact O-N 3.37Å; V325-Y327 HydrophobicContact CB-CE2 4.42Å; V325-Y327 HydrophobicContact CG1-CD2 4.12Å; V325-Y327 HydrophobicContact CG1-CE2 3.58Å
328	Q	88.7	Confident	72.8	Confident	107 Å²	107	82.8 Å²	82.8	50%	0.5	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	139.3	178.7	-75.6	-176.7	-5.6	0	0	111.8	T315 C316 E317 I326	T315-Q328 HydrophobicContact CG2-CB 3.99Å; T315-Q328 HydrophobicContact CG2-CG 3.97Å; C316-Q328 CarbonylContact O-C 3.49Å; C316-Q328 VanDerWaalsContact O-CA 3.28Å; C316-Q328 WeakPolarHBondContact O-CA 3.45Å; E317-Q328 HydrophobicContact CB-CG 4.21Å; E317-Q328 HydrophobicContact CG-CG 3.95Å; E317-Q328 PolarHBondContact OE2-NE2 3.05Å; I326-Q328 HydrophobicContact CG2-CG 4.21Å
329	A	85.2	Confident	70	Confident	15 Å²	15	91.9 Å²	91.9	12%	0.124	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	139.7	173.6	0	0	0	0	0	109.7	L252 I254 T315 C316	L252-A329 HydrophobicContact CB-CB 4.43Å; L252-A329 HydrophobicContact CD2-CB 4.06Å; L252-A329 HydrophobicContact CG-CB 4.03Å; I254-A329 HydrophobicContact CD1-CB 3.54Å; I254-A329 HydrophobicContact CG1-CB 3.91Å; T315-A329 CarbonylContact C-O 3.41Å; T315-A329 WeakPolarHBondContact CA-O 3.1Å; C316-A329 PolarHBondContact N-O 2.64Å; C316-A329 PolarHBondContact O-N 2.73Å
330	K	88.6	Confident	67.4	Low	158 Å²	158	97.8 Å²	97.8	69%	0.687	50%	0.501	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.9	133.2	-172.4	-66.5	-173	177.1	-178.5	0	112.2	T315	T315-K330 HydrophobicContact CG2-CG 4.07Å
331	Y	87.6	Confident	65.3	Low	30 Å²	30	101 Å²	101	12%	0.118	53%	0.53	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	143.8	176	-174.6	-114.8	0	0	0	109.2	I254 I267 R269 L301 N313 Y314 V333	I254-Y331 HydrophobicContact CG2-CD2 4.26Å; I267-Y331 HydrophobicContact CG2-CE1 3.77Å; R269-Y331 HydrophobicContact CG-CD1 4.42Å; R269-Y331 HydrophobicContact CG-CE1 3.95Å; R269-Y331 HydrophobicContact CG-CE2 4.23Å; R269-Y331 PolarHBondContact NE-OH 2.68Å; L301-Y331 HydrophobicContact CD2-CD1 4.14Å; N313-Y331 CarbonylContact C-O 3.6Å; N313-Y331 WeakPolarHBondContact CA-O 3.33Å; Y314-Y331 PolarHBondContact N-O 3.48Å; Y314-Y331 PolarHBondContact O-N 2.83Å; Y314-Y331 VanDerWaalsContact O-O 3.1Å; Y331-V333 HydrophobicContact CD1-CG2 4.02Å; Y331-V333 HydrophobicContact CE1-CG2 3.67Å
332	R	83.8	Confident	63.6	Low	175 Å²	175	100 Å²	100	66%	0.66	53%	0.533	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.7	125.8	179.1	166.9	175.2	-93.7	-157.1	-15.8	109.3	N313	N313-R332 PolarHBondContact OD1-NE 2.98Å
333	V	72.9	Confident	62.7	Low	7 Å²	7	100.8 Å²	100.8	4%	0.042	54%	0.536	C	S	.	.			trans	-97.6	132.3	170.5	-178.7	0	0	0	0	108.5	I267 L303 I305 L311 S312 Y314 Y331	I267-V333 HydrophobicContact CD1-CB 4.37Å; I267-V333 HydrophobicContact CD1-CG1 3.73Å; I267-V333 HydrophobicContact CD1-CG2 3.78Å; L303-V333 HydrophobicContact CD1-CG2 3.94Å; I305-V333 HydrophobicContact CD1-CG1 3.58Å; I305-V333 HydrophobicContact CG1-CG1 4.45Å; L311-V333 CarbonylContact C-O 3.55Å; L311-V333 VanDerWaalsContact C-O 3.29Å; L311-V333 HydrophobicContact CD2-CG1 3.78Å; S312-V333 PolarHBondContact O-N 2.96Å; Y314-V333 HydrophobicContact CD2-CG2 3.81Å; Y314-V333 HydrophobicContact CE2-CB 4.16Å; Y314-V333 HydrophobicContact CE2-CG2 3.68Å; Y331-V333 HydrophobicContact CD1-CG2 4.02Å; Y331-V333 HydrophobicContact CE1-CG2 3.67Å
334	S	64.6	Low	62.4	Low	74 Å²	74	98.1 Å²	98.1	52%	0.517	52%	0.518	S	S	.	.			trans	-157	131.9	178.1	57.5	0	0	0	0	111.4	L336	S334-L336 PolarHBondContact O-N 3.03Å
335	M	53.4	Low	62.7	Low	142 Å²	142	100.2 Å²	100.2	70%	0.7	52%	0.517	S	S	*	.			trans	-62	115.2	176.2	-88.6	-73.9	-127.7	0	0	111.9	L311 N337	L311-M335 HydrophobicContact CD1-CB 3.9Å; L311-M335 HydrophobicContact CD1-CG 3.44Å; L311-M335 VanDerWaalsContact CD1-CG 3.44Å; L311-M335 HydrophobicContact CD2-CG 3.87Å; L311-M335 HydrophobicContact CG-CG 4.31Å; M335-N337 PolarHBondContact O-N 3.35Å; M335-N337 VanDerWaalsContact O-N 3.17Å
336	L	50.3	Low	63.1	Low	102 Å²	102	97.5 Å²	97.5	53%	0.534	50%	0.501	S	S	.	.			trans	-82	92.6	172.6	-79.5	172.5	0	0	0	110.7	S334 G338 Q340	S334-L336 PolarHBondContact O-N 3.03Å; L336-G338 VanDerWaalsContact C-N 3.26Å; L336-G338 PolarHBondContact O-N 3.33Å; L336-Q340 HydrophobicContact CD1-CB 4.25Å; L336-Q340 HydrophobicContact CD2-CB 3.98Å; L336-Q340 VanDerWaalsContact CD2-CD 3.47Å; L336-Q340 HydrophobicContact CD2-CG 3.69Å
337	N	37.6	Very low	63.4	Low	171 Å²	171	95.8 Å²	95.8	91%	0.914	49%	0.492	S	S	*	.			trans	-69.8	79	177.6	-135.3	5.9	0	0	0	110.9	M335	M335-N337 PolarHBondContact O-N 3.35Å; M335-N337 VanDerWaalsContact O-N 3.17Å
338	G	30.7	Very low	63.3	Low	64 Å²	64	93.9 Å²	93.9	66%	0.66	49%	0.486	S	S	*	.	S	Bend	trans	81.6	96.7	175.5	0	0	0	0	0	115	L336	L336-G338 VanDerWaalsContact C-N 3.26Å; L336-G338 PolarHBondContact O-N 3.33Å
339	Q	28.9	Very low	62.9	Low	191 Å²	191	94.6 Å²	94.6	89%	0.893	48%	0.484	S	S	*	.			trans	45.8	80.3	162	-59.5	-172.9	-97.7	0	0	116.7	A341	Q339-A341 VanDerWaalsContact C-N 3.27Å; Q339-A341 PolarHBondContact O-N 2.68Å
340	Q	32.1	Very low	62.2	Low	159 Å²	159	96.5 Å²	96.5	74%	0.743	50%	0.495	S	S	*	.			trans	-67.8	95.7	145.7	-95.3	-174.1	-5.3	0	0	108.6	L336	L336-Q340 HydrophobicContact CD1-CB 4.25Å; L336-Q340 HydrophobicContact CD2-CB 3.98Å; L336-Q340 VanDerWaalsContact CD2-CD 3.47Å; L336-Q340 HydrophobicContact CD2-CG 3.69Å
341	A	37.3	Very low	60.9	Low	79 Å²	79	95.6 Å²	95.6	65%	0.653	50%	0.496	S	S	*	.			trans	-61.4	145.5	149.4	0	0	0	0	0	108	Q339 Q343	Q339-A341 VanDerWaalsContact C-N 3.27Å; Q339-A341 PolarHBondContact O-N 2.68Å; A341-Q343 PolarHBondContact O-N 2.88Å; A341-Q343 VanDerWaalsContact O-N 3.13Å
342	M	46	Very low	59.5	Low	129 Å²	129	98.3 Å²	98.3	64%	0.635	52%	0.516	S	S	*	.			trans	-54.8	123.2	161.4	-80.3	171.4	60.1	0	0	107.5	H344 P369	M342-H344 PolarHBondContact O-CE1 3.47Å; M342-H344 PolarHBondContact O-N 2.79Å; M342-H344 PolarHBondContact O-ND1 3.38Å; M342-P369 HydrophobicContact CE-CB 4.39Å; M342-P369 HydrophobicContact CE-CG 3.6Å
343	Q	53.9	Low	58.1	Low	170 Å²	170	90.7 Å²	90.7	79%	0.794	49%	0.492	S	S	*	.			trans	-78.1	95.6	-178.3	-173.5	171.1	-3.7	0	0	108.6	A341 I345	A341-Q343 PolarHBondContact O-N 2.88Å; A341-Q343 VanDerWaalsContact O-N 3.13Å; Q343-I345 PolarHBondContact O-N 2.75Å
344	H	67	Low	57.5	Low	35 Å²	35	95.6 Å²	95.6	16%	0.162	52%	0.518	C	S	.	.			trans	-74.2	111.6	176.1	-64.2	72.1	0	0	0	108.3	M342 V367 P369 W411	M342-H344 PolarHBondContact O-CE1 3.47Å; M342-H344 PolarHBondContact O-N 2.79Å; M342-H344 PolarHBondContact O-ND1 3.38Å; H344-V367 HydrophobicContact CB-CG1 3.87Å; H344-P369 PolarHBondContact CD2-O 3.4Å; H344-W411 HydrophobicContact CB-CH2 3.7Å; H344-W411 HydrophobicContact CB-CZ2 3.68Å; H344-W411 AromaticContact CG-CZ2 3.55Å; H344-W411 AromaticContact ND1-CZ2 3.74Å
345	I	73.7	Confident	57.5	Low	88 Å²	88	92.2 Å²	92.2	45%	0.451	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	129.7	179.4	-57.5	176.5	0	0	0	108	Q343 V367 E368	Q343-I345 PolarHBondContact O-N 2.75Å; I345-V367 CarbonylContact O-C 3.46Å; I345-V367 WeakPolarHBondContact O-CA 3.05Å; I345-E368 WeakPolarHBondContact CB-O 3Å; I345-E368 PolarHBondContact N-O 2.85Å; I345-E368 PolarHBondContact O-N 3.08Å
346	V	81.5	Confident	57.9	Low	14 Å²	14	90.8 Å²	90.8	9%	0.085	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	128.7	172	179.6	0	0	0	0	108.4	C365 E366 V367 A409 A424 A426	V346-C365 WeakPolarHBondContact CG1-SG 3.07Å; V346-E366 VanDerWaalsContact CA-O 3.32Å; V346-E366 WeakPolarHBondContact CA-O 3.41Å; V346-V367 HydrophobicContact CG2-CG2 4.28Å; V346-A409 HydrophobicContact CG2-CB 3.92Å; V346-A424 HydrophobicContact CB-CB 4.39Å; V346-A424 HydrophobicContact CG2-CB 3.4Å; V346-A424 VanDerWaalsContact CG2-CB 3.4Å; V346-A426 HydrophobicContact CB-CB 4.21Å; V346-A426 HydrophobicContact CG1-CB 3.74Å; V346-A426 WeakPolarHBondContact O-CB 3.38Å
347	N	82.9	Confident	58.7	Low	49 Å²	49	88 Å²	88	26%	0.262	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	148.4	-179.6	-73.8	-37.7	0	0	0	110	C365 E366 E368	N347-C365 WeakPolarHBondContact O-CA 3.34Å; N347-E366 PolarHBondContact N-O 3.38Å; N347-E366 PolarHBondContact O-N 3.04Å; N347-E368 PolarHBondContact ND2-OE2 2.82Å
348	I	83	Confident	60	Low	13 Å²	13	82.1 Å²	82.1	7%	0.067	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	127.2	169.7	-66	165.6	0	0	0	108.8	I351 M363 V364 W379 C407 A426 L428	I348-I351 WeakPolarHBondContact O-CG1 3.38Å; I348-M363 HydrophobicContact CG2-CB 4.18Å; I348-V364 CarbonylContact C-O 3.45Å; I348-V364 WeakPolarHBondContact CA-O 3.41Å; I348-W379 HydrophobicContact CD1-CH2 4Å; I348-W379 HydrophobicContact CD1-CZ3 3.8Å; I348-W379 HydrophobicContact CG1-CH2 3.91Å; I348-W379 HydrophobicContact CG1-CZ3 4.25Å; I348-W379 HydrophobicContact CG2-CH2 3.98Å; I348-C407 HydrophobicContact CD1-CB 4.08Å; I348-C407 HydrophobicContact CG1-CB 4.24Å; I348-A426 HydrophobicContact CD1-CB 3.76Å; I348-A426 WeakPolarHBondContact CD1-O 3.34Å; I348-A426 HydrophobicContact CG1-CB 3.8Å; I348-L428 HydrophobicContact CD1-CB 3.94Å; I348-L428 HydrophobicContact CG2-CB 4.19Å; I348-L428 HydrophobicContact CG2-CD2 3.71Å
349	R	79.7	Confident	61.9	Low	121 Å²	121	86.9 Å²	86.9	46%	0.457	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	137.1	173.3	-56.9	-165	-165.8	-128.3	2.6	110.5	M363 V364 E366 E368	R349-M363 WeakPolarHBondContact O-CA 3.35Å; R349-V364 PolarHBondContact N-O 3.25Å; R349-V364 PolarHBondContact O-N 3.46Å; R349-E366 VanDerWaalsContact CD-OE1 3.3Å; R349-E366 WeakPolarHBondContact CD-OE1 3.28Å; R349-E366 IonicContact CZ-OE2 2.83Å; R349-E366 VanDerWaalsContact NE-CD 3.31Å; R349-E366 IonicContact NE-OE1 2.74Å; R349-E366 PolarHBondContact NE-OE1 2.87Å; R349-E366 IonicContact NE-OE2 3.51Å; R349-E366 PolarHBondContact NE-OE2 2.9Å; R349-E366 IonicContact NH2-OE2 3.16Å; R349-E366 PolarHBondContact NH2-OE2 2.63Å; R349-E368 IonicContact CZ-OE1 2.76Å; R349-E368 IonicContact NH2-OE1 3.48Å; R349-E368 PolarHBondContact NH2-OE1 3.13Å
350	P	71.8	Confident	64.3	Low	55 Å²	55	81.4 Å²	81.4	36%	0.357	43%	0.432	S	S	.	.	S	Bend	cis	-71.8	150.6	-9.8	32.7	-35.3	0	0	0	111.8	T352 E362	P350-T352 VanDerWaalsContact C-N 3.32Å; P350-E362 WeakPolarHBondContact CD-O 3.44Å
351	I	59.4	Low	66.7	Low	140 Å²	140	75.5 Å²	75.5	72%	0.718	40%	0.403	S	S	*	.			trans	-74.3	-26.9	178.4	-61.1	167.4	0	0	0	111.1	I348 G353	I348-I351 WeakPolarHBondContact O-CG1 3.38Å; I351-G353 PolarHBondContact O-N 3.02Å
352	T	58.2	Low	69	Low	86 Å²	86	75.9 Å²	75.9	53%	0.528	39%	0.392	S	S	.	.			trans	-76.5	108.2	-179.6	50	0	0	0	0	111.2	P350 D354 Y361	P350-T352 VanDerWaalsContact C-N 3.32Å; T352-D354 PolarHBondContact O-N 3.17Å; T352-Y361 PolarHBondContact O-OH 3.11Å
353	G	56.1	Low	70.9	Confident	16 Å²	16	69.8 Å²	69.8	17%	0.165	36%	0.362	C	S	.	.			trans	-73	22.2	176.8	0	0	0	0	0	115.6	I351 V355	I351-G353 PolarHBondContact O-N 3.02Å; G353-V355 PolarHBondContact O-N 3.08Å
354	D	58.8	Low	72.7	Confident	109 Å²	109	64 Å²	64	58%	0.583	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.7	102.5	-177.5	-65.5	-50.7	0	0	0	110.6	T352 T433	T352-D354 PolarHBondContact O-N 3.17Å; D354-T433 HydrophobicContact CB-CG2 3.82Å; D354-T433 WeakPolarHBondContact OD1-CG2 3.32Å
355	V	64.4	Low	73.8	Confident	3 Å²	3	62.5 Å²	62.5	2%	0.018	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	139.6	-169.2	-73.2	0	0	0	0	115.3	G353 Y361 L397 L430 A431	G353-V355 PolarHBondContact O-N 3.08Å; V355-Y361 HydrophobicContact CG1-CD2 3.7Å; V355-Y361 HydrophobicContact CG1-CE1 4.41Å; V355-Y361 HydrophobicContact CG1-CE2 3.54Å; V355-Y361 HydrophobicContact CG1-CG 4.17Å; V355-L397 HydrophobicContact CB-CD2 3.48Å; V355-L397 VanDerWaalsContact CB-CD2 3.48Å; V355-L397 HydrophobicContact CG1-CD2 3.98Å; V355-L397 HydrophobicContact CG2-CD2 3.9Å; V355-L430 HydrophobicContact CG1-CB 4.49Å; V355-L430 HydrophobicContact CG1-CD1 4.35Å; V355-L430 HydrophobicContact CG1-CD2 3.95Å; V355-L430 HydrophobicContact CG1-CG 4.49Å; V355-L430 HydrophobicContact CG2-CB 4.35Å; V355-A431 VanDerWaalsContact CG2-O 3.26Å; V355-A431 WeakPolarHBondContact CG2-O 3.4Å
356	I	63.6	Low	74.4	Confident	113 Å²	113	61.1 Å²	61.1	58%	0.579	32%	0.323	S	S	*	.			trans	-109.4	118.3	177.2	-55.7	175.9	0	0	0	109.6	R359	I356-R359 HydrophobicContact CB-CB 4.42Å; I356-R359 HydrophobicContact CB-CG 3.92Å; I356-R359 HydrophobicContact CG2-CG 3.81Å; I356-R359 WeakPolarHBondContact O-CB 3.41Å; I356-R359 PolarHBondContact O-N 2.99Å
357	I	65.6	Low	74.6	Confident	44 Å²	44	61 Å²	61	23%	0.226	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	138.3	175.3	-60.3	-61.4	0	0	0	110.7	R359 L397 Y399 I402 L432	I357-R359 VanDerWaalsContact C-N 3.29Å; I357-R359 PolarHBondContact O-N 2.81Å; I357-L397 HydrophobicContact CD1-CD2 4.1Å; I357-L397 HydrophobicContact CD1-CG 4.21Å; I357-Y399 HydrophobicContact CG1-CE2 4.45Å; I357-Y399 HydrophobicContact CG2-CD2 4.41Å; I357-Y399 HydrophobicContact CG2-CE2 4.25Å; I357-I402 HydrophobicContact CD1-CD1 4.31Å; I357-I402 HydrophobicContact CD1-CG1 4.45Å; I357-L432 HydrophobicContact CD1-CD2 4.03Å; I357-L432 HydrophobicContact CG1-CD2 3.73Å
358	G	65.2	Low	74.4	Confident	47 Å²	47	62.3 Å²	62.3	49%	0.485	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.1	-1.3	-177.5	0	0	0	0	0	115.2	L397	G358-L397 PolarHBondContact N-O 3.2Å
359	R	71.3	Confident	74.2	Confident	164 Å²	164	64.6 Å²	64.6	62%	0.619	34%	0.342	S	S	*	.	S	Bend	trans	-93.6	152.2	167.9	-64.6	-64.1	-176.8	164.8	-1.1	110.8	I356 I357 L397	I356-R359 HydrophobicContact CB-CB 4.42Å; I356-R359 HydrophobicContact CB-CG 3.92Å; I356-R359 HydrophobicContact CG2-CG 3.81Å; I356-R359 WeakPolarHBondContact O-CB 3.41Å; I356-R359 PolarHBondContact O-N 2.99Å; I357-R359 VanDerWaalsContact C-N 3.29Å; I357-R359 PolarHBondContact O-N 2.81Å; R359-L397 WeakPolarHBondContact O-CB 3.43Å; R359-L397 PolarHBondContact O-N 3.3Å
360	P	79.2	Confident	74	Confident	76 Å²	76	63.3 Å²	63.3	49%	0.494	35%	0.35	S	S	.	.			trans	-66	145.3	163.5	29.7	-33.9	0	0	0	109.7	L394	P360-L394 CarbonylContact C-O 3.56Å; P360-L394 WeakPolarHBondContact CA-O 3.45Å
361	Y	81.9	Confident	74.1	Confident	34 Å²	34	61.6 Å²	61.6	13%	0.133	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	141	175.1	-170.3	-95.6	0	0	0	109.3	T352 V355 M363 L394 L430	T352-Y361 PolarHBondContact O-OH 3.11Å; V355-Y361 HydrophobicContact CG1-CD2 3.7Å; V355-Y361 HydrophobicContact CG1-CE1 4.41Å; V355-Y361 HydrophobicContact CG1-CE2 3.54Å; V355-Y361 HydrophobicContact CG1-CG 4.17Å; Y361-M363 HydrophobicContact CD1-CE 4.11Å; Y361-M363 HydrophobicContact CE1-CB 4.29Å; Y361-M363 HydrophobicContact CE1-CE 3.86Å; Y361-L394 PolarHBondContact N-O 2.78Å; Y361-L394 PolarHBondContact O-N 2.81Å; Y361-L430 HydrophobicContact CD1-CD1 4.3Å; Y361-L430 HydrophobicContact CD1-CD2 4.4Å; Y361-L430 HydrophobicContact CE1-CD1 4.36Å; Y361-L430 HydrophobicContact CE1-CD2 3.68Å
362	E	85.8	Confident	75	Confident	88 Å²	88	62.4 Å²	62.4	41%	0.411	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	131.6	-176.4	-170.9	161.4	-179.5	0	0	109.2	P350 S391 L392 R393	P350-E362 WeakPolarHBondContact CD-O 3.44Å; E362-S391 VanDerWaalsContact CG-OG 3.22Å; E362-S391 WeakPolarHBondContact CG-OG 3.14Å; E362-S391 PolarHBondContact OE1-OG 2.65Å; E362-L392 WeakPolarHBondContact CA-O 3.41Å; E362-R393 HydrophobicContact CB-CB 4.41Å; E362-R393 HydrophobicContact CB-CG 4.23Å; E362-R393 HydrophobicContact CG-CB 4.04Å; E362-R393 HydrophobicContact CG-CG 4.27Å; E362-R393 WeakPolarHBondContact OE2-CD 3.29Å; E362-R393 IonicContact OE2-NE 3.54Å; E362-R393 IonicContact OE2-NH1 3.48Å
363	M	86.7	Confident	76	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	126.7	-179.1	53.8	176.5	66.3	0	0	109.2	I348 R349 Y361 W379 S391 L392 Y405 L428 L430	I348-M363 HydrophobicContact CG2-CB 4.18Å; R349-M363 WeakPolarHBondContact O-CA 3.35Å; Y361-M363 HydrophobicContact CD1-CE 4.11Å; Y361-M363 HydrophobicContact CE1-CB 4.29Å; Y361-M363 HydrophobicContact CE1-CE 3.86Å; M363-W379 HydrophobicContact CB-CH2 3.93Å; M363-W379 HydrophobicContact CB-CZ2 4.46Å; M363-W379 HydrophobicContact CG-CH2 3.62Å; M363-W379 HydrophobicContact CG-CZ2 4Å; M363-W379 HydrophobicContact CG-CZ3 3.97Å; M363-W379 WeakPolarHBondContact O-CZ2 3.31Å; M363-W379 HydrophobicContact SD-CE3 3.83Å; M363-W379 HydrophobicContact SD-CH2 3.64Å; M363-W379 HydrophobicContact SD-CZ2 4.4Å; M363-W379 HydrophobicContact SD-CZ3 3.32Å; M363-W379 WeakPolarHBondContact SD-CZ3 3.5Å; M363-S391 CarbonylContact O-C 3.55Å; M363-S391 WeakPolarHBondContact O-CA 3.23Å; M363-L392 HydrophobicContact CG-CB 3.9Å; M363-L392 HydrophobicContact CG-CD2 4.4Å; M363-L392 HydrophobicContact CG-CG 4.15Å; M363-L392 WeakPolarHBondContact CG-O 2.98Å; M363-L392 PolarHBondContact N-O 3.48Å; M363-L392 PolarHBondContact O-N 3.22Å; M363-L392 HydrophobicContact SD-CB 4.44Å; M363-L392 HydrophobicContact SD-CD2 3.9Å; M363-L392 HydrophobicContact SD-CG 4.28Å; M363-Y405 HydrophobicContact CE-CD1 4.16Å; M363-Y405 HydrophobicContact CE-CD2 3.9Å; M363-Y405 HydrophobicContact CE-CE2 4.25Å; M363-Y405 HydrophobicContact CE-CG 3.86Å; M363-Y405 HydrophobicContact SD-CD1 3.86Å; M363-Y405 HydrophobicContact SD-CG 3.87Å; M363-L428 HydrophobicContact CE-CD2 4.18Å; M363-L430 HydrophobicContact CE-CD1 3.78Å; M363-L430 HydrophobicContact CE-CD2 3.95Å; M363-L430 HydrophobicContact CE-CG 4.04Å
364	V	90	Very high	77.3	Confident	49 Å²	49	64.7 Å²	64.7	30%	0.297	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	132.7	-175.8	-173.6	0	0	0	0	109.1	I348 R349 E366	I348-V364 CarbonylContact C-O 3.45Å; I348-V364 WeakPolarHBondContact CA-O 3.41Å; R349-V364 PolarHBondContact N-O 3.25Å; R349-V364 PolarHBondContact O-N 3.46Å; V364-E366 HydrophobicContact CG1-CG 4.2Å
365	C	90.4	Very high	78.6	Confident	3 Å²	3	62 Å²	62	2%	0.02	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	125.5	178.3	-175.1	0	0	0	0	110.4	V346 N347 F377 W379 A390 C407	V346-C365 WeakPolarHBondContact CG1-SG 3.07Å; N347-C365 WeakPolarHBondContact O-CA 3.34Å; C365-F377 HydrophobicContact CB-CD1 4.18Å; C365-F377 HydrophobicContact CB-CE1 4.33Å; C365-W379 HydrophobicContact CB-CH2 4.15Å; C365-W379 HydrophobicContact CB-CZ2 3.6Å; C365-A390 WeakPolarHBondContact CB-O 3.32Å; C365-A390 PolarHBondContact N-O 2.81Å; C365-C407 HydrophobicContact CB-CB 3.75Å; C365-C407 WeakPolarHBondContact CB-SG 3.47Å; C365-C407 WeakPolarHBondContact SG-CB 3.48Å; C365-C407 CovalentContact SG-SG 2.02Å; C365-C407 PolarHBondContact SG-SG 3.23Å
366	E	87.1	Confident	79.8	Confident	59 Å²	59	64.8 Å²	64.8	28%	0.276	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	158.2	-172.2	-65.8	175.1	-164.7	0	0	110.8	V346 N347 R349 V364	V346-E366 VanDerWaalsContact CA-O 3.32Å; V346-E366 WeakPolarHBondContact CA-O 3.41Å; N347-E366 PolarHBondContact N-O 3.38Å; N347-E366 PolarHBondContact O-N 3.04Å; R349-E366 VanDerWaalsContact CD-OE1 3.3Å; R349-E366 WeakPolarHBondContact CD-OE1 3.28Å; R349-E366 IonicContact CZ-OE2 2.83Å; R349-E366 VanDerWaalsContact NE-CD 3.31Å; R349-E366 IonicContact NE-OE1 2.74Å; R349-E366 PolarHBondContact NE-OE1 2.87Å; R349-E366 IonicContact NE-OE2 3.51Å; R349-E366 PolarHBondContact NE-OE2 2.9Å; R349-E366 IonicContact NH2-OE2 3.16Å; R349-E366 PolarHBondContact NH2-OE2 2.63Å; V364-E366 HydrophobicContact CG1-CG 4.2Å
367	V	85.7	Confident	81.2	Confident	13 Å²	13	61 Å²	61	8%	0.079	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	121.6	-179.9	-169.6	0	0	0	0	109.4	H344 I345 V346 P369 P370 I375 F377 A409	H344-V367 HydrophobicContact CB-CG1 3.87Å; I345-V367 CarbonylContact O-C 3.46Å; I345-V367 WeakPolarHBondContact O-CA 3.05Å; V346-V367 HydrophobicContact CG2-CG2 4.28Å; V367-P369 CarbonylContact O-C 3.53Å; V367-P370 WeakPolarHBondContact O-CA 3.39Å; V367-P370 VanDerWaalsContact O-N 3.17Å; V367-I375 HydrophobicContact CB-CD1 4.2Å; V367-I375 HydrophobicContact CG2-CD1 3.92Å; V367-I375 HydrophobicContact CG2-CG2 4.39Å; V367-F377 HydrophobicContact CG2-CE1 4.18Å; V367-F377 HydrophobicContact CG2-CZ 4.33Å; V367-A409 HydrophobicContact CG2-CB 3.87Å
368	E	78.7	Confident	82.4	Confident	75 Å²	75	59.4 Å²	59.4	35%	0.35	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	120.3	-174.3	-69.8	179.5	168.9	0	0	111	I345 N347 R349	I345-E368 WeakPolarHBondContact CB-O 3Å; I345-E368 PolarHBondContact N-O 2.85Å; I345-E368 PolarHBondContact O-N 3.08Å; N347-E368 PolarHBondContact ND2-OE2 2.82Å; R349-E368 IonicContact CZ-OE1 2.76Å; R349-E368 IonicContact NH2-OE1 3.48Å; R349-E368 PolarHBondContact NH2-OE1 3.13Å
369	P	78.2	Confident	83.6	Confident	61 Å²	61	57.2 Å²	57.2	40%	0.396	30%	0.303	S	S	.	.	S	Bend	cis	-63.4	154	-18.4	31.4	-35.6	0	0	0	110.9	M342 H344 V367	M342-P369 HydrophobicContact CE-CB 4.39Å; M342-P369 HydrophobicContact CE-CG 3.6Å; H344-P369 PolarHBondContact CD2-O 3.4Å; V367-P369 CarbonylContact O-C 3.53Å
370	P	76.8	Confident	84.5	Confident	94 Å²	94	52.1 Å²	52.1	61%	0.61	29%	0.285	S	S	*	.	P	Polyproline II helix	trans	-71.9	143.5	174.4	29.3	-34.3	0	0	0	111.2	V367	V367-P370 WeakPolarHBondContact O-CA 3.39Å; V367-P370 VanDerWaalsContact O-N 3.17Å
371	P	73.6	Confident	84.8	Confident	19 Å²	19	49.2 Å²	49.2	12%	0.123	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-70	162.6	173.2	31.1	-34.8	0	0	0	111.9	E373 I375 W411	P371-E373 VanDerWaalsContact C-N 3.29Å; P371-I375 HydrophobicContact CG-CD1 3.96Å; P371-I375 HydrophobicContact CG-CG1 3.64Å; P371-W411 HydrophobicContact CB-CG 4.12Å; P371-W411 HydrophobicContact CG-CB 4.36Å; P371-W411 HydrophobicContact CG-CD2 4.16Å; P371-W411 HydrophobicContact CG-CG 3.93Å
372	E	78.1	Confident	84.6	Confident	158 Å²	158	52.9 Å²	52.9	74%	0.738	29%	0.287	S	S	*	.	S	Bend	trans	-73.1	-23.9	170.4	-64.8	-169.8	161.9	0	0	112.7	R414	E372-R414 IonicContact OE2-CZ 3.36Å; E372-R414 IonicContact OE2-NE 2.64Å; E372-R414 IonicContact OE2-NH2 3.28Å; E372-R414 PolarHBondContact OE2-NH2 3.07Å
373	E	79.5	Confident	84.1	Confident	33 Å²	33	53.5 Å²	53.5	15%	0.154	31%	0.306	C	S	.	.	S	Bend	trans	-88.4	149.6	-176.6	-56.3	95.4	160.6	0	0	112.4	P371 I375 T412 P413 R414	P371-E373 VanDerWaalsContact C-N 3.29Å; E373-I375 PolarHBondContact O-N 2.87Å; E373-T412 WeakPolarHBondContact CG-O 3.49Å; E373-P413 WeakPolarHBondContact OE1-CA 3.4Å; E373-R414 HydrophobicContact CG-CB 4.34Å; E373-R414 WeakPolarHBondContact OE1-CB 3.3Å; E373-R414 PolarHBondContact OE1-N 2.87Å
374	P	82.7	Confident	83.8	Confident	116 Å²	116	60.8 Å²	60.8	75%	0.753	34%	0.338	S	S	*	.	P	Polyproline II helix	trans	-61.5	127.9	-177.5	24.4	-34.8	0	0	0	112.3
375	I	86.9	Confident	83.7	Confident	52 Å²	52	61.6 Å²	61.6	27%	0.267	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-88.6	136.1	-179.8	-41.4	171	0	0	0	109.7	V367 P371 E373 F377 A409	V367-I375 HydrophobicContact CB-CD1 4.2Å; V367-I375 HydrophobicContact CG2-CD1 3.92Å; V367-I375 HydrophobicContact CG2-CG2 4.39Å; P371-I375 HydrophobicContact CG-CD1 3.96Å; P371-I375 HydrophobicContact CG-CG1 3.64Å; E373-I375 PolarHBondContact O-N 2.87Å; I375-F377 HydrophobicContact CB-CE2 3.87Å; I375-F377 HydrophobicContact CB-CZ 4.06Å; I375-F377 HydrophobicContact CD1-CZ 4.2Å; I375-F377 HydrophobicContact CG2-CD2 4.3Å; I375-F377 HydrophobicContact CG2-CE1 4.06Å; I375-F377 HydrophobicContact CG2-CE2 3.74Å; I375-F377 HydrophobicContact CG2-CZ 3.61Å; I375-A409 HydrophobicContact CG2-CB 3.87Å
376	S	89	Confident	83.7	Confident	63 Å²	63	64.7 Å²	64.7	44%	0.441	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	141.6	167	62.2	0	0	0	0	110.3	A409 E410	S376-A409 CarbonylContact O-C 3.58Å; S376-A409 WeakPolarHBondContact O-CA 3.47Å; S376-E410 PolarHBondContact N-O 3.3Å; S376-E410 PolarHBondContact O-N 3.29Å; S376-E410 PolarHBondContact OG-O 3.24Å
377	F	91.9	Very high	83.9	Confident	34 Å²	34	64.5 Å²	64.5	15%	0.149	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	142.8	-176	-65.1	-88.3	0	0	0	111.2	C365 V367 I375 R388 A390 R408 A409	C365-F377 HydrophobicContact CB-CD1 4.18Å; C365-F377 HydrophobicContact CB-CE1 4.33Å; V367-F377 HydrophobicContact CG2-CE1 4.18Å; V367-F377 HydrophobicContact CG2-CZ 4.33Å; I375-F377 HydrophobicContact CB-CE2 3.87Å; I375-F377 HydrophobicContact CB-CZ 4.06Å; I375-F377 HydrophobicContact CD1-CZ 4.2Å; I375-F377 HydrophobicContact CG2-CD2 4.3Å; I375-F377 HydrophobicContact CG2-CE1 4.06Å; I375-F377 HydrophobicContact CG2-CE2 3.74Å; I375-F377 HydrophobicContact CG2-CZ 3.61Å; F377-R388 CarbonylContact O-C 3.59Å; F377-R388 VanDerWaalsContact O-C 3.32Å; F377-R388 VanDerWaalsContact O-CA 3.29Å; F377-R388 WeakPolarHBondContact O-CA 3.48Å; F377-R388 VanDerWaalsContact O-O 3.13Å; F377-A390 HydrophobicContact CD1-CB 4.46Å; F377-A390 HydrophobicContact CD2-CB 3.98Å; F377-A390 HydrophobicContact CE1-CB 4.42Å; F377-A390 HydrophobicContact CE2-CB 3.96Å; F377-A390 HydrophobicContact CG-CB 4.24Å; F377-A390 HydrophobicContact CZ-CB 4.18Å; F377-R408 CarbonylContact C-O 3.55Å; F377-R408 WeakPolarHBondContact CA-O 3.22Å; F377-A409 HydrophobicContact CD1-CB 4.08Å; F377-A409 HydrophobicContact CE1-CB 3.94Å
378	V	91.8	Very high	84.2	Confident	10 Å²	10	72 Å²	72	6%	0.061	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	123.9	172.7	-171	0	0	0	0	109.6	Y380 V385 R408	V378-Y380 HydrophobicContact CB-CE2 3.85Å; V378-Y380 HydrophobicContact CG1-CD2 4.15Å; V378-Y380 HydrophobicContact CG1-CE1 4.34Å; V378-Y380 HydrophobicContact CG1-CE2 3.53Å; V378-V385 HydrophobicContact CG1-CB 4.36Å; V378-V385 HydrophobicContact CG1-CG1 3.72Å; V378-V385 HydrophobicContact CG1-CG2 3.77Å; V378-R408 PolarHBondContact N-O 3.39Å; V378-R408 PolarHBondContact O-N 2.82Å
379	W	91	Very high	84.8	Confident	0 Å²	0	74.8 Å²	74.8	0%	0	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	130.5	173.3	-72.3	93.3	0	0	0	110.7	I348 M363 C365 V385 V386 H387 E389 A390 L392 I406 C407	I348-W379 HydrophobicContact CD1-CH2 4Å; I348-W379 HydrophobicContact CD1-CZ3 3.8Å; I348-W379 HydrophobicContact CG1-CH2 3.91Å; I348-W379 HydrophobicContact CG1-CZ3 4.25Å; I348-W379 HydrophobicContact CG2-CH2 3.98Å; M363-W379 HydrophobicContact CB-CH2 3.93Å; M363-W379 HydrophobicContact CB-CZ2 4.46Å; M363-W379 HydrophobicContact CG-CH2 3.62Å; M363-W379 HydrophobicContact CG-CZ2 4Å; M363-W379 HydrophobicContact CG-CZ3 3.97Å; M363-W379 WeakPolarHBondContact O-CZ2 3.31Å; M363-W379 HydrophobicContact SD-CE3 3.83Å; M363-W379 HydrophobicContact SD-CH2 3.64Å; M363-W379 HydrophobicContact SD-CZ2 4.4Å; M363-W379 HydrophobicContact SD-CZ3 3.32Å; M363-W379 WeakPolarHBondContact SD-CZ3 3.5Å; C365-W379 HydrophobicContact CB-CH2 4.15Å; C365-W379 HydrophobicContact CB-CZ2 3.6Å; W379-V385 CarbonylContact O-C 3.46Å; W379-V385 WeakPolarHBondContact O-CA 3.35Å; W379-V386 HydrophobicContact CB-CG2 3.88Å; W379-V386 WeakPolarHBondContact O-CG2 3.44Å; W379-V386 PolarHBondContact O-N 2.86Å; W379-H387 HydrophobicContact CB-CB 4.03Å; W379-H387 HydrophobicContact CG-CB 4.31Å; W379-H387 PolarHBondContact N-O 3.13Å; W379-H387 PolarHBondContact O-N 2.94Å; W379-E389 PolarHBondContact NE1-O 2.87Å; W379-A390 PolarHBondContact NE1-O 3.02Å; W379-L392 HydrophobicContact CB-CD2 4.04Å; W379-L392 HydrophobicContact CD2-CB 3.95Å; W379-L392 HydrophobicContact CD2-CD2 4.03Å; W379-L392 HydrophobicContact CE3-CD2 4.22Å; W379-L392 HydrophobicContact CG-CB 4Å; W379-L392 HydrophobicContact CG-CD2 3.99Å; W379-L392 HydrophobicContact CZ2-CB 4.29Å; W379-I406 CarbonylContact C-O 3.57Å; W379-I406 WeakPolarHBondContact CA-O 3.46Å; W379-C407 HydrophobicContact CD2-CB 4.2Å; W379-C407 HydrophobicContact CE3-CB 3.96Å; W379-C407 HydrophobicContact CH2-CB 4.07Å; W379-C407 HydrophobicContact CZ2-CB 4.29Å; W379-C407 HydrophobicContact CZ3-CB 3.89Å
380	Y	89.2	Confident	85.3	Confident	57 Å²	57	73.4 Å²	73.4	22%	0.224	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	143.9	173.9	-57.5	-101.5	0	0	0	110.7	V378 K384 V385 Y405 I406 R408	V378-Y380 HydrophobicContact CB-CE2 3.85Å; V378-Y380 HydrophobicContact CG1-CD2 4.15Å; V378-Y380 HydrophobicContact CG1-CE1 4.34Å; V378-Y380 HydrophobicContact CG1-CE2 3.53Å; Y380-K384 CarbonylContact C-O 3.54Å; Y380-K384 VanDerWaalsContact CA-O 3.24Å; Y380-K384 WeakPolarHBondContact CA-O 3.45Å; Y380-V385 HydrophobicContact CD1-CG2 3.83Å; Y380-V385 HydrophobicContact CE1-CG2 3.5Å; Y380-Y405 CarbonylContact O-C 3.53Å; Y380-Y405 VanDerWaalsContact O-CA 3.28Å; Y380-Y405 WeakPolarHBondContact O-CA 3.32Å; Y380-I406 PolarHBondContact N-O 2.85Å; Y380-I406 PolarHBondContact O-N 2.91Å; Y380-R408 HydrophobicContact CE2-CB 3.98Å
381	H	85.9	Confident	86	Confident	16 Å²	16	70.6 Å²	70.6	7%	0.074	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	134.9	169	175.6	-112.4	0	0	0	108.3	A383 K384 V386 R400 I402 M404 Y405	H381-A383 PolarHBondContact O-N 2.82Å; H381-K384 PolarHBondContact N-O 3.2Å; H381-K384 PolarHBondContact O-N 2.92Å; H381-V386 HydrophobicContact CB-CG1 3.88Å; H381-V386 HydrophobicContact CB-CG2 4.11Å; H381-R400 PolarHBondContact CE1-O 3.01Å; H381-I402 PolarHBondContact NE2-O 3.15Å; H381-M404 PolarHBondContact CD2-O 2.8Å; H381-Y405 HydrophobicContact CB-CD1 3.86Å; H381-Y405 HydrophobicContact CB-CE1 3.69Å; H381-Y405 HydrophobicContact CB-CG 4.44Å; H381-Y405 AromaticContact CD2-CD2 3.68Å; H381-Y405 AromaticContact CD2-CE1 3.81Å; H381-Y405 AromaticContact CD2-CE2 3.3Å; H381-Y405 WeakPolarHBondContact CD2-CE2 3.36Å; H381-Y405 AromaticContact CD2-CZ 3.37Å; H381-Y405 AromaticContact CG-CE1 3.82Å; H381-Y405 AromaticContact CG-CZ 3.73Å; H381-Y405 AromaticContact NE2-CE2 3.59Å; H381-Y405 AromaticContact NE2-CZ 3.69Å
382	N	77.9	Confident	86.8	Confident	111 Å²	111	70.3 Å²	70.3	59%	0.594	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.2	44.6	-172.9	-67.6	-63	0	0	0	113.1	K384	N382-K384 PolarHBondContact O-N 2.95Å; N382-K384 VanDerWaalsContact O-N 3.11Å
383	A	74	Confident	87.4	Confident	100 Å²	100	70.1 Å²	70.1	83%	0.826	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	12.9	-175.5	0	0	0	0	0	116.6	H381	H381-A383 PolarHBondContact O-N 2.82Å
384	K	80.5	Confident	87.7	Confident	154 Å²	154	69.8 Å²	69.8	67%	0.67	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.6	141.4	175	-65.8	175.1	-176.1	173.8	0	110.4	Y380 H381 N382 V386	Y380-K384 CarbonylContact C-O 3.54Å; Y380-K384 VanDerWaalsContact CA-O 3.24Å; Y380-K384 WeakPolarHBondContact CA-O 3.45Å; H381-K384 PolarHBondContact N-O 3.2Å; H381-K384 PolarHBondContact O-N 2.92Å; N382-K384 PolarHBondContact O-N 2.95Å; N382-K384 VanDerWaalsContact O-N 3.11Å; K384-V386 PolarHBondContact O-N 3.38Å
385	V	88.6	Confident	87.6	Confident	66 Å²	66	70.1 Å²	70.1	40%	0.4	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	122.5	170.8	177.1	0	0	0	0	108.9	V378 W379 Y380 R388	V378-V385 HydrophobicContact CG1-CB 4.36Å; V378-V385 HydrophobicContact CG1-CG1 3.72Å; V378-V385 HydrophobicContact CG1-CG2 3.77Å; W379-V385 CarbonylContact O-C 3.46Å; W379-V385 WeakPolarHBondContact O-CA 3.35Å; Y380-V385 HydrophobicContact CD1-CG2 3.83Å; Y380-V385 HydrophobicContact CE1-CG2 3.5Å; V385-R388 HydrophobicContact CG1-CG 4.33Å
386	V	90.4	Very high	87.3	Confident	68 Å²	68	71 Å²	71	41%	0.412	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	-29.2	177.3	-69.9	0	0	0	0	112.8	W379 H381 K384 L392 Y405	W379-V386 HydrophobicContact CB-CG2 3.88Å; W379-V386 WeakPolarHBondContact O-CG2 3.44Å; W379-V386 PolarHBondContact O-N 2.86Å; H381-V386 HydrophobicContact CB-CG1 3.88Å; H381-V386 HydrophobicContact CB-CG2 4.11Å; K384-V386 PolarHBondContact O-N 3.38Å; V386-L392 HydrophobicContact CG2-CD2 3.91Å; V386-Y405 HydrophobicContact CG2-CD1 4.46Å; V386-Y405 HydrophobicContact CG2-CE1 4.33Å
387	H	91.4	Very high	86.6	Confident	55 Å²	55	68.1 Å²	68.1	26%	0.255	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	170.8	179.3	-159.8	43.7	0	0	0	113.2	W379 S391 L392	W379-H387 HydrophobicContact CB-CB 4.03Å; W379-H387 HydrophobicContact CG-CB 4.31Å; W379-H387 PolarHBondContact N-O 3.13Å; W379-H387 PolarHBondContact O-N 2.94Å; H387-S391 PolarHBondContact CD2-O 2.91Å; H387-S391 PolarHBondContact NE2-O 2.88Å; H387-L392 HydrophobicContact CB-CB 4.4Å; H387-L392 HydrophobicContact CB-CD1 3.96Å
388	R	91.9	Very high	85.8	Confident	171 Å²	171	68.5 Å²	68.5	65%	0.645	36%	0.363	S	S	*	.			trans	-140.4	13.5	-170.2	-68.8	-175.9	173.7	-84.9	2.7	115	F377 V385	F377-R388 CarbonylContact O-C 3.59Å; F377-R388 VanDerWaalsContact O-C 3.32Å; F377-R388 VanDerWaalsContact O-CA 3.29Å; F377-R388 WeakPolarHBondContact O-CA 3.48Å; F377-R388 VanDerWaalsContact O-O 3.13Å; V385-R388 HydrophobicContact CG1-CG 4.33Å
389	E	91.3	Very high	84.6	Confident	132 Å²	132	72.6 Å²	72.6	62%	0.617	38%	0.378	S	S	*	.	S	Bend	trans	-119.5	166.7	176.1	-57.7	177.6	-151	0	0	109.7	W379 S391	W379-E389 PolarHBondContact NE1-O 2.87Å; E389-S391 PolarHBondContact O-N 3.13Å
390	A	89.4	Confident	83.8	Confident	33 Å²	33	83 Å²	83	27%	0.273	42%	0.417	S	S	.	.	S	Bend	trans	-64.1	-37.7	-176.3	0	0	0	0	0	113	C365 F377 W379	C365-A390 WeakPolarHBondContact CB-O 3.32Å; C365-A390 PolarHBondContact N-O 2.81Å; F377-A390 HydrophobicContact CD1-CB 4.46Å; F377-A390 HydrophobicContact CD2-CB 3.98Å; F377-A390 HydrophobicContact CE1-CB 4.42Å; F377-A390 HydrophobicContact CE2-CB 3.96Å; F377-A390 HydrophobicContact CG-CB 4.24Å; F377-A390 HydrophobicContact CZ-CB 4.18Å; W379-A390 PolarHBondContact NE1-O 3.02Å
391	S	91.2	Very high	83.4	Confident	34 Å²	34	82.1 Å²	82.1	24%	0.238	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	131	171.7	-177.2	0	0	0	0	110.9	E362 M363 H387 E389	E362-S391 VanDerWaalsContact CG-OG 3.22Å; E362-S391 WeakPolarHBondContact CG-OG 3.14Å; E362-S391 PolarHBondContact OE1-OG 2.65Å; M363-S391 CarbonylContact O-C 3.55Å; M363-S391 WeakPolarHBondContact O-CA 3.23Å; H387-S391 PolarHBondContact CD2-O 2.91Å; H387-S391 PolarHBondContact NE2-O 2.88Å; E389-S391 PolarHBondContact O-N 3.13Å
392	L	90.5	Very high	83	Confident	13 Å²	13	83.4 Å²	83.4	7%	0.068	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	117.9	165.7	162.2	58.5	0	0	0	109.2	E362 M363 W379 V386 H387 L394 Y405	E362-L392 WeakPolarHBondContact CA-O 3.41Å; M363-L392 HydrophobicContact CG-CB 3.9Å; M363-L392 HydrophobicContact CG-CD2 4.4Å; M363-L392 HydrophobicContact CG-CG 4.15Å; M363-L392 WeakPolarHBondContact CG-O 2.98Å; M363-L392 PolarHBondContact N-O 3.48Å; M363-L392 PolarHBondContact O-N 3.22Å; M363-L392 HydrophobicContact SD-CB 4.44Å; M363-L392 HydrophobicContact SD-CD2 3.9Å; M363-L392 HydrophobicContact SD-CG 4.28Å; W379-L392 HydrophobicContact CB-CD2 4.04Å; W379-L392 HydrophobicContact CD2-CB 3.95Å; W379-L392 HydrophobicContact CD2-CD2 4.03Å; W379-L392 HydrophobicContact CE3-CD2 4.22Å; W379-L392 HydrophobicContact CG-CB 4Å; W379-L392 HydrophobicContact CG-CD2 3.99Å; W379-L392 HydrophobicContact CZ2-CB 4.29Å; V386-L392 HydrophobicContact CG2-CD2 3.91Å; H387-L392 HydrophobicContact CB-CB 4.4Å; H387-L392 HydrophobicContact CB-CD1 3.96Å; L392-L394 HydrophobicContact CD1-CD2 4.21Å; L392-Y405 HydrophobicContact CD2-CD1 3.75Å; L392-Y405 HydrophobicContact CD2-CE1 3.76Å
393	R	89.6	Confident	82.7	Confident	155 Å²	155	79.1 Å²	79.1	59%	0.585	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.3	114.3	-179.9	-173.8	175.9	176.6	169.1	-3.3	112.4	E362	E362-R393 HydrophobicContact CB-CB 4.41Å; E362-R393 HydrophobicContact CB-CG 4.23Å; E362-R393 HydrophobicContact CG-CB 4.04Å; E362-R393 HydrophobicContact CG-CG 4.27Å; E362-R393 WeakPolarHBondContact OE2-CD 3.29Å; E362-R393 IonicContact OE2-NE 3.54Å; E362-R393 IonicContact OE2-NH1 3.48Å
394	L	85.7	Confident	83	Confident	26 Å²	26	78.3 Å²	78.3	14%	0.136	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	118.9	171.4	-56.1	173.2	0	0	0	108	P360 Y361 L392 L397 D401 L430	P360-L394 CarbonylContact C-O 3.56Å; P360-L394 WeakPolarHBondContact CA-O 3.45Å; Y361-L394 PolarHBondContact N-O 2.78Å; Y361-L394 PolarHBondContact O-N 2.81Å; L392-L394 HydrophobicContact CD1-CD2 4.21Å; L394-L397 HydrophobicContact CD1-CD1 3.52Å; L394-D401 HydrophobicContact CD1-CB 4.28Å; L394-L430 HydrophobicContact CD1-CD1 4.21Å
395	T	82.2	Confident	83.3	Confident	123 Å²	123	71.1 Å²	71.1	76%	0.755	36%	0.355	S	S	*	.	S	Bend	trans	-75.5	-27.9	-172.1	50.5	0	0	0	0	113.9
396	S	80.3	Confident	83.2	Confident	71 Å²	71	70.1 Å²	70.1	50%	0.497	35%	0.347	S	S	.	.	S	Bend	trans	-156.2	99.7	173.4	165.2	0	0	0	0	107.9	S398	S396-S398 PolarHBondContact O-N 2.84Å
397	L	73.2	Confident	83.1	Confident	2 Å²	2	66.9 Å²	66.9	1%	0.01	33%	0.327	C	S	.	.			trans	-59.2	127.8	-176	-172.8	77.2	0	0	0	111.7	V355 I357 G358 R359 L394 D401 L430	V355-L397 HydrophobicContact CB-CD2 3.48Å; V355-L397 VanDerWaalsContact CB-CD2 3.48Å; V355-L397 HydrophobicContact CG1-CD2 3.98Å; V355-L397 HydrophobicContact CG2-CD2 3.9Å; I357-L397 HydrophobicContact CD1-CD2 4.1Å; I357-L397 HydrophobicContact CD1-CG 4.21Å; G358-L397 PolarHBondContact N-O 3.2Å; R359-L397 WeakPolarHBondContact O-CB 3.43Å; R359-L397 PolarHBondContact O-N 3.3Å; L394-L397 HydrophobicContact CD1-CD1 3.52Å; L397-D401 HydrophobicContact CD1-CB 3.63Å; L397-D401 HydrophobicContact CG-CB 4.5Å; L397-L430 HydrophobicContact CD1-CD1 4.07Å
398	S	76.2	Confident	83	Confident	41 Å²	41	68 Å²	68	29%	0.287	33%	0.329	S	S	.	.			trans	-115.2	168.6	177.8	82.9	0	0	0	0	112	S396 R400 D401	S396-S398 PolarHBondContact O-N 2.84Å; S398-R400 PolarHBondContact O-N 3.19Å; S398-R400 VanDerWaalsContact O-N 3.07Å; S398-R400 PolarHBondContact OG-N 3.38Å; S398-R400 VanDerWaalsContact OG-N 3.17Å; S398-D401 WeakPolarHBondContact CA-OD2 3.43Å; S398-D401 VanDerWaalsContact CB-OD2 3.23Å; S398-D401 WeakPolarHBondContact CB-OD2 3.16Å; S398-D401 PolarHBondContact N-OD2 2.9Å; S398-D401 WeakPolarHBondContact O-CB 3.49Å; S398-D401 PolarHBondContact O-N 3.38Å; S398-D401 PolarHBondContact OG-OD2 2.87Å
399	Y	66	Low	82.8	Confident	96 Å²	96	59.9 Å²	59.9	38%	0.376	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-19.4	172.6	-78.2	-83.3	0	0	0	114.3	I357 D401 I402 L432 V447 V449	I357-Y399 HydrophobicContact CG1-CE2 4.45Å; I357-Y399 HydrophobicContact CG2-CD2 4.41Å; I357-Y399 HydrophobicContact CG2-CE2 4.25Å; Y399-D401 VanDerWaalsContact C-N 3.32Å; Y399-I402 HydrophobicContact CD1-CD1 3.63Å; Y399-I402 HydrophobicContact CE1-CD1 4.34Å; Y399-I402 HydrophobicContact CG-CD1 4.31Å; Y399-L432 HydrophobicContact CD1-CD1 4.31Å; Y399-L432 HydrophobicContact CE1-CD1 3.8Å; Y399-V447 WeakPolarHBondContact OH-CG1 3.29Å; Y399-V449 HydrophobicContact CE1-CG2 4.1Å
400	R	75.2	Confident	82.5	Confident	218 Å²	218	55.2 Å²	55.2	82%	0.823	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-18	176.9	-61.7	-174.8	177.3	-150	-2.4	112.8	H381 S398	H381-R400 PolarHBondContact CE1-O 3.01Å; S398-R400 PolarHBondContact O-N 3.19Å; S398-R400 VanDerWaalsContact O-N 3.07Å; S398-R400 PolarHBondContact OG-N 3.38Å; S398-R400 VanDerWaalsContact OG-N 3.17Å
401	D	80.6	Confident	82.3	Confident	39 Å²	39	54.5 Å²	54.5	21%	0.209	27%	0.267	C	S	.	.	S	Bend	trans	-96.8	3	-176.7	-48.3	-58	0	0	0	111.8	L394 L397 S398 Y399 Y405	L394-D401 HydrophobicContact CD1-CB 4.28Å; L397-D401 HydrophobicContact CD1-CB 3.63Å; L397-D401 HydrophobicContact CG-CB 4.5Å; S398-D401 WeakPolarHBondContact CA-OD2 3.43Å; S398-D401 VanDerWaalsContact CB-OD2 3.23Å; S398-D401 WeakPolarHBondContact CB-OD2 3.16Å; S398-D401 PolarHBondContact N-OD2 2.9Å; S398-D401 WeakPolarHBondContact O-CB 3.49Å; S398-D401 PolarHBondContact O-N 3.38Å; S398-D401 PolarHBondContact OG-OD2 2.87Å; Y399-D401 VanDerWaalsContact C-N 3.32Å; D401-Y405 VanDerWaalsContact O-CE2 3.27Å; D401-Y405 WeakPolarHBondContact O-CE2 3.48Å; D401-Y405 PolarHBondContact O-OH 3.07Å; D401-Y405 VanDerWaalsContact O-OH 3.1Å
402	I	76.8	Confident	81.3	Confident	43 Å²	43	56.8 Å²	56.8	22%	0.221	28%	0.28	C	S	.	.			trans	-71	150.3	171.8	-63.3	168.9	0	0	0	109.3	I357 H381 Y399 L430 L432	I357-I402 HydrophobicContact CD1-CD1 4.31Å; I357-I402 HydrophobicContact CD1-CG1 4.45Å; H381-I402 PolarHBondContact NE2-O 3.15Å; Y399-I402 HydrophobicContact CD1-CD1 3.63Å; Y399-I402 HydrophobicContact CE1-CD1 4.34Å; Y399-I402 HydrophobicContact CG-CD1 4.31Å; I402-L430 WeakPolarHBondContact CG2-O 3.27Å; I402-L432 HydrophobicContact CD1-CD1 3.68Å; I402-L432 HydrophobicContact CD1-CD2 4.08Å; I402-L432 HydrophobicContact CD1-CG 3.71Å
403	G	72.4	Confident	80.1	Confident	22 Å²	22	58.3 Å²	58.3	23%	0.227	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	116.3	-164	172.9	0	0	0	0	0	114.1	L430	G403-L430 PolarHBondContact N-O 2.66Å; G403-L430 PolarHBondContact O-N 2.73Å
404	M	79.7	Confident	78.8	Confident	82 Å²	82	58.3 Å²	58.3	40%	0.404	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	120.5	-173.4	-178.3	-175.9	-82.8	0	0	111.9	H381 I406 E427	H381-M404 PolarHBondContact CD2-O 2.8Å; M404-I406 HydrophobicContact CG-CG1 4.08Å; M404-I406 HydrophobicContact SD-CD1 4.18Å; M404-I406 HydrophobicContact SD-CG1 4.25Å; M404-E427 VanDerWaalsContact CE-OE2 3.29Å; M404-E427 WeakPolarHBondContact CE-OE2 3.39Å
405	Y	85.9	Confident	77.2	Confident	3 Å²	3	67.1 Å²	67.1	1%	0.012	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	140.4	163	-71.1	-99.9	0	0	0	109.2	M363 Y380 H381 V386 L392 D401 E427 L428 L430	M363-Y405 HydrophobicContact CE-CD1 4.16Å; M363-Y405 HydrophobicContact CE-CD2 3.9Å; M363-Y405 HydrophobicContact CE-CE2 4.25Å; M363-Y405 HydrophobicContact CE-CG 3.86Å; M363-Y405 HydrophobicContact SD-CD1 3.86Å; M363-Y405 HydrophobicContact SD-CG 3.87Å; Y380-Y405 CarbonylContact O-C 3.53Å; Y380-Y405 VanDerWaalsContact O-CA 3.28Å; Y380-Y405 WeakPolarHBondContact O-CA 3.32Å; H381-Y405 HydrophobicContact CB-CD1 3.86Å; H381-Y405 HydrophobicContact CB-CE1 3.69Å; H381-Y405 HydrophobicContact CB-CG 4.44Å; H381-Y405 AromaticContact CD2-CD2 3.68Å; H381-Y405 AromaticContact CD2-CE1 3.81Å; H381-Y405 AromaticContact CD2-CE2 3.3Å; H381-Y405 WeakPolarHBondContact CD2-CE2 3.36Å; H381-Y405 AromaticContact CD2-CZ 3.37Å; H381-Y405 AromaticContact CG-CE1 3.82Å; H381-Y405 AromaticContact CG-CZ 3.73Å; H381-Y405 AromaticContact NE2-CE2 3.59Å; H381-Y405 AromaticContact NE2-CZ 3.69Å; V386-Y405 HydrophobicContact CG2-CD1 4.46Å; V386-Y405 HydrophobicContact CG2-CE1 4.33Å; L392-Y405 HydrophobicContact CD2-CD1 3.75Å; L392-Y405 HydrophobicContact CD2-CE1 3.76Å; D401-Y405 VanDerWaalsContact O-CE2 3.27Å; D401-Y405 WeakPolarHBondContact O-CE2 3.48Å; D401-Y405 PolarHBondContact O-OH 3.07Å; D401-Y405 VanDerWaalsContact O-OH 3.1Å; Y405-E427 WeakPolarHBondContact O-CA 3.28Å; Y405-L428 PolarHBondContact N-O 2.84Å; Y405-L428 PolarHBondContact O-N 3.47Å; Y405-L430 HydrophobicContact CD2-CD1 4.07Å; Y405-L430 HydrophobicContact CD2-CG 3.92Å; Y405-L430 HydrophobicContact CE2-CD1 3.6Å; Y405-L430 HydrophobicContact CE2-CG 3.89Å
406	I	86.6	Confident	75.4	Confident	46 Å²	46	63.4 Å²	63.4	24%	0.236	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	120.2	174.1	-48.3	-179.8	0	0	0	107.6	W379 Y380 M404 T425 A426 E427	W379-I406 CarbonylContact C-O 3.57Å; W379-I406 WeakPolarHBondContact CA-O 3.46Å; Y380-I406 PolarHBondContact N-O 2.85Å; Y380-I406 PolarHBondContact O-N 2.91Å; M404-I406 HydrophobicContact CG-CG1 4.08Å; M404-I406 HydrophobicContact SD-CD1 4.18Å; M404-I406 HydrophobicContact SD-CG1 4.25Å; I406-T425 HydrophobicContact CG2-CG2 4.42Å; I406-A426 CarbonylContact C-O 3.52Å; I406-A426 WeakPolarHBondContact CA-O 3.16Å; I406-E427 HydrophobicContact CG1-CG 4.18Å; I406-E427 HydrophobicContact CG2-CG 4.34Å
407	C	89.7	Confident	74	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	137.7	163.3	179.4	0	0	0	0	109.4	I348 C365 W379 T425 A426	I348-C407 HydrophobicContact CD1-CB 4.08Å; I348-C407 HydrophobicContact CG1-CB 4.24Å; C365-C407 HydrophobicContact CB-CB 3.75Å; C365-C407 WeakPolarHBondContact CB-SG 3.47Å; C365-C407 WeakPolarHBondContact SG-CB 3.48Å; C365-C407 CovalentContact SG-SG 2.02Å; C365-C407 PolarHBondContact SG-SG 3.23Å; W379-C407 HydrophobicContact CD2-CB 4.2Å; W379-C407 HydrophobicContact CE3-CB 3.96Å; W379-C407 HydrophobicContact CH2-CB 4.07Å; W379-C407 HydrophobicContact CZ2-CB 4.29Å; W379-C407 HydrophobicContact CZ3-CB 3.89Å; C407-T425 CarbonylContact O-C 3.56Å; C407-T425 WeakPolarHBondContact O-CA 3.39Å; C407-A426 PolarHBondContact N-O 3.19Å; C407-A426 PolarHBondContact O-N 3.28Å
408	R	89.4	Confident	72.6	Confident	79 Å²	79	76.3 Å²	76.3	30%	0.298	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	123.2	168.5	177.7	172.5	169.5	168.6	-10.8	108.9	F377 V378 Y380 E410 N423 T425	F377-R408 CarbonylContact C-O 3.55Å; F377-R408 WeakPolarHBondContact CA-O 3.22Å; V378-R408 PolarHBondContact N-O 3.39Å; V378-R408 PolarHBondContact O-N 2.82Å; Y380-R408 HydrophobicContact CE2-CB 3.98Å; R408-E410 HydrophobicContact CG-CG 3.89Å; R408-E410 IonicContact CZ-OE1 3.96Å; R408-E410 IonicContact CZ-OE2 3.57Å; R408-E410 IonicContact NE-OE1 2.71Å; R408-E410 PolarHBondContact NE-OE1 3.34Å; R408-E410 IonicContact NE-OE2 3.41Å; R408-E410 PolarHBondContact NE-OE2 2.92Å; R408-E410 IonicContact NH2-OE1 3.08Å; R408-E410 PolarHBondContact NH2-OE1 2.9Å; R408-E410 IonicContact NH2-OE2 2.74Å; R408-E410 PolarHBondContact NH2-OE2 2.88Å; R408-N423 PolarHBondContact NH2-ND2 2.89Å; R408-T425 HydrophobicContact CB-CG2 3.92Å; R408-T425 HydrophobicContact CG-CG2 4.05Å
409	A	88	Confident	71.3	Confident	0 Å²	0	79.4 Å²	79.4	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	133	170.8	0	0	0	0	0	109.2	V346 V367 I375 S376 F377 W411 N423 A424	V346-A409 HydrophobicContact CG2-CB 3.92Å; V367-A409 HydrophobicContact CG2-CB 3.87Å; I375-A409 HydrophobicContact CG2-CB 3.87Å; S376-A409 CarbonylContact O-C 3.58Å; S376-A409 WeakPolarHBondContact O-CA 3.47Å; F377-A409 HydrophobicContact CD1-CB 4.08Å; F377-A409 HydrophobicContact CE1-CB 3.94Å; A409-W411 HydrophobicContact CB-CZ3 4.46Å; A409-N423 CarbonylContact O-C 3.54Å; A409-N423 WeakPolarHBondContact O-CA 3.44Å; A409-N423 VanDerWaalsContact O-CB 3.23Å; A409-N423 WeakPolarHBondContact O-CB 2.98Å; A409-A424 PolarHBondContact N-O 2.85Å; A409-A424 PolarHBondContact O-N 3.18Å
410	E	84.5	Confident	70.5	Confident	34 Å²	34	80.1 Å²	80.1	16%	0.159	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	137.1	179.3	-35.7	-157.1	85.8	0	0	112.3	S376 R408 A422 N423	S376-E410 PolarHBondContact N-O 3.3Å; S376-E410 PolarHBondContact O-N 3.29Å; S376-E410 PolarHBondContact OG-O 3.24Å; R408-E410 HydrophobicContact CG-CG 3.89Å; R408-E410 IonicContact CZ-OE1 3.96Å; R408-E410 IonicContact CZ-OE2 3.57Å; R408-E410 IonicContact NE-OE1 2.71Å; R408-E410 PolarHBondContact NE-OE1 3.34Å; R408-E410 IonicContact NE-OE2 3.41Å; R408-E410 PolarHBondContact NE-OE2 2.92Å; R408-E410 IonicContact NH2-OE1 3.08Å; R408-E410 PolarHBondContact NH2-OE1 2.9Å; R408-E410 IonicContact NH2-OE2 2.74Å; R408-E410 PolarHBondContact NH2-OE2 2.88Å; E410-A422 VanDerWaalsContact CA-O 3.32Å; E410-A422 WeakPolarHBondContact CA-O 3.32Å; E410-N423 HydrophobicContact CB-CB 4.06Å; E410-N423 HydrophobicContact CG-CB 3.77Å; E410-N423 WeakPolarHBondContact OE1-CB 3.46Å; E410-N423 PolarHBondContact OE1-ND2 3.06Å
411	W	83.7	Confident	69.7	Low	18 Å²	18	72.4 Å²	72.4	7%	0.068	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	157.7	177.8	61.6	109.8	0	0	0	110.5	H344 P371 A409 S421 A422 A424	H344-W411 HydrophobicContact CB-CH2 3.7Å; H344-W411 HydrophobicContact CB-CZ2 3.68Å; H344-W411 AromaticContact CG-CZ2 3.55Å; H344-W411 AromaticContact ND1-CZ2 3.74Å; P371-W411 HydrophobicContact CB-CG 4.12Å; P371-W411 HydrophobicContact CG-CB 4.36Å; P371-W411 HydrophobicContact CG-CD2 4.16Å; P371-W411 HydrophobicContact CG-CG 3.93Å; A409-W411 HydrophobicContact CB-CZ3 4.46Å; W411-S421 CarbonylContact O-C 3.57Å; W411-S421 WeakPolarHBondContact O-CA 3.46Å; W411-A422 HydrophobicContact CD2-CB 4.04Å; W411-A422 HydrophobicContact CG-CB 4.44Å; W411-A422 HydrophobicContact CH2-CB 4.39Å; W411-A422 HydrophobicContact CZ2-CB 3.77Å; W411-A422 PolarHBondContact N-O 3.44Å; W411-A422 PolarHBondContact O-N 2.88Å; W411-A422 VanDerWaalsContact O-O 3.13Å; W411-A424 HydrophobicContact CH2-CB 4.16Å; W411-A424 HydrophobicContact CZ3-CB 4.36Å
412	T	71.3	Confident	68.6	Low	82 Å²	82	71.9 Å²	71.9	50%	0.503	37%	0.367	S	S	.	.			trans	-110.6	108	178.9	49.7	0	0	0	0	110.5	E373	E373-T412 WeakPolarHBondContact CG-O 3.49Å
413	P	65.8	Low	68.5	Low	45 Å²	45	73.4 Å²	73.4	29%	0.292	38%	0.376	S	S	.	.			trans	-59.7	135.2	-176	-25.6	35.2	0	0	0	113.2	E373 Y415 S416 A422	E373-P413 WeakPolarHBondContact OE1-CA 3.4Å; P413-Y415 PolarHBondContact O-N 3.07Å; P413-S416 PolarHBondContact O-N 2.9Å; P413-S416 PolarHBondContact O-OG 2.65Å; P413-A422 HydrophobicContact CG-CB 4.09Å
414	R	61.3	Low	68.3	Low	155 Å²	155	73.4 Å²	73.4	59%	0.585	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-17	-170.9	-145.5	-170.3	-62.1	-110.5	9.7	114.8	E372 E373	E372-R414 IonicContact OE2-CZ 3.36Å; E372-R414 IonicContact OE2-NE 2.64Å; E372-R414 IonicContact OE2-NH2 3.28Å; E372-R414 PolarHBondContact OE2-NH2 3.07Å; E373-R414 HydrophobicContact CG-CB 4.34Å; E373-R414 WeakPolarHBondContact OE1-CB 3.3Å; E373-R414 PolarHBondContact OE1-N 2.87Å
415	Y	53.2	Low	68.3	Low	210 Å²	210	73.6 Å²	73.6	82%	0.824	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.3	5.8	-178	-62.9	-74.8	0	0	0	114.8	P413 R417	P413-Y415 PolarHBondContact O-N 3.07Å; Y415-R417 PolarHBondContact O-N 2.86Å
416	S	44.7	Very low	67.9	Low	45 Å²	45	74 Å²	74	32%	0.315	38%	0.384	S	S	.	.			trans	-72.9	99.4	-178.9	71.4	0	0	0	0	111.3	P413 T418	P413-S416 PolarHBondContact O-N 2.9Å; P413-S416 PolarHBondContact O-OG 2.65Å; S416-T418 CarbonylContact C-O 3.55Å; S416-T418 WeakPolarHBondContact CB-O 3.43Å; S416-T418 CarbonylContact O-C 3.53Å; S416-T418 PolarHBondContact O-N 2.85Å; S416-T418 VanDerWaalsContact O-O 3.09Å; S416-T418 PolarHBondContact OG-O 2.75Å; S416-T418 VanDerWaalsContact OG-O 3.08Å
417	R	50.7	Low	67.7	Low	256 Å²	256	77.8 Å²	77.8	97%	0.966	40%	0.4	S	S	*	.	S	Bend	trans	-62.1	-21.3	176.8	-65.8	-174.4	-179.4	-175.7	0.6	113.4	Y415	Y415-R417 PolarHBondContact O-N 2.86Å
418	T	44.1	Very low	67.1	Low	89 Å²	89	78.4 Å²	78.4	55%	0.546	40%	0.404	S	S	.	.	S	Bend	trans	-105.1	141.5	163.8	43.9	0	0	0	0	107.9	S416 I420	S416-T418 CarbonylContact C-O 3.55Å; S416-T418 WeakPolarHBondContact CB-O 3.43Å; S416-T418 CarbonylContact O-C 3.53Å; S416-T418 PolarHBondContact O-N 2.85Å; S416-T418 VanDerWaalsContact O-O 3.09Å; S416-T418 PolarHBondContact OG-O 2.75Å; S416-T418 VanDerWaalsContact OG-O 3.08Å; T418-I420 PolarHBondContact O-N 2.99Å; T418-I420 VanDerWaalsContact OG1-CD1 3.29Å; T418-I420 WeakPolarHBondContact OG1-CD1 3.39Å
419	A	48.5	Very low	66.4	Low	105 Å²	105	77.8 Å²	77.8	87%	0.868	41%	0.412	S	S	*	.			trans	-75.7	57.3	-176.6	0	0	0	0	0	112.9
420	I	48.1	Very low	65.6	Low	112 Å²	112	78 Å²	78	57%	0.574	41%	0.413	S	S	*	.			trans	-87.4	112.4	178.8	-59.9	175.3	0	0	0	107.8	T418 A422	T418-I420 PolarHBondContact O-N 2.99Å; T418-I420 VanDerWaalsContact OG1-CD1 3.29Å; T418-I420 WeakPolarHBondContact OG1-CD1 3.39Å; I420-A422 PolarHBondContact O-N 3.16Å
421	S	58.1	Low	64.5	Low	55 Å²	55	79 Å²	79	39%	0.385	43%	0.427	S	S	.	.			trans	-68.5	125.3	165.6	52.3	0	0	0	0	109.6	W411	W411-S421 CarbonylContact O-C 3.57Å; W411-S421 WeakPolarHBondContact O-CA 3.46Å
422	A	58.2	Low	63.2	Low	28 Å²	28	80.8 Å²	80.8	23%	0.231	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	142.2	159.5	0	0	0	0	0	108.3	E410 W411 P413 I420	E410-A422 VanDerWaalsContact CA-O 3.32Å; E410-A422 WeakPolarHBondContact CA-O 3.32Å; W411-A422 HydrophobicContact CD2-CB 4.04Å; W411-A422 HydrophobicContact CG-CB 4.44Å; W411-A422 HydrophobicContact CH2-CB 4.39Å; W411-A422 HydrophobicContact CZ2-CB 3.77Å; W411-A422 PolarHBondContact N-O 3.44Å; W411-A422 PolarHBondContact O-N 2.88Å; W411-A422 VanDerWaalsContact O-O 3.13Å; P413-A422 HydrophobicContact CG-CB 4.09Å; I420-A422 PolarHBondContact O-N 3.16Å
423	N	74.4	Confident	62	Low	76 Å²	76	79.3 Å²	79.3	41%	0.406	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	161.3	171.1	62.6	30.5	0	0	0	111.7	R408 A409 E410	R408-N423 PolarHBondContact NH2-ND2 2.89Å; A409-N423 CarbonylContact O-C 3.54Å; A409-N423 WeakPolarHBondContact O-CA 3.44Å; A409-N423 VanDerWaalsContact O-CB 3.23Å; A409-N423 WeakPolarHBondContact O-CB 2.98Å; E410-N423 HydrophobicContact CB-CB 4.06Å; E410-N423 HydrophobicContact CG-CB 3.77Å; E410-N423 WeakPolarHBondContact OE1-CB 3.46Å; E410-N423 PolarHBondContact OE1-ND2 3.06Å
424	A	68.7	Low	61.1	Low	22 Å²	22	85.2 Å²	85.2	18%	0.182	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	158.1	173.9	0	0	0	0	0	109.2	V346 A409 W411	V346-A424 HydrophobicContact CB-CB 4.39Å; V346-A424 HydrophobicContact CG2-CB 3.4Å; V346-A424 VanDerWaalsContact CG2-CB 3.4Å; A409-A424 PolarHBondContact N-O 2.85Å; A409-A424 PolarHBondContact O-N 3.18Å; W411-A424 HydrophobicContact CH2-CB 4.16Å; W411-A424 HydrophobicContact CZ3-CB 4.36Å
425	T	80.1	Confident	60.4	Low	85 Å²	85	82.6 Å²	82.6	52%	0.521	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	144.9	-171.2	50.3	0	0	0	0	112.2	I406 C407 R408	I406-T425 HydrophobicContact CG2-CG2 4.42Å; C407-T425 CarbonylContact O-C 3.56Å; C407-T425 WeakPolarHBondContact O-CA 3.39Å; R408-T425 HydrophobicContact CB-CG2 3.92Å; R408-T425 HydrophobicContact CG-CG2 4.05Å
426	A	76.9	Confident	59.9	Low	13 Å²	13	79.4 Å²	79.4	11%	0.107	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	145.1	172	0	0	0	0	0	110.4	V346 I348 I406 C407	V346-A426 HydrophobicContact CB-CB 4.21Å; V346-A426 HydrophobicContact CG1-CB 3.74Å; V346-A426 WeakPolarHBondContact O-CB 3.38Å; I348-A426 HydrophobicContact CD1-CB 3.76Å; I348-A426 WeakPolarHBondContact CD1-O 3.34Å; I348-A426 HydrophobicContact CG1-CB 3.8Å; I406-A426 CarbonylContact C-O 3.52Å; I406-A426 WeakPolarHBondContact CA-O 3.16Å; C407-A426 PolarHBondContact N-O 3.19Å; C407-A426 PolarHBondContact O-N 3.28Å
427	E	82.6	Confident	60	Low	124 Å²	124	85.2 Å²	85.2	58%	0.579	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.4	134.6	-179.7	-55.4	-169.7	166.1	0	0	110.6	M404 Y405 I406	M404-E427 VanDerWaalsContact CE-OE2 3.29Å; M404-E427 WeakPolarHBondContact CE-OE2 3.39Å; Y405-E427 WeakPolarHBondContact O-CA 3.28Å; I406-E427 HydrophobicContact CG1-CG 4.18Å; I406-E427 HydrophobicContact CG2-CG 4.34Å
428	L	77.9	Confident	60.4	Low	13 Å²	13	73.7 Å²	73.7	7%	0.068	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	119.2	171.2	175.6	62.2	0	0	0	109	I348 M363 Y405 L430	I348-L428 HydrophobicContact CD1-CB 3.94Å; I348-L428 HydrophobicContact CG2-CB 4.19Å; I348-L428 HydrophobicContact CG2-CD2 3.71Å; M363-L428 HydrophobicContact CE-CD2 4.18Å; Y405-L428 PolarHBondContact N-O 2.84Å; Y405-L428 PolarHBondContact O-N 3.47Å; L428-L430 HydrophobicContact CD2-CD2 3.92Å; L428-L430 HydrophobicContact CG-CD2 4.08Å
429	S	74.8	Confident	61.4	Low	67 Å²	67	74.5 Å²	74.5	47%	0.469	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	108.2	173.1	-70.5	0	0	0	0	110.4	A431	S429-A431 PolarHBondContact O-N 2.91Å
430	L	71.1	Confident	62.9	Low	3 Å²	3	69.6 Å²	69.6	2%	0.016	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	117.9	169	-59.5	-168.5	0	0	0	108.8	V355 Y361 M363 L394 L397 I402 G403 Y405 L428	V355-L430 HydrophobicContact CG1-CB 4.49Å; V355-L430 HydrophobicContact CG1-CD1 4.35Å; V355-L430 HydrophobicContact CG1-CD2 3.95Å; V355-L430 HydrophobicContact CG1-CG 4.49Å; V355-L430 HydrophobicContact CG2-CB 4.35Å; Y361-L430 HydrophobicContact CD1-CD1 4.3Å; Y361-L430 HydrophobicContact CD1-CD2 4.4Å; Y361-L430 HydrophobicContact CE1-CD1 4.36Å; Y361-L430 HydrophobicContact CE1-CD2 3.68Å; M363-L430 HydrophobicContact CE-CD1 3.78Å; M363-L430 HydrophobicContact CE-CD2 3.95Å; M363-L430 HydrophobicContact CE-CG 4.04Å; L394-L430 HydrophobicContact CD1-CD1 4.21Å; L397-L430 HydrophobicContact CD1-CD1 4.07Å; I402-L430 WeakPolarHBondContact CG2-O 3.27Å; G403-L430 PolarHBondContact N-O 2.66Å; G403-L430 PolarHBondContact O-N 2.73Å; Y405-L430 HydrophobicContact CD2-CD1 4.07Å; Y405-L430 HydrophobicContact CD2-CG 3.92Å; Y405-L430 HydrophobicContact CE2-CD1 3.6Å; Y405-L430 HydrophobicContact CE2-CG 3.89Å; L428-L430 HydrophobicContact CD2-CD2 3.92Å; L428-L430 HydrophobicContact CG-CD2 4.08Å
431	A	61.5	Low	64.5	Low	55 Å²	55	66.2 Å²	66.2	46%	0.455	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	141.2	-178.6	0	0	0	0	0	110	V355 S429 T433	V355-A431 VanDerWaalsContact CG2-O 3.26Å; V355-A431 WeakPolarHBondContact CG2-O 3.4Å; S429-A431 PolarHBondContact O-N 2.91Å; A431-T433 PolarHBondContact O-N 2.83Å
432	L	55.6	Low	65.7	Low	56 Å²	56	67.7 Å²	67.7	29%	0.293	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	127.1	170.3	-71.6	164.7	0	0	0	109	I357 Y399 I402 R434 V449	I357-L432 HydrophobicContact CD1-CD2 4.03Å; I357-L432 HydrophobicContact CG1-CD2 3.73Å; Y399-L432 HydrophobicContact CD1-CD1 4.31Å; Y399-L432 HydrophobicContact CE1-CD1 3.8Å; I402-L432 HydrophobicContact CD1-CD1 3.68Å; I402-L432 HydrophobicContact CD1-CD2 4.08Å; I402-L432 HydrophobicContact CD1-CG 3.71Å; L432-R434 PolarHBondContact O-N 2.81Å; L432-V449 HydrophobicContact CD1-CG2 3.97Å
433	T	46.5	Very low	66.9	Low	52 Å²	52	69.8 Å²	69.8	32%	0.319	38%	0.381	S	S	.	.			trans	-59.5	112.3	174.1	47.3	0	0	0	0	109.3	D354 A431 E435	D354-T433 HydrophobicContact CB-CG2 3.82Å; D354-T433 WeakPolarHBondContact OD1-CG2 3.32Å; A431-T433 PolarHBondContact O-N 2.83Å; T433-E435 PolarHBondContact O-N 2.85Å
434	R	46.3	Very low	66.7	Low	169 Å²	169	72 Å²	72	64%	0.638	40%	0.4	S	S	*	.			trans	-74.8	66	166.5	-82.9	-171.3	168.6	-168.4	-2.2	108.7	L432 T436	L432-R434 PolarHBondContact O-N 2.81Å; R434-T436 PolarHBondContact O-N 2.8Å; R434-T436 VanDerWaalsContact O-N 3.07Å
435	E	47.5	Very low	66.9	Low	99 Å²	99	71.9 Å²	71.9	46%	0.463	40%	0.401	S	S	.	.			trans	-55.1	116.1	171.2	-73.6	-176.1	-179.4	0	0	109	T433 K437 I438	T433-E435 PolarHBondContact O-N 2.85Å; E435-K437 PolarHBondContact O-N 3.01Å; E435-I438 HydrophobicContact CB-CD1 3.87Å; E435-I438 HydrophobicContact CB-CG1 3.59Å
436	T	42	Very low	66.5	Low	144 Å²	144	69 Å²	69	88%	0.883	39%	0.385	S	S	*	.	S	Bend	trans	-79.2	-2.4	-178	49.6	0	0	0	0	112.6	R434	R434-T436 PolarHBondContact O-N 2.8Å; R434-T436 VanDerWaalsContact O-N 3.07Å
437	K	46.6	Very low	66.3	Low	167 Å²	167	71.7 Å²	71.7	73%	0.726	40%	0.399	S	S	*	.	S	Bend	trans	-156.5	77.7	-170.8	-164	-175.1	-176.4	-166.4	0	110.9	E435	E435-K437 PolarHBondContact O-N 3.01Å
438	I	59.4	Low	65.8	Low	14 Å²	14	66 Å²	66	7%	0.072	37%	0.373	C	S	.	.			trans	-90.4	114.3	-174.4	-50.3	-164.3	0	0	0	110.7	E435 M448 H459	E435-I438 HydrophobicContact CB-CD1 3.87Å; E435-I438 HydrophobicContact CB-CG1 3.59Å; I438-M448 HydrophobicContact CB-CE 3.8Å; I438-M448 HydrophobicContact CD1-CB 4.21Å; I438-M448 HydrophobicContact CD1-CE 3.64Å; I438-M448 HydrophobicContact CD1-CG 4.09Å; I438-M448 HydrophobicContact CG1-CE 3.8Å; I438-H459 PolarHBondContact O-N 3.28Å
439	E	64.7	Low	65.5	Low	105 Å²	105	67.2 Å²	67.2	49%	0.491	38%	0.381	S	S	.	.	B	Isolated β-bridge	trans	-75.5	137.5	159.4	-92.7	-160.2	-119.4	0	0	110.5	H459 K524	E439-H459 WeakPolarHBondContact CA-O 3.47Å; E439-H459 HydrophobicContact CG-CB 4.25Å; E439-K524 IonicContact OE2-NZ 2.82Å; E439-K524 PolarHBondContact OE2-NZ 2.87Å
440	M	80.1	Confident	65.3	Low	2 Å²	2	64.1 Å²	64.1	1%	0.01	36%	0.359	C	S	.	.			trans	-68.2	137.2	171.6	-62.1	174.3	66.5	0	0	109.8	L458 H459 C460 W472 Y515 C517 K524 T526	M440-L458 HydrophobicContact CG-CB 4.45Å; M440-L458 HydrophobicContact SD-CB 4.06Å; M440-H459 PolarHBondContact N-O 2.8Å; M440-C460 HydrophobicContact SD-CB 4.12Å; M440-W472 HydrophobicContact CE-CH2 4.34Å; M440-W472 HydrophobicContact CE-CZ3 3.84Å; M440-W472 HydrophobicContact SD-CE3 4.47Å; M440-W472 HydrophobicContact SD-CH2 3.26Å; M440-W472 WeakPolarHBondContact SD-CH2 3.46Å; M440-W472 HydrophobicContact SD-CZ2 4.38Å; M440-W472 HydrophobicContact SD-CZ3 3.32Å; M440-W472 WeakPolarHBondContact SD-CZ3 3.19Å; M440-Y515 WeakPolarHBondContact CE-O 3.33Å; M440-C517 HydrophobicContact CE-CB 4.28Å; M440-C517 HydrophobicContact SD-CB 4.44Å; M440-K524 HydrophobicContact CB-CB 3.8Å; M440-K524 WeakPolarHBondContact CE-O 3.14Å; M440-K524 WeakPolarHBondContact O-CD 3.33Å; M440-K524 WeakPolarHBondContact O-CE 3.4Å; M440-K524 WeakPolarHBondContact O-CG 3.4Å; M440-K524 PolarHBondContact O-NZ 2.83Å; M440-T526 HydrophobicContact CE-CG2 4.1Å; M440-T526 HydrophobicContact CG-CG2 3.92Å; M440-T526 HydrophobicContact SD-CG2 4.35Å
441	S	82.2	Confident	65.4	Low	41 Å²	41	65.5 Å²	65.5	29%	0.287	37%	0.366	S	S	.	.	B	Isolated β-bridge	trans	-111.9	159.8	-177	55.7	0	0	0	0	111.7	G445 S446 K524 Q525	S441-G445 VanDerWaalsContact OG-CA 3.32Å; S441-G445 WeakPolarHBondContact OG-CA 3.39Å; S441-S446 PolarHBondContact OG-N 2.78Å; S441-S446 VanDerWaalsContact OG-N 3.09Å; S441-K524 CarbonylContact O-C 3.53Å; S441-K524 WeakPolarHBondContact O-CA 3.43Å; S441-Q525 PolarHBondContact O-N 2.7Å
442	P	83.1	Confident	66.1	Low	87 Å²	87	66.1 Å²	66.1	57%	0.565	37%	0.366	S	S	*	.	S	Bend	trans	-59.2	151.4	177	-24.8	35.5	0	0	0	112.9	G445 I523	P442-G445 WeakPolarHBondContact O-CA 3.4Å; P442-G445 PolarHBondContact O-N 2.78Å; P442-I523 WeakPolarHBondContact CA-O 3.48Å
443	P	82.3	Confident	67	Low	71 Å²	71	66 Å²	66	46%	0.461	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.1	131.1	177.2	-29	32.9	0	0	0	112.9	G445 I523 Q525	P443-G445 VanDerWaalsContact C-N 3.34Å; P443-G445 VanDerWaalsContact CA-N 3.33Å; P443-I523 VanDerWaalsContact CD-O 3.26Å; P443-I523 WeakPolarHBondContact CD-O 3.38Å; P443-I523 HydrophobicContact CG-CB 4.26Å; P443-I523 HydrophobicContact CG-CG2 3.99Å; P443-Q525 HydrophobicContact CG-CG 4.28Å
444	P	71.9	Confident	68.3	Low	122 Å²	122	65.7 Å²	65.7	79%	0.792	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	cis	-76.8	-2.5	13.7	32.2	-37.8	0	0	0	116.2	Q525	P444-Q525 VanDerWaalsContact C-NE2 3.26Å; P444-Q525 PolarHBondContact O-NE2 3.17Å
445	G	72.6	Confident	69.9	Low	21 Å²	21	61.4 Å²	61.4	22%	0.216	37%	0.366	C	S	.	.			trans	80	-174.3	176.6	0	0	0	0	0	114.6	S441 P442 P443 Q525	S441-G445 VanDerWaalsContact OG-CA 3.32Å; S441-G445 WeakPolarHBondContact OG-CA 3.39Å; P442-G445 WeakPolarHBondContact O-CA 3.4Å; P442-G445 PolarHBondContact O-N 2.78Å; P443-G445 VanDerWaalsContact C-N 3.34Å; P443-G445 VanDerWaalsContact CA-N 3.33Å; G445-Q525 VanDerWaalsContact CA-O 3.24Å; G445-Q525 WeakPolarHBondContact CA-O 3.25Å
446	S	71	Confident	71.5	Confident	25 Å²	25	58.4 Å²	58.4	18%	0.175	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	163.8	173.6	54.4	0	0	0	0	111.4	S441 Q525 T526 H527	S441-S446 PolarHBondContact OG-N 2.78Å; S441-S446 VanDerWaalsContact OG-N 3.09Å; S446-Q525 PolarHBondContact N-O 2.78Å; S446-T526 CarbonylContact O-C 3.53Å; S446-T526 VanDerWaalsContact O-CA 3.24Å; S446-T526 WeakPolarHBondContact O-CA 3.21Å; S446-T526 PolarHBondContact O-OG1 3.32Å; S446-T526 WeakPolarHBondContact OG-CB 3.44Å; S446-T526 PolarHBondContact OG-OG1 2.69Å; S446-H527 PolarHBondContact O-N 3.38Å
447	V	73.4	Confident	73.6	Confident	68 Å²	68	55.9 Å²	55.9	41%	0.412	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	114.3	171.6	-170.3	0	0	0	0	108.4	Y399 H527 V529	Y399-V447 WeakPolarHBondContact OH-CG1 3.29Å; V447-H527 CarbonylContact C-O 3.57Å; V447-H527 WeakPolarHBondContact CA-O 3.46Å; V447-H527 HydrophobicContact CG1-CB 4.44Å; V447-H527 WeakPolarHBondContact CG1-O 3.34Å; V447-V529 HydrophobicContact CG1-CG2 3.8Å
448	M	70.5	Confident	75.6	Confident	5 Å²	5	48 Å²	48	3%	0.025	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	130.6	176.9	-178.4	-178.4	-76.6	0	0	108.8	I438 R456 L458 H527 L528 V529	I438-M448 HydrophobicContact CB-CE 3.8Å; I438-M448 HydrophobicContact CD1-CB 4.21Å; I438-M448 HydrophobicContact CD1-CE 3.64Å; I438-M448 HydrophobicContact CD1-CG 4.09Å; I438-M448 HydrophobicContact CG1-CE 3.8Å; M448-R456 HydrophobicContact SD-CB 3.75Å; M448-R456 HydrophobicContact SD-CG 3.71Å; M448-L458 HydrophobicContact CE-CD2 3.64Å; M448-L458 HydrophobicContact SD-CD2 3.82Å; M448-H527 PolarHBondContact N-O 2.85Å; M448-L528 HydrophobicContact CB-CD1 4.12Å; M448-L528 HydrophobicContact CG-CD1 3.91Å; M448-L528 CarbonylContact O-C 3.54Å; M448-L528 WeakPolarHBondContact O-CA 3.39Å; M448-L528 HydrophobicContact SD-CD1 3.99Å; M448-V529 PolarHBondContact O-N 2.01Å
449	V	71.8	Confident	76.9	Confident	39 Å²	39	48.9 Å²	48.9	24%	0.236	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	134.3	170.2	-175.3	0	0	0	0	109.2	Y399 L432 V529 R531	Y399-V449 HydrophobicContact CE1-CG2 4.1Å; L432-V449 HydrophobicContact CD1-CG2 3.97Å; V449-V529 WeakPolarHBondContact CA-O 3.48Å; V449-V529 HydrophobicContact CG2-CB 4.31Å; V449-R531 HydrophobicContact CG1-CB 4.27Å
450	S	72.2	Confident	77.9	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.007	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	150.5	179.6	-151.7	0	0	0	0	111.7	E454 R456 I507 V529 V530 R531	S450-E454 WeakPolarHBondContact CA-OE2 3.26Å; S450-E454 WeakPolarHBondContact CB-OE2 3.49Å; S450-E454 PolarHBondContact OG-OE2 2.81Å; S450-R456 VanDerWaalsContact OG-CG 3.24Å; S450-R456 WeakPolarHBondContact OG-CG 3.42Å; S450-R456 PolarHBondContact OG-NE 3.13Å; S450-I507 VanDerWaalsContact OG-CD1 3.25Å; S450-I507 WeakPolarHBondContact OG-CD1 3.43Å; S450-V529 PolarHBondContact N-O 2.76Å; S450-V530 WeakPolarHBondContact O-CA 3.34Å; S450-R531 PolarHBondContact O-N 3Å
451	L	71.4	Confident	78.1	Confident	32 Å²	32	46.9 Å²	46.9	17%	0.168	29%	0.289	C	S	.	.			trans	-94.2	151.7	175.7	-55.5	-178.7	0	0	0	110.9	G453 E454 R531 E533	L451-G453 PolarHBondContact O-N 3.41Å; L451-E454 HydrophobicContact CB-CG 4.11Å; L451-E454 PolarHBondContact N-OE2 2.85Å; L451-E454 WeakPolarHBondContact O-CB 3.35Å; L451-E454 PolarHBondContact O-N 2.85Å; L451-E454 VanDerWaalsContact O-N 3.15Å; L451-R531 VanDerWaalsContact CD2-O 3.27Å; L451-R531 WeakPolarHBondContact CD2-O 3.47Å; L451-E533 HydrophobicContact CD2-CG 3.81Å
452	P	77.7	Confident	77.8	Confident	68 Å²	68	45.8 Å²	45.8	44%	0.442	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	136.9	170.9	-27.5	34.9	0	0	0	112.5	E454 I507 V530 R531 A532	P452-E454 VanDerWaalsContact C-N 3.31Å; P452-E454 PolarHBondContact O-N 2.86Å; P452-I507 CarbonylContact C-O 3.57Å; P452-I507 VanDerWaalsContact CA-O 3.24Å; P452-I507 WeakPolarHBondContact CA-O 3.37Å; P452-V530 HydrophobicContact CG-CG1 4.3Å; P452-R531 VanDerWaalsContact CD-O 3.24Å; P452-R531 WeakPolarHBondContact CD-O 3.46Å; P452-A532 HydrophobicContact CG-CB 4.36Å
453	G	73.5	Confident	77.2	Confident	55 Å²	55	47.3 Å²	47.3	57%	0.567	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.3	-12.9	-177	0	0	0	0	0	115.7	L451 I507	L451-G453 PolarHBondContact O-N 3.41Å; G453-I507 PolarHBondContact N-O 2.66Å
454	E	74.9	Confident	76.3	Confident	44 Å²	44	51 Å²	51	21%	0.206	31%	0.31	C	S	.	.			trans	-65.6	162.4	172.9	-72.6	-174	142.1	0	0	112.1	S450 L451 P452 R456 G506 I507	S450-E454 WeakPolarHBondContact CA-OE2 3.26Å; S450-E454 WeakPolarHBondContact CB-OE2 3.49Å; S450-E454 PolarHBondContact OG-OE2 2.81Å; L451-E454 HydrophobicContact CB-CG 4.11Å; L451-E454 PolarHBondContact N-OE2 2.85Å; L451-E454 WeakPolarHBondContact O-CB 3.35Å; L451-E454 PolarHBondContact O-N 2.85Å; L451-E454 VanDerWaalsContact O-N 3.15Å; P452-E454 VanDerWaalsContact C-N 3.31Å; P452-E454 PolarHBondContact O-N 2.86Å; E454-R456 VanDerWaalsContact CD-NH2 3.27Å; E454-R456 IonicContact OE1-NH2 2.74Å; E454-R456 PolarHBondContact OE1-NH2 2.87Å; E454-R456 VanDerWaalsContact OE1-NH2 3.16Å; E454-R456 IonicContact OE2-CZ 2.75Å; E454-R456 IonicContact OE2-NE 3.81Å; E454-R456 PolarHBondContact OE2-NE 2.89Å; E454-R456 IonicContact OE2-NH2 3.86Å; E454-R456 PolarHBondContact OE2-NH2 2.85Å; E454-G506 WeakPolarHBondContact O-CA 3.29Å; E454-G506 PolarHBondContact O-N 2.93Å; E454-I507 PolarHBondContact O-N 3.28Å
455	T	79.4	Confident	75.8	Confident	80 Å²	80	46.1 Å²	46.1	49%	0.491	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	132.4	167.8	-65	0	0	0	0	109.1	T503 I504 R505	T455-T503 HydrophobicContact CG2-CG2 4.07Å; T455-I504 CarbonylContact C-O 3.57Å; T455-I504 VanDerWaalsContact CA-O 3.26Å; T455-I504 WeakPolarHBondContact CA-O 3.32Å; T455-I504 WeakPolarHBondContact CG2-O 3.37Å; T455-R505 HydrophobicContact CG2-CG 3.97Å
456	R	81.3	Confident	75.6	Confident	35 Å²	35	49 Å²	49	13%	0.132	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	154.5	179.1	-63.5	-68.1	177.8	165.6	-5.9	111.2	M448 S450 E454 T503 I504 I507	M448-R456 HydrophobicContact SD-CB 3.75Å; M448-R456 HydrophobicContact SD-CG 3.71Å; S450-R456 VanDerWaalsContact OG-CG 3.24Å; S450-R456 WeakPolarHBondContact OG-CG 3.42Å; S450-R456 PolarHBondContact OG-NE 3.13Å; E454-R456 VanDerWaalsContact CD-NH2 3.27Å; E454-R456 IonicContact OE1-NH2 2.74Å; E454-R456 PolarHBondContact OE1-NH2 2.87Å; E454-R456 VanDerWaalsContact OE1-NH2 3.16Å; E454-R456 IonicContact OE2-CZ 2.75Å; E454-R456 IonicContact OE2-NE 3.81Å; E454-R456 PolarHBondContact OE2-NE 2.89Å; E454-R456 IonicContact OE2-NH2 3.86Å; E454-R456 PolarHBondContact OE2-NH2 2.85Å; R456-T503 CarbonylContact O-C 3.59Å; R456-T503 WeakPolarHBondContact O-CA 3.42Å; R456-I504 PolarHBondContact N-O 2.92Å; R456-I504 PolarHBondContact O-N 2.88Å; R456-I507 HydrophobicContact CB-CD1 3.9Å; R456-I507 HydrophobicContact CG-CD1 3.43Å; R456-I507 VanDerWaalsContact CG-CD1 3.43Å
457	E	85.7	Confident	75.3	Confident	91 Å²	91	48.4 Å²	48.4	43%	0.425	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	128.6	173.8	-62.4	-174	163.2	0	0	109.4	H459 I501 V502 T503	E457-H459 WeakPolarHBondContact CB-NE2 3.3Å; E457-H459 IonicContact OE2-CD2 3.05Å; E457-H459 IonicContact OE2-CE1 2.74Å; E457-H459 PolarHBondContact OE2-CE1 2.82Å; E457-H459 IonicContact OE2-NE2 3.04Å; E457-H459 PolarHBondContact OE2-NE2 2.93Å; E457-I501 HydrophobicContact CB-CG2 4.03Å; E457-I501 HydrophobicContact CG-CG2 4.47Å; E457-V502 CarbonylContact C-O 3.58Å; E457-V502 WeakPolarHBondContact CA-O 3.42Å; E457-T503 HydrophobicContact CG-CG2 4.08Å
458	L	88.4	Confident	75.1	Confident	1 Å²	1	55 Å²	55	1%	0.005	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	108	174.9	-47.4	-178.6	0	0	0	107.3	M440 M448 W472 I501 V502 Y515 T526	M440-L458 HydrophobicContact CG-CB 4.45Å; M440-L458 HydrophobicContact SD-CB 4.06Å; M448-L458 HydrophobicContact CE-CD2 3.64Å; M448-L458 HydrophobicContact SD-CD2 3.82Å; L458-W472 HydrophobicContact CB-CH2 3.85Å; L458-W472 HydrophobicContact CB-CZ3 4.07Å; L458-W472 HydrophobicContact CD1-CZ3 4.28Å; L458-W472 WeakPolarHBondContact O-CH2 3.42Å; L458-I501 WeakPolarHBondContact O-CA 3.4Å; L458-V502 HydrophobicContact CB-CB 4.42Å; L458-V502 HydrophobicContact CD1-CG1 4.33Å; L458-V502 PolarHBondContact N-O 2.89Å; L458-V502 PolarHBondContact O-N 3.21Å; L458-V502 VanDerWaalsContact O-N 3.09Å; L458-Y515 HydrophobicContact CD1-CD1 3.67Å; L458-Y515 HydrophobicContact CD1-CD2 3.89Å; L458-Y515 HydrophobicContact CD1-CE1 4.23Å; L458-Y515 HydrophobicContact CD1-CE2 4.42Å; L458-Y515 HydrophobicContact CD1-CG 3.47Å; L458-Y515 VanDerWaalsContact CD1-CG 3.47Å; L458-T526 HydrophobicContact CD1-CG2 4.19Å; L458-T526 HydrophobicContact CD2-CG2 3.99Å
459	H	86.6	Confident	75.7	Confident	33 Å²	33	59.2 Å²	59.2	15%	0.153	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	122.3	-175.4	-75.1	-107.8	0	0	0	111	I438 E439 M440 E457 V499	I438-H459 PolarHBondContact O-N 3.28Å; E439-H459 WeakPolarHBondContact CA-O 3.47Å; E439-H459 HydrophobicContact CG-CB 4.25Å; M440-H459 PolarHBondContact N-O 2.8Å; E457-H459 WeakPolarHBondContact CB-NE2 3.3Å; E457-H459 IonicContact OE2-CD2 3.05Å; E457-H459 IonicContact OE2-CE1 2.74Å; E457-H459 PolarHBondContact OE2-CE1 2.82Å; E457-H459 IonicContact OE2-NE2 3.04Å; E457-H459 PolarHBondContact OE2-NE2 2.93Å; H459-V499 HydrophobicContact CB-CG2 4.44Å
460	C	86.6	Confident	76.4	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.007	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	86	-179.9	-174.8	0	0	0	0	111.4	M440 F462 W472 V499 S500 C517	M440-C460 HydrophobicContact SD-CB 4.12Å; C460-F462 WeakPolarHBondContact SG-CE2 3.49Å; C460-W472 HydrophobicContact CB-CH2 3.95Å; C460-W472 HydrophobicContact CB-CZ2 3.68Å; C460-V499 WeakPolarHBondContact O-CA 3.4Å; C460-S500 WeakPolarHBondContact CA-O 3.26Å; C460-S500 WeakPolarHBondContact CB-O 3.44Å; C460-S500 PolarHBondContact N-O 3.44Å; C460-S500 PolarHBondContact O-N 3.4Å; C460-C517 HydrophobicContact CB-CB 3.81Å; C460-C517 WeakPolarHBondContact CB-SG 3.31Å; C460-C517 WeakPolarHBondContact SG-CB 2.92Å; C460-C517 CovalentContact SG-SG 2.02Å; C460-C517 PolarHBondContact SG-SG 3.1Å
461	E	82.5	Confident	77.3	Confident	65 Å²	65	64.6 Å²	64.6	30%	0.304	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	138.2	170.6	178.8	151.5	-172.6	0	0	110.9	R498 V499 K524	E461-R498 HydrophobicContact CG-CB 4.37Å; E461-R498 WeakPolarHBondContact OE1-CB 3.41Å; E461-V499 HydrophobicContact CB-CB 4.14Å; E461-V499 HydrophobicContact CB-CG2 4.16Å; E461-K524 WeakPolarHBondContact O-CE 3Å; E461-K524 PolarHBondContact O-NZ 3.09Å
462	F	77.7	Confident	78.2	Confident	17 Å²	17	63.1 Å²	63.1	8%	0.075	34%	0.335	C	S	.	.			trans	-129.4	128.4	172.7	-76.1	-72	0	0	0	108.8	C460 V464 A465 V470 I519 D522 K524	C460-F462 WeakPolarHBondContact SG-CE2 3.49Å; F462-V464 PolarHBondContact O-N 2.74Å; F462-A465 HydrophobicContact CB-CB 3.59Å; F462-A465 PolarHBondContact O-N 2.77Å; F462-V470 HydrophobicContact CD2-CG2 3.97Å; F462-V470 HydrophobicContact CE2-CG1 4.34Å; F462-V470 HydrophobicContact CE2-CG2 4.29Å; F462-I519 HydrophobicContact CB-CG2 4.39Å; F462-I519 HydrophobicContact CD1-CG2 3.87Å; F462-I519 HydrophobicContact CD2-CB 4.4Å; F462-I519 HydrophobicContact CD2-CG2 3.55Å; F462-I519 HydrophobicContact CE1-CG2 3.92Å; F462-I519 HydrophobicContact CE2-CB 4.27Å; F462-I519 HydrophobicContact CE2-CG2 3.57Å; F462-I519 HydrophobicContact CG-CG2 3.7Å; F462-I519 HydrophobicContact CZ-CG2 3.77Å; F462-D522 HydrophobicContact CD1-CB 4.24Å; F462-D522 HydrophobicContact CE1-CB 3.71Å; F462-D522 HydrophobicContact CZ-CB 4.43Å; F462-K524 HydrophobicContact CD1-CD 4.45Å; F462-K524 HydrophobicContact CE1-CD 3.99Å; F462-K524 HydrophobicContact CE1-CG 4Å; F462-K524 HydrophobicContact CZ-CB 4.29Å; F462-K524 HydrophobicContact CZ-CD 4.15Å; F462-K524 HydrophobicContact CZ-CG 4.13Å
463	P	70	Confident	78.9	Confident	120 Å²	120	61.7 Å²	61.7	78%	0.779	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-18.8	-163.8	-28.5	35.6	0	0	0	117.6
464	V	62.8	Low	79.8	Confident	148 Å²	148	59.6 Å²	59.6	90%	0.897	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.7	22	-174.3	-151.2	0	0	0	0	112.2	F462	F462-V464 PolarHBondContact O-N 2.74Å
465	A	62.4	Low	80.4	Confident	20 Å²	20	61.6 Å²	61.6	17%	0.165	31%	0.305	C	S	.	.			trans	-93.2	145.1	-173	0	0	0	0	0	114.1	F462 I519	F462-A465 HydrophobicContact CB-CB 3.59Å; F462-A465 PolarHBondContact O-N 2.77Å; A465-I519 HydrophobicContact CB-CD1 3.5Å; A465-I519 VanDerWaalsContact CB-CD1 3.5Å
466	N	67.4	Low	80.7	Confident	82 Å²	82	62.9 Å²	62.9	44%	0.439	31%	0.309	S	S	.	.			trans	-79.6	123.5	152.3	172.6	8	0	0	0	107.9	R468 D469	N466-R468 PolarHBondContact O-N 2.67Å; N466-R468 PolarHBondContact OD1-N 2.84Å; N466-D469 WeakPolarHBondContact CB-OD2 3.4Å; N466-D469 WeakPolarHBondContact O-CB 3.5Å; N466-D469 PolarHBondContact O-N 2.93Å
467	P	64.3	Low	81.1	Confident	12 Å²	12	66.2 Å²	66.2	8%	0.078	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-54.6	-26	-177.1	-27.1	32.8	0	0	0	115.1	D469 V470 R493 D495 R496	P467-D469 VanDerWaalsContact C-N 3.3Å; P467-D469 PolarHBondContact O-N 2.93Å; P467-V470 WeakPolarHBondContact O-CB 3.47Å; P467-V470 PolarHBondContact O-N 2.8Å; P467-R493 PolarHBondContact O-NH2 3.09Å; P467-R493 VanDerWaalsContact O-NH2 3.15Å; P467-D495 HydrophobicContact CB-CB 3.94Å; P467-R496 WeakPolarHBondContact CG-O 3.16Å
468	R	70.3	Confident	81.2	Confident	205 Å²	205	64 Å²	64	77%	0.774	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-72.3	-20.2	178.1	-67.3	-175.3	173	-173.5	-2.3	114.1	N466 V470	N466-R468 PolarHBondContact O-N 2.67Å; N466-R468 PolarHBondContact OD1-N 2.84Å; R468-V470 VanDerWaalsContact C-N 3.32Å
469	D	83.6	Confident	81.2	Confident	94 Å²	94	64.7 Å²	64.7	50%	0.503	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-83.6	-14.9	179	-59.8	-24	0	0	0	111.7	N466 P467 I519	N466-D469 WeakPolarHBondContact CB-OD2 3.4Å; N466-D469 WeakPolarHBondContact O-CB 3.5Å; N466-D469 PolarHBondContact O-N 2.93Å; P467-D469 VanDerWaalsContact C-N 3.3Å; P467-D469 PolarHBondContact O-N 2.93Å; D469-I519 HydrophobicContact CB-CD1 3.82Å; D469-I519 HydrophobicContact CB-CG1 4.19Å
470	V	86.3	Confident	80.9	Confident	2 Å²	2	67.7 Å²	67.7	1%	0.012	34%	0.335	C	S	.	.			trans	-70	126.7	172.7	-176.1	0	0	0	0	109.6	F462 P467 R468 R493 C517 I519	F462-V470 HydrophobicContact CD2-CG2 3.97Å; F462-V470 HydrophobicContact CE2-CG1 4.34Å; F462-V470 HydrophobicContact CE2-CG2 4.29Å; P467-V470 WeakPolarHBondContact O-CB 3.47Å; P467-V470 PolarHBondContact O-N 2.8Å; R468-V470 VanDerWaalsContact C-N 3.32Å; V470-R493 PolarHBondContact O-NH1 2.97Å; V470-R493 PolarHBondContact O-NH2 2.83Å; V470-C517 HydrophobicContact CG1-CB 3.79Å; V470-I519 HydrophobicContact CG2-CB 4.49Å; V470-I519 HydrophobicContact CG2-CD1 4.34Å
471	R	89.9	Confident	80.6	Confident	152 Å²	152	73.9 Å²	73.9	57%	0.574	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110	130.5	173.2	-66.7	-176.3	-176.8	-179.3	0.5	110.5	Y473 C517 R518	R471-Y473 HydrophobicContact CB-CD2 4.5Å; R471-Y473 HydrophobicContact CB-CE2 3.67Å; R471-C517 WeakPolarHBondContact O-CA 3.5Å; R471-R518 PolarHBondContact N-O 3.45Å; R471-R518 PolarHBondContact O-N 2.88Å
472	W	91.3	Very high	80.6	Confident	1 Å²	1	71.6 Å²	71.6	0%	0.004	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	139	176.9	-74.5	89.1	0	0	0	111.7	M440 L458 C460 L479 S500 V502 E516 C517	M440-W472 HydrophobicContact CE-CH2 4.34Å; M440-W472 HydrophobicContact CE-CZ3 3.84Å; M440-W472 HydrophobicContact SD-CE3 4.47Å; M440-W472 HydrophobicContact SD-CH2 3.26Å; M440-W472 WeakPolarHBondContact SD-CH2 3.46Å; M440-W472 HydrophobicContact SD-CZ2 4.38Å; M440-W472 HydrophobicContact SD-CZ3 3.32Å; M440-W472 WeakPolarHBondContact SD-CZ3 3.19Å; L458-W472 HydrophobicContact CB-CH2 3.85Å; L458-W472 HydrophobicContact CB-CZ3 4.07Å; L458-W472 HydrophobicContact CD1-CZ3 4.28Å; L458-W472 WeakPolarHBondContact O-CH2 3.42Å; C460-W472 HydrophobicContact CB-CH2 3.95Å; C460-W472 HydrophobicContact CB-CZ2 3.68Å; W472-L479 HydrophobicContact CB-CB 3.85Å; W472-L479 HydrophobicContact CB-CD2 3.83Å; W472-L479 HydrophobicContact CG-CD2 4.39Å; W472-L479 PolarHBondContact O-N 2.92Å; W472-S500 PolarHBondContact NE1-OG 3.11Å; W472-V502 HydrophobicContact CD2-CB 4.39Å; W472-V502 HydrophobicContact CD2-CG2 3.42Å; W472-V502 VanDerWaalsContact CD2-CG2 3.42Å; W472-V502 HydrophobicContact CE3-CB 4.2Å; W472-V502 HydrophobicContact CE3-CG2 3.63Å; W472-V502 HydrophobicContact CG-CG2 3.9Å; W472-V502 HydrophobicContact CH2-CB 3.92Å; W472-V502 HydrophobicContact CH2-CG2 3.93Å; W472-V502 HydrophobicContact CZ2-CB 4.15Å; W472-V502 HydrophobicContact CZ2-CG2 3.78Å; W472-V502 HydrophobicContact CZ3-CB 3.94Å; W472-V502 HydrophobicContact CZ3-CG2 3.87Å; W472-E516 CarbonylContact C-O 3.58Å; W472-E516 WeakPolarHBondContact CA-O 3.29Å; W472-C517 HydrophobicContact CD2-CB 4.04Å; W472-C517 HydrophobicContact CE3-CB 4.12Å; W472-C517 HydrophobicContact CH2-CB 4.33Å; W472-C517 HydrophobicContact CZ2-CB 4.21Å; W472-C517 HydrophobicContact CZ3-CB 4.28Å
473	Y	91.9	Very high	80.5	Confident	38 Å²	38	75.4 Å²	75.4	15%	0.149	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	150	175.8	-61.6	-101.2	0	0	0	109.9	R471 Q477 L478 Y515 E516 R518	R471-Y473 HydrophobicContact CB-CD2 4.5Å; R471-Y473 HydrophobicContact CB-CE2 3.67Å; Y473-Q477 CarbonylContact C-O 3.44Å; Y473-Q477 WeakPolarHBondContact CA-O 3.02Å; Y473-Q477 WeakPolarHBondContact CB-O 3.06Å; Y473-L478 HydrophobicContact CD1-CB 4.31Å; Y473-L478 HydrophobicContact CE1-CB 4.18Å; Y473-L478 HydrophobicContact CE1-CG 4.46Å; Y473-Y515 WeakPolarHBondContact O-CA 3.47Å; Y473-E516 PolarHBondContact N-O 3.05Å; Y473-E516 PolarHBondContact O-N 2.91Å; Y473-R518 HydrophobicContact CD2-CB 4.45Å; Y473-R518 HydrophobicContact CD2-CG 3.85Å; Y473-R518 HydrophobicContact CE2-CB 4.11Å; Y473-R518 HydrophobicContact CE2-CG 3.9Å
474	F	91.6	Very high	80.7	Confident	10 Å²	10	73 Å²	73	4%	0.044	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	128.2	166.1	174.6	-90.1	0	0	0	107.8	N476 Q477 L479 H482 I485 G512 T514 Y515	F474-N476 VanDerWaalsContact C-N 3.25Å; F474-N476 PolarHBondContact O-N 3.02Å; F474-Q477 PolarHBondContact N-O 3.16Å; F474-Q477 PolarHBondContact O-N 3Å; F474-L479 HydrophobicContact CB-CD1 3.96Å; F474-H482 AromaticContact CD1-CE1 3.44Å; F474-H482 VanDerWaalsContact CD1-CE1 3.44Å; F474-H482 WeakPolarHBondContact CD1-CE1 3.24Å; F474-H482 AromaticContact CD1-ND1 3.71Å; F474-H482 AromaticContact CD1-NE2 3.75Å; F474-H482 AromaticContact CE1-CE1 3.6Å; F474-I485 HydrophobicContact CD1-CD1 3.64Å; F474-I485 HydrophobicContact CD2-CD1 3.6Å; F474-I485 HydrophobicContact CE1-CD1 3.48Å; F474-I485 VanDerWaalsContact CE1-CD1 3.48Å; F474-I485 HydrophobicContact CE1-CG1 4.41Å; F474-I485 HydrophobicContact CE2-CD1 3.41Å; F474-I485 VanDerWaalsContact CE2-CD1 3.41Å; F474-I485 HydrophobicContact CG-CD1 3.69Å; F474-I485 HydrophobicContact CZ-CD1 3.35Å; F474-G512 WeakPolarHBondContact CZ-O 3.3Å; F474-T514 WeakPolarHBondContact CA-O 3.35Å; F474-Y515 HydrophobicContact CB-CD1 4.5Å; F474-Y515 HydrophobicContact CB-CE1 4.5Å; F474-Y515 HydrophobicContact CD2-CD1 4.05Å; F474-Y515 AromaticContact CD2-CD2 3.89Å; F474-Y515 HydrophobicContact CD2-CD2 3.89Å; F474-Y515 AromaticContact CD2-CE1 3.78Å; F474-Y515 HydrophobicContact CD2-CE1 3.78Å; F474-Y515 AromaticContact CD2-CE2 3.6Å; F474-Y515 HydrophobicContact CD2-CE2 3.6Å; F474-Y515 HydrophobicContact CD2-CG 4.1Å; F474-Y515 AromaticContact CD2-CZ 3.55Å; F474-Y515 HydrophobicContact CE2-CD2 4.22Å; F474-Y515 AromaticContact CE2-CE2 3.69Å; F474-Y515 HydrophobicContact CE2-CE2 3.69Å; F474-Y515 AromaticContact CE2-CZ 3.89Å
475	E	88	Confident	81.5	Confident	87 Å²	87	66 Å²	66	41%	0.407	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.7	50.3	-176.6	-69.9	-59.1	139.1	0	0	112.6	Q477 T514	E475-Q477 PolarHBondContact O-N 3.35Å; E475-T514 PolarHBondContact N-O 3.42Å; E475-T514 WeakPolarHBondContact OE1-CA 3.47Å; E475-T514 WeakPolarHBondContact OE1-CB 3.39Å; E475-T514 PolarHBondContact OE1-N 3.31Å; E475-T514 PolarHBondContact OE1-OG1 2.84Å
476	N	85.5	Confident	81.8	Confident	107 Å²	107	69.2 Å²	69.2	57%	0.572	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.5	-3	-175.1	-83.4	-86.1	0	0	0	117.5	F474 R518	F474-N476 VanDerWaalsContact C-N 3.25Å; F474-N476 PolarHBondContact O-N 3.02Å; N476-R518 PolarHBondContact OD1-NH2 2.8Å
477	Q	89.4	Confident	82	Confident	104 Å²	104	69.3 Å²	69.3	49%	0.486	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	149.4	172.9	-60.9	-172.1	34.2	0	0	111	Y473 F474 E475 L479	Y473-Q477 CarbonylContact C-O 3.44Å; Y473-Q477 WeakPolarHBondContact CA-O 3.02Å; Y473-Q477 WeakPolarHBondContact CB-O 3.06Å; F474-Q477 PolarHBondContact N-O 3.16Å; F474-Q477 PolarHBondContact O-N 3Å; E475-Q477 PolarHBondContact O-N 3.35Å; Q477-L479 PolarHBondContact O-N 2.92Å
478	L	89.4	Confident	82.5	Confident	46 Å²	46	70.5 Å²	70.5	24%	0.241	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	122	-177.8	-163	156.2	0	0	0	109.5	Y473 E480 N481 H482	Y473-L478 HydrophobicContact CD1-CB 4.31Å; Y473-L478 HydrophobicContact CE1-CB 4.18Å; Y473-L478 HydrophobicContact CE1-CG 4.46Å; L478-E480 VanDerWaalsContact C-N 3.29Å; L478-E480 HydrophobicContact CD2-CB 3.77Å; L478-E480 HydrophobicContact CD2-CG 4.21Å; L478-E480 PolarHBondContact O-N 2.85Å; L478-N481 WeakPolarHBondContact O-CA 3.49Å; L478-N481 PolarHBondContact O-N 2.92Å; L478-H482 PolarHBondContact O-N 3.41Å
479	L	87	Confident	83	Confident	14 Å²	14	62.8 Å²	62.8	7%	0.073	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-54.7	-41.8	-165	179.1	65.6	0	0	0	113.3	W472 F474 Q477 N481 H482 I485 V491 V502 Y515	W472-L479 HydrophobicContact CB-CB 3.85Å; W472-L479 HydrophobicContact CB-CD2 3.83Å; W472-L479 HydrophobicContact CG-CD2 4.39Å; W472-L479 PolarHBondContact O-N 2.92Å; F474-L479 HydrophobicContact CB-CD1 3.96Å; Q477-L479 PolarHBondContact O-N 2.92Å; L479-N481 PolarHBondContact O-N 3.12Å; L479-H482 WeakPolarHBondContact O-CB 3.36Å; L479-H482 PolarHBondContact O-N 2.81Å; L479-H482 VanDerWaalsContact O-N 3.11Å; L479-I485 HydrophobicContact CD1-CG2 4.02Å; L479-V491 HydrophobicContact CD2-CG1 4.31Å; L479-V502 HydrophobicContact CD2-CG1 4.19Å; L479-V502 HydrophobicContact CD2-CG2 3.74Å; L479-Y515 HydrophobicContact CD1-CE1 4.12Å
480	E	81	Confident	83.1	Confident	97 Å²	97	60.8 Å²	60.8	45%	0.453	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-62.1	-21.9	179.8	-62.2	160.3	-169.1	0	0	112.7	L478 N486 R493	L478-E480 VanDerWaalsContact C-N 3.29Å; L478-E480 HydrophobicContact CD2-CB 3.77Å; L478-E480 HydrophobicContact CD2-CG 4.21Å; L478-E480 PolarHBondContact O-N 2.85Å; E480-N486 PolarHBondContact O-ND2 2.84Å; E480-R493 IonicContact OE1-CZ 2.85Å; E480-R493 IonicContact OE1-NH1 3.86Å; E480-R493 PolarHBondContact OE1-NH1 2.78Å
481	N	80.7	Confident	83.1	Confident	131 Å²	131	61.7 Å²	61.7	70%	0.701	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-108.7	4.8	178.1	-66.1	-26.5	0	0	0	113.4	L478 L479	L478-N481 WeakPolarHBondContact O-CA 3.49Å; L478-N481 PolarHBondContact O-N 2.92Å; L479-N481 PolarHBondContact O-N 3.12Å
482	H	81.9	Confident	83	Confident	17 Å²	17	58.9 Å²	58.9	8%	0.079	33%	0.325	C	S	.	.			trans	-74.3	122.5	-172.6	-168.2	-111.2	0	0	0	111.7	F474 L478 L479 T484 N486	F474-H482 AromaticContact CD1-CE1 3.44Å; F474-H482 VanDerWaalsContact CD1-CE1 3.44Å; F474-H482 WeakPolarHBondContact CD1-CE1 3.24Å; F474-H482 AromaticContact CD1-ND1 3.71Å; F474-H482 AromaticContact CD1-NE2 3.75Å; F474-H482 AromaticContact CE1-CE1 3.6Å; L478-H482 PolarHBondContact O-N 3.41Å; L479-H482 WeakPolarHBondContact O-CB 3.36Å; L479-H482 PolarHBondContact O-N 2.81Å; L479-H482 VanDerWaalsContact O-N 3.11Å; H482-T484 VanDerWaalsContact C-N 3.35Å; H482-T484 PolarHBondContact CE1-OG1 2.66Å; H482-T484 PolarHBondContact ND1-OG1 2.96Å; H482-T484 PolarHBondContact O-N 2.83Å; H482-N486 PolarHBondContact O-N 2.84Å
483	P	75	Confident	82.9	Confident	96 Å²	96	62.4 Å²	62.4	62%	0.623	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-20.5	-161.4	26.3	-36.2	0	0	0	115.5
484	T	74.3	Confident	82.5	Confident	71 Å²	71	63.3 Å²	63.3	44%	0.436	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-60.1	175.6	55.3	0	0	0	0	111.2	H482 N486 A487 T488	H482-T484 VanDerWaalsContact C-N 3.35Å; H482-T484 PolarHBondContact CE1-OG1 2.66Å; H482-T484 PolarHBondContact ND1-OG1 2.96Å; H482-T484 PolarHBondContact O-N 2.83Å; T484-N486 VanDerWaalsContact C-N 3.34Å; T484-N486 PolarHBondContact O-N 2.86Å; T484-A487 WeakPolarHBondContact O-CA 3.3Å; T484-A487 VanDerWaalsContact O-CB 3.3Å; T484-A487 WeakPolarHBondContact O-CB 3.19Å; T484-A487 PolarHBondContact O-N 2.91Å; T484-T488 PolarHBondContact O-N 2.85Å
485	I	79.4	Confident	82.2	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-34.8	-171.1	-69.6	-170.3	0	0	0	113.8	F474 L479 A487 T488 V491	F474-I485 HydrophobicContact CD1-CD1 3.64Å; F474-I485 HydrophobicContact CD2-CD1 3.6Å; F474-I485 HydrophobicContact CE1-CD1 3.48Å; F474-I485 VanDerWaalsContact CE1-CD1 3.48Å; F474-I485 HydrophobicContact CE1-CG1 4.41Å; F474-I485 HydrophobicContact CE2-CD1 3.41Å; F474-I485 VanDerWaalsContact CE2-CD1 3.41Å; F474-I485 HydrophobicContact CG-CD1 3.69Å; F474-I485 HydrophobicContact CZ-CD1 3.35Å; L479-I485 HydrophobicContact CD1-CG2 4.02Å; I485-A487 VanDerWaalsContact C-N 3.3Å; I485-T488 PolarHBondContact O-OG1 3.48Å; I485-T488 VanDerWaalsContact O-OG1 3.06Å; I485-V491 HydrophobicContact CG2-CB 4.21Å; I485-V491 HydrophobicContact CG2-CG2 3.48Å; I485-V491 VanDerWaalsContact CG2-CG2 3.48Å
486	N	70.2	Confident	81.7	Confident	88 Å²	88	69.6 Å²	69.6	47%	0.471	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-20.8	175.3	-158.1	10.7	0	0	0	112.1	E480 H482 T484	E480-N486 PolarHBondContact O-ND2 2.84Å; H482-N486 PolarHBondContact O-N 2.84Å; T484-N486 VanDerWaalsContact C-N 3.34Å; T484-N486 PolarHBondContact O-N 2.86Å
487	A	70.8	Confident	80.9	Confident	83 Å²	83	72.5 Å²	72.5	69%	0.686	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-17.6	178.4	0	0	0	0	0	113.7	T484 I485 G489	T484-A487 WeakPolarHBondContact O-CA 3.3Å; T484-A487 VanDerWaalsContact O-CB 3.3Å; T484-A487 WeakPolarHBondContact O-CB 3.19Å; T484-A487 PolarHBondContact O-N 2.91Å; I485-A487 VanDerWaalsContact C-N 3.3Å; A487-G489 PolarHBondContact O-N 2.93Å
488	T	75.5	Confident	80.2	Confident	37 Å²	37	75.6 Å²	75.6	23%	0.227	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-20.4	174.5	72.6	0	0	0	0	112.5	T484 I485 K490 D510 H511	T484-T488 PolarHBondContact O-N 2.85Å; I485-T488 PolarHBondContact O-OG1 3.48Å; I485-T488 VanDerWaalsContact O-OG1 3.06Å; T488-K490 PolarHBondContact O-N 2.86Å; T488-K490 PolarHBondContact OG1-N 2.63Å; T488-D510 VanDerWaalsContact CG2-OD2 3.26Å; T488-D510 WeakPolarHBondContact CG2-OD2 3.38Å; T488-H511 PolarHBondContact OG1-CE1 2.83Å; T488-H511 PolarHBondContact OG1-NE2 2.76Å; T488-H511 VanDerWaalsContact OG1-NE2 3.09Å
489	G	80.5	Confident	79.8	Confident	44 Å²	44	74.6 Å²	74.6	45%	0.454	39%	0.386	S	S	.	.	S	Bend	trans	67.7	10.7	-177	0	0	0	0	0	114.7	A487 Y492	A487-G489 PolarHBondContact O-N 2.93Å; G489-Y492 VanDerWaalsContact O-CZ 3.23Å; G489-Y492 PolarHBondContact O-OH 2.85Å
490	K	85	Confident	79.8	Confident	52 Å²	52	74 Å²	74	23%	0.226	38%	0.383	C	S	.	.			trans	-105.9	-9.3	-172	-75.6	172.9	168.9	-175.2	0	115.4	T488 Y492 R505 G506 E508	T488-K490 PolarHBondContact O-N 2.86Å; T488-K490 PolarHBondContact OG1-N 2.63Å; K490-Y492 WeakPolarHBondContact O-CD2 3.17Å; K490-Y492 WeakPolarHBondContact O-CE2 3.49Å; K490-R505 WeakPolarHBondContact CB-O 3.22Å; K490-R505 WeakPolarHBondContact CD-O 3.44Å; K490-R505 VanDerWaalsContact CG-O 3.29Å; K490-R505 WeakPolarHBondContact CG-O 3.38Å; K490-R505 PolarHBondContact O-N 2.83Å; K490-G506 WeakPolarHBondContact CD-O 3.32Å; K490-G506 PolarHBondContact NZ-O 3.41Å; K490-E508 VanDerWaalsContact CD-OE2 3.29Å; K490-E508 WeakPolarHBondContact CD-OE2 3.47Å; K490-E508 WeakPolarHBondContact CE-OE2 3.39Å; K490-E508 IonicContact NZ-OE1 2.8Å; K490-E508 PolarHBondContact NZ-OE1 2.78Å; K490-E508 IonicContact NZ-OE2 3.98Å; K490-E508 PolarHBondContact NZ-OE2 3.09Å
491	V	87.3	Confident	80.2	Confident	20 Å²	20	70.1 Å²	70.1	12%	0.121	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	127.7	178.9	-174	0	0	0	0	110.1	L479 I485 V502 T503 I504	L479-V491 HydrophobicContact CD2-CG1 4.31Å; I485-V491 HydrophobicContact CG2-CB 4.21Å; I485-V491 HydrophobicContact CG2-CG2 3.48Å; I485-V491 VanDerWaalsContact CG2-CG2 3.48Å; V491-V502 HydrophobicContact CG1-CG1 3.61Å; V491-T503 WeakPolarHBondContact CA-O 3.45Å; V491-I504 HydrophobicContact CG1-CG1 4.37Å; V491-I504 HydrophobicContact CG2-CG1 4.11Å; V491-I504 HydrophobicContact CG2-CG2 4.16Å
492	Y	88	Confident	80.6	Confident	93 Å²	93	63.9 Å²	63.9	37%	0.365	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	133.1	-176.2	-48.3	-79.4	0	0	0	110.5	G489 K490 V502 T503 R505	G489-Y492 VanDerWaalsContact O-CZ 3.23Å; G489-Y492 PolarHBondContact O-OH 2.85Å; K490-Y492 WeakPolarHBondContact O-CD2 3.17Å; K490-Y492 WeakPolarHBondContact O-CE2 3.49Å; Y492-V502 WeakPolarHBondContact O-CA 3.5Å; Y492-T503 PolarHBondContact N-O 3.19Å; Y492-T503 PolarHBondContact O-N 2.98Å; Y492-R505 HydrophobicContact CD2-CG 4.09Å; Y492-R505 HydrophobicContact CE2-CB 4.09Å; Y492-R505 HydrophobicContact CE2-CG 3.76Å
493	R	88.4	Confident	80.9	Confident	76 Å²	76	63.3 Å²	63.3	29%	0.287	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	133.4	171.6	-178.5	-178.8	170.6	152.7	8.7	110.2	P467 V470 E480 D495 I501	P467-R493 PolarHBondContact O-NH2 3.09Å; P467-R493 VanDerWaalsContact O-NH2 3.15Å; V470-R493 PolarHBondContact O-NH1 2.97Å; V470-R493 PolarHBondContact O-NH2 2.83Å; E480-R493 IonicContact OE1-CZ 2.85Å; E480-R493 IonicContact OE1-NH1 3.86Å; E480-R493 PolarHBondContact OE1-NH1 2.78Å; R493-D495 IonicContact CZ-OD1 3.87Å; R493-D495 IonicContact CZ-OD2 2.73Å; R493-D495 IonicContact NE-OD1 3.28Å; R493-D495 PolarHBondContact NE-OD1 3.1Å; R493-D495 IonicContact NE-OD2 3.3Å; R493-D495 PolarHBondContact NE-OD2 2.84Å; R493-D495 IonicContact NH2-OD1 3.63Å; R493-D495 PolarHBondContact NH2-OD1 3.08Å; R493-D495 IonicContact NH2-OD2 3.52Å; R493-D495 PolarHBondContact NH2-OD2 2.96Å; R493-I501 CarbonylContact C-O 3.56Å; R493-I501 WeakPolarHBondContact CA-O 3.33Å
494	I	84.5	Confident	81.6	Confident	56 Å²	56	58.7 Å²	58.7	29%	0.287	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	107.3	176.8	-52.4	177.4	0	0	0	108.7	R496 I501	I494-R496 HydrophobicContact CG2-CG 4.29Å; I494-I501 HydrophobicContact CB-CB 4.38Å; I494-I501 PolarHBondContact N-O 2.77Å; I494-I501 PolarHBondContact O-N 3.08Å
495	D	83.7	Confident	82.2	Confident	60 Å²	60	61.8 Å²	61.8	32%	0.321	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	128.2	175.2	-64.9	-33.8	0	0	0	110.8	P467 R493 S500	P467-D495 HydrophobicContact CB-CB 3.94Å; R493-D495 IonicContact CZ-OD1 3.87Å; R493-D495 IonicContact CZ-OD2 2.73Å; R493-D495 IonicContact NE-OD1 3.28Å; R493-D495 PolarHBondContact NE-OD1 3.1Å; R493-D495 IonicContact NE-OD2 3.3Å; R493-D495 PolarHBondContact NE-OD2 2.84Å; R493-D495 IonicContact NH2-OD1 3.63Å; R493-D495 PolarHBondContact NH2-OD1 3.08Å; R493-D495 IonicContact NH2-OD2 3.52Å; R493-D495 PolarHBondContact NH2-OD2 2.96Å; D495-S500 VanDerWaalsContact OD1-CB 3.32Å; D495-S500 WeakPolarHBondContact OD1-CB 3.4Å; D495-S500 PolarHBondContact OD1-OG 3.25Å
496	R	78	Confident	82.2	Confident	169 Å²	169	62.8 Å²	62.8	64%	0.638	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.4	159.8	175.9	-60.4	-60.6	-166.8	-177.1	4.1	109.6	P467 I494 R498 V499	P467-R496 WeakPolarHBondContact CG-O 3.16Å; I494-R496 HydrophobicContact CG2-CG 4.29Å; R496-R498 PolarHBondContact O-N 3.47Å; R496-V499 HydrophobicContact CB-CG1 3.87Å; R496-V499 PolarHBondContact N-O 3.06Å; R496-V499 PolarHBondContact O-N 2.85Å
497	L	69	Low	82.9	Confident	169 Å²	169	58.6 Å²	58.6	89%	0.885	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-39.3	-27.8	-164	-68.7	171.2	0	0	0	119.2
498	R	73.8	Confident	83.5	Confident	169 Å²	169	58.5 Å²	58.5	64%	0.638	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.4	-5.9	174.3	-63.2	-175.1	179	177.8	-1.4	115.1	E461 R496	E461-R498 HydrophobicContact CG-CB 4.37Å; E461-R498 WeakPolarHBondContact OE1-CB 3.41Å; R496-R498 PolarHBondContact O-N 3.47Å
499	V	81.8	Confident	83.8	Confident	24 Å²	24	63.6 Å²	63.6	15%	0.145	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	130	-167.9	62.5	0	0	0	0	110.1	H459 C460 E461 R496 I501	H459-V499 HydrophobicContact CB-CG2 4.44Å; C460-V499 WeakPolarHBondContact O-CA 3.4Å; E461-V499 HydrophobicContact CB-CB 4.14Å; E461-V499 HydrophobicContact CB-CG2 4.16Å; R496-V499 HydrophobicContact CB-CG1 3.87Å; R496-V499 PolarHBondContact N-O 3.06Å; R496-V499 PolarHBondContact O-N 2.85Å; V499-I501 HydrophobicContact CG1-CD1 4.21Å; V499-I501 HydrophobicContact CG1-CG1 4.29Å; V499-I501 HydrophobicContact CG2-CD1 4.46Å; V499-I501 HydrophobicContact CG2-CG1 3.81Å
500	S	87.6	Confident	84	Confident	1 Å²	1	64.7 Å²	64.7	1%	0.007	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	135.5	163.8	-168	0	0	0	0	108	C460 W472 D495	C460-S500 WeakPolarHBondContact CA-O 3.26Å; C460-S500 WeakPolarHBondContact CB-O 3.44Å; C460-S500 PolarHBondContact N-O 3.44Å; C460-S500 PolarHBondContact O-N 3.4Å; W472-S500 PolarHBondContact NE1-OG 3.11Å; D495-S500 VanDerWaalsContact OD1-CB 3.32Å; D495-S500 WeakPolarHBondContact OD1-CB 3.4Å; D495-S500 PolarHBondContact OD1-OG 3.25Å
501	I	87.9	Confident	84.2	Confident	17 Å²	17	62.2 Å²	62.2	9%	0.087	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	135.5	-176.2	-52.8	167.9	0	0	0	108.7	E457 L458 R493 I494 V499	E457-I501 HydrophobicContact CB-CG2 4.03Å; E457-I501 HydrophobicContact CG-CG2 4.47Å; L458-I501 WeakPolarHBondContact O-CA 3.4Å; R493-I501 CarbonylContact C-O 3.56Å; R493-I501 WeakPolarHBondContact CA-O 3.33Å; I494-I501 HydrophobicContact CB-CB 4.38Å; I494-I501 PolarHBondContact N-O 2.77Å; I494-I501 PolarHBondContact O-N 3.08Å; V499-I501 HydrophobicContact CG1-CD1 4.21Å; V499-I501 HydrophobicContact CG1-CG1 4.29Å; V499-I501 HydrophobicContact CG2-CD1 4.46Å; V499-I501 HydrophobicContact CG2-CG1 3.81Å
502	V	90.3	Very high	84.2	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	116.7	165.8	164.1	0	0	0	0	109.2	E457 L458 W472 L479 V491 Y492 I504	E457-V502 CarbonylContact C-O 3.58Å; E457-V502 WeakPolarHBondContact CA-O 3.42Å; L458-V502 HydrophobicContact CB-CB 4.42Å; L458-V502 HydrophobicContact CD1-CG1 4.33Å; L458-V502 PolarHBondContact N-O 2.89Å; L458-V502 PolarHBondContact O-N 3.21Å; L458-V502 VanDerWaalsContact O-N 3.09Å; W472-V502 HydrophobicContact CD2-CB 4.39Å; W472-V502 HydrophobicContact CD2-CG2 3.42Å; W472-V502 VanDerWaalsContact CD2-CG2 3.42Å; W472-V502 HydrophobicContact CE3-CB 4.2Å; W472-V502 HydrophobicContact CE3-CG2 3.63Å; W472-V502 HydrophobicContact CG-CG2 3.9Å; W472-V502 HydrophobicContact CH2-CB 3.92Å; W472-V502 HydrophobicContact CH2-CG2 3.93Å; W472-V502 HydrophobicContact CZ2-CB 4.15Å; W472-V502 HydrophobicContact CZ2-CG2 3.78Å; W472-V502 HydrophobicContact CZ3-CB 3.94Å; W472-V502 HydrophobicContact CZ3-CG2 3.87Å; L479-V502 HydrophobicContact CD2-CG1 4.19Å; L479-V502 HydrophobicContact CD2-CG2 3.74Å; V491-V502 HydrophobicContact CG1-CG1 3.61Å; Y492-V502 WeakPolarHBondContact O-CA 3.5Å; V502-I504 HydrophobicContact CG1-CG1 4.3Å
503	T	88.4	Confident	84.3	Confident	4 Å²	4	58.5 Å²	58.5	3%	0.025	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	126	175.7	-52.7	0	0	0	0	109.5	T455 R456 E457 V491 Y492 R505	T455-T503 HydrophobicContact CG2-CG2 4.07Å; R456-T503 CarbonylContact O-C 3.59Å; R456-T503 WeakPolarHBondContact O-CA 3.42Å; E457-T503 HydrophobicContact CG-CG2 4.08Å; V491-T503 WeakPolarHBondContact CA-O 3.45Å; Y492-T503 PolarHBondContact N-O 3.19Å; Y492-T503 PolarHBondContact O-N 2.98Å; T503-R505 HydrophobicContact CG2-CG 4.06Å
504	I	89.4	Confident	84.3	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	120.2	173.7	-51.7	165.4	0	0	0	107.4	T455 R456 V491 V502 I507 H511 Y515 L528	T455-I504 CarbonylContact C-O 3.57Å; T455-I504 VanDerWaalsContact CA-O 3.26Å; T455-I504 WeakPolarHBondContact CA-O 3.32Å; T455-I504 WeakPolarHBondContact CG2-O 3.37Å; R456-I504 PolarHBondContact N-O 2.92Å; R456-I504 PolarHBondContact O-N 2.88Å; V491-I504 HydrophobicContact CG1-CG1 4.37Å; V491-I504 HydrophobicContact CG2-CG1 4.11Å; V491-I504 HydrophobicContact CG2-CG2 4.16Å; V502-I504 HydrophobicContact CG1-CG1 4.3Å; I504-I507 HydrophobicContact CB-CD1 4.45Å; I504-I507 HydrophobicContact CB-CG1 4.05Å; I504-I507 HydrophobicContact CG2-CD1 4.37Å; I504-I507 HydrophobicContact CG2-CG1 3.48Å; I504-I507 VanDerWaalsContact CG2-CG1 3.48Å; I504-H511 HydrophobicContact CG2-CB 4.43Å; I504-H511 WeakPolarHBondContact CG2-CD2 3.29Å; I504-Y515 HydrophobicContact CD1-CE1 4.25Å; I504-Y515 HydrophobicContact CD1-CE2 4.15Å; I504-Y515 WeakPolarHBondContact CD1-OH 3.36Å; I504-L528 HydrophobicContact CD1-CD2 3.55Å
505	R	85.8	Confident	84.7	Confident	136 Å²	136	53.6 Å²	53.6	51%	0.513	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	122.6	-177.1	-63.3	-172.5	-178.6	164.7	-2.9	112.2	T455 K490 Y492 T503	T455-R505 HydrophobicContact CG2-CG 3.97Å; K490-R505 WeakPolarHBondContact CB-O 3.22Å; K490-R505 WeakPolarHBondContact CD-O 3.44Å; K490-R505 VanDerWaalsContact CG-O 3.29Å; K490-R505 WeakPolarHBondContact CG-O 3.38Å; K490-R505 PolarHBondContact O-N 2.83Å; Y492-R505 HydrophobicContact CD2-CG 4.09Å; Y492-R505 HydrophobicContact CE2-CB 4.09Å; Y492-R505 HydrophobicContact CE2-CG 3.76Å; T503-R505 HydrophobicContact CG2-CG 4.06Å
506	G	81	Confident	85.1	Confident	20 Å²	20	51.3 Å²	51.3	21%	0.206	25%	0.245	C	C	.	.	S	Bend	trans	70.1	53.8	177.9	0	0	0	0	0	111.3	E454 K490	E454-G506 WeakPolarHBondContact O-CA 3.29Å; E454-G506 PolarHBondContact O-N 2.93Å; K490-G506 WeakPolarHBondContact CD-O 3.32Å; K490-G506 PolarHBondContact NZ-O 3.41Å
507	I	84.8	Confident	85.8	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.005	22%	0.215	C	C	.	.			trans	-45.9	140.8	-173.8	-79.3	167.5	0	0	0	112.6	S450 P452 G453 E454 R456 I504 V530	S450-I507 VanDerWaalsContact OG-CD1 3.25Å; S450-I507 WeakPolarHBondContact OG-CD1 3.43Å; P452-I507 CarbonylContact C-O 3.57Å; P452-I507 VanDerWaalsContact CA-O 3.24Å; P452-I507 WeakPolarHBondContact CA-O 3.37Å; G453-I507 PolarHBondContact N-O 2.66Å; E454-I507 PolarHBondContact O-N 3.28Å; R456-I507 HydrophobicContact CB-CD1 3.9Å; R456-I507 HydrophobicContact CG-CD1 3.43Å; R456-I507 VanDerWaalsContact CG-CD1 3.43Å; I504-I507 HydrophobicContact CB-CD1 4.45Å; I504-I507 HydrophobicContact CB-CG1 4.05Å; I504-I507 HydrophobicContact CG2-CD1 4.37Å; I504-I507 HydrophobicContact CG2-CG1 3.48Å; I504-I507 VanDerWaalsContact CG2-CG1 3.48Å; I507-V530 HydrophobicContact CG2-CB 4.21Å; I507-V530 HydrophobicContact CG2-CG1 3.6Å; I507-V530 HydrophobicContact CG2-CG2 3.51Å
508	E	83.9	Confident	86.8	Confident	80 Å²	80	38 Å²	38	37%	0.374	18%	0.183	S	C	.	.			trans	-125.2	164.3	173.5	-78.6	153.1	157.7	0	0	110.3	K490 D510 H511	K490-E508 VanDerWaalsContact CD-OE2 3.29Å; K490-E508 WeakPolarHBondContact CD-OE2 3.47Å; K490-E508 WeakPolarHBondContact CE-OE2 3.39Å; K490-E508 IonicContact NZ-OE1 2.8Å; K490-E508 PolarHBondContact NZ-OE1 2.78Å; K490-E508 IonicContact NZ-OE2 3.98Å; K490-E508 PolarHBondContact NZ-OE2 3.09Å; E508-D510 WeakPolarHBondContact CB-OD1 3.43Å; E508-D510 PolarHBondContact O-N 2.85Å; E508-D510 VanDerWaalsContact O-N 3.14Å; E508-H511 PolarHBondContact N-ND1 2.97Å; E508-H511 WeakPolarHBondContact O-CB 3.13Å; E508-H511 PolarHBondContact O-N 3.23Å; E508-H511 PolarHBondContact O-ND1 3.12Å; E508-H511 IonicContact OE2-CE1 3.96Å
509	Q	80.9	Confident	87.5	Confident	144 Å²	144	31.4 Å²	31.4	67%	0.673	16%	0.16	S	C	*	.	G	3₁₀ helix	trans	-60.9	-25.3	-172.2	-163.2	172.8	24.3	0	0	113.7	H511 G512	Q509-H511 VanDerWaalsContact C-N 3.35Å; Q509-G512 PolarHBondContact O-N 3.39Å
510	D	84.4	Confident	87.5	Confident	68 Å²	68	34.5 Å²	34.5	36%	0.364	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-78.3	-13	177	69.5	-33.3	0	0	0	114.5	T488 E508	T488-D510 VanDerWaalsContact CG2-OD2 3.26Å; T488-D510 WeakPolarHBondContact CG2-OD2 3.38Å; E508-D510 WeakPolarHBondContact CB-OD1 3.43Å; E508-D510 PolarHBondContact O-N 2.85Å; E508-D510 VanDerWaalsContact O-N 3.14Å
511	H	89.3	Confident	87.3	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-81.4	-4	171	-61.1	73.8	0	0	0	111.9	T488 I504 E508 Q509 Y515	T488-H511 PolarHBondContact OG1-CE1 2.83Å; T488-H511 PolarHBondContact OG1-NE2 2.76Å; T488-H511 VanDerWaalsContact OG1-NE2 3.09Å; I504-H511 HydrophobicContact CG2-CB 4.43Å; I504-H511 WeakPolarHBondContact CG2-CD2 3.29Å; E508-H511 PolarHBondContact N-ND1 2.97Å; E508-H511 WeakPolarHBondContact O-CB 3.13Å; E508-H511 PolarHBondContact O-N 3.23Å; E508-H511 PolarHBondContact O-ND1 3.12Å; E508-H511 IonicContact OE2-CE1 3.96Å; Q509-H511 VanDerWaalsContact C-N 3.35Å; H511-Y515 WeakPolarHBondContact O-CE2 3.13Å; H511-Y515 PolarHBondContact O-OH 3.32Å
512	G	87	Confident	87.2	Confident	29 Å²	29	50.2 Å²	50.2	30%	0.299	26%	0.263	S	S	.	.			trans	-74.7	127.8	176.6	0	0	0	0	0	112.5	F474 Q509 L528	F474-G512 WeakPolarHBondContact CZ-O 3.3Å; Q509-G512 PolarHBondContact O-N 3.39Å; G512-L528 CarbonylContact C-O 3.59Å; G512-L528 WeakPolarHBondContact CA-O 3.4Å
513	G	89.5	Confident	87.2	Confident	6 Å²	6	53 Å²	53	6%	0.062	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	154.4	-171.8	-179.5	0	0	0	0	0	113.6	L528	G513-L528 PolarHBondContact N-O 3.08Å; G513-L528 PolarHBondContact O-N 2.79Å
514	T	90.1	Very high	87.2	Confident	29 Å²	29	54.1 Å²	54.1	18%	0.178	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	112.7	-172	-42.9	0	0	0	0	111.1	F474 E475 H527	F474-T514 WeakPolarHBondContact CA-O 3.35Å; E475-T514 PolarHBondContact N-O 3.42Å; E475-T514 WeakPolarHBondContact OE1-CA 3.47Å; E475-T514 WeakPolarHBondContact OE1-CB 3.39Å; E475-T514 PolarHBondContact OE1-N 3.31Å; E475-T514 PolarHBondContact OE1-OG1 2.84Å; T514-H527 PolarHBondContact OG1-ND1 2.8Å
515	Y	92.2	Very high	87.3	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	132.9	171.9	-70	-96.8	0	0	0	110	M440 L458 Y473 F474 L479 I504 H511 Q525 T526 L528	M440-Y515 WeakPolarHBondContact CE-O 3.33Å; L458-Y515 HydrophobicContact CD1-CD1 3.67Å; L458-Y515 HydrophobicContact CD1-CD2 3.89Å; L458-Y515 HydrophobicContact CD1-CE1 4.23Å; L458-Y515 HydrophobicContact CD1-CE2 4.42Å; L458-Y515 HydrophobicContact CD1-CG 3.47Å; L458-Y515 VanDerWaalsContact CD1-CG 3.47Å; Y473-Y515 WeakPolarHBondContact O-CA 3.47Å; F474-Y515 HydrophobicContact CB-CD1 4.5Å; F474-Y515 HydrophobicContact CB-CE1 4.5Å; F474-Y515 HydrophobicContact CD2-CD1 4.05Å; F474-Y515 AromaticContact CD2-CD2 3.89Å; F474-Y515 HydrophobicContact CD2-CD2 3.89Å; F474-Y515 AromaticContact CD2-CE1 3.78Å; F474-Y515 HydrophobicContact CD2-CE1 3.78Å; F474-Y515 AromaticContact CD2-CE2 3.6Å; F474-Y515 HydrophobicContact CD2-CE2 3.6Å; F474-Y515 HydrophobicContact CD2-CG 4.1Å; F474-Y515 AromaticContact CD2-CZ 3.55Å; F474-Y515 HydrophobicContact CE2-CD2 4.22Å; F474-Y515 AromaticContact CE2-CE2 3.69Å; F474-Y515 HydrophobicContact CE2-CE2 3.69Å; F474-Y515 AromaticContact CE2-CZ 3.89Å; L479-Y515 HydrophobicContact CD1-CE1 4.12Å; I504-Y515 HydrophobicContact CD1-CE1 4.25Å; I504-Y515 HydrophobicContact CD1-CE2 4.15Å; I504-Y515 WeakPolarHBondContact CD1-OH 3.36Å; H511-Y515 WeakPolarHBondContact O-CE2 3.13Å; H511-Y515 PolarHBondContact O-OH 3.32Å; Y515-Q525 CarbonylContact O-C 3.58Å; Y515-Q525 VanDerWaalsContact O-CA 3.31Å; Y515-Q525 WeakPolarHBondContact O-CA 3.36Å; Y515-T526 PolarHBondContact N-O 2.96Å; Y515-T526 PolarHBondContact O-N 2.97Å; Y515-L528 HydrophobicContact CD2-CB 4.05Å; Y515-L528 HydrophobicContact CE2-CB 3.9Å; Y515-L528 HydrophobicContact CE2-CD2 3.9Å
516	E	92.5	Very high	87.3	Confident	11 Å²	11	49.6 Å²	49.6	5%	0.051	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	143.1	174.5	-54.2	179.2	-130.3	0	0	110.7	W472 Y473 R518 K524 Q525	W472-E516 CarbonylContact C-O 3.58Å; W472-E516 WeakPolarHBondContact CA-O 3.29Å; Y473-E516 PolarHBondContact N-O 3.05Å; Y473-E516 PolarHBondContact O-N 2.91Å; E516-R518 HydrophobicContact CB-CG 4.48Å; E516-R518 IonicContact OE1-CZ 2.74Å; E516-R518 IonicContact OE1-NH2 3.14Å; E516-R518 PolarHBondContact OE1-NH2 2.9Å; E516-R518 IonicContact OE2-CZ 3.7Å; E516-R518 IonicContact OE2-NE 2.79Å; E516-R518 PolarHBondContact OE2-NE 2.89Å; E516-R518 IonicContact OE2-NH2 3.81Å; E516-R518 PolarHBondContact OE2-NH2 2.85Å; E516-K524 WeakPolarHBondContact CA-O 3.15Å; E516-Q525 HydrophobicContact CB-CB 4.41Å; E516-Q525 HydrophobicContact CG-CB 3.85Å
517	C	91.4	Very high	87.6	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	128	164.6	61.2	0	0	0	0	108.9	M440 C460 V470 R471 W472 K524	M440-C517 HydrophobicContact CE-CB 4.28Å; M440-C517 HydrophobicContact SD-CB 4.44Å; C460-C517 HydrophobicContact CB-CB 3.81Å; C460-C517 WeakPolarHBondContact CB-SG 3.31Å; C460-C517 WeakPolarHBondContact SG-CB 2.92Å; C460-C517 CovalentContact SG-SG 2.02Å; C460-C517 PolarHBondContact SG-SG 3.1Å; V470-C517 HydrophobicContact CG1-CB 3.79Å; R471-C517 WeakPolarHBondContact O-CA 3.5Å; W472-C517 HydrophobicContact CD2-CB 4.04Å; W472-C517 HydrophobicContact CE3-CB 4.12Å; W472-C517 HydrophobicContact CH2-CB 4.33Å; W472-C517 HydrophobicContact CZ2-CB 4.21Å; W472-C517 HydrophobicContact CZ3-CB 4.28Å; C517-K524 PolarHBondContact N-O 2.91Å; C517-K524 PolarHBondContact O-N 3.33Å
518	R	91.2	Very high	87.7	Confident	60 Å²	60	52.3 Å²	52.3	23%	0.226	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	135.3	-172.6	-51.8	-173.9	-178.7	159.8	-6.8	110.4	R471 Y473 N476 E516 D522 I523	R471-R518 PolarHBondContact N-O 3.45Å; R471-R518 PolarHBondContact O-N 2.88Å; Y473-R518 HydrophobicContact CD2-CB 4.45Å; Y473-R518 HydrophobicContact CD2-CG 3.85Å; Y473-R518 HydrophobicContact CE2-CB 4.11Å; Y473-R518 HydrophobicContact CE2-CG 3.9Å; N476-R518 PolarHBondContact OD1-NH2 2.8Å; E516-R518 HydrophobicContact CB-CG 4.48Å; E516-R518 IonicContact OE1-CZ 2.74Å; E516-R518 IonicContact OE1-NH2 3.14Å; E516-R518 PolarHBondContact OE1-NH2 2.9Å; E516-R518 IonicContact OE2-CZ 3.7Å; E516-R518 IonicContact OE2-NE 2.79Å; E516-R518 PolarHBondContact OE2-NE 2.89Å; E516-R518 IonicContact OE2-NH2 3.81Å; E516-R518 PolarHBondContact OE2-NH2 2.85Å; R518-D522 WeakPolarHBondContact CA-O 3.49Å; R518-I523 HydrophobicContact CB-CG1 4.49Å; R518-I523 HydrophobicContact CG-CD1 4.49Å; R518-I523 HydrophobicContact CG-CG1 4.07Å; R518-I523 HydrophobicContact CG-CG2 4.28Å
519	I	87.3	Confident	87.6	Confident	29 Å²	29	50.6 Å²	50.6	15%	0.149	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	120	168.6	-169.1	174	0	0	0	110.5	F462 A465 D469 V470 R521 D522	F462-I519 HydrophobicContact CB-CG2 4.39Å; F462-I519 HydrophobicContact CD1-CG2 3.87Å; F462-I519 HydrophobicContact CD2-CB 4.4Å; F462-I519 HydrophobicContact CD2-CG2 3.55Å; F462-I519 HydrophobicContact CE1-CG2 3.92Å; F462-I519 HydrophobicContact CE2-CB 4.27Å; F462-I519 HydrophobicContact CE2-CG2 3.57Å; F462-I519 HydrophobicContact CG-CG2 3.7Å; F462-I519 HydrophobicContact CZ-CG2 3.77Å; A465-I519 HydrophobicContact CB-CD1 3.5Å; A465-I519 VanDerWaalsContact CB-CD1 3.5Å; D469-I519 HydrophobicContact CB-CD1 3.82Å; D469-I519 HydrophobicContact CB-CG1 4.19Å; V470-I519 HydrophobicContact CG2-CB 4.49Å; V470-I519 HydrophobicContact CG2-CD1 4.34Å; I519-R521 PolarHBondContact O-N 3.23Å; I519-D522 HydrophobicContact CG2-CB 4.21Å; I519-D522 PolarHBondContact N-O 3.45Å; I519-D522 PolarHBondContact O-N 3.05Å
520	G	82.5	Confident	87.6	Confident	90 Å²	90	44.6 Å²	44.6	93%	0.928	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.7	-99	-177.9	0	0	0	0	0	113
521	R	83.2	Confident	86.8	Confident	242 Å²	242	48.7 Å²	48.7	91%	0.913	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.2	-13.1	172.9	-68.7	-177	178.3	174.1	-0.1	113.4	I519	I519-R521 PolarHBondContact O-N 3.23Å
522	D	86.5	Confident	85.5	Confident	105 Å²	105	50.5 Å²	50.5	56%	0.561	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84	130.9	-175.2	-57.7	-44.2	0	0	0	109.6	F462 R518 I519	F462-D522 HydrophobicContact CD1-CB 4.24Å; F462-D522 HydrophobicContact CE1-CB 3.71Å; F462-D522 HydrophobicContact CZ-CB 4.43Å; R518-D522 WeakPolarHBondContact CA-O 3.49Å; I519-D522 HydrophobicContact CG2-CB 4.21Å; I519-D522 PolarHBondContact N-O 3.45Å; I519-D522 PolarHBondContact O-N 3.05Å
523	I	89.4	Confident	84.2	Confident	60 Å²	60	53 Å²	53	31%	0.308	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	130.6	179.7	-56.3	-178.7	0	0	0	107.2	P442 P443 R518	P442-I523 WeakPolarHBondContact CA-O 3.48Å; P443-I523 VanDerWaalsContact CD-O 3.26Å; P443-I523 WeakPolarHBondContact CD-O 3.38Å; P443-I523 HydrophobicContact CG-CB 4.26Å; P443-I523 HydrophobicContact CG-CG2 3.99Å; R518-I523 HydrophobicContact CB-CG1 4.49Å; R518-I523 HydrophobicContact CG-CD1 4.49Å; R518-I523 HydrophobicContact CG-CG1 4.07Å; R518-I523 HydrophobicContact CG-CG2 4.28Å
524	K	89	Confident	82.8	Confident	27 Å²	27	60.4 Å²	60.4	12%	0.117	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	140	161.8	-78	174.1	148.9	-161.5	0	107.1	E439 M440 S441 E461 F462 E516 C517	E439-K524 IonicContact OE2-NZ 2.82Å; E439-K524 PolarHBondContact OE2-NZ 2.87Å; M440-K524 HydrophobicContact CB-CB 3.8Å; M440-K524 WeakPolarHBondContact CE-O 3.14Å; M440-K524 WeakPolarHBondContact O-CD 3.33Å; M440-K524 WeakPolarHBondContact O-CE 3.4Å; M440-K524 WeakPolarHBondContact O-CG 3.4Å; M440-K524 PolarHBondContact O-NZ 2.83Å; S441-K524 CarbonylContact O-C 3.53Å; S441-K524 WeakPolarHBondContact O-CA 3.43Å; E461-K524 WeakPolarHBondContact O-CE 3Å; E461-K524 PolarHBondContact O-NZ 3.09Å; F462-K524 HydrophobicContact CD1-CD 4.45Å; F462-K524 HydrophobicContact CE1-CD 3.99Å; F462-K524 HydrophobicContact CE1-CG 4Å; F462-K524 HydrophobicContact CZ-CB 4.29Å; F462-K524 HydrophobicContact CZ-CD 4.15Å; F462-K524 HydrophobicContact CZ-CG 4.13Å; E516-K524 WeakPolarHBondContact CA-O 3.15Å; C517-K524 PolarHBondContact N-O 2.91Å; C517-K524 PolarHBondContact O-N 3.33Å
525	Q	90.5	Very high	82	Confident	39 Å²	39	59.1 Å²	59.1	18%	0.182	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	156.6	-178.9	76.1	-176.3	36.6	0	0	112.4	S441 P443 P444 G445 S446 Y515 E516	S441-Q525 PolarHBondContact O-N 2.7Å; P443-Q525 HydrophobicContact CG-CG 4.28Å; P444-Q525 VanDerWaalsContact C-NE2 3.26Å; P444-Q525 PolarHBondContact O-NE2 3.17Å; G445-Q525 VanDerWaalsContact CA-O 3.24Å; G445-Q525 WeakPolarHBondContact CA-O 3.25Å; S446-Q525 PolarHBondContact N-O 2.78Å; Y515-Q525 CarbonylContact O-C 3.58Å; Y515-Q525 VanDerWaalsContact O-CA 3.31Å; Y515-Q525 WeakPolarHBondContact O-CA 3.36Å; E516-Q525 HydrophobicContact CB-CB 4.41Å; E516-Q525 HydrophobicContact CG-CB 3.85Å
526	T	87.2	Confident	81.7	Confident	1 Å²	1	60.3 Å²	60.3	1%	0.006	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	140.4	171.7	-166.5	0	0	0	0	110.1	M440 S446 L458 Y515	M440-T526 HydrophobicContact CE-CG2 4.1Å; M440-T526 HydrophobicContact CG-CG2 3.92Å; M440-T526 HydrophobicContact SD-CG2 4.35Å; S446-T526 CarbonylContact O-C 3.53Å; S446-T526 VanDerWaalsContact O-CA 3.24Å; S446-T526 WeakPolarHBondContact O-CA 3.21Å; S446-T526 PolarHBondContact O-OG1 3.32Å; S446-T526 WeakPolarHBondContact OG-CB 3.44Å; S446-T526 PolarHBondContact OG-OG1 2.69Å; L458-T526 HydrophobicContact CD1-CG2 4.19Å; L458-T526 HydrophobicContact CD2-CG2 3.99Å; Y515-T526 PolarHBondContact N-O 2.96Å; Y515-T526 PolarHBondContact O-N 2.97Å
527	H	86.5	Confident	81.3	Confident	78 Å²	78	62.8 Å²	62.8	36%	0.361	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	113.8	179.3	-170.7	78.7	0	0	0	109.4	S446 V447 M448 T514	S446-H527 PolarHBondContact O-N 3.38Å; V447-H527 CarbonylContact C-O 3.57Å; V447-H527 WeakPolarHBondContact CA-O 3.46Å; V447-H527 HydrophobicContact CG1-CB 4.44Å; V447-H527 WeakPolarHBondContact CG1-O 3.34Å; M448-H527 PolarHBondContact N-O 2.85Å; T514-H527 PolarHBondContact OG1-ND1 2.8Å
528	L	87.3	Confident	81.1	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	109.9	179.7	177.7	55	0	0	0	109.8	M448 I504 G512 G513 Y515 V530	M448-L528 HydrophobicContact CB-CD1 4.12Å; M448-L528 HydrophobicContact CG-CD1 3.91Å; M448-L528 CarbonylContact O-C 3.54Å; M448-L528 WeakPolarHBondContact O-CA 3.39Å; M448-L528 HydrophobicContact SD-CD1 3.99Å; I504-L528 HydrophobicContact CD1-CD2 3.55Å; G512-L528 CarbonylContact C-O 3.59Å; G512-L528 WeakPolarHBondContact CA-O 3.4Å; G513-L528 PolarHBondContact N-O 3.08Å; G513-L528 PolarHBondContact O-N 2.79Å; Y515-L528 HydrophobicContact CD2-CB 4.05Å; Y515-L528 HydrophobicContact CE2-CB 3.9Å; Y515-L528 HydrophobicContact CE2-CD2 3.9Å; L528-V530 HydrophobicContact CD2-CG2 4.38Å; L528-V530 HydrophobicContact CG-CG2 4.08Å
529	V	82.6	Confident	80.7	Confident	45 Å²	45	64.2 Å²	64.2	27%	0.273	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	103.9	172.7	-177.5	0	0	0	0	108.5	V447 M448 V449 S450 R531	V447-V529 HydrophobicContact CG1-CG2 3.8Å; M448-V529 PolarHBondContact O-N 2.01Å; V449-V529 WeakPolarHBondContact CA-O 3.48Å; V449-V529 HydrophobicContact CG2-CB 4.31Å; S450-V529 PolarHBondContact N-O 2.76Å; V529-R531 PolarHBondContact O-N 3.23Å
530	V	80.8	Confident	80.6	Confident	18 Å²	18	64.4 Å²	64.4	11%	0.109	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	107.2	172.2	-176.8	0	0	0	0	108.7	S450 P452 I507 L528	S450-V530 WeakPolarHBondContact O-CA 3.34Å; P452-V530 HydrophobicContact CG-CG1 4.3Å; I507-V530 HydrophobicContact CG2-CB 4.21Å; I507-V530 HydrophobicContact CG2-CG1 3.6Å; I507-V530 HydrophobicContact CG2-CG2 3.51Å; L528-V530 HydrophobicContact CD2-CG2 4.38Å; L528-V530 HydrophobicContact CG-CG2 4.08Å
531	R	67.7	Low	80.5	Confident	153 Å²	153	66.6 Å²	66.6	58%	0.577	31%	0.314	S	S	*	.			trans	-98.2	104.3	178.5	-174.2	175.3	-174.3	175.5	0.3	109	V449 S450 L451 P452 V529 E533	V449-R531 HydrophobicContact CG1-CB 4.27Å; S450-R531 PolarHBondContact O-N 3Å; L451-R531 VanDerWaalsContact CD2-O 3.27Å; L451-R531 WeakPolarHBondContact CD2-O 3.47Å; P452-R531 VanDerWaalsContact CD-O 3.24Å; P452-R531 WeakPolarHBondContact CD-O 3.46Å; V529-R531 PolarHBondContact O-N 3.23Å; R531-E533 PolarHBondContact O-N 3.48Å
532	A	60.8	Low	80.6	Confident	39 Å²	39	58.8 Å²	58.8	32%	0.322	30%	0.297	S	S	.	.			trans	-59.8	123.2	156.2	0	0	0	0	0	107.8	P452	P452-A532 HydrophobicContact CG-CB 4.36Å
533	E	59.6	Low	80.5	Confident	82 Å²	82	55.9 Å²	55.9	38%	0.383	28%	0.281	S	S	.	.			trans	-78.9	115.8	162	-76.2	171.5	169.1	0	0	106	L451 R531 H558	L451-E533 HydrophobicContact CD2-CG 3.81Å; R531-E533 PolarHBondContact O-N 3.48Å; E533-H558 WeakPolarHBondContact O-CB 3.37Å
534	E	61.4	Low	80.2	Confident	160 Å²	160	55.9 Å²	55.9	75%	0.748	28%	0.284	S	S	*	.			trans	-104.7	147.9	171.5	-68.9	-177	169.2	0	0	108.2
535	G	73	Confident	79.8	Confident	3 Å²	3	54.9 Å²	54.9	3%	0.031	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	95.8	-156.2	177.5	0	0	0	0	0	114.2	H558 E627	G535-H558 PolarHBondContact N-O 2.62Å; G535-H558 PolarHBondContact O-N 3.38Å; G535-E627 WeakPolarHBondContact CA-OE2 3.5Å
536	L	85.1	Confident	79.1	Confident	24 Å²	24	55.8 Å²	55.8	13%	0.126	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	138.2	-173.6	-72.3	169.5	0	0	0	114.8	V557 L568 L622 E627 I629	L536-V557 HydrophobicContact CD2-CG2 3.82Å; L536-L568 HydrophobicContact CD2-CD2 3.72Å; L536-L622 HydrophobicContact CD1-CB 3.94Å; L536-L622 HydrophobicContact CD2-CB 4.17Å; L536-L622 HydrophobicContact CG-CB 4.21Å; L536-E627 HydrophobicContact CD1-CB 3.73Å; L536-E627 WeakPolarHBondContact CD1-O 3.23Å; L536-E627 HydrophobicContact CG-CB 4.26Å; L536-E627 PolarHBondContact N-OE2 3.21Å; L536-E627 VanDerWaalsContact N-OE2 3.16Å; L536-I629 HydrophobicContact CB-CB 3.99Å; L536-I629 HydrophobicContact CB-CG2 3.72Å; L536-I629 HydrophobicContact CD1-CG2 4.22Å; L536-I629 HydrophobicContact CG-CG2 4.48Å; L536-I629 VanDerWaalsContact O-CD1 3.27Å; L536-I629 WeakPolarHBondContact O-CD1 3.33Å
537	E	84	Confident	78.7	Confident	63 Å²	63	58 Å²	58	29%	0.294	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	144.3	165	-178.7	177.9	-156.4	0	0	109.9	C555 R556 H558	E537-C555 CarbonylContact O-C 3.57Å; E537-C555 WeakPolarHBondContact O-CA 3.4Å; E537-R556 HydrophobicContact CB-CB 4.47Å; E537-R556 PolarHBondContact N-O 3.32Å; E537-R556 PolarHBondContact O-N 3.23Å; E537-H558 IonicContact OE2-CD2 3.33Å; E537-H558 IonicContact OE2-CE1 2.71Å; E537-H558 PolarHBondContact OE2-CE1 3.33Å; E537-H558 IonicContact OE2-NE2 3.35Å; E537-H558 PolarHBondContact OE2-NE2 2.72Å
538	I	87.6	Confident	78.2	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.005	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	137.7	167.4	-164	170.1	0	0	0	110.3	K541 F553 H554 W570 I629	I538-K541 HydrophobicContact CG2-CG 4.34Å; I538-K541 VanDerWaalsContact O-CG 3.25Å; I538-K541 WeakPolarHBondContact O-CG 3.16Å; I538-F553 HydrophobicContact CD1-CB 4.4Å; I538-F553 HydrophobicContact CD1-CD1 4.24Å; I538-F553 HydrophobicContact CG1-CD1 4.41Å; I538-H554 CarbonylContact C-O 3.52Å; I538-H554 VanDerWaalsContact CA-O 3.32Å; I538-H554 WeakPolarHBondContact CA-O 3.3Å; I538-H554 WeakPolarHBondContact CG1-O 3.32Å; I538-W570 HydrophobicContact CD1-CH2 3.69Å; I538-W570 HydrophobicContact CD1-CZ3 3.61Å; I538-W570 HydrophobicContact CG1-CH2 4.29Å; I538-I629 HydrophobicContact CB-CD1 4.46Å; I538-I629 HydrophobicContact CB-CG1 4.41Å; I538-I629 HydrophobicContact CB-CG2 3.94Å; I538-I629 HydrophobicContact CG2-CD1 4Å; I538-I629 HydrophobicContact CG2-CG1 3.8Å; I538-I629 HydrophobicContact CG2-CG2 4.2Å
539	N	82.8	Confident	78	Confident	89 Å²	89	61.1 Å²	61.1	48%	0.476	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	128.3	179.9	-178.6	59.4	0	0	0	110.3	H554	N539-H554 PolarHBondContact N-O 2.87Å; N539-H554 PolarHBondContact O-N 3.46Å
540	P	85.5	Confident	78.2	Confident	33 Å²	33	62.3 Å²	62.3	21%	0.214	34%	0.336	C	S	.	.	S	Bend	cis	-67.6	154.8	-9.3	30.8	-35.6	0	0	0	112.1	S542 D543 E552 F553	P540-S542 VanDerWaalsContact C-N 3.33Å; P540-D543 HydrophobicContact CG-CB 3.75Å; P540-E552 VanDerWaalsContact CD-O 3.31Å; P540-E552 WeakPolarHBondContact CD-O 3.28Å; P540-F553 HydrophobicContact CG-CD1 4.09Å; P540-F553 HydrophobicContact CG-CE1 3.95Å; P540-F553 WeakPolarHBondContact O-CD1 3.39Å; P540-F553 WeakPolarHBondContact O-CE1 3.24Å
541	K	79.9	Confident	78.7	Confident	137 Å²	137	61.6 Å²	61.6	60%	0.596	33%	0.332	S	S	*	.	S	Bend	trans	-75.5	-26.8	172.6	-67.2	-178.5	-179.3	175.3	0	112.2	I538 G631 K632	I538-K541 HydrophobicContact CG2-CG 4.34Å; I538-K541 VanDerWaalsContact O-CG 3.25Å; I538-K541 WeakPolarHBondContact O-CG 3.16Å; K541-G631 WeakPolarHBondContact O-CA 3.3Å; K541-K632 PolarHBondContact O-N 2.78Å
542	S	85.4	Confident	79.8	Confident	78 Å²	78	58.6 Å²	58.6	55%	0.545	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	128.3	170.6	54	0	0	0	0	108.6	P540 K632	P540-S542 VanDerWaalsContact C-N 3.33Å; S542-K632 CarbonylContact C-O 3.58Å; S542-K632 VanDerWaalsContact CA-O 3.29Å; S542-K632 WeakPolarHBondContact CA-O 3.48Å
543	D	83.6	Confident	81.3	Confident	43 Å²	43	56.7 Å²	56.7	23%	0.23	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	155.5	173.1	-155.9	-4.6	0	0	0	110.6	P540 F553 K632 L633 F634	P540-D543 HydrophobicContact CG-CB 3.75Å; D543-F553 HydrophobicContact CB-CZ 4.35Å; D543-K632 PolarHBondContact N-O 3.24Å; D543-L633 HydrophobicContact CB-CD1 4.13Å; D543-F634 WeakPolarHBondContact O-CD2 3.46Å; D543-F634 PolarHBondContact O-N 2.96Å
544	T	84.8	Confident	82.8	Confident	60 Å²	60	55.5 Å²	55.5	37%	0.368	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	90.8	177.3	-58.8	0	0	0	0	109	F634 R636	T544-F634 WeakPolarHBondContact CA-O 3.28Å; T544-F634 HydrophobicContact CG2-CB 4.08Å; T544-R636 HydrophobicContact CG2-CG 4.26Å
545	V	79.5	Confident	84.3	Confident	7 Å²	7	47.9 Å²	47.9	4%	0.042	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	158.4	-177	-57.6	0	0	0	0	111.2	E549 V551 A610 L633 F634 V635 R636	V545-E549 HydrophobicContact CB-CB 4.44Å; V545-V551 HydrophobicContact CG1-CB 4.24Å; V545-A610 HydrophobicContact CG2-CB 3.58Å; V545-L633 HydrophobicContact CG1-CD1 4.48Å; V545-L633 HydrophobicContact CG2-CD1 3.9Å; V545-F634 PolarHBondContact N-O 2.86Å; V545-F634 VanDerWaalsContact N-O 3.1Å; V545-V635 HydrophobicContact CG2-CG1 4.45Å; V545-V635 HydrophobicContact CG2-CG2 4.13Å; V545-V635 WeakPolarHBondContact O-CA 3.47Å; V545-R636 PolarHBondContact O-N 3.1Å
546	D	76.7	Confident	85	Confident	57 Å²	57	53.3 Å²	53.3	31%	0.305	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	138.1	172.4	-96.2	38.1	0	0	0	108.7	G548 E549 R636 V638	D546-G548 PolarHBondContact O-N 2.81Å; D546-E549 HydrophobicContact CB-CG 3.98Å; D546-E549 WeakPolarHBondContact CB-OE2 3.07Å; D546-E549 PolarHBondContact N-OE2 2.86Å; D546-E549 VanDerWaalsContact N-OE2 3.09Å; D546-E549 WeakPolarHBondContact O-CB 3.11Å; D546-E549 WeakPolarHBondContact O-CG 3.46Å; D546-E549 PolarHBondContact O-N 2.74Å; D546-R636 WeakPolarHBondContact OD1-CD 3.47Å; D546-R636 IonicContact OD1-NH1 3.12Å; D546-R636 PolarHBondContact OD1-NH1 2.86Å; D546-V638 VanDerWaalsContact C-CG2 3.5Å; D546-V638 HydrophobicContact CB-CG2 3.28Å
547	E	77.8	Confident	85	Confident	49 Å²	49	52.2 Å²	52.2	23%	0.229	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	128.5	-176.6	178.2	157.4	-125.2	0	0	112.5	R611 V612 V635 R636 V638	E547-R611 WeakPolarHBondContact OE1-CA 3.43Å; E547-V612 PolarHBondContact OE1-N 3.24Å; E547-V635 HydrophobicContact CB-CG1 3.92Å; E547-R636 VanDerWaalsContact CB-O 3.3Å; E547-R636 WeakPolarHBondContact CB-O 3.22Å; E547-R636 PolarHBondContact N-O 2.91Å; E547-V638 HydrophobicContact CB-CB 4.23Å; E547-V638 HydrophobicContact CB-CG2 4.26Å; E547-V638 WeakPolarHBondContact O-CB 3.39Å; E547-V638 WeakPolarHBondContact O-CG2 3.49Å
548	G	77.2	Confident	84.7	Confident	37 Å²	37	50.7 Å²	50.7	38%	0.381	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.5	-10.4	-170.8	0	0	0	0	0	115.1	D546 A610	D546-G548 PolarHBondContact O-N 2.81Å; G548-A610 PolarHBondContact N-O 2.8Å
549	E	83	Confident	83.7	Confident	106 Å²	106	54 Å²	54	50%	0.495	31%	0.309	S	S	.	.	S	Bend	trans	-73.7	166.5	166.8	-63.5	-164.5	126.8	0	0	112.1	V545 D546 R609 A610	V545-E549 HydrophobicContact CB-CB 4.44Å; D546-E549 HydrophobicContact CB-CG 3.98Å; D546-E549 WeakPolarHBondContact CB-OE2 3.07Å; D546-E549 PolarHBondContact N-OE2 2.86Å; D546-E549 VanDerWaalsContact N-OE2 3.09Å; D546-E549 WeakPolarHBondContact O-CB 3.11Å; D546-E549 WeakPolarHBondContact O-CG 3.46Å; D546-E549 PolarHBondContact O-N 2.74Å; E549-R609 CarbonylContact O-C 3.57Å; E549-R609 VanDerWaalsContact O-CA 3.3Å; E549-R609 WeakPolarHBondContact O-CA 3.42Å; E549-A610 PolarHBondContact O-N 2.85Å
550	A	86	Confident	83.1	Confident	69 Å²	69	52.5 Å²	52.5	57%	0.57	30%	0.299	S	S	*	.			trans	-88.7	142.4	175.4	0	0	0	0	0	111.7	K607	A550-K607 CarbonylContact C-O 3.57Å; A550-K607 VanDerWaalsContact CA-O 3.22Å; A550-K607 WeakPolarHBondContact CA-O 3.5Å
551	V	90.5	Very high	82.2	Confident	4 Å²	4	58.6 Å²	58.6	2%	0.024	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	144.9	175.9	55.4	0	0	0	0	110.1	V545 F553 F591 S606 K607 A610 L633	V545-V551 HydrophobicContact CG1-CB 4.24Å; V551-F553 HydrophobicContact CG2-CD2 4.29Å; V551-F553 HydrophobicContact CG2-CE2 3.86Å; V551-F553 HydrophobicContact CG2-CZ 4.46Å; V551-F591 HydrophobicContact CG1-CE1 3.9Å; V551-F591 HydrophobicContact CG1-CZ 3.82Å; V551-S606 CarbonylContact O-C 3.58Å; V551-S606 VanDerWaalsContact O-CA 3.24Å; V551-S606 WeakPolarHBondContact O-CA 3.26Å; V551-K607 HydrophobicContact CG1-CB 3.85Å; V551-K607 PolarHBondContact N-O 2.91Å; V551-K607 PolarHBondContact O-N 2.85Å; V551-A610 HydrophobicContact CG1-CB 4.24Å; V551-L633 HydrophobicContact CB-CD1 4.36Å; V551-L633 HydrophobicContact CG1-CD2 4.15Å; V551-L633 HydrophobicContact CG2-CD1 3.69Å; V551-L633 HydrophobicContact CG2-CD2 4.1Å
552	E	91.7	Very high	81.7	Confident	89 Å²	89	53.9 Å²	53.9	42%	0.416	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	135.1	178	-173	173.6	78.1	0	0	111.4	P540 H554 I605	P540-E552 VanDerWaalsContact CD-O 3.31Å; P540-E552 WeakPolarHBondContact CD-O 3.28Å; E552-H554 IonicContact OE1-CD2 2.68Å; E552-H554 IonicContact OE1-CE1 3.34Å; E552-H554 IonicContact OE1-NE2 3.23Å; E552-H554 PolarHBondContact OE1-NE2 3.31Å; E552-I605 WeakPolarHBondContact CA-O 3.32Å
553	F	92.1	Very high	81.4	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	128.5	171.8	-69.3	-80.1	0	0	0	110.8	I538 P540 D543 V551 W570 I605 Y618 L633	I538-F553 HydrophobicContact CD1-CB 4.4Å; I538-F553 HydrophobicContact CD1-CD1 4.24Å; I538-F553 HydrophobicContact CG1-CD1 4.41Å; P540-F553 HydrophobicContact CG-CD1 4.09Å; P540-F553 HydrophobicContact CG-CE1 3.95Å; P540-F553 WeakPolarHBondContact O-CD1 3.39Å; P540-F553 WeakPolarHBondContact O-CE1 3.24Å; D543-F553 HydrophobicContact CB-CZ 4.35Å; V551-F553 HydrophobicContact CG2-CD2 4.29Å; V551-F553 HydrophobicContact CG2-CE2 3.86Å; V551-F553 HydrophobicContact CG2-CZ 4.46Å; F553-W570 HydrophobicContact CB-CH2 3.81Å; F553-W570 HydrophobicContact CB-CZ3 4.27Å; F553-I605 HydrophobicContact CB-CD1 4.4Å; F553-I605 HydrophobicContact CB-CG1 3.95Å; F553-I605 HydrophobicContact CD2-CD1 4.45Å; F553-I605 PolarHBondContact N-O 2.87Å; F553-I605 PolarHBondContact O-N 2.81Å; F553-Y618 HydrophobicContact CD2-CG 4.29Å; F553-Y618 AromaticContact CE2-CD2 3.93Å; F553-Y618 HydrophobicContact CE2-CD2 3.93Å; F553-Y618 HydrophobicContact CE2-CE2 4.45Å; F553-Y618 HydrophobicContact CE2-CG 4.02Å; F553-Y618 HydrophobicContact CZ-CD2 4.41Å; F553-L633 HydrophobicContact CE2-CB 4.2Å; F553-L633 HydrophobicContact CZ-CB 4.04Å
554	H	91.4	Very high	81.4	Confident	57 Å²	57	51.6 Å²	51.6	26%	0.264	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	121.8	172.7	-53.8	172.5	0	0	0	108.4	I538 N539 E552 T602 F604	I538-H554 CarbonylContact C-O 3.52Å; I538-H554 VanDerWaalsContact CA-O 3.32Å; I538-H554 WeakPolarHBondContact CA-O 3.3Å; I538-H554 WeakPolarHBondContact CG1-O 3.32Å; N539-H554 PolarHBondContact N-O 2.87Å; N539-H554 PolarHBondContact O-N 3.46Å; E552-H554 IonicContact OE1-CD2 2.68Å; E552-H554 IonicContact OE1-CE1 3.34Å; E552-H554 IonicContact OE1-NE2 3.23Å; E552-H554 PolarHBondContact OE1-NE2 3.31Å; H554-T602 HydrophobicContact CB-CG2 4.02Å; H554-F604 HydrophobicContact CB-CE1 4.49Å; H554-F604 AromaticContact CD2-CD1 3.38Å; H554-F604 WeakPolarHBondContact CD2-CD1 3.24Å; H554-F604 AromaticContact CD2-CE1 3.73Å; H554-F604 AromaticContact CG-CD1 3.89Å; H554-F604 AromaticContact CG-CE1 3.84Å; H554-F604 AromaticContact NE2-CD1 3.75Å; H554-F604 AromaticContact NE2-CE1 3.89Å
555	C	91.7	Very high	81.3	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	121.3	170.6	178.2	0	0	0	0	110.2	E537 L568 W570 T602 S603 C620	E537-C555 CarbonylContact O-C 3.57Å; E537-C555 WeakPolarHBondContact O-CA 3.4Å; C555-L568 HydrophobicContact CB-CD1 4.36Å; C555-L568 WeakPolarHBondContact O-CD1 3.42Å; C555-W570 HydrophobicContact CB-CH2 3.56Å; C555-W570 HydrophobicContact CB-CZ2 3.32Å; C555-T602 CarbonylContact O-C 3.32Å; C555-T602 VanDerWaalsContact O-CA 3.27Å; C555-T602 WeakPolarHBondContact O-CA 3.48Å; C555-S603 PolarHBondContact N-O 3.36Å; C555-S603 PolarHBondContact O-N 3.18Å; C555-C620 HydrophobicContact CB-CB 3.59Å; C555-C620 WeakPolarHBondContact CB-SG 3.13Å; C555-C620 WeakPolarHBondContact SG-CB 3.4Å; C555-C620 CovalentContact SG-SG 2.02Å; C555-C620 PolarHBondContact SG-SG 2.87Å
556	R	88	Confident	81.5	Confident	116 Å²	116	56.5 Å²	56.5	44%	0.438	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	140.5	-174.3	177.6	174.9	171.2	176.1	-6.5	111.3	E537 H558 H601 T602	E537-R556 HydrophobicContact CB-CB 4.47Å; E537-R556 PolarHBondContact N-O 3.32Å; E537-R556 PolarHBondContact O-N 3.23Å; R556-H558 PolarHBondContact NE-CE1 3.19Å; R556-H558 PolarHBondContact NE-ND1 2.72Å; R556-H558 PolarHBondContact NH2-CE1 3.38Å; R556-H558 PolarHBondContact NH2-ND1 2.74Å; R556-H601 WeakPolarHBondContact CA-O 3.37Å; R556-T602 HydrophobicContact CB-CG2 4.34Å
557	V	85.7	Confident	82	Confident	2 Å²	2	58.5 Å²	58.5	1%	0.012	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	133.5	166.7	-178	0	0	0	0	109.3	L536 M560 I564 L568 H601 L622	L536-V557 HydrophobicContact CD2-CG2 3.82Å; V557-M560 HydrophobicContact CG1-CB 3.9Å; V557-M560 HydrophobicContact CG1-CG 3.82Å; V557-M560 HydrophobicContact CG1-SD 3.91Å; V557-I564 HydrophobicContact CB-CG2 4.37Å; V557-I564 HydrophobicContact CG2-CG2 3.87Å; V557-L568 HydrophobicContact CG2-CD1 4.27Å; V557-L568 HydrophobicContact CG2-CD2 3.75Å; V557-L568 HydrophobicContact CG2-CG 4.36Å; V557-H601 PolarHBondContact N-O 2.89Å; V557-L622 HydrophobicContact CG1-CD2 4.13Å; V557-L622 HydrophobicContact CG2-CD1 4.33Å; V557-L622 HydrophobicContact CG2-CD2 4.1Å
558	H	77.2	Confident	82.6	Confident	31 Å²	31	56.2 Å²	56.2	14%	0.144	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	153.3	168.1	-59.8	-87.3	0	0	0	111	E533 G535 E537 R556 M560	E533-H558 WeakPolarHBondContact O-CB 3.37Å; G535-H558 PolarHBondContact N-O 2.62Å; G535-H558 PolarHBondContact O-N 3.38Å; E537-H558 IonicContact OE2-CD2 3.33Å; E537-H558 IonicContact OE2-CE1 2.71Å; E537-H558 PolarHBondContact OE2-CE1 3.33Å; E537-H558 IonicContact OE2-NE2 3.35Å; E537-H558 PolarHBondContact OE2-NE2 2.72Å; R556-H558 PolarHBondContact NE-CE1 3.19Å; R556-H558 PolarHBondContact NE-ND1 2.72Å; R556-H558 PolarHBondContact NH2-CE1 3.38Å; R556-H558 PolarHBondContact NH2-ND1 2.74Å; H558-M560 VanDerWaalsContact C-N 3.32Å; H558-M560 PolarHBondContact O-N 2.79Å
559	G	67.7	Low	83.3	Confident	71 Å²	71	56.1 Å²	56.1	73%	0.732	30%	0.3	S	S	*	.	S	Bend	trans	81.6	-10.5	176.7	0	0	0	0	0	116.9
560	M	68.8	Low	83.8	Confident	56 Å²	56	51.4 Å²	51.4	28%	0.276	28%	0.277	S	S	.	.			trans	-105.9	141.9	179.5	-65.1	-169.1	68.5	0	0	113.9	V557 H558 I564 H601 L622 Q625	V557-M560 HydrophobicContact CG1-CB 3.9Å; V557-M560 HydrophobicContact CG1-CG 3.82Å; V557-M560 HydrophobicContact CG1-SD 3.91Å; H558-M560 VanDerWaalsContact C-N 3.32Å; H558-M560 PolarHBondContact O-N 2.79Å; M560-I564 HydrophobicContact CB-CD1 3.32Å; M560-I564 HydrophobicContact CE-CD1 4Å; M560-I564 HydrophobicContact CG-CD1 4.37Å; M560-I564 HydrophobicContact SD-CD1 4.24Å; M560-H601 PolarHBondContact O-CE1 2.89Å; M560-H601 PolarHBondContact O-ND1 2.88Å; M560-H601 VanDerWaalsContact O-ND1 3.16Å; M560-L622 HydrophobicContact SD-CD2 3.84Å; M560-Q625 PolarHBondContact SD-OE1 2.83Å
561	N	66.7	Low	84.2	Confident	161 Å²	161	49.7 Å²	49.7	86%	0.861	26%	0.256	S	S	*	.			trans	-96.4	144	178.9	-73.5	-40.2	0	0	0	113.3
562	G	70.1	Confident	84.3	Confident	38 Å²	38	51 Å²	51	39%	0.392	26%	0.261	S	S	.	.	S	Bend	trans	99.5	177.6	176.1	0	0	0	0	0	114.1	I564 H601	G562-I564 WeakPolarHBondContact O-CG1 3.06Å; G562-I564 PolarHBondContact O-N 2.74Å; G562-I564 VanDerWaalsContact O-N 3.14Å; G562-H601 PolarHBondContact O-CE1 2.76Å; G562-H601 VanDerWaalsContact O-CE1 3.3Å
563	N	78.7	Confident	84.3	Confident	69 Å²	69	50.7 Å²	50.7	37%	0.369	26%	0.256	S	S	.	.			trans	-79.7	98.1	-175.6	-164.6	27.6	0	0	0	111.4	N565 Q600	N563-N565 PolarHBondContact OD1-OD1 2.87Å; N563-Q600 HydrophobicContact CB-CB 4.46Å; N563-Q600 VanDerWaalsContact OD1-CA 3.32Å; N563-Q600 WeakPolarHBondContact OD1-CA 3.42Å; N563-Q600 PolarHBondContact OD1-O 2.98Å
564	I	83.9	Confident	84	Confident	4 Å²	4	52.6 Å²	52.6	2%	0.021	27%	0.269	C	S	.	.			trans	-111.6	-17.4	-168.1	-67.9	159.3	0	0	0	111.8	V557 M560 G562 R566 Q567 Q600 L622	V557-I564 HydrophobicContact CB-CG2 4.37Å; V557-I564 HydrophobicContact CG2-CG2 3.87Å; M560-I564 HydrophobicContact CB-CD1 3.32Å; M560-I564 HydrophobicContact CE-CD1 4Å; M560-I564 HydrophobicContact CG-CD1 4.37Å; M560-I564 HydrophobicContact SD-CD1 4.24Å; G562-I564 WeakPolarHBondContact O-CG1 3.06Å; G562-I564 PolarHBondContact O-N 2.74Å; G562-I564 VanDerWaalsContact O-N 3.14Å; I564-R566 VanDerWaalsContact C-N 3.29Å; I564-R566 PolarHBondContact O-N 2.75Å; I564-Q567 HydrophobicContact CG2-CB 4.46Å; I564-Q567 WeakPolarHBondContact O-CA 3.49Å; I564-Q567 VanDerWaalsContact O-CB 3.3Å; I564-Q567 WeakPolarHBondContact O-CB 3.37Å; I564-Q567 PolarHBondContact O-N 2.83Å; I564-Q600 PolarHBondContact N-O 3.17Å; I564-L622 HydrophobicContact CG2-CD1 4.11Å
565	N	83.7	Confident	83.5	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.005	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-48.5	-48.1	179.7	58.5	14.3	0	0	0	113.2	N563 Q567 L568 R593 D595 D596 A599 Q600 T602	N563-N565 PolarHBondContact OD1-OD1 2.87Å; N565-Q567 PolarHBondContact O-N 2.94Å; N565-L568 WeakPolarHBondContact O-CB 3.36Å; N565-L568 PolarHBondContact O-N 2.87Å; N565-L568 VanDerWaalsContact O-N 3.15Å; N565-R593 PolarHBondContact O-NH2 3.1Å; N565-D595 HydrophobicContact CB-CB 4.44Å; N565-D596 PolarHBondContact ND2-O 3.45Å; N565-A599 PolarHBondContact ND2-O 3.25Å; N565-Q600 PolarHBondContact N-O 2.85Å; N565-T602 VanDerWaalsContact CB-C 3.49Å; N565-T602 WeakPolarHBondContact CB-O 3.33Å
566	R	83.3	Confident	82.5	Confident	169 Å²	169	63 Å²	63	64%	0.638	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-68.2	-10.7	176.5	-70.3	178.3	-177.1	-158.3	-2.4	115.7	I564 D595	I564-R566 VanDerWaalsContact C-N 3.29Å; I564-R566 PolarHBondContact O-N 2.75Å; R566-D595 HydrophobicContact CG-CB 4.5Å
567	Q	87.3	Confident	81.9	Confident	99 Å²	99	59.4 Å²	59.4	46%	0.463	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-87.8	-15	174.7	-53.9	-175.8	14.9	0	0	112.4	I564 N565 P623	I564-Q567 HydrophobicContact CG2-CB 4.46Å; I564-Q567 WeakPolarHBondContact O-CA 3.49Å; I564-Q567 VanDerWaalsContact O-CB 3.3Å; I564-Q567 WeakPolarHBondContact O-CB 3.37Å; I564-Q567 PolarHBondContact O-N 2.83Å; N565-Q567 PolarHBondContact O-N 2.94Å; Q567-P623 WeakPolarHBondContact O-CD 3.21Å
568	L	89.5	Confident	81.3	Confident	2 Å²	2	64.9 Å²	64.9	1%	0.01	34%	0.34	C	S	.	.			trans	-72.3	131.2	176.7	-64.7	171.3	0	0	0	111	L536 C555 V557 N565 R593 R621 L622	L536-L568 HydrophobicContact CD2-CD2 3.72Å; C555-L568 HydrophobicContact CB-CD1 4.36Å; C555-L568 WeakPolarHBondContact O-CD1 3.42Å; V557-L568 HydrophobicContact CG2-CD1 4.27Å; V557-L568 HydrophobicContact CG2-CD2 3.75Å; V557-L568 HydrophobicContact CG2-CG 4.36Å; N565-L568 WeakPolarHBondContact O-CB 3.36Å; N565-L568 PolarHBondContact O-N 2.87Å; N565-L568 VanDerWaalsContact O-N 3.15Å; L568-R593 PolarHBondContact O-NH1 2.03Å; L568-R593 PolarHBondContact O-NH2 2.97Å; L568-R621 WeakPolarHBondContact CA-O 3.34Å; L568-L622 HydrophobicContact CD2-CB 4.13Å; L568-L622 HydrophobicContact CD2-CD1 4.04Å
569	E	92	Very high	81.4	Confident	35 Å²	35	67.5 Å²	67.5	16%	0.164	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	143.6	174.8	-58.5	-169.2	115.7	0	0	110.6	Y571 R582 C620 R621 P623	E569-Y571 HydrophobicContact CB-CD2 4.4Å; E569-Y571 HydrophobicContact CB-CE2 3.74Å; E569-Y571 PolarHBondContact OE2-OH 3.01Å; E569-R582 IonicContact OE1-CZ 3.82Å; E569-R582 IonicContact OE1-NH1 2.82Å; E569-R582 PolarHBondContact OE1-NH1 3.34Å; E569-R582 IonicContact OE1-NH2 3.18Å; E569-R582 PolarHBondContact OE1-NH2 2.91Å; E569-C620 CarbonylContact O-C 3.53Å; E569-C620 WeakPolarHBondContact O-CA 3.31Å; E569-R621 HydrophobicContact CB-CB 4.29Å; E569-R621 PolarHBondContact N-O 2.88Å; E569-R621 PolarHBondContact O-N 3.43Å; E569-R621 IonicContact OE2-NH1 2.68Å; E569-R621 PolarHBondContact OE2-NH1 2.92Å; E569-P623 HydrophobicContact CG-CG 3.72Å
570	W	93.4	Very high	82.3	Confident	6 Å²	6	70.4 Å²	70.4	2%	0.023	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	138	177.1	-71.8	97.6	0	0	0	111.3	I538 F553 C555 L583 S603 I605 I619 C620	I538-W570 HydrophobicContact CD1-CH2 3.69Å; I538-W570 HydrophobicContact CD1-CZ3 3.61Å; I538-W570 HydrophobicContact CG1-CH2 4.29Å; F553-W570 HydrophobicContact CB-CH2 3.81Å; F553-W570 HydrophobicContact CB-CZ3 4.27Å; C555-W570 HydrophobicContact CB-CH2 3.56Å; C555-W570 HydrophobicContact CB-CZ2 3.32Å; W570-L583 HydrophobicContact CB-CB 3.99Å; W570-L583 HydrophobicContact CB-CD2 4.02Å; W570-L583 PolarHBondContact O-N 2.85Å; W570-S603 PolarHBondContact NE1-OG 2.79Å; W570-S603 VanDerWaalsContact NE1-OG 3.13Å; W570-I605 HydrophobicContact CD2-CD1 3.73Å; W570-I605 HydrophobicContact CD2-CG1 4.11Å; W570-I605 HydrophobicContact CD2-CG2 4.01Å; W570-I605 HydrophobicContact CE3-CD1 3.47Å; W570-I605 VanDerWaalsContact CE3-CD1 3.47Å; W570-I605 HydrophobicContact CE3-CG1 4.15Å; W570-I605 HydrophobicContact CG-CD1 4.37Å; W570-I605 HydrophobicContact CG-CG2 3.93Å; W570-I605 HydrophobicContact CH2-CD1 3.98Å; W570-I605 HydrophobicContact CH2-CG1 3.85Å; W570-I605 HydrophobicContact CZ2-CD1 4.24Å; W570-I605 HydrophobicContact CZ2-CG1 3.83Å; W570-I605 HydrophobicContact CZ2-CG2 4.34Å; W570-I605 HydrophobicContact CZ3-CD1 3.61Å; W570-I605 HydrophobicContact CZ3-CG1 4.03Å; W570-I619 WeakPolarHBondContact CA-O 3.34Å; W570-C620 HydrophobicContact CD2-CB 4.27Å; W570-C620 HydrophobicContact CE3-CB 3.94Å; W570-C620 HydrophobicContact CH2-CB 4.05Å; W570-C620 HydrophobicContact CZ2-CB 4.34Å; W570-C620 HydrophobicContact CZ3-CB 3.83Å
571	Y	94.2	Very high	83.3	Confident	34 Å²	34	71.2 Å²	71.2	13%	0.133	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	157.2	178.5	-65.9	-100.5	0	0	0	110.1	E569 V581 R582 I619 R621	E569-Y571 HydrophobicContact CB-CD2 4.4Å; E569-Y571 HydrophobicContact CB-CE2 3.74Å; E569-Y571 PolarHBondContact OE2-OH 3.01Å; Y571-V581 CarbonylContact C-O 3.55Å; Y571-V581 WeakPolarHBondContact CA-O 2.94Å; Y571-V581 VanDerWaalsContact CB-O 3.3Å; Y571-V581 WeakPolarHBondContact CB-O 3.34Å; Y571-V581 WeakPolarHBondContact CD1-O 3.4Å; Y571-R582 HydrophobicContact CD1-CB 4.29Å; Y571-R582 HydrophobicContact CE1-CB 4.25Å; Y571-R582 HydrophobicContact CE1-CG 4.49Å; Y571-I619 PolarHBondContact N-O 3.47Å; Y571-I619 PolarHBondContact O-N 3.27Å; Y571-R621 HydrophobicContact CD2-CB 4.35Å; Y571-R621 HydrophobicContact CE2-CB 4.19Å
572	Y	93.2	Very high	84.4	Confident	32 Å²	32	70.6 Å²	70.6	13%	0.125	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	143.4	179.1	173.7	-123.6	0	0	0	110.9	P574 R580 V581 A613 D614 Q615 E617 Y618	Y572-P574 HydrophobicContact CD1-CG 4.42Å; Y572-P574 HydrophobicContact CE1-CG 3.72Å; Y572-R580 WeakPolarHBondContact O-CA 3.45Å; Y572-V581 HydrophobicContact CD1-CG2 4.2Å; Y572-V581 PolarHBondContact N-O 3.31Å; Y572-V581 PolarHBondContact O-N 3.03Å; Y572-A613 PolarHBondContact OH-O 2.79Å; Y572-A613 VanDerWaalsContact OH-O 3.05Å; Y572-D614 VanDerWaalsContact OH-C 3.27Å; Y572-D614 PolarHBondContact OH-O 2.7Å; Y572-Q615 PolarHBondContact OH-O 3.09Å; Y572-E617 CarbonylContact C-O 3.55Å; Y572-E617 WeakPolarHBondContact CA-O 3.4Å; Y572-Y618 HydrophobicContact CD2-CD2 4.31Å; Y572-Y618 HydrophobicContact CD2-CE1 4.19Å; Y572-Y618 AromaticContact CD2-CE2 3.84Å; Y572-Y618 HydrophobicContact CD2-CE2 3.84Å; Y572-Y618 AromaticContact CD2-CZ 3.77Å; Y572-Y618 AromaticContact CE2-CE2 3.85Å; Y572-Y618 HydrophobicContact CE2-CE2 3.85Å; Y572-Y618 AromaticContact CE2-CZ 3.93Å
573	R	91.4	Very high	85.3	Confident	81 Å²	81	69.8 Å²	69.8	31%	0.306	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	109.5	173.1	176.2	170.3	64.5	-156.9	1.1	109.6	S577 E617 I619	R573-S577 WeakPolarHBondContact CD-O 3.47Å; R573-S577 WeakPolarHBondContact CG-O 3.41Å; R573-E617 HydrophobicContact CB-CB 4.4Å; R573-E617 IonicContact CZ-OE2 2.83Å; R573-E617 PolarHBondContact N-O 2.74Å; R573-E617 IonicContact NE-OE2 3.62Å; R573-E617 PolarHBondContact NE-OE2 3.08Å; R573-E617 IonicContact NH2-OE2 3.57Å; R573-E617 PolarHBondContact NH2-OE2 2.79Å; R573-E617 PolarHBondContact O-N 2.96Å; R573-I619 HydrophobicContact CB-CD1 4.09Å
574	P	86.1	Confident	85.3	Confident	41 Å²	41	72.3 Å²	72.3	27%	0.266	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	142.1	172	-22	31.1	0	0	0	111.3	Y572 Y576 S577	Y572-P574 HydrophobicContact CD1-CG 4.42Å; Y572-P574 HydrophobicContact CE1-CG 3.72Å; P574-Y576 PolarHBondContact O-N 3.45Å; P574-S577 PolarHBondContact O-N 2.66Å
575	F	80.7	Confident	85.1	Confident	59 Å²	59	74 Å²	74	26%	0.259	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-30.3	-175.3	-66.9	-48.9	0	0	0	114.3	S577 Q615 E617 K632 L633 F634	F575-S577 VanDerWaalsContact C-N 3.32Å; F575-Q615 HydrophobicContact CD2-CG 3.55Å; F575-Q615 HydrophobicContact CE2-CG 3.49Å; F575-Q615 VanDerWaalsContact CE2-CG 3.49Å; F575-E617 HydrophobicContact CD1-CG 3.73Å; F575-E617 HydrophobicContact CE1-CG 3.52Å; F575-K632 HydrophobicContact CE1-CB 4.31Å; F575-K632 HydrophobicContact CE1-CD 4.14Å; F575-K632 HydrophobicContact CE1-CG 4.27Å; F575-K632 HydrophobicContact CZ-CB 4.14Å; F575-L633 WeakPolarHBondContact CE2-O 3.07Å; F575-F634 HydrophobicContact CD2-CE1 4.34Å; F575-F634 AromaticContact CE2-CD1 3.6Å; F575-F634 HydrophobicContact CE2-CD1 3.6Å; F575-F634 AromaticContact CE2-CE1 3.48Å; F575-F634 HydrophobicContact CE2-CE1 3.48Å; F575-F634 VanDerWaalsContact CE2-CE1 3.48Å; F575-F634 HydrophobicContact CE2-CG 4.3Å; F575-F634 HydrophobicContact CE2-CZ 4.09Å; F575-F634 HydrophobicContact CZ-CD1 4.08Å; F575-F634 AromaticContact CZ-CE1 3.69Å; F575-F634 HydrophobicContact CZ-CE1 3.69Å; F575-F634 HydrophobicContact CZ-CE2 4.28Å; F575-F634 AromaticContact CZ-CZ 3.8Å; F575-F634 HydrophobicContact CZ-CZ 3.8Å
576	Y	71.5	Confident	84.8	Confident	217 Å²	217	78.9 Å²	78.9	85%	0.851	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	9.2	179.8	-49.7	-67.5	0	0	0	113.7	P574	P574-Y576 PolarHBondContact O-N 3.45Å
577	S	74.2	Confident	84.3	Confident	40 Å²	40	73 Å²	73	28%	0.28	36%	0.36	S	S	.	.			trans	-128.6	132.8	-174.8	-177.6	0	0	0	0	111.7	R573 P574 F575 T579	R573-S577 WeakPolarHBondContact CD-O 3.47Å; R573-S577 WeakPolarHBondContact CG-O 3.41Å; P574-S577 PolarHBondContact O-N 2.66Å; F575-S577 VanDerWaalsContact C-N 3.32Å; S577-T579 VanDerWaalsContact C-N 3.26Å; S577-T579 WeakPolarHBondContact OG-CB 3.45Å; S577-T579 PolarHBondContact OG-N 3.41Å; S577-T579 VanDerWaalsContact OG-N 3.12Å
578	S	73.8	Confident	83.5	Confident	117 Å²	117	74.5 Å²	74.5	82%	0.818	38%	0.378	S	S	*	.	S	Bend	trans	-76.4	-15.2	168.4	54	0	0	0	0	112.9	R580	S578-R580 PolarHBondContact O-N 2.81Å
579	T	78.9	Confident	82.5	Confident	86 Å²	86	80.3 Å²	80.3	53%	0.528	41%	0.409	S	S	.	.			trans	-80.1	113	-174.4	-55	0	0	0	0	111.1	S577 V581	S577-T579 VanDerWaalsContact C-N 3.26Å; S577-T579 WeakPolarHBondContact OG-CB 3.45Å; S577-T579 PolarHBondContact OG-N 3.41Å; S577-T579 VanDerWaalsContact OG-N 3.12Å; T579-V581 HydrophobicContact CG2-CG1 4.43Å
580	R	86.8	Confident	81.9	Confident	131 Å²	131	79.4 Å²	79.4	49%	0.494	41%	0.41	S	S	.	.			trans	-81.6	137.6	165.7	68.9	178.3	-178	171.8	1.9	110.9	Y572 S578 E628	Y572-R580 WeakPolarHBondContact O-CA 3.45Å; S578-R580 PolarHBondContact O-N 2.81Å; R580-E628 IonicContact NH1-OE1 3.88Å; R580-E628 PolarHBondContact NH1-OE1 3.04Å; R580-E628 VanDerWaalsContact NH1-OE1 3.08Å; R580-E628 IonicContact NH1-OE2 3.07Å; R580-E628 PolarHBondContact NH1-OE2 3.43Å; R580-E628 VanDerWaalsContact NH1-OE2 3.17Å
581	V	89	Confident	81.7	Confident	73 Å²	73	79.3 Å²	79.3	44%	0.442	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	155.2	170.7	-64.4	0	0	0	0	109.8	Y571 Y572 T579	Y571-V581 CarbonylContact C-O 3.55Å; Y571-V581 WeakPolarHBondContact CA-O 2.94Å; Y571-V581 VanDerWaalsContact CB-O 3.3Å; Y571-V581 WeakPolarHBondContact CB-O 3.34Å; Y571-V581 WeakPolarHBondContact CD1-O 3.4Å; Y572-V581 HydrophobicContact CD1-CG2 4.2Å; Y572-V581 PolarHBondContact N-O 3.31Å; Y572-V581 PolarHBondContact O-N 3.03Å; T579-V581 HydrophobicContact CG2-CG1 4.43Å
582	R	90.7	Very high	81.4	Confident	149 Å²	149	81.5 Å²	81.5	56%	0.562	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.4	136.4	167.3	-165.8	-178.2	-169.1	90	-1.2	107.5	E569 Y571 D584	E569-R582 IonicContact OE1-CZ 3.82Å; E569-R582 IonicContact OE1-NH1 2.82Å; E569-R582 PolarHBondContact OE1-NH1 3.34Å; E569-R582 IonicContact OE1-NH2 3.18Å; E569-R582 PolarHBondContact OE1-NH2 2.91Å; Y571-R582 HydrophobicContact CD1-CB 4.29Å; Y571-R582 HydrophobicContact CE1-CB 4.25Å; Y571-R582 HydrophobicContact CE1-CG 4.49Å; R582-D584 PolarHBondContact O-N 2.98Å
583	L	88.6	Confident	81.3	Confident	21 Å²	21	82.7 Å²	82.7	11%	0.11	43%	0.426	C	S	.	.			trans	-70.5	122.8	177.2	-179.1	64.7	0	0	0	108.5	W570 V585 F591 I605 Y618	W570-L583 HydrophobicContact CB-CB 3.99Å; W570-L583 HydrophobicContact CB-CD2 4.02Å; W570-L583 PolarHBondContact O-N 2.85Å; L583-V585 HydrophobicContact CD2-CG1 3.99Å; L583-V585 HydrophobicContact CG-CG1 3.97Å; L583-V585 PolarHBondContact O-N 3.47Å; L583-F591 HydrophobicContact CD1-CD2 4.25Å; L583-F591 HydrophobicContact CD2-CB 4.13Å; L583-F591 HydrophobicContact CD2-CG 4.28Å; L583-I605 HydrophobicContact CD2-CD1 3.53Å; L583-I605 HydrophobicContact CD2-CG2 4.42Å; L583-Y618 HydrophobicContact CD1-CE1 4.11Å; L583-Y618 HydrophobicContact CD2-CD1 4.19Å; L583-Y618 HydrophobicContact CD2-CE1 4.21Å
584	D	79.8	Confident	80.8	Confident	121 Å²	121	83.3 Å²	83.3	65%	0.647	43%	0.432	S	S	*	.			trans	-82	98.2	178.1	-161.6	22.6	0	0	0	108.9	R582 T587	R582-D584 PolarHBondContact O-N 2.98Å; D584-T587 PolarHBondContact O-OG1 3.33Å; D584-T587 WeakPolarHBondContact OD2-CG2 3.23Å
585	V	79	Confident	80.6	Confident	39 Å²	39	82.4 Å²	82.4	24%	0.236	43%	0.425	C	S	.	.	B	Isolated β-bridge	trans	-92.9	154.7	-176.3	-65.4	0	0	0	0	111.6	L583 T587 F591 R593 I605	L583-V585 HydrophobicContact CD2-CG1 3.99Å; L583-V585 HydrophobicContact CG-CG1 3.97Å; L583-V585 PolarHBondContact O-N 3.47Å; V585-T587 VanDerWaalsContact C-N 3.3Å; V585-T587 PolarHBondContact O-N 3.06Å; V585-F591 CarbonylContact C-O 3.57Å; V585-F591 VanDerWaalsContact CA-O 3.24Å; V585-F591 WeakPolarHBondContact CA-O 3.05Å; V585-R593 HydrophobicContact CB-CB 4.25Å; V585-R593 HydrophobicContact CG1-CB 4.49Å; V585-R593 HydrophobicContact CG2-CB 4.36Å; V585-I605 HydrophobicContact CG1-CG2 4.31Å
586	D	77.5	Confident	80.5	Confident	104 Å²	104	83.6 Å²	83.6	56%	0.556	43%	0.434	S	S	*	.	S	Bend	trans	67.4	27.1	177.7	-47.2	-38.2	0	0	0	113.7	F591 M592 R593	D586-F591 PolarHBondContact N-O 3.2Å; D586-M592 WeakPolarHBondContact OD1-CA 3.41Å; D586-R593 PolarHBondContact OD1-N 2.83Å
587	T	72.5	Confident	80.8	Confident	46 Å²	46	78.9 Å²	78.9	28%	0.282	42%	0.423	S	S	.	.			trans	-91.7	147.6	168.3	51.9	0	0	0	0	111.7	D584 V585 D589 G590	D584-T587 PolarHBondContact O-OG1 3.33Å; D584-T587 WeakPolarHBondContact OD2-CG2 3.23Å; V585-T587 VanDerWaalsContact C-N 3.3Å; V585-T587 PolarHBondContact O-N 3.06Å; T587-D589 VanDerWaalsContact C-N 3.32Å; T587-D589 PolarHBondContact O-N 2.98Å; T587-G590 PolarHBondContact O-N 2.96Å; T587-G590 VanDerWaalsContact O-N 3.11Å; T587-G590 WeakPolarHBondContact OG1-CA 3.43Å
588	P	70.3	Confident	81.2	Confident	130 Å²	130	83.2 Å²	83.2	84%	0.844	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-36	-169.9	-28.4	36	0	0	0	116.1
589	D	69.2	Low	81.5	Confident	124 Å²	124	78.9 Å²	78.9	66%	0.663	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.8	16.8	-179.5	-57.6	-67.6	0	0	0	112.7	T587 K607	T587-D589 VanDerWaalsContact C-N 3.32Å; T587-D589 PolarHBondContact O-N 2.98Å; D589-K607 WeakPolarHBondContact O-CE 3.29Å; D589-K607 PolarHBondContact O-NZ 2.89Å
590	G	80	Confident	81.8	Confident	17 Å²	17	78.9 Å²	78.9	18%	0.175	41%	0.413	C	S	.	.	S	Bend	trans	-106	-150.5	-176.1	0	0	0	0	0	113.5	T587 K607	T587-G590 PolarHBondContact O-N 2.96Å; T587-G590 VanDerWaalsContact O-N 3.11Å; T587-G590 WeakPolarHBondContact OG1-CA 3.43Å; G590-K607 VanDerWaalsContact O-CD 3.32Å; G590-K607 WeakPolarHBondContact O-CD 3.44Å; G590-K607 VanDerWaalsContact O-CE 3.26Å; G590-K607 WeakPolarHBondContact O-CE 3.46Å; G590-K607 VanDerWaalsContact O-CG 3.24Å; G590-K607 WeakPolarHBondContact O-CG 3.46Å
591	F	88.4	Confident	81.7	Confident	4 Å²	4	75.6 Å²	75.6	2%	0.018	40%	0.403	C	S	.	.	B	Isolated β-bridge	trans	-93.8	141.4	169.2	-80.8	-107.1	0	0	0	109.2	V551 L583 V585 D586 I605 S606 K607 Y618 L633	V551-F591 HydrophobicContact CG1-CE1 3.9Å; V551-F591 HydrophobicContact CG1-CZ 3.82Å; L583-F591 HydrophobicContact CD1-CD2 4.25Å; L583-F591 HydrophobicContact CD2-CB 4.13Å; L583-F591 HydrophobicContact CD2-CG 4.28Å; V585-F591 CarbonylContact C-O 3.57Å; V585-F591 VanDerWaalsContact CA-O 3.24Å; V585-F591 WeakPolarHBondContact CA-O 3.05Å; D586-F591 PolarHBondContact N-O 3.2Å; F591-I605 HydrophobicContact CD1-CB 4.21Å; F591-I605 HydrophobicContact CD1-CD1 4.09Å; F591-I605 HydrophobicContact CD1-CG1 4.32Å; F591-I605 HydrophobicContact CE1-CD1 4.48Å; F591-S606 CarbonylContact C-O 3.57Å; F591-S606 VanDerWaalsContact CA-O 3.3Å; F591-S606 WeakPolarHBondContact CA-O 3.5Å; F591-K607 HydrophobicContact CD1-CB 3.85Å; F591-K607 HydrophobicContact CD2-CB 4.04Å; F591-K607 HydrophobicContact CD2-CD 3.85Å; F591-K607 HydrophobicContact CE1-CB 3.79Å; F591-K607 HydrophobicContact CE2-CB 3.95Å; F591-K607 HydrophobicContact CE2-CD 3.59Å; F591-K607 HydrophobicContact CE2-CG 4.41Å; F591-K607 HydrophobicContact CG-CB 3.98Å; F591-K607 HydrophobicContact CZ-CB 3.83Å; F591-K607 HydrophobicContact CZ-CD 4.17Å; F591-Y618 HydrophobicContact CD1-CE1 4.33Å; F591-Y618 HydrophobicContact CD2-CE1 4.16Å; F591-Y618 AromaticContact CE1-CE1 3.86Å; F591-Y618 HydrophobicContact CE1-CE1 3.86Å; F591-Y618 AromaticContact CE2-CE1 3.71Å; F591-Y618 HydrophobicContact CE2-CE1 3.71Å; F591-Y618 AromaticContact CE2-CZ 3.7Å; F591-Y618 WeakPolarHBondContact CE2-OH 3.15Å; F591-Y618 HydrophobicContact CG-CE1 4.47Å; F591-Y618 AromaticContact CZ-CE1 3.54Å; F591-Y618 HydrophobicContact CZ-CE1 3.54Å; F591-Y618 AromaticContact CZ-CZ 3.51Å; F591-Y618 WeakPolarHBondContact CZ-OH 3.32Å; F591-L633 HydrophobicContact CZ-CD2 4.29Å
592	M	88.1	Confident	81.7	Confident	79 Å²	79	73.2 Å²	73.2	39%	0.389	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	148.6	169.9	-61.6	-173.7	-68	0	0	109.9	D586 H594 I605 S606	D586-M592 WeakPolarHBondContact OD1-CA 3.41Å; M592-H594 VanDerWaalsContact CB-CE1 3.44Å; M592-H594 WeakPolarHBondContact CB-CE1 3.46Å; M592-I605 WeakPolarHBondContact O-CA 3.47Å; M592-S606 PolarHBondContact N-O 2.82Å; M592-S606 PolarHBondContact O-N 3.45Å
593	R	90	Very high	81.7	Confident	58 Å²	58	66.1 Å²	66.1	22%	0.219	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	128.7	177.2	-173.3	176.1	176.5	142.5	3.2	110.9	N565 L568 V585 D586 D595 S603 F604	N565-R593 PolarHBondContact O-NH2 3.1Å; L568-R593 PolarHBondContact O-NH1 2.03Å; L568-R593 PolarHBondContact O-NH2 2.97Å; V585-R593 HydrophobicContact CB-CB 4.25Å; V585-R593 HydrophobicContact CG1-CB 4.49Å; V585-R593 HydrophobicContact CG2-CB 4.36Å; D586-R593 PolarHBondContact OD1-N 2.83Å; R593-D595 IonicContact CZ-OD2 3.05Å; R593-D595 VanDerWaalsContact CZ-OD2 3.23Å; R593-D595 VanDerWaalsContact NE-CG 3.35Å; R593-D595 IonicContact NE-OD1 3.64Å; R593-D595 PolarHBondContact NE-OD1 3.17Å; R593-D595 IonicContact NE-OD2 3.65Å; R593-D595 PolarHBondContact NE-OD2 2.81Å; R593-D595 IonicContact NH2-OD1 3.66Å; R593-D595 IonicContact NH2-OD2 2.73Å; R593-D595 PolarHBondContact NH2-OD2 2.83Å; R593-S603 PolarHBondContact NE-OG 3.07Å; R593-S603 PolarHBondContact NH2-OG 2.9Å; R593-F604 WeakPolarHBondContact CA-O 3.25Å
594	H	82.7	Confident	81.8	Confident	93 Å²	93	66.8 Å²	66.8	43%	0.431	36%	0.364	S	S	.	.			trans	-129.5	51.9	-169.3	-65.8	-17.6	0	0	0	112.5	M592 D596 F604	M592-H594 VanDerWaalsContact CB-CE1 3.44Å; M592-H594 WeakPolarHBondContact CB-CE1 3.46Å; H594-D596 PolarHBondContact O-N 2.77Å; H594-D596 VanDerWaalsContact O-N 3.08Å; H594-F604 HydrophobicContact CB-CB 4.29Å; H594-F604 PolarHBondContact N-O 3.07Å; H594-F604 WeakPolarHBondContact O-CD2 3.23Å
595	D	81.1	Confident	82.4	Confident	23 Å²	23	61 Å²	61	12%	0.123	33%	0.333	C	S	.	.			trans	-68	100.8	179.6	-67.3	2.1	0	0	0	112.5	N565 R566 R593 S603 F604	N565-D595 HydrophobicContact CB-CB 4.44Å; R566-D595 HydrophobicContact CG-CB 4.5Å; R593-D595 IonicContact CZ-OD2 3.05Å; R593-D595 VanDerWaalsContact CZ-OD2 3.23Å; R593-D595 VanDerWaalsContact NE-CG 3.35Å; R593-D595 IonicContact NE-OD1 3.64Å; R593-D595 PolarHBondContact NE-OD1 3.17Å; R593-D595 IonicContact NE-OD2 3.65Å; R593-D595 PolarHBondContact NE-OD2 2.81Å; R593-D595 IonicContact NH2-OD1 3.66Å; R593-D595 IonicContact NH2-OD2 2.73Å; R593-D595 PolarHBondContact NH2-OD2 2.83Å; D595-S603 WeakPolarHBondContact OD1-CA 3.39Å; D595-S603 VanDerWaalsContact OD1-CB 3.27Å; D595-S603 WeakPolarHBondContact OD1-CB 3.46Å; D595-S603 PolarHBondContact OD1-OG 2.71Å; D595-F604 PolarHBondContact OD1-N 2.65Å
596	D	77.6	Confident	82.9	Confident	84 Å²	84	60 Å²	60	45%	0.449	33%	0.327	S	S	.	.			trans	-70.7	147.4	178.6	-168.8	-69.8	0	0	0	113.2	N565 H594 V598 A599	N565-D596 PolarHBondContact ND2-O 3.45Å; H594-D596 PolarHBondContact O-N 2.77Å; H594-D596 VanDerWaalsContact O-N 3.08Å; D596-V598 WeakPolarHBondContact OD1-CA 3.48Å; D596-V598 VanDerWaalsContact OD1-CB 3.28Å; D596-V598 WeakPolarHBondContact OD1-CB 3.43Å; D596-V598 WeakPolarHBondContact OD1-CG2 3.39Å; D596-V598 PolarHBondContact OD1-N 2.87Å; D596-A599 HydrophobicContact CB-CB 4.07Å; D596-A599 PolarHBondContact O-N 3.43Å
597	L	79.3	Confident	83.6	Confident	118 Å²	118	55.5 Å²	55.5	62%	0.618	30%	0.303	S	S	*	.	S	Bend	trans	-74.5	-21.8	-178.4	-63.2	176.5	0	0	0	114.2	Q600	L597-Q600 VanDerWaalsContact O-CG 3.3Å; L597-Q600 WeakPolarHBondContact O-CG 3.31Å; L597-Q600 PolarHBondContact O-NE2 2.82Å
598	V	81.5	Confident	84.2	Confident	131 Å²	131	56.5 Å²	56.5	79%	0.794	32%	0.316	S	S	*	.	S	Bend	trans	-81.5	-37.9	172.8	-174.4	0	0	0	0	109.9	D596 Q600	D596-V598 WeakPolarHBondContact OD1-CA 3.48Å; D596-V598 VanDerWaalsContact OD1-CB 3.28Å; D596-V598 WeakPolarHBondContact OD1-CB 3.43Å; D596-V598 WeakPolarHBondContact OD1-CG2 3.39Å; D596-V598 PolarHBondContact OD1-N 2.87Å; V598-Q600 PolarHBondContact O-N 2.8Å
599	A	81.3	Confident	84.8	Confident	26 Å²	26	59.3 Å²	59.3	22%	0.215	31%	0.31	C	S	.	.			trans	-83.5	55	-179	0	0	0	0	0	112.8	N565 D596 H601 T602 F604	N565-A599 PolarHBondContact ND2-O 3.25Å; D596-A599 HydrophobicContact CB-CB 4.07Å; D596-A599 PolarHBondContact O-N 3.43Å; A599-H601 PolarHBondContact O-N 3.13Å; A599-T602 PolarHBondContact O-N 3.11Å; A599-T602 VanDerWaalsContact O-O 3.11Å; A599-F604 HydrophobicContact CB-CE2 3.66Å; A599-F604 HydrophobicContact CB-CZ 3.94Å
600	Q	83.9	Confident	85.6	Confident	85 Å²	85	53.5 Å²	53.5	40%	0.397	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-18.1	-170	-65.7	-175.1	14.3	0	0	115.5	N563 I564 N565 L597 V598	N563-Q600 HydrophobicContact CB-CB 4.46Å; N563-Q600 VanDerWaalsContact OD1-CA 3.32Å; N563-Q600 WeakPolarHBondContact OD1-CA 3.42Å; N563-Q600 PolarHBondContact OD1-O 2.98Å; I564-Q600 PolarHBondContact N-O 3.17Å; N565-Q600 PolarHBondContact N-O 2.85Å; L597-Q600 VanDerWaalsContact O-CG 3.3Å; L597-Q600 WeakPolarHBondContact O-CG 3.31Å; L597-Q600 PolarHBondContact O-NE2 2.82Å; V598-Q600 PolarHBondContact O-N 2.8Å
601	H	85.9	Confident	85.8	Confident	63 Å²	63	57.8 Å²	57.8	29%	0.292	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.4	0.8	-178.6	-54.8	-80.9	0	0	0	113.9	R556 V557 M560 G562 A599	R556-H601 WeakPolarHBondContact CA-O 3.37Å; V557-H601 PolarHBondContact N-O 2.89Å; M560-H601 PolarHBondContact O-CE1 2.89Å; M560-H601 PolarHBondContact O-ND1 2.88Å; M560-H601 VanDerWaalsContact O-ND1 3.16Å; G562-H601 PolarHBondContact O-CE1 2.76Å; G562-H601 VanDerWaalsContact O-CE1 3.3Å; A599-H601 PolarHBondContact O-N 3.13Å
602	T	87.6	Confident	85.3	Confident	22 Å²	22	61 Å²	61	14%	0.135	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	125.9	-175.8	-50	0	0	0	0	111.4	H554 C555 R556 N565 A599 F604	H554-T602 HydrophobicContact CB-CG2 4.02Å; C555-T602 CarbonylContact O-C 3.32Å; C555-T602 VanDerWaalsContact O-CA 3.27Å; C555-T602 WeakPolarHBondContact O-CA 3.48Å; R556-T602 HydrophobicContact CB-CG2 4.34Å; N565-T602 VanDerWaalsContact CB-C 3.49Å; N565-T602 WeakPolarHBondContact CB-O 3.33Å; A599-T602 PolarHBondContact O-N 3.11Å; A599-T602 VanDerWaalsContact O-O 3.11Å; T602-F604 HydrophobicContact CG2-CD2 4.34Å; T602-F604 HydrophobicContact CG2-CE1 4.03Å; T602-F604 HydrophobicContact CG2-CE2 3.75Å; T602-F604 HydrophobicContact CG2-CZ 3.57Å; T602-F604 WeakPolarHBondContact O-CE2 3.47Å
603	S	91.3	Very high	85.1	Confident	0 Å²	0	61 Å²	61	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	143.4	167.1	179.8	0	0	0	0	110.5	C555 W570 R593 D595	C555-S603 PolarHBondContact N-O 3.36Å; C555-S603 PolarHBondContact O-N 3.18Å; W570-S603 PolarHBondContact NE1-OG 2.79Å; W570-S603 VanDerWaalsContact NE1-OG 3.13Å; R593-S603 PolarHBondContact NE-OG 3.07Å; R593-S603 PolarHBondContact NH2-OG 2.9Å; D595-S603 WeakPolarHBondContact OD1-CA 3.39Å; D595-S603 VanDerWaalsContact OD1-CB 3.27Å; D595-S603 WeakPolarHBondContact OD1-CB 3.46Å; D595-S603 PolarHBondContact OD1-OG 2.71Å
604	F	90.5	Very high	85	Confident	36 Å²	36	58.9 Å²	58.9	16%	0.158	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	127.5	-177.1	-57	-101.3	0	0	0	109.1	H554 R593 H594 D595 A599 T602	H554-F604 HydrophobicContact CB-CE1 4.49Å; H554-F604 AromaticContact CD2-CD1 3.38Å; H554-F604 WeakPolarHBondContact CD2-CD1 3.24Å; H554-F604 AromaticContact CD2-CE1 3.73Å; H554-F604 AromaticContact CG-CD1 3.89Å; H554-F604 AromaticContact CG-CE1 3.84Å; H554-F604 AromaticContact NE2-CD1 3.75Å; H554-F604 AromaticContact NE2-CE1 3.89Å; R593-F604 WeakPolarHBondContact CA-O 3.25Å; H594-F604 HydrophobicContact CB-CB 4.29Å; H594-F604 PolarHBondContact N-O 3.07Å; H594-F604 WeakPolarHBondContact O-CD2 3.23Å; D595-F604 PolarHBondContact OD1-N 2.65Å; A599-F604 HydrophobicContact CB-CE2 3.66Å; A599-F604 HydrophobicContact CB-CZ 3.94Å; T602-F604 HydrophobicContact CG2-CD2 4.34Å; T602-F604 HydrophobicContact CG2-CE1 4.03Å; T602-F604 HydrophobicContact CG2-CE2 3.75Å; T602-F604 HydrophobicContact CG2-CZ 3.57Å; T602-F604 WeakPolarHBondContact O-CE2 3.47Å
605	I	92.3	Very high	85.3	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	137.1	162.4	58.5	167.6	0	0	0	109.3	E552 F553 W570 L583 V585 F591 M592 Y618	E552-I605 WeakPolarHBondContact CA-O 3.32Å; F553-I605 HydrophobicContact CB-CD1 4.4Å; F553-I605 HydrophobicContact CB-CG1 3.95Å; F553-I605 HydrophobicContact CD2-CD1 4.45Å; F553-I605 PolarHBondContact N-O 2.87Å; F553-I605 PolarHBondContact O-N 2.81Å; W570-I605 HydrophobicContact CD2-CD1 3.73Å; W570-I605 HydrophobicContact CD2-CG1 4.11Å; W570-I605 HydrophobicContact CD2-CG2 4.01Å; W570-I605 HydrophobicContact CE3-CD1 3.47Å; W570-I605 VanDerWaalsContact CE3-CD1 3.47Å; W570-I605 HydrophobicContact CE3-CG1 4.15Å; W570-I605 HydrophobicContact CG-CD1 4.37Å; W570-I605 HydrophobicContact CG-CG2 3.93Å; W570-I605 HydrophobicContact CH2-CD1 3.98Å; W570-I605 HydrophobicContact CH2-CG1 3.85Å; W570-I605 HydrophobicContact CZ2-CD1 4.24Å; W570-I605 HydrophobicContact CZ2-CG1 3.83Å; W570-I605 HydrophobicContact CZ2-CG2 4.34Å; W570-I605 HydrophobicContact CZ3-CD1 3.61Å; W570-I605 HydrophobicContact CZ3-CG1 4.03Å; L583-I605 HydrophobicContact CD2-CD1 3.53Å; L583-I605 HydrophobicContact CD2-CG2 4.42Å; V585-I605 HydrophobicContact CG1-CG2 4.31Å; F591-I605 HydrophobicContact CD1-CB 4.21Å; F591-I605 HydrophobicContact CD1-CD1 4.09Å; F591-I605 HydrophobicContact CD1-CG1 4.32Å; F591-I605 HydrophobicContact CE1-CD1 4.48Å; M592-I605 WeakPolarHBondContact O-CA 3.47Å; I605-Y618 HydrophobicContact CD1-CD1 3.78Å; I605-Y618 HydrophobicContact CD1-CE1 4.41Å
606	S	91.2	Very high	85.7	Confident	17 Å²	17	55.4 Å²	55.4	12%	0.119	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	157.8	176.6	70.5	0	0	0	0	111.1	V551 F591 M592	V551-S606 CarbonylContact O-C 3.58Å; V551-S606 VanDerWaalsContact O-CA 3.24Å; V551-S606 WeakPolarHBondContact O-CA 3.26Å; F591-S606 CarbonylContact C-O 3.57Å; F591-S606 VanDerWaalsContact CA-O 3.3Å; F591-S606 WeakPolarHBondContact CA-O 3.5Å; M592-S606 PolarHBondContact N-O 2.82Å; M592-S606 PolarHBondContact O-N 3.45Å
607	K	90.7	Very high	86.5	Confident	9 Å²	9	52.7 Å²	52.7	4%	0.039	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	125.8	170.6	178.4	167.7	-160	-176.4	0	109.3	A550 V551 D589 G590 F591 R609 R611 D614	A550-K607 CarbonylContact C-O 3.57Å; A550-K607 VanDerWaalsContact CA-O 3.22Å; A550-K607 WeakPolarHBondContact CA-O 3.5Å; V551-K607 HydrophobicContact CG1-CB 3.85Å; V551-K607 PolarHBondContact N-O 2.91Å; V551-K607 PolarHBondContact O-N 2.85Å; D589-K607 WeakPolarHBondContact O-CE 3.29Å; D589-K607 PolarHBondContact O-NZ 2.89Å; G590-K607 VanDerWaalsContact O-CD 3.32Å; G590-K607 WeakPolarHBondContact O-CD 3.44Å; G590-K607 VanDerWaalsContact O-CE 3.26Å; G590-K607 WeakPolarHBondContact O-CE 3.46Å; G590-K607 VanDerWaalsContact O-CG 3.24Å; G590-K607 WeakPolarHBondContact O-CG 3.46Å; F591-K607 HydrophobicContact CD1-CB 3.85Å; F591-K607 HydrophobicContact CD2-CB 4.04Å; F591-K607 HydrophobicContact CD2-CD 3.85Å; F591-K607 HydrophobicContact CE1-CB 3.79Å; F591-K607 HydrophobicContact CE2-CB 3.95Å; F591-K607 HydrophobicContact CE2-CD 3.59Å; F591-K607 HydrophobicContact CE2-CG 4.41Å; F591-K607 HydrophobicContact CG-CB 3.98Å; F591-K607 HydrophobicContact CZ-CB 3.83Å; F591-K607 HydrophobicContact CZ-CD 4.17Å; K607-R609 VanDerWaalsContact C-N 3.26Å; K607-R609 WeakPolarHBondContact CD-O 3.22Å; K607-R609 WeakPolarHBondContact CE-O 3.43Å; K607-R609 WeakPolarHBondContact CG-O 3.37Å; K607-R609 PolarHBondContact O-N 2.9Å; K607-R611 VanDerWaalsContact NZ-CZ 3.28Å; K607-D614 IonicContact NZ-OD1 3.31Å; K607-D614 PolarHBondContact NZ-OD1 3.28Å; K607-D614 IonicContact NZ-OD2 2.83Å; K607-D614 PolarHBondContact NZ-OD2 3.45Å
608	A	84.9	Confident	87.2	Confident	68 Å²	68	47.2 Å²	47.2	56%	0.562	25%	0.254	S	S	*	.	S	Bend	trans	-71.5	-16.5	-174.7	0	0	0	0	0	114.6
609	R	84.2	Confident	87.8	Confident	189 Å²	189	41.3 Å²	41.3	71%	0.713	22%	0.218	S	C	*	.	S	Bend	trans	-147.9	101.7	177.8	-72.9	-173.3	155.4	-167.9	-10.3	110.5	E549 K607	E549-R609 CarbonylContact O-C 3.57Å; E549-R609 VanDerWaalsContact O-CA 3.3Å; E549-R609 WeakPolarHBondContact O-CA 3.42Å; K607-R609 VanDerWaalsContact C-N 3.26Å; K607-R609 WeakPolarHBondContact CD-O 3.22Å; K607-R609 WeakPolarHBondContact CE-O 3.43Å; K607-R609 WeakPolarHBondContact CG-O 3.37Å; K607-R609 PolarHBondContact O-N 2.9Å
610	A	84.5	Confident	88.3	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.008	21%	0.208	C	C	.	.			trans	-68.6	149.6	171	0	0	0	0	0	111.2	V545 G548 E549 V551 V635	V545-A610 HydrophobicContact CG2-CB 3.58Å; G548-A610 PolarHBondContact N-O 2.8Å; E549-A610 PolarHBondContact O-N 2.85Å; V551-A610 HydrophobicContact CG1-CB 4.24Å; A610-V635 HydrophobicContact CB-CG1 4.2Å; A610-V635 HydrophobicContact CB-CG2 4.1Å
611	R	85.5	Confident	88.8	Confident	107 Å²	107	38.1 Å²	38.1	40%	0.404	20%	0.197	S	C	.	.			trans	-130.4	157.8	174.2	-51.6	165.5	-63.3	-166.4	4.8	109.9	E547 K607 A613 D614	E547-R611 WeakPolarHBondContact OE1-CA 3.43Å; K607-R611 VanDerWaalsContact NZ-CZ 3.28Å; R611-A613 PolarHBondContact O-N 3.1Å; R611-A613 VanDerWaalsContact O-N 3.08Å; R611-D614 VanDerWaalsContact CB-OD2 3.28Å; R611-D614 WeakPolarHBondContact CB-OD2 3.26Å; R611-D614 WeakPolarHBondContact CG-OD2 3.33Å; R611-D614 IonicContact CZ-OD1 3.52Å; R611-D614 IonicContact CZ-OD2 2.89Å; R611-D614 PolarHBondContact N-OD2 3.1Å; R611-D614 IonicContact NE-OD1 3.08Å; R611-D614 IonicContact NE-OD2 3.42Å; R611-D614 PolarHBondContact NE-OD2 3.06Å; R611-D614 IonicContact NH2-OD1 3.44Å; R611-D614 PolarHBondContact NH2-OD1 3.21Å; R611-D614 IonicContact NH2-OD2 3.62Å; R611-D614 WeakPolarHBondContact O-CB 3.31Å; R611-D614 PolarHBondContact O-N 3.32Å
612	V	78.3	Confident	89	Confident	73 Å²	73	35.1 Å²	35.1	44%	0.442	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-55.7	-29.8	175.1	175	0	0	0	0	112.2	E547 D614 Q615 A637	E547-V612 PolarHBondContact OE1-N 3.24Å; V612-D614 VanDerWaalsContact C-N 3.27Å; V612-D614 PolarHBondContact O-N 3.06Å; V612-Q615 VanDerWaalsContact O-CB 3.32Å; V612-Q615 WeakPolarHBondContact O-CB 3.49Å; V612-Q615 PolarHBondContact O-N 3.24Å; V612-A637 HydrophobicContact CG2-CB 4.02Å
613	A	83.4	Confident	88.8	Confident	78 Å²	78	37 Å²	37	65%	0.645	20%	0.195	S	C	*	.	G	3₁₀ helix	trans	-71	-15.7	175.1	0	0	0	0	0	115	Y572 R611 Q615	Y572-A613 PolarHBondContact OH-O 2.79Å; Y572-A613 VanDerWaalsContact OH-O 3.05Å; R611-A613 PolarHBondContact O-N 3.1Å; R611-A613 VanDerWaalsContact O-N 3.08Å; A613-Q615 VanDerWaalsContact C-N 3.35Å
614	D	87.4	Confident	88.5	Confident	14 Å²	14	40.5 Å²	40.5	8%	0.075	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-90	1.3	176.4	-52.9	-57.6	0	0	0	112	Y572 K607 R611 V612 G616 Y618	Y572-D614 VanDerWaalsContact OH-C 3.27Å; Y572-D614 PolarHBondContact OH-O 2.7Å; K607-D614 IonicContact NZ-OD1 3.31Å; K607-D614 PolarHBondContact NZ-OD1 3.28Å; K607-D614 IonicContact NZ-OD2 2.83Å; K607-D614 PolarHBondContact NZ-OD2 3.45Å; R611-D614 VanDerWaalsContact CB-OD2 3.28Å; R611-D614 WeakPolarHBondContact CB-OD2 3.26Å; R611-D614 WeakPolarHBondContact CG-OD2 3.33Å; R611-D614 IonicContact CZ-OD1 3.52Å; R611-D614 IonicContact CZ-OD2 2.89Å; R611-D614 PolarHBondContact N-OD2 3.1Å; R611-D614 IonicContact NE-OD1 3.08Å; R611-D614 IonicContact NE-OD2 3.42Å; R611-D614 PolarHBondContact NE-OD2 3.06Å; R611-D614 IonicContact NH2-OD1 3.44Å; R611-D614 PolarHBondContact NH2-OD1 3.21Å; R611-D614 IonicContact NH2-OD2 3.62Å; R611-D614 WeakPolarHBondContact O-CB 3.31Å; R611-D614 PolarHBondContact O-N 3.32Å; V612-D614 VanDerWaalsContact C-N 3.27Å; V612-D614 PolarHBondContact O-N 3.06Å; D614-G616 PolarHBondContact O-N 2.85Å; D614-Y618 PolarHBondContact O-OH 3.28Å; D614-Y618 VanDerWaalsContact O-OH 3.09Å
615	Q	89.1	Confident	88	Confident	43 Å²	43	43.5 Å²	43.5	20%	0.201	23%	0.234	C	C	.	.			trans	-70.9	119.7	179.5	170.3	158.2	-50.5	0	0	113	Y572 F575 V612 A613 L633 V635	Y572-Q615 PolarHBondContact OH-O 3.09Å; F575-Q615 HydrophobicContact CD2-CG 3.55Å; F575-Q615 HydrophobicContact CE2-CG 3.49Å; F575-Q615 VanDerWaalsContact CE2-CG 3.49Å; V612-Q615 VanDerWaalsContact O-CB 3.32Å; V612-Q615 WeakPolarHBondContact O-CB 3.49Å; V612-Q615 PolarHBondContact O-N 3.24Å; A613-Q615 VanDerWaalsContact C-N 3.35Å; Q615-L633 WeakPolarHBondContact CG-O 3.43Å; Q615-V635 HydrophobicContact CB-CG2 4.39Å; Q615-V635 PolarHBondContact OE1-O 2.86Å
616	G	89.9	Confident	87.5	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	169.3	-155.6	178	0	0	0	0	0	115	D614 L633	D614-G616 PolarHBondContact O-N 2.85Å; G616-L633 PolarHBondContact N-O 2.79Å; G616-L633 VanDerWaalsContact N-O 3.13Å; G616-L633 PolarHBondContact O-N 3.04Å
617	E	93	Very high	87.2	Confident	27 Å²	27	50.8 Å²	50.8	13%	0.126	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	127.5	-177.8	-63.3	-173.1	136.5	0	0	111	Y572 R573 F575 V630 G631 K632	Y572-E617 CarbonylContact C-O 3.55Å; Y572-E617 WeakPolarHBondContact CA-O 3.4Å; R573-E617 HydrophobicContact CB-CB 4.4Å; R573-E617 IonicContact CZ-OE2 2.83Å; R573-E617 PolarHBondContact N-O 2.74Å; R573-E617 IonicContact NE-OE2 3.62Å; R573-E617 PolarHBondContact NE-OE2 3.08Å; R573-E617 IonicContact NH2-OE2 3.57Å; R573-E617 PolarHBondContact NH2-OE2 2.79Å; R573-E617 PolarHBondContact O-N 2.96Å; F575-E617 HydrophobicContact CD1-CG 3.73Å; F575-E617 HydrophobicContact CE1-CG 3.52Å; E617-V630 HydrophobicContact CB-CG1 3.76Å; E617-V630 HydrophobicContact CG-CG1 4.11Å; E617-G631 WeakPolarHBondContact CA-O 3.35Å; E617-K632 HydrophobicContact CG-CG 4.35Å; E617-K632 WeakPolarHBondContact OE1-CE 3.36Å; E617-K632 IonicContact OE1-NZ 3.56Å; E617-K632 PolarHBondContact OE1-NZ 2.79Å
618	Y	93.9	Very high	87.3	Confident	3 Å²	3	54.4 Å²	54.4	1%	0.012	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	109.3	179.1	-73.9	-99.2	0	0	0	108.4	F553 Y572 L583 F591 I605 D614 V630 G631 L633	F553-Y618 HydrophobicContact CD2-CG 4.29Å; F553-Y618 AromaticContact CE2-CD2 3.93Å; F553-Y618 HydrophobicContact CE2-CD2 3.93Å; F553-Y618 HydrophobicContact CE2-CE2 4.45Å; F553-Y618 HydrophobicContact CE2-CG 4.02Å; F553-Y618 HydrophobicContact CZ-CD2 4.41Å; Y572-Y618 HydrophobicContact CD2-CD2 4.31Å; Y572-Y618 HydrophobicContact CD2-CE1 4.19Å; Y572-Y618 AromaticContact CD2-CE2 3.84Å; Y572-Y618 HydrophobicContact CD2-CE2 3.84Å; Y572-Y618 AromaticContact CD2-CZ 3.77Å; Y572-Y618 AromaticContact CE2-CE2 3.85Å; Y572-Y618 HydrophobicContact CE2-CE2 3.85Å; Y572-Y618 AromaticContact CE2-CZ 3.93Å; L583-Y618 HydrophobicContact CD1-CE1 4.11Å; L583-Y618 HydrophobicContact CD2-CD1 4.19Å; L583-Y618 HydrophobicContact CD2-CE1 4.21Å; F591-Y618 HydrophobicContact CD1-CE1 4.33Å; F591-Y618 HydrophobicContact CD2-CE1 4.16Å; F591-Y618 AromaticContact CE1-CE1 3.86Å; F591-Y618 HydrophobicContact CE1-CE1 3.86Å; F591-Y618 AromaticContact CE2-CE1 3.71Å; F591-Y618 HydrophobicContact CE2-CE1 3.71Å; F591-Y618 AromaticContact CE2-CZ 3.7Å; F591-Y618 WeakPolarHBondContact CE2-OH 3.15Å; F591-Y618 HydrophobicContact CG-CE1 4.47Å; F591-Y618 AromaticContact CZ-CE1 3.54Å; F591-Y618 HydrophobicContact CZ-CE1 3.54Å; F591-Y618 AromaticContact CZ-CZ 3.51Å; F591-Y618 WeakPolarHBondContact CZ-OH 3.32Å; I605-Y618 HydrophobicContact CD1-CD1 3.78Å; I605-Y618 HydrophobicContact CD1-CE1 4.41Å; D614-Y618 PolarHBondContact O-OH 3.28Å; D614-Y618 VanDerWaalsContact O-OH 3.09Å; Y618-V630 WeakPolarHBondContact O-CA 3.24Å; Y618-G631 PolarHBondContact N-O 3.3Å; Y618-G631 PolarHBondContact O-N 2.91Å; Y618-L633 HydrophobicContact CD2-CB 4.03Å; Y618-L633 HydrophobicContact CE2-CB 3.73Å; Y618-L633 HydrophobicContact CE2-CD2 3.92Å; Y618-L633 HydrophobicContact CE2-CG 4.48Å
619	I	94.3	Very high	87.5	Confident	7 Å²	7	52.9 Å²	52.9	4%	0.036	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	116.1	-175.3	-45.7	93	0	0	0	109	W570 Y571 R573 E628 I629 V630	W570-I619 WeakPolarHBondContact CA-O 3.34Å; Y571-I619 PolarHBondContact N-O 3.47Å; Y571-I619 PolarHBondContact O-N 3.27Å; R573-I619 HydrophobicContact CB-CD1 4.09Å; I619-E628 HydrophobicContact CG2-CB 3.91Å; I619-E628 HydrophobicContact CG2-CG 4.32Å; I619-I629 CarbonylContact C-O 3.56Å; I619-I629 WeakPolarHBondContact CA-O 3.25Å; I619-V630 HydrophobicContact CG1-CG1 4.49Å; I619-V630 HydrophobicContact CG1-CG2 3.95Å; I619-V630 HydrophobicContact CG2-CG2 4.2Å
620	C	93.5	Very high	87.8	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	136.1	167.5	-178.9	0	0	0	0	109.6	C555 E569 W570 E628 I629	C555-C620 HydrophobicContact CB-CB 3.59Å; C555-C620 WeakPolarHBondContact CB-SG 3.13Å; C555-C620 WeakPolarHBondContact SG-CB 3.4Å; C555-C620 CovalentContact SG-SG 2.02Å; C555-C620 PolarHBondContact SG-SG 2.87Å; E569-C620 CarbonylContact O-C 3.53Å; E569-C620 WeakPolarHBondContact O-CA 3.31Å; W570-C620 HydrophobicContact CD2-CB 4.27Å; W570-C620 HydrophobicContact CE3-CB 3.94Å; W570-C620 HydrophobicContact CH2-CB 4.05Å; W570-C620 HydrophobicContact CZ2-CB 4.34Å; W570-C620 HydrophobicContact CZ3-CB 3.83Å; C620-E628 CarbonylContact O-C 3.54Å; C620-E628 WeakPolarHBondContact O-CA 3.47Å; C620-I629 HydrophobicContact CB-CG2 4.02Å; C620-I629 PolarHBondContact N-O 3Å; C620-I629 PolarHBondContact O-N 2.94Å
621	R	93	Very high	88	Confident	44 Å²	44	46.4 Å²	46.4	17%	0.166	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	138	-173	179.9	171.6	-169	-102.7	-6.2	111.4	L568 E569 Y571 P623 N626 E627 E628	L568-R621 WeakPolarHBondContact CA-O 3.34Å; E569-R621 HydrophobicContact CB-CB 4.29Å; E569-R621 PolarHBondContact N-O 2.88Å; E569-R621 PolarHBondContact O-N 3.43Å; E569-R621 IonicContact OE2-NH1 2.68Å; E569-R621 PolarHBondContact OE2-NH1 2.92Å; Y571-R621 HydrophobicContact CD2-CB 4.35Å; Y571-R621 HydrophobicContact CE2-CB 4.19Å; R621-P623 WeakPolarHBondContact O-CD 3.29Å; R621-N626 PolarHBondContact NH2-OD1 3.49Å; R621-E627 WeakPolarHBondContact CA-O 3.42Å; R621-E628 HydrophobicContact CB-CG 3.9Å; R621-E628 VanDerWaalsContact CD-OE1 3.29Å; R621-E628 WeakPolarHBondContact CD-OE1 3.43Å; R621-E628 HydrophobicContact CG-CG 3.64Å; R621-E628 IonicContact NE-OE1 2.86Å; R621-E628 PolarHBondContact NE-OE1 2.98Å
622	L	89.7	Confident	88.1	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	101.3	173.8	-179.9	58.5	0	0	0	109.8	L536 V557 M560 I564 L568 S624 Q625 N626 E627	L536-L622 HydrophobicContact CD1-CB 3.94Å; L536-L622 HydrophobicContact CD2-CB 4.17Å; L536-L622 HydrophobicContact CG-CB 4.21Å; V557-L622 HydrophobicContact CG1-CD2 4.13Å; V557-L622 HydrophobicContact CG2-CD1 4.33Å; V557-L622 HydrophobicContact CG2-CD2 4.1Å; M560-L622 HydrophobicContact SD-CD2 3.84Å; I564-L622 HydrophobicContact CG2-CD1 4.11Å; L568-L622 HydrophobicContact CD2-CB 4.13Å; L568-L622 HydrophobicContact CD2-CD1 4.04Å; L622-S624 WeakPolarHBondContact CD1-OG 3.47Å; L622-S624 WeakPolarHBondContact CG-OG 3.3Å; L622-S624 PolarHBondContact O-N 3.47Å; L622-Q625 HydrophobicContact CD2-CB 4.32Å; L622-Q625 HydrophobicContact CD2-CG 4.32Å; L622-Q625 PolarHBondContact O-N 2.95Å; L622-N626 WeakPolarHBondContact O-CA 3.49Å; L622-N626 PolarHBondContact O-N 2.91Å; L622-E627 PolarHBondContact N-O 3.28Å
623	P	85.3	Confident	88.6	Confident	60 Å²	60	41.9 Å²	41.9	39%	0.39	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-23.4	-170.9	-24.8	36	0	0	0	115	Q567 E569 R621	Q567-P623 WeakPolarHBondContact O-CD 3.21Å; E569-P623 HydrophobicContact CG-CG 3.72Å; R621-P623 WeakPolarHBondContact O-CD 3.29Å
624	S	83.9	Confident	88.8	Confident	74 Å²	74	41.8 Å²	41.8	52%	0.517	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-33.4	-177.8	51.4	0	0	0	0	113.8	L622	L622-S624 WeakPolarHBondContact CD1-OG 3.47Å; L622-S624 WeakPolarHBondContact CG-OG 3.3Å; L622-S624 PolarHBondContact O-N 3.47Å
625	Q	79.2	Confident	88.5	Confident	99 Å²	99	41.5 Å²	41.5	46%	0.463	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.5	-9.9	177.1	-65.1	-179.2	-79.7	0	0	112.7	M560 L622 E627	M560-Q625 PolarHBondContact SD-OE1 2.83Å; L622-Q625 HydrophobicContact CD2-CB 4.32Å; L622-Q625 HydrophobicContact CD2-CG 4.32Å; L622-Q625 PolarHBondContact O-N 2.95Å; Q625-E627 HydrophobicContact CB-CG 4.12Å; Q625-E627 PolarHBondContact O-N 3.46Å
626	N	83.7	Confident	87.4	Confident	100 Å²	100	46.4 Å²	46.4	54%	0.535	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.4	38.4	-170.9	-166.3	82.9	0	0	0	112.6	R621 L622	R621-N626 PolarHBondContact NH2-OD1 3.49Å; L622-N626 WeakPolarHBondContact O-CA 3.49Å; L622-N626 PolarHBondContact O-N 2.91Å
627	E	84.2	Confident	86	Confident	71 Å²	71	49.5 Å²	49.5	33%	0.332	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	145.8	166.5	-64.3	-166.5	170.2	0	0	110.5	G535 L536 R621 L622 Q625	G535-E627 WeakPolarHBondContact CA-OE2 3.5Å; L536-E627 HydrophobicContact CD1-CB 3.73Å; L536-E627 WeakPolarHBondContact CD1-O 3.23Å; L536-E627 HydrophobicContact CG-CB 4.26Å; L536-E627 PolarHBondContact N-OE2 3.21Å; L536-E627 VanDerWaalsContact N-OE2 3.16Å; R621-E627 WeakPolarHBondContact CA-O 3.42Å; L622-E627 PolarHBondContact N-O 3.28Å; Q625-E627 HydrophobicContact CB-CG 4.12Å; Q625-E627 PolarHBondContact O-N 3.46Å
628	E	91.6	Very high	84.2	Confident	84 Å²	84	50.7 Å²	50.7	39%	0.393	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	132.9	175.8	-71	-177.3	-159.7	0	0	108.2	R580 I619 C620 R621	R580-E628 IonicContact NH1-OE1 3.88Å; R580-E628 PolarHBondContact NH1-OE1 3.04Å; R580-E628 VanDerWaalsContact NH1-OE1 3.08Å; R580-E628 IonicContact NH1-OE2 3.07Å; R580-E628 PolarHBondContact NH1-OE2 3.43Å; R580-E628 VanDerWaalsContact NH1-OE2 3.17Å; I619-E628 HydrophobicContact CG2-CB 3.91Å; I619-E628 HydrophobicContact CG2-CG 4.32Å; C620-E628 CarbonylContact O-C 3.54Å; C620-E628 WeakPolarHBondContact O-CA 3.47Å; R621-E628 HydrophobicContact CB-CG 3.9Å; R621-E628 VanDerWaalsContact CD-OE1 3.29Å; R621-E628 WeakPolarHBondContact CD-OE1 3.43Å; R621-E628 HydrophobicContact CG-CG 3.64Å; R621-E628 IonicContact NE-OE1 2.86Å; R621-E628 PolarHBondContact NE-OE1 2.98Å
629	I	89.4	Confident	82.3	Confident	37 Å²	37	56.7 Å²	56.7	19%	0.19	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	147.7	172.6	-166.8	162.7	0	0	0	110.6	L536 I538 I619 C620	L536-I629 HydrophobicContact CB-CB 3.99Å; L536-I629 HydrophobicContact CB-CG2 3.72Å; L536-I629 HydrophobicContact CD1-CG2 4.22Å; L536-I629 HydrophobicContact CG-CG2 4.48Å; L536-I629 VanDerWaalsContact O-CD1 3.27Å; L536-I629 WeakPolarHBondContact O-CD1 3.33Å; I538-I629 HydrophobicContact CB-CD1 4.46Å; I538-I629 HydrophobicContact CB-CG1 4.41Å; I538-I629 HydrophobicContact CB-CG2 3.94Å; I538-I629 HydrophobicContact CG2-CD1 4Å; I538-I629 HydrophobicContact CG2-CG1 3.8Å; I538-I629 HydrophobicContact CG2-CG2 4.2Å; I619-I629 CarbonylContact C-O 3.56Å; I619-I629 WeakPolarHBondContact CA-O 3.25Å; C620-I629 HydrophobicContact CB-CG2 4.02Å; C620-I629 PolarHBondContact N-O 3Å; C620-I629 PolarHBondContact O-N 2.94Å
630	V	91.8	Very high	80.4	Confident	53 Å²	53	58.5 Å²	58.5	32%	0.321	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	124.8	-171.2	-175.1	0	0	0	0	111.1	E617 Y618 I619	E617-V630 HydrophobicContact CB-CG1 3.76Å; E617-V630 HydrophobicContact CG-CG1 4.11Å; Y618-V630 WeakPolarHBondContact O-CA 3.24Å; I619-V630 HydrophobicContact CG1-CG1 4.49Å; I619-V630 HydrophobicContact CG1-CG2 3.95Å; I619-V630 HydrophobicContact CG2-CG2 4.2Å
631	G	87	Confident	79.4	Confident	0 Å²	0	61 Å²	61	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	151.7	161.6	0	0	0	0	0	110.4	K541 E617 Y618	K541-G631 WeakPolarHBondContact O-CA 3.3Å; E617-G631 WeakPolarHBondContact CA-O 3.35Å; Y618-G631 PolarHBondContact N-O 3.3Å; Y618-G631 PolarHBondContact O-N 2.91Å
632	K	89.4	Confident	78.9	Confident	85 Å²	85	62.2 Å²	62.2	37%	0.37	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	134.2	178.1	-61.5	-165.5	174.9	-166.2	0	110.8	K541 S542 D543 F575 E617 F634	K541-K632 PolarHBondContact O-N 2.78Å; S542-K632 CarbonylContact C-O 3.58Å; S542-K632 VanDerWaalsContact CA-O 3.29Å; S542-K632 WeakPolarHBondContact CA-O 3.48Å; D543-K632 PolarHBondContact N-O 3.24Å; F575-K632 HydrophobicContact CE1-CB 4.31Å; F575-K632 HydrophobicContact CE1-CD 4.14Å; F575-K632 HydrophobicContact CE1-CG 4.27Å; F575-K632 HydrophobicContact CZ-CB 4.14Å; E617-K632 HydrophobicContact CG-CG 4.35Å; E617-K632 WeakPolarHBondContact OE1-CE 3.36Å; E617-K632 IonicContact OE1-NZ 3.56Å; E617-K632 PolarHBondContact OE1-NZ 2.79Å; K632-F634 HydrophobicContact CB-CE2 4.11Å
633	L	88.3	Confident	78.9	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	120.4	172.7	-178.5	56.3	0	0	0	109.7	D543 V545 V551 F553 F575 F591 Q615 G616 Y618 V635	D543-L633 HydrophobicContact CB-CD1 4.13Å; V545-L633 HydrophobicContact CG1-CD1 4.48Å; V545-L633 HydrophobicContact CG2-CD1 3.9Å; V551-L633 HydrophobicContact CB-CD1 4.36Å; V551-L633 HydrophobicContact CG1-CD2 4.15Å; V551-L633 HydrophobicContact CG2-CD1 3.69Å; V551-L633 HydrophobicContact CG2-CD2 4.1Å; F553-L633 HydrophobicContact CE2-CB 4.2Å; F553-L633 HydrophobicContact CZ-CB 4.04Å; F575-L633 WeakPolarHBondContact CE2-O 3.07Å; F591-L633 HydrophobicContact CZ-CD2 4.29Å; Q615-L633 WeakPolarHBondContact CG-O 3.43Å; G616-L633 PolarHBondContact N-O 2.79Å; G616-L633 VanDerWaalsContact N-O 3.13Å; G616-L633 PolarHBondContact O-N 3.04Å; Y618-L633 HydrophobicContact CD2-CB 4.03Å; Y618-L633 HydrophobicContact CE2-CB 3.73Å; Y618-L633 HydrophobicContact CE2-CD2 3.92Å; Y618-L633 HydrophobicContact CE2-CG 4.48Å; L633-V635 HydrophobicContact CD1-CG2 4.33Å; L633-V635 HydrophobicContact CD2-CG2 4.1Å; L633-V635 HydrophobicContact CG-CG2 3.88Å
634	F	88.1	Confident	79	Confident	76 Å²	76	61.4 Å²	61.4	33%	0.333	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	136.9	164.7	-58.5	-87.6	0	0	0	108.7	D543 T544 V545 F575 K632	D543-F634 WeakPolarHBondContact O-CD2 3.46Å; D543-F634 PolarHBondContact O-N 2.96Å; T544-F634 WeakPolarHBondContact CA-O 3.28Å; T544-F634 HydrophobicContact CG2-CB 4.08Å; V545-F634 PolarHBondContact N-O 2.86Å; V545-F634 VanDerWaalsContact N-O 3.1Å; F575-F634 HydrophobicContact CD2-CE1 4.34Å; F575-F634 AromaticContact CE2-CD1 3.6Å; F575-F634 HydrophobicContact CE2-CD1 3.6Å; F575-F634 AromaticContact CE2-CE1 3.48Å; F575-F634 HydrophobicContact CE2-CE1 3.48Å; F575-F634 VanDerWaalsContact CE2-CE1 3.48Å; F575-F634 HydrophobicContact CE2-CG 4.3Å; F575-F634 HydrophobicContact CE2-CZ 4.09Å; F575-F634 HydrophobicContact CZ-CD1 4.08Å; F575-F634 AromaticContact CZ-CE1 3.69Å; F575-F634 HydrophobicContact CZ-CE1 3.69Å; F575-F634 HydrophobicContact CZ-CE2 4.28Å; F575-F634 AromaticContact CZ-CZ 3.8Å; F575-F634 HydrophobicContact CZ-CZ 3.8Å; K632-F634 HydrophobicContact CB-CE2 4.11Å
635	V	79.9	Confident	79.3	Confident	8 Å²	8	58 Å²	58	5%	0.048	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	113.5	178.2	-173.3	0	0	0	0	108.7	V545 E547 A610 Q615 L633	V545-V635 HydrophobicContact CG2-CG1 4.45Å; V545-V635 HydrophobicContact CG2-CG2 4.13Å; V545-V635 WeakPolarHBondContact O-CA 3.47Å; E547-V635 HydrophobicContact CB-CG1 3.92Å; A610-V635 HydrophobicContact CB-CG1 4.2Å; A610-V635 HydrophobicContact CB-CG2 4.1Å; Q615-V635 HydrophobicContact CB-CG2 4.39Å; Q615-V635 PolarHBondContact OE1-O 2.86Å; L633-V635 HydrophobicContact CD1-CG2 4.33Å; L633-V635 HydrophobicContact CD2-CG2 4.1Å; L633-V635 HydrophobicContact CG-CG2 3.88Å
636	R	67	Low	79.2	Confident	147 Å²	147	56.6 Å²	56.6	56%	0.555	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.5	129.1	173.7	-65.7	163.4	178.1	159.2	6.7	108.6	T544 V545 D546 E547 V638	T544-R636 HydrophobicContact CG2-CG 4.26Å; V545-R636 PolarHBondContact O-N 3.1Å; D546-R636 WeakPolarHBondContact OD1-CD 3.47Å; D546-R636 IonicContact OD1-NH1 3.12Å; D546-R636 PolarHBondContact OD1-NH1 2.86Å; E547-R636 VanDerWaalsContact CB-O 3.3Å; E547-R636 WeakPolarHBondContact CB-O 3.22Å; E547-R636 PolarHBondContact N-O 2.91Å; R636-V638 PolarHBondContact O-N 2.7Å
637	A	59.7	Low	79	Confident	64 Å²	64	54.2 Å²	54.2	53%	0.529	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-63.9	121.3	173.5	0	0	0	0	0	109.8	V612	V612-A637 HydrophobicContact CG2-CB 4.02Å
638	V	55.2	Low	78.6	Confident	52 Å²	52	57 Å²	57	32%	0.315	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-91.8	123.8	-178.1	166	0	0	0	0	109.6	D546 E547 R636	D546-V638 VanDerWaalsContact C-CG2 3.5Å; D546-V638 HydrophobicContact CB-CG2 3.28Å; E547-V638 HydrophobicContact CB-CB 4.23Å; E547-V638 HydrophobicContact CB-CG2 4.26Å; E547-V638 WeakPolarHBondContact O-CB 3.39Å; E547-V638 WeakPolarHBondContact O-CG2 3.49Å; R636-V638 PolarHBondContact O-N 2.7Å
639	R	53.1	Low	78	Confident	130 Å²	130	61.3 Å²	61.3	49%	0.491	30%	0.303	S	S	.	.			trans	49.5	70.3	172.9	-69.3	176.3	162.3	155.6	0.2	112.2	Y641 D668	R639-Y641 PolarHBondContact O-N 3.37Å; R639-Y641 VanDerWaalsContact O-N 3.07Å; R639-D668 IonicContact CZ-OD2 3.05Å; R639-D668 IonicContact NE-OD2 3.06Å; R639-D668 PolarHBondContact NE-OD2 3.47Å; R639-D668 IonicContact NH2-OD2 3.17Å; R639-D668 PolarHBondContact NH2-OD2 2.89Å
640	S	56.3	Low	77.3	Confident	44 Å²	44	61.4 Å²	61.4	31%	0.308	30%	0.304	S	S	.	.			trans	-46	119.1	154.6	-8.9	0	0	0	0	108.4	V642 E667	S640-V642 PolarHBondContact O-N 3.02Å; S640-E667 VanDerWaalsContact CB-OE1 3.28Å; S640-E667 WeakPolarHBondContact CB-OE1 3.44Å; S640-E667 WeakPolarHBondContact O-CG 3.45Å; S640-E667 PolarHBondContact OG-OE1 2.79Å
641	Y	72.1	Confident	76.5	Confident	53 Å²	53	62 Å²	62	21%	0.208	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	125.2	173.9	-70.3	-85.9	0	0	0	108.8	R639 L643 A665 A672 F674 E720 P721 S722	R639-Y641 PolarHBondContact O-N 3.37Å; R639-Y641 VanDerWaalsContact O-N 3.07Å; Y641-L643 PolarHBondContact O-N 2.86Å; Y641-A665 CarbonylContact C-O 3.57Å; Y641-A665 WeakPolarHBondContact CA-O 3.34Å; Y641-A672 HydrophobicContact CD1-CB 3.61Å; Y641-A672 HydrophobicContact CE1-CB 3.65Å; Y641-F674 AromaticContact CD1-CE1 3.69Å; Y641-F674 HydrophobicContact CD1-CE1 3.69Å; Y641-F674 HydrophobicContact CD1-CZ 4.1Å; Y641-F674 AromaticContact CD2-CE1 3.6Å; Y641-F674 HydrophobicContact CD2-CE1 3.6Å; Y641-F674 HydrophobicContact CD2-CZ 4.13Å; Y641-F674 AromaticContact CE1-CE1 3.93Å; Y641-F674 HydrophobicContact CE1-CE1 3.93Å; Y641-F674 AromaticContact CE2-CE1 3.84Å; Y641-F674 HydrophobicContact CE2-CE1 3.84Å; Y641-F674 AromaticContact CG-CE1 3.5Å; Y641-F674 HydrophobicContact CG-CE1 3.5Å; Y641-F674 AromaticContact CG-CZ 3.74Å; Y641-F674 HydrophobicContact CG-CZ 3.74Å; Y641-F674 AromaticContact CZ-CE1 3.99Å; Y641-E720 HydrophobicContact CD2-CB 4.17Å; Y641-E720 HydrophobicContact CE2-CB 4.39Å; Y641-P721 PolarHBondContact N-O 2.89Å; Y641-S722 WeakPolarHBondContact O-CA 3.41Å; Y641-S722 WeakPolarHBondContact O-CB 3.4Å
642	V	82.6	Confident	75.5	Confident	69 Å²	69	62 Å²	62	42%	0.418	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	104.8	175	-175.6	0	0	0	0	107.3	S640 A665 E667	S640-V642 PolarHBondContact O-N 3.02Å; V642-A665 PolarHBondContact N-O 2.89Å; V642-A665 PolarHBondContact O-N 3.49Å; V642-E667 HydrophobicContact CG2-CG 4.12Å
643	L	89	Confident	74	Confident	11 Å²	11	63 Å²	63	6%	0.058	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	129.8	165.1	-64.8	174.9	0	0	0	108.2	Y641 A664 F674 P676 C716 A725	Y641-L643 PolarHBondContact O-N 2.86Å; L643-A664 HydrophobicContact CD2-CB 3.81Å; L643-F674 HydrophobicContact CD2-CE2 4.46Å; L643-P676 HydrophobicContact CD2-CB 3.97Å; L643-P676 HydrophobicContact CD2-CG 4.3Å; L643-C716 WeakPolarHBondContact CD1-O 3.45Å; L643-A725 HydrophobicContact CB-CB 3.87Å; L643-A725 WeakPolarHBondContact O-CB 3.45Å
644	T	87.9	Confident	73.1	Confident	33 Å²	33	63.6 Å²	63.6	20%	0.202	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	117	174.3	-58.7	0	0	0	0	108.6	C662 F663	T644-C662 VanDerWaalsContact O-CA 3.27Å; T644-C662 WeakPolarHBondContact O-CA 3.38Å; T644-F663 HydrophobicContact CG2-CE1 3.7Å; T644-F663 HydrophobicContact CG2-CE2 4.32Å; T644-F663 HydrophobicContact CG2-CZ 3.55Å; T644-F663 PolarHBondContact N-O 3.3Å; T644-F663 PolarHBondContact O-N 3.04Å
645	I	90	Very high	72.4	Confident	1 Å²	1	66.8 Å²	66.8	1%	0.005	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	131.4	169.2	-169.4	168.1	0	0	0	109	Q648 F660 E661 F678 V714 C716 A725 A727	I645-Q648 HydrophobicContact CG2-CG 4.49Å; I645-Q648 WeakPolarHBondContact O-CG 3.27Å; I645-F660 HydrophobicContact CD1-CB 4.41Å; I645-F660 HydrophobicContact CD1-CG 4.43Å; I645-F660 HydrophobicContact CG1-CB 4.25Å; I645-F660 HydrophobicContact CG1-CD1 4.35Å; I645-F660 HydrophobicContact CG1-CG 4.5Å; I645-E661 WeakPolarHBondContact CA-O 3.34Å; I645-F678 HydrophobicContact CD1-CD1 4.34Å; I645-F678 HydrophobicContact CD1-CE1 3.78Å; I645-F678 HydrophobicContact CG1-CE1 4.26Å; I645-V714 HydrophobicContact CD1-CB 4.49Å; I645-V714 HydrophobicContact CD1-CG1 4.17Å; I645-C716 HydrophobicContact CB-CB 4.44Å; I645-C716 HydrophobicContact CD1-CB 4.4Å; I645-A725 HydrophobicContact CB-CB 4.31Å; I645-A725 HydrophobicContact CG2-CB 3.92Å; I645-A727 HydrophobicContact CD1-CB 3.64Å; I645-A727 HydrophobicContact CG1-CB 4.03Å; I645-A727 HydrophobicContact CG2-CB 4.06Å
646	T	76.4	Confident	71.8	Confident	71 Å²	71	70.1 Å²	70.1	44%	0.436	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	130.4	-177.1	-61	0	0	0	0	110.1	E661	T646-E661 PolarHBondContact N-O 3.29Å; T646-E661 PolarHBondContact O-N 2.89Å
647	P	79.8	Confident	72.3	Confident	49 Å²	49	66.8 Å²	66.8	32%	0.318	34%	0.337	S	S	.	.	S	Bend	cis	-72.4	158.4	-10.5	30.9	-35.1	0	0	0	112.8	L650 F660 A727	P647-L650 HydrophobicContact CG-CB 4.11Å; P647-L650 HydrophobicContact CG-CD1 3.68Å; P647-L650 HydrophobicContact CG-CG 4.42Å; P647-F660 HydrophobicContact CG-CD1 4.26Å; P647-F660 HydrophobicContact CG-CE1 4.16Å; P647-F660 VanDerWaalsContact O-CD1 3.29Å; P647-F660 WeakPolarHBondContact O-CD1 3.35Å; P647-F660 VanDerWaalsContact O-CE1 3.24Å; P647-F660 WeakPolarHBondContact O-CE1 3.22Å; P647-A727 WeakPolarHBondContact O-CB 3.09Å
648	Q	75.3	Confident	73.3	Confident	129 Å²	129	63.8 Å²	63.8	60%	0.603	31%	0.312	S	S	*	.	S	Bend	trans	-81.9	-23.7	177.6	-68.1	-176.4	-5.6	0	0	113.6	I645 A727 I728	I645-Q648 HydrophobicContact CG2-CG 4.49Å; I645-Q648 WeakPolarHBondContact O-CG 3.27Å; Q648-A727 VanDerWaalsContact O-CA 3.22Å; Q648-A727 WeakPolarHBondContact O-CA 3.41Å; Q648-I728 PolarHBondContact O-N 3.27Å
649	R	79.8	Confident	74.8	Confident	176 Å²	176	65.3 Å²	65.3	66%	0.664	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.3	131.7	167.7	-62.1	-169.6	176.6	-120.7	6.8	107.1	I728	R649-I728 WeakPolarHBondContact CA-O 3.36Å; R649-I728 HydrophobicContact CB-CG2 4.39Å; R649-I728 HydrophobicContact CG-CG2 3.8Å
650	L	74	Confident	76.2	Confident	39 Å²	39	59.1 Å²	59.1	20%	0.204	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	109.1	176.2	-173.2	75.6	0	0	0	109.2	P647 V652 V658 F660 I728 I729 T730	P647-L650 HydrophobicContact CG-CB 4.11Å; P647-L650 HydrophobicContact CG-CD1 3.68Å; P647-L650 HydrophobicContact CG-CG 4.42Å; L650-V652 HydrophobicContact CD1-CG1 4.46Å; L650-V652 HydrophobicContact CD2-CG1 3.56Å; L650-V652 HydrophobicContact CG-CG1 3.64Å; L650-V658 HydrophobicContact CD2-CB 4.17Å; L650-V658 HydrophobicContact CD2-CG1 3.72Å; L650-V658 HydrophobicContact CD2-CG2 3.96Å; L650-F660 HydrophobicContact CB-CE1 3.87Å; L650-F660 HydrophobicContact CB-CZ 3.89Å; L650-F660 HydrophobicContact CD2-CE1 4.34Å; L650-F660 HydrophobicContact CD2-CZ 4.05Å; L650-I728 PolarHBondContact N-O 2.84Å; L650-I729 CarbonylContact O-C 3.5Å; L650-I729 WeakPolarHBondContact O-CA 3.49Å; L650-T730 PolarHBondContact O-N 2.84Å
651	T	75	Confident	77.7	Confident	64 Å²	64	58.6 Å²	58.6	39%	0.393	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	117.1	171.3	-54.2	0	0	0	0	108.8	T730 E732 I734	T651-T730 WeakPolarHBondContact CA-O 3.35Å; T651-T730 WeakPolarHBondContact CA-OG1 3.47Å; T651-T730 PolarHBondContact OG1-OG1 3.38Å; T651-T730 VanDerWaalsContact OG1-OG1 3.12Å; T651-E732 HydrophobicContact CG2-CB 3.7Å; T651-E732 HydrophobicContact CG2-CG 3.91Å; T651-E732 WeakPolarHBondContact CG2-OE1 3.46Å; T651-I734 HydrophobicContact CG2-CD1 4.41Å
652	V	66.6	Low	78.6	Confident	2 Å²	2	56 Å²	56	1%	0.012	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	155.7	178.7	-60.5	0	0	0	0	111.9	L650 Q656 V658 I729 T730 V731 E732	L650-V652 HydrophobicContact CD1-CG1 4.46Å; L650-V652 HydrophobicContact CD2-CG1 3.56Å; L650-V652 HydrophobicContact CG-CG1 3.64Å; V652-Q656 HydrophobicContact CB-CB 4.29Å; V652-V658 HydrophobicContact CB-CG2 4.47Å; V652-V658 HydrophobicContact CG1-CG2 3.84Å; V652-V658 HydrophobicContact CG2-CG2 4.05Å; V652-I729 HydrophobicContact CG2-CG2 3.67Å; V652-T730 PolarHBondContact N-O 3.04Å; V652-V731 HydrophobicContact CG2-CG2 4.24Å; V652-V731 CarbonylContact O-C 3.47Å; V652-V731 VanDerWaalsContact O-CA 3.3Å; V652-V731 WeakPolarHBondContact O-CA 3.26Å; V652-E732 PolarHBondContact O-N 3.36Å
653	R	58.2	Low	79	Confident	104 Å²	104	54.8 Å²	54.8	39%	0.392	26%	0.264	S	S	.	.			trans	-73	149.9	165.9	-55.9	179	-163.7	-166.7	-0.4	109.7	Y655 Q656 E732 I734	R653-Y655 PolarHBondContact O-N 2.95Å; R653-Q656 HydrophobicContact CB-CB 4.25Å; R653-Q656 WeakPolarHBondContact O-CB 3.47Å; R653-Q656 PolarHBondContact O-N 3.43Å; R653-E732 WeakPolarHBondContact CA-O 3.36Å; R653-I734 HydrophobicContact CG-CB 4.41Å; R653-I734 PolarHBondContact NE-O 3.47Å; R653-I734 PolarHBondContact NH1-O 2.88Å; R653-I734 PolarHBondContact NH2-O 2.81Å
654	P	70.1	Confident	79.1	Confident	14 Å²	14	54.2 Å²	54.2	9%	0.091	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-43.7	129.3	167.2	-30.1	33.2	0	0	0	112.7	Q656 L705 P707 V731 D733 R741	P654-Q656 PolarHBondContact O-N 3.04Å; P654-L705 CarbonylContact C-O 3.58Å; P654-L705 WeakPolarHBondContact CA-O 3.47Å; P654-P707 HydrophobicContact CB-CG 4.12Å; P654-P707 HydrophobicContact CG-CG 3.97Å; P654-V731 HydrophobicContact CB-CG1 4.2Å; P654-V731 HydrophobicContact CG-CG1 3.56Å; P654-D733 WeakPolarHBondContact CD-OD1 3.4Å; P654-R741 VanDerWaalsContact CG-NH1 3.31Å
655	Y	72	Confident	78.9	Confident	142 Å²	142	53.4 Å²	53.4	56%	0.557	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.9	7.1	-178.7	-43.1	-67	0	0	0	116.8	R653 R703 L705	R653-Y655 PolarHBondContact O-N 2.95Å; Y655-R703 WeakPolarHBondContact CA-O 3.23Å; Y655-L705 PolarHBondContact N-O 2.87Å
656	Q	68.1	Low	78.3	Confident	79 Å²	79	53.8 Å²	53.8	37%	0.369	26%	0.26	S	S	.	.			trans	-70.5	133.7	169.8	179.8	-178.3	-17.8	0	0	110.5	V652 R653 P654 V658 G704	V652-Q656 HydrophobicContact CB-CB 4.29Å; R653-Q656 HydrophobicContact CB-CB 4.25Å; R653-Q656 WeakPolarHBondContact O-CB 3.47Å; R653-Q656 PolarHBondContact O-N 3.43Å; P654-Q656 PolarHBondContact O-N 3.04Å; Q656-V658 PolarHBondContact O-N 2.91Å; Q656-G704 WeakPolarHBondContact O-CA 2.89Å
657	P	76.3	Confident	77.9	Confident	77 Å²	77	56.6 Å²	56.6	50%	0.5	27%	0.268	S	S	.	.			trans	-54.6	138.8	177.6	-26.6	34.7	0	0	0	113	L701	P657-L701 WeakPolarHBondContact CA-O 3Å
658	V	82.4	Confident	77	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.006	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	131.5	-179.4	163.4	0	0	0	0	109.4	L650 V652 Q656 F660 F699 L701 I729	L650-V658 HydrophobicContact CD2-CB 4.17Å; L650-V658 HydrophobicContact CD2-CG1 3.72Å; L650-V658 HydrophobicContact CD2-CG2 3.96Å; V652-V658 HydrophobicContact CB-CG2 4.47Å; V652-V658 HydrophobicContact CG1-CG2 3.84Å; V652-V658 HydrophobicContact CG2-CG2 4.05Å; Q656-V658 PolarHBondContact O-N 2.91Å; V658-F660 HydrophobicContact CG1-CD2 3.88Å; V658-F660 HydrophobicContact CG1-CE2 3.37Å; V658-F660 HydrophobicContact CG1-CZ 4.09Å; V658-F699 HydrophobicContact CG1-CE1 4.26Å; V658-L701 HydrophobicContact CB-CB 4.13Å; V658-L701 HydrophobicContact CB-CD2 4.34Å; V658-L701 PolarHBondContact N-O 3.01Å; V658-L701 PolarHBondContact O-N 2.78Å; V658-I729 HydrophobicContact CG1-CD1 3.94Å; V658-I729 HydrophobicContact CG1-CG1 4.32Å; V658-I729 HydrophobicContact CG2-CD1 4.5Å; V658-I729 HydrophobicContact CG2-CG2 4.32Å
659	E	86.2	Confident	76.6	Confident	83 Å²	83	53.5 Å²	53.5	39%	0.388	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	138.7	175.9	-176.4	170.6	169.9	0	0	110.1	R698 F699 V700	E659-R698 HydrophobicContact CG-CG 4.09Å; E659-R698 WeakPolarHBondContact OE1-CD 3.22Å; E659-R698 IonicContact OE1-CZ 3.2Å; E659-R698 IonicContact OE1-NE 3.28Å; E659-R698 PolarHBondContact OE1-NE 2.83Å; E659-R698 VanDerWaalsContact OE1-NE 3.14Å; E659-R698 IonicContact OE1-NH1 3.7Å; E659-R698 PolarHBondContact OE1-NH1 2.98Å; E659-F699 WeakPolarHBondContact CA-O 3.41Å; E659-V700 HydrophobicContact CG-CG2 4.42Å
660	F	81.5	Confident	76.4	Confident	1 Å²	1	50.3 Å²	50.3	0%	0.004	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	146.9	169.6	-63.7	-79	0	0	0	109.8	I645 P647 L650 V658 F678 R698 F699 V714 A727 I729	I645-F660 HydrophobicContact CD1-CB 4.41Å; I645-F660 HydrophobicContact CD1-CG 4.43Å; I645-F660 HydrophobicContact CG1-CB 4.25Å; I645-F660 HydrophobicContact CG1-CD1 4.35Å; I645-F660 HydrophobicContact CG1-CG 4.5Å; P647-F660 HydrophobicContact CG-CD1 4.26Å; P647-F660 HydrophobicContact CG-CE1 4.16Å; P647-F660 VanDerWaalsContact O-CD1 3.29Å; P647-F660 WeakPolarHBondContact O-CD1 3.35Å; P647-F660 VanDerWaalsContact O-CE1 3.24Å; P647-F660 WeakPolarHBondContact O-CE1 3.22Å; L650-F660 HydrophobicContact CB-CE1 3.87Å; L650-F660 HydrophobicContact CB-CZ 3.89Å; L650-F660 HydrophobicContact CD2-CE1 4.34Å; L650-F660 HydrophobicContact CD2-CZ 4.05Å; V658-F660 HydrophobicContact CG1-CD2 3.88Å; V658-F660 HydrophobicContact CG1-CE2 3.37Å; V658-F660 HydrophobicContact CG1-CZ 4.09Å; F660-F678 HydrophobicContact CB-CE1 4.28Å; F660-F678 HydrophobicContact CB-CZ 4.4Å; F660-R698 CarbonylContact O-C 3.55Å; F660-R698 WeakPolarHBondContact O-CA 3.45Å; F660-F699 HydrophobicContact CB-CB 4.27Å; F660-F699 AromaticContact CD2-CD1 3.82Å; F660-F699 HydrophobicContact CD2-CD1 3.82Å; F660-F699 HydrophobicContact CD2-CE1 4.2Å; F660-F699 HydrophobicContact CD2-CG 4.45Å; F660-F699 PolarHBondContact N-O 2.78Å; F660-F699 PolarHBondContact O-N 3.25Å; F660-V714 HydrophobicContact CD2-CG1 4.44Å; F660-V714 HydrophobicContact CD2-CG2 4.3Å; F660-V714 HydrophobicContact CE2-CB 4.31Å; F660-V714 HydrophobicContact CE2-CG2 3.81Å; F660-A727 HydrophobicContact CD1-CB 3.97Å; F660-A727 HydrophobicContact CE1-CB 3.52Å; F660-A727 HydrophobicContact CZ-CB 3.93Å; F660-I729 HydrophobicContact CE2-CD1 3.98Å; F660-I729 HydrophobicContact CE2-CG1 3.85Å; F660-I729 HydrophobicContact CZ-CD1 4.3Å; F660-I729 HydrophobicContact CZ-CG1 3.64Å
661	E	87.6	Confident	76.8	Confident	32 Å²	32	52.6 Å²	52.6	15%	0.15	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	136.8	161.8	-63.9	-157.8	141.6	0	0	110.2	I645 T646 R696 V697 R698	I645-E661 WeakPolarHBondContact CA-O 3.34Å; T646-E661 PolarHBondContact N-O 3.29Å; T646-E661 PolarHBondContact O-N 2.89Å; E661-R696 WeakPolarHBondContact OE2-CD 3.33Å; E661-R696 IonicContact OE2-CZ 3.16Å; E661-R696 IonicContact OE2-NE 2.85Å; E661-R696 IonicContact OE2-NH1 2.66Å; E661-R696 PolarHBondContact OE2-NH1 2.66Å; E661-V697 WeakPolarHBondContact CA-O 3.46Å; E661-R698 HydrophobicContact CG-CB 4.22Å; E661-R698 HydrophobicContact CG-CG 4.19Å; E661-R698 IonicContact OE1-CZ 2.78Å; E661-R698 IonicContact OE1-NE 2.69Å; E661-R698 PolarHBondContact OE1-NE 2.89Å; E661-R698 IonicContact OE1-NH2 2.99Å; E661-R698 PolarHBondContact OE1-NH2 2.91Å
662	C	91.1	Very high	77.2	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	135.3	167.3	-175.1	0	0	0	0	110.1	T644 F678 R696 V697 C716	T644-C662 VanDerWaalsContact O-CA 3.27Å; T644-C662 WeakPolarHBondContact O-CA 3.38Å; C662-F678 HydrophobicContact CB-CE1 3.77Å; C662-F678 HydrophobicContact CB-CE2 4.31Å; C662-F678 HydrophobicContact CB-CZ 3.56Å; C662-R696 WeakPolarHBondContact O-CA 3.32Å; C662-V697 HydrophobicContact CB-CG1 4.33Å; C662-V697 PolarHBondContact N-O 3.49Å; C662-V697 PolarHBondContact O-N 2.87Å; C662-C716 HydrophobicContact CB-CB 3.7Å; C662-C716 WeakPolarHBondContact CB-SG 3.37Å; C662-C716 WeakPolarHBondContact SG-CB 3.48Å; C662-C716 CovalentContact SG-SG 2.01Å; C662-C716 PolarHBondContact SG-SG 2.97Å
663	F	92	Very high	78.1	Confident	42 Å²	42	54.7 Å²	54.7	18%	0.184	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	152.1	174.3	60.2	-83	0	0	0	112.3	T644 N695 R696	T644-F663 HydrophobicContact CG2-CE1 3.7Å; T644-F663 HydrophobicContact CG2-CE2 4.32Å; T644-F663 HydrophobicContact CG2-CZ 3.55Å; T644-F663 PolarHBondContact N-O 3.3Å; T644-F663 PolarHBondContact O-N 3.04Å; F663-N695 CarbonylContact C-O 3.55Å; F663-N695 WeakPolarHBondContact CA-O 3.35Å; F663-R696 HydrophobicContact CB-CB 3.96Å; F663-R696 HydrophobicContact CB-CG 4.02Å; F663-R696 VanDerWaalsContact CD1-NH2 3.3Å
664	A	90	Very high	79.4	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	133.6	176.1	0	0	0	0	0	110.9	L643 A672 F674 P676 N695	L643-A664 HydrophobicContact CD2-CB 3.81Å; A664-A672 HydrophobicContact CB-CB 3.54Å; A664-A672 WeakPolarHBondContact O-CB 3.2Å; A664-A672 PolarHBondContact O-N 2.77Å; A664-A672 VanDerWaalsContact O-N 3.1Å; A664-F674 HydrophobicContact CB-CD2 4.33Å; A664-F674 HydrophobicContact CB-CE1 4.45Å; A664-F674 HydrophobicContact CB-CE2 3.42Å; A664-F674 VanDerWaalsContact CB-CE2 3.42Å; A664-F674 HydrophobicContact CB-CZ 3.52Å; A664-P676 HydrophobicContact CB-CG 4.17Å; A664-N695 PolarHBondContact N-O 2.88Å; A664-N695 PolarHBondContact O-ND2 2.87Å
665	A	85.2	Confident	80.3	Confident	16 Å²	16	52.7 Å²	52.7	13%	0.132	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	158.9	171.1	0	0	0	0	0	110.3	Y641 V642 Q670	Y641-A665 CarbonylContact C-O 3.57Å; Y641-A665 WeakPolarHBondContact CA-O 3.34Å; V642-A665 PolarHBondContact N-O 2.89Å; V642-A665 PolarHBondContact O-N 3.49Å; A665-Q670 CarbonylContact C-O 3.57Å; A665-Q670 WeakPolarHBondContact CA-O 3.42Å; A665-Q670 WeakPolarHBondContact CB-O 3.44Å
666	S	77.4	Confident	81.3	Confident	8 Å²	8	46.2 Å²	46.2	6%	0.056	26%	0.263	C	S	.	.			trans	-72.6	168.3	166.2	70.5	0	0	0	0	110.9	D668 G669 Q670	S666-D668 PolarHBondContact O-N 2.76Å; S666-D668 PolarHBondContact OG-N 2.88Å; S666-G669 WeakPolarHBondContact O-CA 3.25Å; S666-G669 PolarHBondContact O-N 2.91Å; S666-Q670 PolarHBondContact N-O 3.42Å; S666-Q670 PolarHBondContact OG-N 3.01Å
667	E	66.8	Low	82.4	Confident	131 Å²	131	47.7 Å²	47.7	61%	0.612	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-23	172.1	-59.7	-176.5	173.8	0	0	112.8	S640 V642 G669	S640-E667 VanDerWaalsContact CB-OE1 3.28Å; S640-E667 WeakPolarHBondContact CB-OE1 3.44Å; S640-E667 WeakPolarHBondContact O-CG 3.45Å; S640-E667 PolarHBondContact OG-OE1 2.79Å; V642-E667 HydrophobicContact CG2-CG 4.12Å; E667-G669 PolarHBondContact O-N 2.6Å
668	D	62.3	Low	83.2	Confident	71 Å²	71	45 Å²	45	38%	0.38	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	1.7	171.2	-53.2	-70.7	0	0	0	113.9	R639 S666 Q670	R639-D668 IonicContact CZ-OD2 3.05Å; R639-D668 IonicContact NE-OD2 3.06Å; R639-D668 PolarHBondContact NE-OD2 3.47Å; R639-D668 IonicContact NH2-OD2 3.17Å; R639-D668 PolarHBondContact NH2-OD2 2.89Å; S666-D668 PolarHBondContact O-N 2.76Å; S666-D668 PolarHBondContact OG-N 2.88Å; D668-Q670 VanDerWaalsContact C-N 3.28Å; D668-Q670 HydrophobicContact CB-CG 4.43Å; D668-Q670 PolarHBondContact O-N 3.01Å
669	G	66.9	Low	83.6	Confident	42 Å²	42	49.5 Å²	49.5	43%	0.433	27%	0.267	S	S	.	.	S	Bend	trans	74.8	7.7	-176.2	0	0	0	0	0	115.1	S666 E667	S666-G669 WeakPolarHBondContact O-CA 3.25Å; S666-G669 PolarHBondContact O-N 2.91Å; E667-G669 PolarHBondContact O-N 2.6Å
670	Q	75	Confident	83.7	Confident	108 Å²	108	46.6 Å²	46.6	51%	0.505	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-76.5	139.1	178.3	-67.9	-63.8	-51.7	0	0	111.2	A665 S666 D668 A672	A665-Q670 CarbonylContact C-O 3.57Å; A665-Q670 WeakPolarHBondContact CA-O 3.42Å; A665-Q670 WeakPolarHBondContact CB-O 3.44Å; S666-Q670 PolarHBondContact N-O 3.42Å; S666-Q670 PolarHBondContact OG-N 3.01Å; D668-Q670 VanDerWaalsContact C-N 3.28Å; D668-Q670 HydrophobicContact CB-CG 4.43Å; D668-Q670 PolarHBondContact O-N 3.01Å; Q670-A672 PolarHBondContact O-N 2.76Å
671	P	82	Confident	83.8	Confident	88 Å²	88	57.7 Å²	57.7	57%	0.571	30%	0.296	S	S	*	.	B	Isolated β-bridge	trans	-55.1	135.5	174.1	-25.6	34.8	0	0	0	112.3	N695	P671-N695 HydrophobicContact CB-CB 4.38Å
672	A	83.8	Confident	83.5	Confident	6 Å²	6	58 Å²	58	5%	0.05	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-71.9	154.3	174.9	0	0	0	0	0	112.5	Y641 A664 Q670 F674 N695	Y641-A672 HydrophobicContact CD1-CB 3.61Å; Y641-A672 HydrophobicContact CE1-CB 3.65Å; A664-A672 HydrophobicContact CB-CB 3.54Å; A664-A672 WeakPolarHBondContact O-CB 3.2Å; A664-A672 PolarHBondContact O-N 2.77Å; A664-A672 VanDerWaalsContact O-N 3.1Å; Q670-A672 PolarHBondContact O-N 2.76Å; A672-F674 VanDerWaalsContact C-N 3.28Å; A672-F674 HydrophobicContact CB-CD1 3.79Å; A672-F674 HydrophobicContact CB-CE1 3.51Å; A672-F674 HydrophobicContact CB-CE2 4.39Å; A672-F674 HydrophobicContact CB-CG 4.39Å; A672-F674 HydrophobicContact CB-CZ 3.84Å; A672-F674 PolarHBondContact O-N 3.05Å; A672-N695 HydrophobicContact CB-CB 4.38Å; A672-N695 WeakPolarHBondContact O-CB 3.46Å
673	S	84.8	Confident	83	Confident	103 Å²	103	64 Å²	64	72%	0.72	34%	0.341	S	S	*	.	S	Bend	trans	-89.8	23.3	177	60.7	0	0	0	0	113.9
674	F	85.9	Confident	82.6	Confident	26 Å²	26	69.2 Å²	69.2	11%	0.114	36%	0.359	C	S	.	.	S	Bend	trans	-142.7	154.6	-178.4	65.8	-98.8	0	0	0	111.3	Y641 L643 A664 A672 E694 N695 S718 E720	Y641-F674 AromaticContact CD1-CE1 3.69Å; Y641-F674 HydrophobicContact CD1-CE1 3.69Å; Y641-F674 HydrophobicContact CD1-CZ 4.1Å; Y641-F674 AromaticContact CD2-CE1 3.6Å; Y641-F674 HydrophobicContact CD2-CE1 3.6Å; Y641-F674 HydrophobicContact CD2-CZ 4.13Å; Y641-F674 AromaticContact CE1-CE1 3.93Å; Y641-F674 HydrophobicContact CE1-CE1 3.93Å; Y641-F674 AromaticContact CE2-CE1 3.84Å; Y641-F674 HydrophobicContact CE2-CE1 3.84Å; Y641-F674 AromaticContact CG-CE1 3.5Å; Y641-F674 HydrophobicContact CG-CE1 3.5Å; Y641-F674 AromaticContact CG-CZ 3.74Å; Y641-F674 HydrophobicContact CG-CZ 3.74Å; Y641-F674 AromaticContact CZ-CE1 3.99Å; L643-F674 HydrophobicContact CD2-CE2 4.46Å; A664-F674 HydrophobicContact CB-CD2 4.33Å; A664-F674 HydrophobicContact CB-CE1 4.45Å; A664-F674 HydrophobicContact CB-CE2 3.42Å; A664-F674 VanDerWaalsContact CB-CE2 3.42Å; A664-F674 HydrophobicContact CB-CZ 3.52Å; A672-F674 VanDerWaalsContact C-N 3.28Å; A672-F674 HydrophobicContact CB-CD1 3.79Å; A672-F674 HydrophobicContact CB-CE1 3.51Å; A672-F674 HydrophobicContact CB-CE2 4.39Å; A672-F674 HydrophobicContact CB-CG 4.39Å; A672-F674 HydrophobicContact CB-CZ 3.84Å; A672-F674 PolarHBondContact O-N 3.05Å; F674-E694 CarbonylContact C-O 3.55Å; F674-N695 WeakPolarHBondContact O-CA 3.41Å; F674-S718 WeakPolarHBondContact CD2-OG 3.24Å; F674-S718 WeakPolarHBondContact CE2-OG 3.41Å; F674-S718 WeakPolarHBondContact CZ-OG 3.2Å; F674-E720 HydrophobicContact CD1-CB 3.89Å; F674-E720 HydrophobicContact CD1-CG 3.47Å; F674-E720 VanDerWaalsContact CD1-CG 3.47Å; F674-E720 HydrophobicContact CE1-CB 3.58Å; F674-E720 HydrophobicContact CE1-CG 3.73Å; F674-E720 HydrophobicContact CG-CB 4.5Å; F674-E720 HydrophobicContact CG-CG 3.99Å; F674-E720 HydrophobicContact CZ-CB 4.01Å; F674-E720 HydrophobicContact CZ-CG 4.48Å
675	T	89.1	Confident	82.3	Confident	50 Å²	50	69.8 Å²	69.8	31%	0.307	36%	0.362	S	S	.	.			trans	-94.9	123.9	179	-52.2	0	0	0	0	110.5	R691 E694 V697	T675-R691 HydrophobicContact CG2-CG 4.06Å; T675-R691 PolarHBondContact OG1-NE 2.86Å; T675-R691 PolarHBondContact OG1-NH2 2.91Å; T675-E694 WeakPolarHBondContact CA-O 3.46Å; T675-E694 WeakPolarHBondContact CB-O 3.14Å; T675-E694 PolarHBondContact N-O 2.01Å; T675-E694 VanDerWaalsContact N-O 3.15Å; T675-E694 PolarHBondContact OG1-O 3.16Å; T675-V697 HydrophobicContact CG2-CB 4.21Å
676	P	92.4	Very high	82.3	Confident	6 Å²	6	74.1 Å²	74.1	4%	0.039	39%	0.391	C	S	.	.			trans	-66.7	166.8	174.4	5.1	-0.2	0	0	0	112.7	L643 A664 N695 V697 L717	L643-P676 HydrophobicContact CD2-CB 3.97Å; L643-P676 HydrophobicContact CD2-CG 4.3Å; A664-P676 HydrophobicContact CB-CG 4.17Å; P676-N695 WeakPolarHBondContact CD-O 3.49Å; P676-V697 HydrophobicContact CB-CG1 4.13Å; P676-V697 HydrophobicContact CG-CG1 4.08Å; P676-V697 VanDerWaalsContact O-CG1 3.24Å; P676-V697 WeakPolarHBondContact O-CG1 3Å; P676-L717 WeakPolarHBondContact CA-O 3.37Å
677	R	92.1	Very high	82.9	Confident	110 Å²	110	76.9 Å²	76.9	42%	0.415	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	154.4	175.4	63.6	177.7	163.7	-130	-8.7	111.7	C716 L717 S718 D719	R677-C716 WeakPolarHBondContact O-CA 3.42Å; R677-L717 HydrophobicContact CG-CB 3.89Å; R677-L717 PolarHBondContact N-O 2.79Å; R677-L717 PolarHBondContact O-N 2.73Å; R677-S718 PolarHBondContact NH2-O 2.87Å; R677-D719 IonicContact CZ-OD1 3.68Å; R677-D719 IonicContact CZ-OD2 2.8Å; R677-D719 IonicContact NH1-OD1 3.49Å; R677-D719 PolarHBondContact NH1-OD1 2.03Å; R677-D719 IonicContact NH1-OD2 2.68Å; R677-D719 PolarHBondContact NH1-OD2 3.39Å; R677-D719 IonicContact NH2-OD1 2.69Å; R677-D719 PolarHBondContact NH2-OD1 2.87Å; R677-D719 IonicContact NH2-OD2 3.55Å
678	F	92.2	Very high	84	Confident	21 Å²	21	75.8 Å²	75.8	9%	0.092	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	149.7	172.4	-71	-79.8	0	0	0	112.1	I645 F660 C662 F687 T689 V697 F699 V714 E715 C716	I645-F678 HydrophobicContact CD1-CD1 4.34Å; I645-F678 HydrophobicContact CD1-CE1 3.78Å; I645-F678 HydrophobicContact CG1-CE1 4.26Å; F660-F678 HydrophobicContact CB-CE1 4.28Å; F660-F678 HydrophobicContact CB-CZ 4.4Å; C662-F678 HydrophobicContact CB-CE1 3.77Å; C662-F678 HydrophobicContact CB-CE2 4.31Å; C662-F678 HydrophobicContact CB-CZ 3.56Å; F678-F687 HydrophobicContact CB-CE2 4.24Å; F678-T689 HydrophobicContact CD2-CG2 4.22Å; F678-V697 HydrophobicContact CD2-CG1 3.94Å; F678-V697 HydrophobicContact CD2-CG2 4.19Å; F678-V697 HydrophobicContact CE2-CB 4.21Å; F678-V697 HydrophobicContact CE2-CG1 3.53Å; F678-V697 HydrophobicContact CE2-CG2 4.01Å; F678-V697 HydrophobicContact CZ-CG1 4.31Å; F678-F699 HydrophobicContact CB-CD2 3.98Å; F678-F699 HydrophobicContact CD1-CB 4.06Å; F678-F699 HydrophobicContact CD1-CD2 4.18Å; F678-F699 HydrophobicContact CD1-CG 4.49Å; F678-F699 HydrophobicContact CD2-CB 3.75Å; F678-F699 HydrophobicContact CD2-CD2 4.37Å; F678-F699 HydrophobicContact CE1-CB 3.87Å; F678-F699 HydrophobicContact CE2-CB 3.54Å; F678-F699 HydrophobicContact CG-CB 3.99Å; F678-F699 AromaticContact CG-CD2 3.95Å; F678-F699 HydrophobicContact CG-CD2 3.95Å; F678-F699 HydrophobicContact CG-CG 4.45Å; F678-F699 HydrophobicContact CZ-CB 3.59Å; F678-V714 HydrophobicContact CD1-CG1 3.83Å; F678-V714 HydrophobicContact CE1-CG1 4.39Å; F678-E715 CarbonylContact C-O 3.54Å; F678-E715 WeakPolarHBondContact CA-O 3.16Å; F678-C716 HydrophobicContact CD1-CB 4.42Å; F678-C716 HydrophobicContact CE1-CB 4.45Å
679	Q	90.4	Very high	85.3	Confident	96 Å²	96	76.4 Å²	76.4	45%	0.449	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	145.8	171.6	177.6	167.5	-24.1	0	0	109.7	E715 L717	Q679-E715 HydrophobicContact CB-CB 4.47Å; Q679-E715 PolarHBondContact N-O 2.86Å; Q679-E715 PolarHBondContact O-N 2.81Å; Q679-L717 HydrophobicContact CB-CD1 4.05Å
680	V	89	Confident	86.3	Confident	22 Å²	22	78.1 Å²	78.1	13%	0.133	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	139.8	174.6	-176.3	0	0	0	0	108	I685 F687 F699 T712 V714	V680-I685 HydrophobicContact CG1-CB 4.2Å; V680-I685 HydrophobicContact CG1-CD1 3.84Å; V680-I685 HydrophobicContact CG1-CG2 4.36Å; V680-F687 HydrophobicContact CB-CE1 4.23Å; V680-F687 HydrophobicContact CG2-CD1 4.09Å; V680-F687 HydrophobicContact CG2-CE1 3.81Å; V680-F687 HydrophobicContact CG2-CZ 4.43Å; V680-F699 HydrophobicContact CG2-CE2 3.64Å; V680-F699 HydrophobicContact CG2-CZ 3.99Å; V680-T712 HydrophobicContact CG1-CG2 4.07Å; V680-V714 HydrophobicContact CG2-CG1 4.22Å; V680-V714 HydrophobicContact CG2-CG2 4.12Å
681	R	82.8	Confident	87	Confident	233 Å²	233	79.7 Å²	79.7	88%	0.879	41%	0.407	S	S	*	.	S	Bend	trans	-79.2	-28.5	-172.6	-170.3	174.7	177.8	-172.9	-0.5	114.2
682	D	82.2	Confident	87.2	Confident	40 Å²	40	78.8 Å²	78.8	21%	0.214	40%	0.4	C	S	.	.			trans	-89.4	110.9	176.7	-178.2	1.6	0	0	0	110.5	R684 I685	D682-R684 PolarHBondContact O-N 2.91Å; D682-R684 VanDerWaalsContact O-N 3.15Å; D682-R684 VanDerWaalsContact OD1-CB 3.26Å; D682-R684 WeakPolarHBondContact OD1-CB 3.28Å; D682-R684 VanDerWaalsContact OD1-CG 3.23Å; D682-R684 WeakPolarHBondContact OD1-CG 3.38Å; D682-R684 PolarHBondContact OD1-N 2.71Å; D682-R684 IonicContact OD1-NE 2.74Å; D682-R684 PolarHBondContact OD1-NE 2.84Å; D682-R684 VanDerWaalsContact OD1-NE 3.15Å; D682-R684 IonicContact OD2-CZ 3.23Å; D682-R684 IonicContact OD2-NE 3Å; D682-R684 PolarHBondContact OD2-NE 2.96Å; D682-R684 IonicContact OD2-NH2 2.76Å; D682-R684 PolarHBondContact OD2-NH2 2.89Å; D682-I685 HydrophobicContact CB-CD1 3.89Å; D682-I685 HydrophobicContact CB-CG1 4.15Å; D682-I685 WeakPolarHBondContact O-CB 3.04Å; D682-I685 PolarHBondContact O-N 2.82Å; D682-I685 VanDerWaalsContact O-N 3.09Å
683	S	81.3	Confident	87.3	Confident	125 Å²	125	80.6 Å²	80.6	87%	0.874	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-4.4	-179.6	56	0	0	0	0	114.5	I685	S683-I685 VanDerWaalsContact C-N 3.27Å
684	R	82	Confident	87.4	Confident	151 Å²	151	81.2 Å²	81.2	57%	0.57	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-19	168.4	-58.6	178.9	-61.1	155.3	2.5	112.6	D682 S686 D708	D682-R684 PolarHBondContact O-N 2.91Å; D682-R684 VanDerWaalsContact O-N 3.15Å; D682-R684 VanDerWaalsContact OD1-CB 3.26Å; D682-R684 WeakPolarHBondContact OD1-CB 3.28Å; D682-R684 VanDerWaalsContact OD1-CG 3.23Å; D682-R684 WeakPolarHBondContact OD1-CG 3.38Å; D682-R684 PolarHBondContact OD1-N 2.71Å; D682-R684 IonicContact OD1-NE 2.74Å; D682-R684 PolarHBondContact OD1-NE 2.84Å; D682-R684 VanDerWaalsContact OD1-NE 3.15Å; D682-R684 IonicContact OD2-CZ 3.23Å; D682-R684 IonicContact OD2-NE 3Å; D682-R684 PolarHBondContact OD2-NE 2.96Å; D682-R684 IonicContact OD2-NH2 2.76Å; D682-R684 PolarHBondContact OD2-NH2 2.89Å; R684-S686 PolarHBondContact O-N 2.78Å; R684-D708 IonicContact CZ-OD2 3.58Å; R684-D708 IonicContact NH1-OD2 3.69Å; R684-D708 PolarHBondContact NH1-OD2 2.86Å; R684-D708 IonicContact NH2-OD2 3.54Å; R684-D708 PolarHBondContact NH2-OD2 3.15Å
685	I	83.7	Confident	87.6	Confident	13 Å²	13	81.3 Å²	81.3	7%	0.067	41%	0.405	C	S	.	.			trans	-89	106.2	-173.9	-58.8	175.9	0	0	0	109.7	V680 D682 S683 L701 L705 T712	V680-I685 HydrophobicContact CG1-CB 4.2Å; V680-I685 HydrophobicContact CG1-CD1 3.84Å; V680-I685 HydrophobicContact CG1-CG2 4.36Å; D682-I685 HydrophobicContact CB-CD1 3.89Å; D682-I685 HydrophobicContact CB-CG1 4.15Å; D682-I685 WeakPolarHBondContact O-CB 3.04Å; D682-I685 PolarHBondContact O-N 2.82Å; D682-I685 VanDerWaalsContact O-N 3.09Å; S683-I685 VanDerWaalsContact C-N 3.27Å; I685-L701 HydrophobicContact CG2-CD1 4Å; I685-L701 HydrophobicContact CG2-CD2 3.96Å; I685-L705 HydrophobicContact CD1-CD2 3.66Å; I685-L705 HydrophobicContact CG1-CD2 3.92Å; I685-L705 HydrophobicContact CG2-CD2 4.28Å; I685-T712 HydrophobicContact CD1-CG2 3.55Å
686	S	86	Confident	87.8	Confident	106 Å²	106	82.5 Å²	82.5	74%	0.741	40%	0.404	S	S	*	.			trans	-97.1	121.5	175.6	-171.7	0	0	0	0	110.4	R684 L701	R684-S686 PolarHBondContact O-N 2.78Å; S686-L701 WeakPolarHBondContact O-CD1 3.16Å
687	F	89.9	Confident	87.8	Confident	67 Å²	67	82.6 Å²	82.6	29%	0.294	41%	0.405	S	S	.	.			trans	-130.8	157.7	-173.8	60.9	-90.8	0	0	0	111.9	F678 V680 T689 F699	F678-F687 HydrophobicContact CB-CE2 4.24Å; V680-F687 HydrophobicContact CB-CE1 4.23Å; V680-F687 HydrophobicContact CG2-CD1 4.09Å; V680-F687 HydrophobicContact CG2-CE1 3.81Å; V680-F687 HydrophobicContact CG2-CZ 4.43Å; F687-T689 HydrophobicContact CD2-CG2 3.83Å; F687-T689 HydrophobicContact CE2-CG2 3.7Å; F687-F699 HydrophobicContact CB-CD2 4.11Å; F687-F699 HydrophobicContact CB-CE1 4.17Å; F687-F699 HydrophobicContact CB-CE2 3.54Å; F687-F699 HydrophobicContact CB-CZ 3.57Å; F687-F699 AromaticContact CD1-CE2 3.6Å; F687-F699 HydrophobicContact CD1-CE2 3.6Å; F687-F699 HydrophobicContact CD1-CZ 4.09Å; F687-F699 AromaticContact CD2-CD2 3.41Å; F687-F699 HydrophobicContact CD2-CD2 3.41Å; F687-F699 VanDerWaalsContact CD2-CD2 3.41Å; F687-F699 AromaticContact CD2-CE2 3.33Å; F687-F699 HydrophobicContact CD2-CE2 3.33Å; F687-F699 HydrophobicContact CD2-CG 4.4Å; F687-F699 HydrophobicContact CD2-CZ 4.27Å; F687-F699 HydrophobicContact CE1-CE2 4.08Å; F687-F699 AromaticContact CE2-CD2 3.88Å; F687-F699 HydrophobicContact CE2-CD2 3.88Å; F687-F699 AromaticContact CE2-CE2 3.85Å; F687-F699 HydrophobicContact CE2-CE2 3.85Å; F687-F699 AromaticContact CG-CD2 3.77Å; F687-F699 HydrophobicContact CG-CD2 3.77Å; F687-F699 AromaticContact CG-CE2 3.19Å; F687-F699 HydrophobicContact CG-CE2 3.19Å; F687-F699 AromaticContact CG-CZ 3.74Å; F687-F699 HydrophobicContact CG-CZ 3.74Å; F687-F699 HydrophobicContact CZ-CE2 4.19Å
688	E	89.6	Confident	87.8	Confident	108 Å²	108	81.5 Å²	81.5	51%	0.505	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	147.4	176.6	-62.6	174.4	159.2	0	0	109.6	V700 Q702	E688-V700 HydrophobicContact CB-CB 4.48Å; E688-V700 PolarHBondContact N-O 3.05Å; E688-V700 PolarHBondContact O-N 3.42Å; E688-Q702 WeakPolarHBondContact OE2-CG 3.38Å; E688-Q702 PolarHBondContact OE2-NE2 3.27Å
689	T	89.3	Confident	87.7	Confident	83 Å²	83	80.6 Å²	80.6	51%	0.509	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	133.6	175	57.3	0	0	0	0	111.8	F678 F687 R698	F678-T689 HydrophobicContact CD2-CG2 4.22Å; F687-T689 HydrophobicContact CD2-CG2 3.83Å; F687-T689 HydrophobicContact CE2-CG2 3.7Å; T689-R698 CarbonylContact C-O 3.56Å; T689-R698 VanDerWaalsContact CA-O 3.24Å; T689-R698 WeakPolarHBondContact CA-O 3.37Å
690	T	89.1	Confident	87.6	Confident	78 Å²	78	76.9 Å²	76.9	48%	0.479	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	128.6	179.8	-60.8	0	0	0	0	110.6	V692 R698	T690-V692 PolarHBondContact O-N 2.7Å; T690-R698 PolarHBondContact N-O 3.08Å; T690-R698 PolarHBondContact O-N 3.23Å
691	R	89.6	Confident	87.5	Confident	141 Å²	141	76.2 Å²	76.2	53%	0.532	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	120.6	174.3	-169.6	180	-159.5	-132.8	6.2	108.8	T675 S693 E694	T675-R691 HydrophobicContact CG2-CG 4.06Å; T675-R691 PolarHBondContact OG1-NE 2.86Å; T675-R691 PolarHBondContact OG1-NH2 2.91Å; R691-S693 WeakPolarHBondContact CG-O 3.31Å; R691-E694 IonicContact CZ-OE1 3.2Å; R691-E694 IonicContact NH1-OE1 2.7Å; R691-E694 PolarHBondContact NH1-OE1 2.62Å; R691-E694 VanDerWaalsContact NH1-OE1 3.08Å; R691-E694 IonicContact NH2-OE1 3.01Å; R691-E694 PolarHBondContact NH2-OE1 3.06Å
692	V	86.4	Confident	87.4	Confident	69 Å²	69	70.6 Å²	70.6	42%	0.418	36%	0.36	S	S	.	.			trans	-96.2	-41.3	-177.5	-177.8	0	0	0	0	110.6	T690 R696 R698	T690-V692 PolarHBondContact O-N 2.7Å; V692-R696 HydrophobicContact CB-CB 4.24Å; V692-R696 HydrophobicContact CB-CG 4.01Å; V692-R696 HydrophobicContact CG1-CG 4.41Å; V692-R696 HydrophobicContact CG2-CG 4.42Å; V692-R696 PolarHBondContact N-O 2.88Å; V692-R698 HydrophobicContact CG2-CB 3.74Å
693	S	86.3	Confident	87.2	Confident	44 Å²	44	78.9 Å²	78.9	31%	0.308	39%	0.389	S	S	.	.	S	Bend	trans	-143.5	-175.1	171.6	72	0	0	0	0	109.3	R691 N695 R696	R691-S693 WeakPolarHBondContact CG-O 3.31Å; S693-N695 PolarHBondContact O-N 3.36Å; S693-N695 PolarHBondContact OG-N 3Å; S693-N695 VanDerWaalsContact OG-N 3.16Å; S693-N695 PolarHBondContact OG-OD1 2.64Å; S693-R696 PolarHBondContact N-O 2.87Å; S693-R696 VanDerWaalsContact N-O 3.15Å; S693-R696 VanDerWaalsContact OG-CB 3.24Å; S693-R696 WeakPolarHBondContact OG-CB 3.5Å; S693-R696 PolarHBondContact OG-N 2.96Å
694	E	87	Confident	87.2	Confident	117 Å²	117	73.2 Å²	73.2	55%	0.547	35%	0.35	S	S	.	.	S	Bend	trans	-61.1	-33.7	171.5	-60.6	-120.7	95.7	0	0	112.4	F674 T675 R691	F674-E694 CarbonylContact C-O 3.55Å; T675-E694 WeakPolarHBondContact CA-O 3.46Å; T675-E694 WeakPolarHBondContact CB-O 3.14Å; T675-E694 PolarHBondContact N-O 2.01Å; T675-E694 VanDerWaalsContact N-O 3.15Å; T675-E694 PolarHBondContact OG1-O 3.16Å; R691-E694 IonicContact CZ-OE1 3.2Å; R691-E694 IonicContact NH1-OE1 2.7Å; R691-E694 PolarHBondContact NH1-OE1 2.62Å; R691-E694 VanDerWaalsContact NH1-OE1 3.08Å; R691-E694 IonicContact NH2-OE1 3.01Å; R691-E694 PolarHBondContact NH2-OE1 3.06Å
695	N	90.2	Very high	87.2	Confident	27 Å²	27	66.1 Å²	66.1	14%	0.144	32%	0.323	C	S	.	.	S	Bend	trans	-105.7	0	-175	83.1	-55.3	0	0	0	115.2	F663 A664 P671 A672 F674 P676 S693	F663-N695 CarbonylContact C-O 3.55Å; F663-N695 WeakPolarHBondContact CA-O 3.35Å; A664-N695 PolarHBondContact N-O 2.88Å; A664-N695 PolarHBondContact O-ND2 2.87Å; P671-N695 HydrophobicContact CB-CB 4.38Å; A672-N695 HydrophobicContact CB-CB 4.38Å; A672-N695 WeakPolarHBondContact O-CB 3.46Å; F674-N695 WeakPolarHBondContact O-CA 3.41Å; P676-N695 WeakPolarHBondContact CD-O 3.49Å; S693-N695 PolarHBondContact O-N 3.36Å; S693-N695 PolarHBondContact OG-N 3Å; S693-N695 VanDerWaalsContact OG-N 3.16Å; S693-N695 PolarHBondContact OG-OD1 2.64Å
696	R	92.3	Very high	86.6	Confident	75 Å²	75	65.5 Å²	65.5	28%	0.283	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	131.7	-173.9	-175.4	177.8	-74.8	-127.1	1.3	112.2	E661 C662 F663 V692 S693	E661-R696 WeakPolarHBondContact OE2-CD 3.33Å; E661-R696 IonicContact OE2-CZ 3.16Å; E661-R696 IonicContact OE2-NE 2.85Å; E661-R696 IonicContact OE2-NH1 2.66Å; E661-R696 PolarHBondContact OE2-NH1 2.66Å; C662-R696 WeakPolarHBondContact O-CA 3.32Å; F663-R696 HydrophobicContact CB-CB 3.96Å; F663-R696 HydrophobicContact CB-CG 4.02Å; F663-R696 VanDerWaalsContact CD1-NH2 3.3Å; V692-R696 HydrophobicContact CB-CB 4.24Å; V692-R696 HydrophobicContact CB-CG 4.01Å; V692-R696 HydrophobicContact CG1-CG 4.41Å; V692-R696 HydrophobicContact CG2-CG 4.42Å; V692-R696 PolarHBondContact N-O 2.88Å; S693-R696 PolarHBondContact N-O 2.87Å; S693-R696 VanDerWaalsContact N-O 3.15Å; S693-R696 VanDerWaalsContact OG-CB 3.24Å; S693-R696 WeakPolarHBondContact OG-CB 3.5Å; S693-R696 PolarHBondContact OG-N 2.96Å
697	V	93.3	Very high	85.7	Confident	9 Å²	9	63.9 Å²	63.9	6%	0.055	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	147.7	175.4	60.6	0	0	0	0	109.9	E661 C662 T675 P676 F678	E661-V697 WeakPolarHBondContact CA-O 3.46Å; C662-V697 HydrophobicContact CB-CG1 4.33Å; C662-V697 PolarHBondContact N-O 3.49Å; C662-V697 PolarHBondContact O-N 2.87Å; T675-V697 HydrophobicContact CG2-CB 4.21Å; P676-V697 HydrophobicContact CB-CG1 4.13Å; P676-V697 HydrophobicContact CG-CG1 4.08Å; P676-V697 VanDerWaalsContact O-CG1 3.24Å; P676-V697 WeakPolarHBondContact O-CG1 3Å; F678-V697 HydrophobicContact CD2-CG1 3.94Å; F678-V697 HydrophobicContact CD2-CG2 4.19Å; F678-V697 HydrophobicContact CE2-CB 4.21Å; F678-V697 HydrophobicContact CE2-CG1 3.53Å; F678-V697 HydrophobicContact CE2-CG2 4.01Å; F678-V697 HydrophobicContact CZ-CG1 4.31Å
698	R	91	Very high	85.1	Confident	87 Å²	87	65.6 Å²	65.6	33%	0.328	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	135.7	179	-179.8	-177.3	-68.9	-147.8	5.9	110	E659 F660 E661 T689 T690 V692 V700	E659-R698 HydrophobicContact CG-CG 4.09Å; E659-R698 WeakPolarHBondContact OE1-CD 3.22Å; E659-R698 IonicContact OE1-CZ 3.2Å; E659-R698 IonicContact OE1-NE 3.28Å; E659-R698 PolarHBondContact OE1-NE 2.83Å; E659-R698 VanDerWaalsContact OE1-NE 3.14Å; E659-R698 IonicContact OE1-NH1 3.7Å; E659-R698 PolarHBondContact OE1-NH1 2.98Å; F660-R698 CarbonylContact O-C 3.55Å; F660-R698 WeakPolarHBondContact O-CA 3.45Å; E661-R698 HydrophobicContact CG-CB 4.22Å; E661-R698 HydrophobicContact CG-CG 4.19Å; E661-R698 IonicContact OE1-CZ 2.78Å; E661-R698 IonicContact OE1-NE 2.69Å; E661-R698 PolarHBondContact OE1-NE 2.89Å; E661-R698 IonicContact OE1-NH2 2.99Å; E661-R698 PolarHBondContact OE1-NH2 2.91Å; T689-R698 CarbonylContact C-O 3.56Å; T689-R698 VanDerWaalsContact CA-O 3.24Å; T689-R698 WeakPolarHBondContact CA-O 3.37Å; T690-R698 PolarHBondContact N-O 3.08Å; T690-R698 PolarHBondContact O-N 3.23Å; V692-R698 HydrophobicContact CG2-CB 3.74Å; R698-V700 HydrophobicContact CG-CG2 3.99Å
699	F	90.1	Very high	84.5	Confident	1 Å²	1	61.8 Å²	61.8	0%	0.004	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	133.1	173.6	173.4	-78.6	0	0	0	108.1	V658 E659 F660 F678 V680 F687 L701 V714	V658-F699 HydrophobicContact CG1-CE1 4.26Å; E659-F699 WeakPolarHBondContact CA-O 3.41Å; F660-F699 HydrophobicContact CB-CB 4.27Å; F660-F699 AromaticContact CD2-CD1 3.82Å; F660-F699 HydrophobicContact CD2-CD1 3.82Å; F660-F699 HydrophobicContact CD2-CE1 4.2Å; F660-F699 HydrophobicContact CD2-CG 4.45Å; F660-F699 PolarHBondContact N-O 2.78Å; F660-F699 PolarHBondContact O-N 3.25Å; F678-F699 HydrophobicContact CB-CD2 3.98Å; F678-F699 HydrophobicContact CD1-CB 4.06Å; F678-F699 HydrophobicContact CD1-CD2 4.18Å; F678-F699 HydrophobicContact CD1-CG 4.49Å; F678-F699 HydrophobicContact CD2-CB 3.75Å; F678-F699 HydrophobicContact CD2-CD2 4.37Å; F678-F699 HydrophobicContact CE1-CB 3.87Å; F678-F699 HydrophobicContact CE2-CB 3.54Å; F678-F699 HydrophobicContact CG-CB 3.99Å; F678-F699 AromaticContact CG-CD2 3.95Å; F678-F699 HydrophobicContact CG-CD2 3.95Å; F678-F699 HydrophobicContact CG-CG 4.45Å; F678-F699 HydrophobicContact CZ-CB 3.59Å; V680-F699 HydrophobicContact CG2-CE2 3.64Å; V680-F699 HydrophobicContact CG2-CZ 3.99Å; F687-F699 HydrophobicContact CB-CD2 4.11Å; F687-F699 HydrophobicContact CB-CE1 4.17Å; F687-F699 HydrophobicContact CB-CE2 3.54Å; F687-F699 HydrophobicContact CB-CZ 3.57Å; F687-F699 AromaticContact CD1-CE2 3.6Å; F687-F699 HydrophobicContact CD1-CE2 3.6Å; F687-F699 HydrophobicContact CD1-CZ 4.09Å; F687-F699 AromaticContact CD2-CD2 3.41Å; F687-F699 HydrophobicContact CD2-CD2 3.41Å; F687-F699 VanDerWaalsContact CD2-CD2 3.41Å; F687-F699 AromaticContact CD2-CE2 3.33Å; F687-F699 HydrophobicContact CD2-CE2 3.33Å; F687-F699 HydrophobicContact CD2-CG 4.4Å; F687-F699 HydrophobicContact CD2-CZ 4.27Å; F687-F699 HydrophobicContact CE1-CE2 4.08Å; F687-F699 AromaticContact CE2-CD2 3.88Å; F687-F699 HydrophobicContact CE2-CD2 3.88Å; F687-F699 AromaticContact CE2-CE2 3.85Å; F687-F699 HydrophobicContact CE2-CE2 3.85Å; F687-F699 AromaticContact CG-CD2 3.77Å; F687-F699 HydrophobicContact CG-CD2 3.77Å; F687-F699 AromaticContact CG-CE2 3.19Å; F687-F699 HydrophobicContact CG-CE2 3.19Å; F687-F699 AromaticContact CG-CZ 3.74Å; F687-F699 HydrophobicContact CG-CZ 3.74Å; F687-F699 HydrophobicContact CZ-CE2 4.19Å; F699-L701 HydrophobicContact CE1-CB 3.84Å; F699-L701 HydrophobicContact CZ-CB 4.45Å; F699-V714 HydrophobicContact CD2-CG1 4.17Å; F699-V714 HydrophobicContact CE2-CG1 4.05Å; F699-V714 HydrophobicContact CZ-CG1 4.43Å; F699-V714 HydrophobicContact CZ-CG2 4.19Å
700	V	88.2	Confident	84	Confident	19 Å²	19	62.2 Å²	62.2	12%	0.115	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	127.9	177.1	-168.6	0	0	0	0	110.4	E659 E688 R698 Q702	E659-V700 HydrophobicContact CG-CG2 4.42Å; E688-V700 HydrophobicContact CB-CB 4.48Å; E688-V700 PolarHBondContact N-O 3.05Å; E688-V700 PolarHBondContact O-N 3.42Å; R698-V700 HydrophobicContact CG-CG2 3.99Å; V700-Q702 HydrophobicContact CG1-CG 4.31Å
701	L	88.1	Confident	83.7	Confident	8 Å²	8	60 Å²	60	4%	0.042	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	85.4	177.1	174.3	63.7	0	0	0	108.6	P657 V658 I685 S686 F699 R703 G704 L705	P657-L701 WeakPolarHBondContact CA-O 3Å; V658-L701 HydrophobicContact CB-CB 4.13Å; V658-L701 HydrophobicContact CB-CD2 4.34Å; V658-L701 PolarHBondContact N-O 3.01Å; V658-L701 PolarHBondContact O-N 2.78Å; I685-L701 HydrophobicContact CG2-CD1 4Å; I685-L701 HydrophobicContact CG2-CD2 3.96Å; S686-L701 WeakPolarHBondContact O-CD1 3.16Å; F699-L701 HydrophobicContact CE1-CB 3.84Å; F699-L701 HydrophobicContact CZ-CB 4.45Å; L701-R703 PolarHBondContact O-N 3.05Å; L701-G704 WeakPolarHBondContact CD2-O 3.44Å; L701-G704 PolarHBondContact O-N 3.05Å; L701-L705 HydrophobicContact CD2-CD2 3.58Å; L701-L705 HydrophobicContact CD2-CG 3.77Å
702	Q	79.9	Confident	83.6	Confident	114 Å²	114	54.1 Å²	54.1	53%	0.533	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-19.6	-172	-57.9	-69.8	-1.5	0	0	114.9	E688 V700	E688-Q702 WeakPolarHBondContact OE2-CG 3.38Å; E688-Q702 PolarHBondContact OE2-NE2 3.27Å; V700-Q702 HydrophobicContact CG1-CG 4.31Å
703	R	78.1	Confident	83.7	Confident	215 Å²	215	53.6 Å²	53.6	81%	0.811	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	-1.3	-177.8	-62.6	-174.4	179.6	-167.7	-0.1	114	Y655 L701	Y655-R703 WeakPolarHBondContact CA-O 3.23Å; L701-R703 PolarHBondContact O-N 3.05Å
704	G	81.9	Confident	83.9	Confident	6 Å²	6	51.6 Å²	51.6	6%	0.062	26%	0.256	C	S	.	.			trans	59.8	-158	-171	0	0	0	0	0	113.9	Q656 L701	Q656-G704 WeakPolarHBondContact O-CA 2.89Å; L701-G704 WeakPolarHBondContact CD2-O 3.44Å; L701-G704 PolarHBondContact O-N 3.05Å
705	L	80.5	Confident	84.2	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.005	24%	0.243	C	C	.	.			trans	-124.7	147.7	177.8	-71.4	-174.6	0	0	0	111.7	P654 Y655 I685 L701 Q709 T712 I729 V731	P654-L705 CarbonylContact C-O 3.58Å; P654-L705 WeakPolarHBondContact CA-O 3.47Å; Y655-L705 PolarHBondContact N-O 2.87Å; I685-L705 HydrophobicContact CD1-CD2 3.66Å; I685-L705 HydrophobicContact CG1-CD2 3.92Å; I685-L705 HydrophobicContact CG2-CD2 4.28Å; L701-L705 HydrophobicContact CD2-CD2 3.58Å; L701-L705 HydrophobicContact CD2-CG 3.77Å; L705-Q709 HydrophobicContact CB-CB 3.99Å; L705-Q709 HydrophobicContact CD1-CB 4.21Å; L705-Q709 HydrophobicContact CD2-CB 4.03Å; L705-Q709 HydrophobicContact CD2-CG 4.47Å; L705-Q709 HydrophobicContact CG-CB 4.31Å; L705-T712 HydrophobicContact CD1-CG2 3.97Å; L705-I729 HydrophobicContact CD1-CB 4.07Å; L705-I729 HydrophobicContact CD1-CD1 3.48Å; L705-I729 VanDerWaalsContact CD1-CD1 3.48Å; L705-I729 HydrophobicContact CD1-CG1 4.39Å; L705-I729 HydrophobicContact CD1-CG2 3.95Å; L705-I729 HydrophobicContact CG-CD1 4.42Å; L705-V731 HydrophobicContact CB-CG2 4.13Å
706	G	72.8	Confident	84.2	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.236	C	C	.	.			trans	-77.3	166.9	171.5	0	0	0	0	0	113	D708 Q709	G706-D708 PolarHBondContact O-N 2.86Å; G706-Q709 WeakPolarHBondContact O-CB 3.27Å; G706-Q709 PolarHBondContact O-N 2.88Å
707	P	67.1	Low	84.2	Confident	73 Å²	73	45.7 Å²	45.7	47%	0.474	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-60.4	-26.8	173.7	-21	33.1	0	0	0	113.3	P654 Q709 N710	P654-P707 HydrophobicContact CB-CG 4.12Å; P654-P707 HydrophobicContact CG-CG 3.97Å; P707-Q709 PolarHBondContact O-N 2.96Å; P707-N710 PolarHBondContact O-N 2.76Å
708	D	75.5	Confident	83.8	Confident	102 Å²	102	46.1 Å²	46.1	55%	0.545	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-73.1	-2.4	174.2	72.7	-64.6	0	0	0	113.9	R684 G706	R684-D708 IonicContact CZ-OD2 3.58Å; R684-D708 IonicContact NH1-OD2 3.69Å; R684-D708 PolarHBondContact NH1-OD2 2.86Å; R684-D708 IonicContact NH2-OD2 3.54Å; R684-D708 PolarHBondContact NH2-OD2 3.15Å; G706-D708 PolarHBondContact O-N 2.86Å
709	Q	78.7	Confident	83.3	Confident	29 Å²	29	48.4 Å²	48.4	14%	0.136	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-117.9	12.8	-179.8	-57.6	179.2	-64.9	0	0	111.9	L705 G706 P707 T712	L705-Q709 HydrophobicContact CB-CB 3.99Å; L705-Q709 HydrophobicContact CD1-CB 4.21Å; L705-Q709 HydrophobicContact CD2-CB 4.03Å; L705-Q709 HydrophobicContact CD2-CG 4.47Å; L705-Q709 HydrophobicContact CG-CB 4.31Å; G706-Q709 WeakPolarHBondContact O-CB 3.27Å; G706-Q709 PolarHBondContact O-N 2.88Å; P707-Q709 PolarHBondContact O-N 2.96Å; Q709-T712 WeakPolarHBondContact O-CB 3.35Å; Q709-T712 PolarHBondContact O-N 2.79Å; Q709-T712 PolarHBondContact O-OG1 2.84Å
710	N	78.6	Confident	82.8	Confident	91 Å²	91	53 Å²	53	49%	0.487	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	136.6	172	-169.5	9.1	0	0	0	111.1	P707 T730 V731	P707-N710 PolarHBondContact O-N 2.76Å; N710-T730 WeakPolarHBondContact OD1-CA 3.45Å; N710-V731 HydrophobicContact CB-CB 4Å; N710-V731 HydrophobicContact CB-CG2 4.38Å; N710-V731 PolarHBondContact OD1-N 3Å
711	G	82.6	Confident	81.9	Confident	33 Å²	33	55.6 Å²	55.6	34%	0.34	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.5	16.1	-175.3	0	0	0	0	0	114.3	V713 I729	G711-V713 PolarHBondContact O-N 2.82Å; G711-I729 WeakPolarHBondContact CA-O 3.21Å; G711-I729 PolarHBondContact N-O 2.89Å
712	T	86.4	Confident	81.2	Confident	16 Å²	16	57.1 Å²	57.1	10%	0.098	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	129.8	172.7	-72.8	0	0	0	0	110.5	V680 I685 L705 Q709 I729	V680-T712 HydrophobicContact CG1-CG2 4.07Å; I685-T712 HydrophobicContact CD1-CG2 3.55Å; L705-T712 HydrophobicContact CD1-CG2 3.97Å; Q709-T712 WeakPolarHBondContact O-CB 3.35Å; Q709-T712 PolarHBondContact O-N 2.79Å; Q709-T712 PolarHBondContact O-OG1 2.84Å; T712-I729 HydrophobicContact CG2-CD1 4.02Å; T712-I729 PolarHBondContact N-O 2.92Å; T712-I729 PolarHBondContact O-N 3.33Å
713	V	90.1	Very high	81	Confident	59 Å²	59	61.8 Å²	61.8	36%	0.358	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	129.1	175	-177.6	0	0	0	0	110.1	G711 E715 A727	G711-V713 PolarHBondContact O-N 2.82Å; V713-E715 HydrophobicContact CG1-CG 4.17Å; V713-A727 WeakPolarHBondContact CA-O 3.48Å
714	V	89.6	Confident	81.3	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.006	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	126.5	171	-177.6	0	0	0	0	107.8	I645 F660 F678 V680 F699 S726 A727 I729	I645-V714 HydrophobicContact CD1-CB 4.49Å; I645-V714 HydrophobicContact CD1-CG1 4.17Å; F660-V714 HydrophobicContact CD2-CG1 4.44Å; F660-V714 HydrophobicContact CD2-CG2 4.3Å; F660-V714 HydrophobicContact CE2-CB 4.31Å; F660-V714 HydrophobicContact CE2-CG2 3.81Å; F678-V714 HydrophobicContact CD1-CG1 3.83Å; F678-V714 HydrophobicContact CE1-CG1 4.39Å; V680-V714 HydrophobicContact CG2-CG1 4.22Å; V680-V714 HydrophobicContact CG2-CG2 4.12Å; F699-V714 HydrophobicContact CD2-CG1 4.17Å; F699-V714 HydrophobicContact CE2-CG1 4.05Å; F699-V714 HydrophobicContact CZ-CG1 4.43Å; F699-V714 HydrophobicContact CZ-CG2 4.19Å; V714-S726 CarbonylContact O-C 3.56Å; V714-S726 WeakPolarHBondContact O-CA 3.29Å; V714-A727 PolarHBondContact N-O 2.85Å; V714-A727 PolarHBondContact O-N 2.79Å; V714-I729 HydrophobicContact CG2-CD1 3.94Å
715	E	92.6	Very high	81.5	Confident	60 Å²	60	55.7 Å²	55.7	28%	0.28	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	137.4	-179.1	-61.4	-179.5	114.1	0	0	110.2	F678 Q679 V713 L717	F678-E715 CarbonylContact C-O 3.54Å; F678-E715 WeakPolarHBondContact CA-O 3.16Å; Q679-E715 HydrophobicContact CB-CB 4.47Å; Q679-E715 PolarHBondContact N-O 2.86Å; Q679-E715 PolarHBondContact O-N 2.81Å; V713-E715 HydrophobicContact CG1-CG 4.17Å; E715-L717 HydrophobicContact CB-CD2 4.46Å
716	C	91.7	Very high	82	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	132.1	169	-178.6	0	0	0	0	110.3	L643 I645 C662 R677 F678 P724 A725	L643-C716 WeakPolarHBondContact CD1-O 3.45Å; I645-C716 HydrophobicContact CB-CB 4.44Å; I645-C716 HydrophobicContact CD1-CB 4.4Å; C662-C716 HydrophobicContact CB-CB 3.7Å; C662-C716 WeakPolarHBondContact CB-SG 3.37Å; C662-C716 WeakPolarHBondContact SG-CB 3.48Å; C662-C716 CovalentContact SG-SG 2.01Å; C662-C716 PolarHBondContact SG-SG 2.97Å; R677-C716 WeakPolarHBondContact O-CA 3.42Å; F678-C716 HydrophobicContact CD1-CB 4.42Å; F678-C716 HydrophobicContact CE1-CB 4.45Å; C716-P724 WeakPolarHBondContact O-CA 3.39Å; C716-A725 HydrophobicContact CB-CB 4.48Å; C716-A725 PolarHBondContact N-O 3.32Å; C716-A725 PolarHBondContact O-N 3.19Å
717	L	92.2	Very high	82.4	Confident	35 Å²	35	58.6 Å²	58.6	18%	0.183	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	163.7	-170.4	-49.6	174.3	0	0	0	110.9	P676 R677 Q679 E715 P724	P676-L717 WeakPolarHBondContact CA-O 3.37Å; R677-L717 HydrophobicContact CG-CB 3.89Å; R677-L717 PolarHBondContact N-O 2.79Å; R677-L717 PolarHBondContact O-N 2.73Å; Q679-L717 HydrophobicContact CB-CD1 4.05Å; E715-L717 HydrophobicContact CB-CD2 4.46Å; L717-P724 HydrophobicContact CD2-CB 3.61Å
718	S	85.3	Confident	83.4	Confident	18 Å²	18	57.7 Å²	57.7	13%	0.126	32%	0.316	C	S	.	.			trans	-128.7	174.9	165.9	-167.9	0	0	0	0	110.7	F674 R677 E720 S722	F674-S718 WeakPolarHBondContact CD2-OG 3.24Å; F674-S718 WeakPolarHBondContact CE2-OG 3.41Å; F674-S718 WeakPolarHBondContact CZ-OG 3.2Å; R677-S718 PolarHBondContact NH2-O 2.87Å; S718-E720 PolarHBondContact OG-N 3.32Å; S718-S722 WeakPolarHBondContact CB-OG 3.3Å
719	D	80.1	Confident	83.7	Confident	136 Å²	136	52.9 Å²	52.9	73%	0.727	29%	0.29	S	S	*	.	S	Bend	trans	-93.5	-17.6	159.2	-68.1	-57	0	0	0	112.1	R677	R677-D719 IonicContact CZ-OD1 3.68Å; R677-D719 IonicContact CZ-OD2 2.8Å; R677-D719 IonicContact NH1-OD1 3.49Å; R677-D719 PolarHBondContact NH1-OD1 2.03Å; R677-D719 IonicContact NH1-OD2 2.68Å; R677-D719 PolarHBondContact NH1-OD2 3.39Å; R677-D719 IonicContact NH2-OD1 2.69Å; R677-D719 PolarHBondContact NH2-OD1 2.87Å; R677-D719 IonicContact NH2-OD2 3.55Å
720	E	79.3	Confident	83.8	Confident	98 Å²	98	52.7 Å²	52.7	46%	0.458	29%	0.291	S	S	.	.	S	Bend	trans	-85	152.1	174.6	-67.5	-66	167.6	0	0	112.2	Y641 F674 S718 S722	Y641-E720 HydrophobicContact CD2-CB 4.17Å; Y641-E720 HydrophobicContact CE2-CB 4.39Å; F674-E720 HydrophobicContact CD1-CB 3.89Å; F674-E720 HydrophobicContact CD1-CG 3.47Å; F674-E720 VanDerWaalsContact CD1-CG 3.47Å; F674-E720 HydrophobicContact CE1-CB 3.58Å; F674-E720 HydrophobicContact CE1-CG 3.73Å; F674-E720 HydrophobicContact CG-CB 4.5Å; F674-E720 HydrophobicContact CG-CG 3.99Å; F674-E720 HydrophobicContact CZ-CB 4.01Å; F674-E720 HydrophobicContact CZ-CG 4.48Å; S718-E720 PolarHBondContact OG-N 3.32Å; E720-S722 PolarHBondContact O-N 2.96Å; E720-S722 PolarHBondContact O-OG 3.16Å
721	P	69.6	Low	83.5	Confident	73 Å²	73	49 Å²	49	47%	0.474	27%	0.272	S	S	.	.	S	Bend	trans	-52.7	109.3	-179.2	-28.3	36.3	0	0	0	113.4	Y641	Y641-P721 PolarHBondContact N-O 2.89Å
722	S	73.2	Confident	82.5	Confident	39 Å²	39	51.9 Å²	51.9	27%	0.273	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	158.3	-173.5	49.6	0	0	0	0	110.8	Y641 S718 E720	Y641-S722 WeakPolarHBondContact O-CA 3.41Å; Y641-S722 WeakPolarHBondContact O-CB 3.4Å; S718-S722 WeakPolarHBondContact CB-OG 3.3Å; E720-S722 PolarHBondContact O-N 2.96Å; E720-S722 PolarHBondContact O-OG 3.16Å
723	R	75.1	Confident	81	Confident	212 Å²	212	55 Å²	55	80%	0.8	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88	137.1	164.8	-70.9	-172.8	179.1	-167.1	0.9	109
724	P	85.3	Confident	79.4	Confident	81 Å²	81	56.1 Å²	56.1	53%	0.526	30%	0.296	S	S	.	.			trans	-63.4	145.7	174.9	30	-36.5	0	0	0	110.2	C716 L717	C716-P724 WeakPolarHBondContact O-CA 3.39Å; L717-P724 HydrophobicContact CD2-CB 3.61Å
725	A	86.3	Confident	78	Confident	13 Å²	13	57 Å²	57	11%	0.107	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	125	177	0	0	0	0	0	109.8	L643 I645 C716	L643-A725 HydrophobicContact CB-CB 3.87Å; L643-A725 WeakPolarHBondContact O-CB 3.45Å; I645-A725 HydrophobicContact CB-CB 4.31Å; I645-A725 HydrophobicContact CG2-CB 3.92Å; C716-A725 HydrophobicContact CB-CB 4.48Å; C716-A725 PolarHBondContact N-O 3.32Å; C716-A725 PolarHBondContact O-N 3.19Å
726	S	90	Very high	75.7	Confident	61 Å²	61	58.2 Å²	58.2	43%	0.427	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	138.9	-175.1	-50.9	0	0	0	0	111.2	V714	V714-S726 CarbonylContact O-C 3.56Å; V714-S726 WeakPolarHBondContact O-CA 3.29Å
727	A	81.6	Confident	73.3	Confident	1 Å²	1	66.5 Å²	66.5	1%	0.008	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	146.9	165.7	0	0	0	0	0	110.4	I645 P647 Q648 F660 V713 V714	I645-A727 HydrophobicContact CD1-CB 3.64Å; I645-A727 HydrophobicContact CG1-CB 4.03Å; I645-A727 HydrophobicContact CG2-CB 4.06Å; P647-A727 WeakPolarHBondContact O-CB 3.09Å; Q648-A727 VanDerWaalsContact O-CA 3.22Å; Q648-A727 WeakPolarHBondContact O-CA 3.41Å; F660-A727 HydrophobicContact CD1-CB 3.97Å; F660-A727 HydrophobicContact CE1-CB 3.52Å; F660-A727 HydrophobicContact CZ-CB 3.93Å; V713-A727 WeakPolarHBondContact CA-O 3.48Å; V714-A727 PolarHBondContact N-O 2.85Å; V714-A727 PolarHBondContact O-N 2.79Å
728	I	87.4	Confident	71.1	Confident	53 Å²	53	67.7 Å²	67.7	27%	0.272	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	132.5	173.8	-175.9	168.5	0	0	0	110.4	Q648 R649 L650	Q648-I728 PolarHBondContact O-N 3.27Å; R649-I728 WeakPolarHBondContact CA-O 3.36Å; R649-I728 HydrophobicContact CB-CG2 4.39Å; R649-I728 HydrophobicContact CG-CG2 3.8Å; L650-I728 PolarHBondContact N-O 2.84Å
729	I	82.9	Confident	70.1	Confident	1 Å²	1	68.1 Å²	68.1	1%	0.005	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	114.9	173.2	-53.8	158.1	0	0	0	107.6	L650 V652 V658 F660 L705 G711 T712 V714 V731	L650-I729 CarbonylContact O-C 3.5Å; L650-I729 WeakPolarHBondContact O-CA 3.49Å; V652-I729 HydrophobicContact CG2-CG2 3.67Å; V658-I729 HydrophobicContact CG1-CD1 3.94Å; V658-I729 HydrophobicContact CG1-CG1 4.32Å; V658-I729 HydrophobicContact CG2-CD1 4.5Å; V658-I729 HydrophobicContact CG2-CG2 4.32Å; F660-I729 HydrophobicContact CE2-CD1 3.98Å; F660-I729 HydrophobicContact CE2-CG1 3.85Å; F660-I729 HydrophobicContact CZ-CD1 4.3Å; F660-I729 HydrophobicContact CZ-CG1 3.64Å; L705-I729 HydrophobicContact CD1-CB 4.07Å; L705-I729 HydrophobicContact CD1-CD1 3.48Å; L705-I729 VanDerWaalsContact CD1-CD1 3.48Å; L705-I729 HydrophobicContact CD1-CG1 4.39Å; L705-I729 HydrophobicContact CD1-CG2 3.95Å; L705-I729 HydrophobicContact CG-CD1 4.42Å; G711-I729 WeakPolarHBondContact CA-O 3.21Å; G711-I729 PolarHBondContact N-O 2.89Å; T712-I729 HydrophobicContact CG2-CD1 4.02Å; T712-I729 PolarHBondContact N-O 2.92Å; T712-I729 PolarHBondContact O-N 3.33Å; V714-I729 HydrophobicContact CG2-CD1 3.94Å; I729-V731 HydrophobicContact CG2-CG2 4.28Å
730	T	80.4	Confident	69.3	Low	26 Å²	26	64 Å²	64	16%	0.16	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	139.8	164.8	60.5	0	0	0	0	109.2	L650 T651 V652 N710 E732	L650-T730 PolarHBondContact O-N 2.84Å; T651-T730 WeakPolarHBondContact CA-O 3.35Å; T651-T730 WeakPolarHBondContact CA-OG1 3.47Å; T651-T730 PolarHBondContact OG1-OG1 3.38Å; T651-T730 VanDerWaalsContact OG1-OG1 3.12Å; V652-T730 PolarHBondContact N-O 3.04Å; N710-T730 WeakPolarHBondContact OD1-CA 3.45Å; T730-E732 WeakPolarHBondContact CB-OE1 3.42Å; T730-E732 PolarHBondContact OG1-OE1 3.06Å
731	V	71.3	Confident	68.7	Low	14 Å²	14	61 Å²	61	9%	0.085	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	103.1	-176.8	179.2	0	0	0	0	107.7	V652 P654 L705 N710 I729	V652-V731 HydrophobicContact CG2-CG2 4.24Å; V652-V731 CarbonylContact O-C 3.47Å; V652-V731 VanDerWaalsContact O-CA 3.3Å; V652-V731 WeakPolarHBondContact O-CA 3.26Å; P654-V731 HydrophobicContact CB-CG1 4.2Å; P654-V731 HydrophobicContact CG-CG1 3.56Å; L705-V731 HydrophobicContact CB-CG2 4.13Å; N710-V731 HydrophobicContact CB-CB 4Å; N710-V731 HydrophobicContact CB-CG2 4.38Å; N710-V731 PolarHBondContact OD1-N 3Å; I729-V731 HydrophobicContact CG2-CG2 4.28Å
732	E	61.5	Low	69.1	Low	92 Å²	92	57.5 Å²	57.5	43%	0.43	32%	0.319	S	S	.	.			trans	-133.4	144	-167.1	-65.1	171.3	-132.8	0	0	111.3	T651 V652 R653 T730 I734	T651-E732 HydrophobicContact CG2-CB 3.7Å; T651-E732 HydrophobicContact CG2-CG 3.91Å; T651-E732 WeakPolarHBondContact CG2-OE1 3.46Å; V652-E732 PolarHBondContact O-N 3.36Å; R653-E732 WeakPolarHBondContact CA-O 3.36Å; T730-E732 WeakPolarHBondContact CB-OE1 3.42Å; T730-E732 PolarHBondContact OG1-OE1 3.06Å; E732-I734 PolarHBondContact O-N 2.91Å
733	D	56.8	Low	69.1	Low	81 Å²	81	62.1 Å²	62.1	43%	0.433	33%	0.331	S	S	.	.			trans	-95.9	84.3	-170.6	-87	-25.9	0	0	0	113.7	P654 C735 R741	P654-D733 WeakPolarHBondContact CD-OD1 3.4Å; D733-C735 PolarHBondContact O-N 2.87Å; D733-R741 HydrophobicContact CB-CB 4.26Å; D733-R741 VanDerWaalsContact CG-CD 3.41Å; D733-R741 VanDerWaalsContact CG-CZ 3.45Å; D733-R741 VanDerWaalsContact CG-NE 3.31Å; D733-R741 WeakPolarHBondContact OD1-CD 3.34Å; D733-R741 IonicContact OD1-CZ 3.6Å; D733-R741 IonicContact OD1-NE 2.65Å; D733-R741 PolarHBondContact OD1-NE 2.83Å; D733-R741 IonicContact OD1-NH1 2.74Å; D733-R741 PolarHBondContact OD1-NH1 2.84Å; D733-R741 IonicContact OD1-NH2 3.77Å; D733-R741 IonicContact OD2-CZ 2.65Å; D733-R741 VanDerWaalsContact OD2-CZ 3.24Å; D733-R741 IonicContact OD2-NE 3.05Å; D733-R741 PolarHBondContact OD2-NE 3.3Å; D733-R741 VanDerWaalsContact OD2-NE 3.08Å; D733-R741 IonicContact OD2-NH1 2.67Å; D733-R741 IonicContact OD2-NH2 2.69Å
734	I	55.4	Low	69	Low	83 Å²	83	54.2 Å²	54.2	43%	0.426	31%	0.308	S	S	.	.			trans	-79.2	78.7	178	-45.7	168	0	0	0	110.3	T651 R653 E732	T651-I734 HydrophobicContact CG2-CD1 4.41Å; R653-I734 HydrophobicContact CG-CB 4.41Å; R653-I734 PolarHBondContact NE-O 3.47Å; R653-I734 PolarHBondContact NH1-O 2.88Å; R653-I734 PolarHBondContact NH2-O 2.81Å; E732-I734 PolarHBondContact O-N 2.91Å
735	C	60.5	Low	68.1	Low	21 Å²	21	52 Å²	52	14%	0.142	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-81.1	144.6	160	-69.6	0	0	0	0	110	D733 S739 R740 R741 C747	D733-C735 PolarHBondContact O-N 2.87Å; C735-S739 WeakPolarHBondContact CB-OG 3.44Å; C735-R740 VanDerWaalsContact SG-C 3.58Å; C735-R741 WeakPolarHBondContact SG-CB 3.26Å; C735-R741 VanDerWaalsContact SG-CG 3.51Å; C735-C747 WeakPolarHBondContact CA-SG 3.41Å; C735-C747 HydrophobicContact CB-CB 3.91Å; C735-C747 WeakPolarHBondContact CB-SG 3Å; C735-C747 WeakPolarHBondContact SG-CB 3.41Å; C735-C747 CovalentContact SG-SG 2.05Å; C735-C747 PolarHBondContact SG-SG 3.35Å
736	P	44.9	Very low	67.5	Low	84 Å²	84	54.3 Å²	54.3	55%	0.545	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-63.7	160.4	179.2	25.2	-33.2	0	0	0	112.3	G738 S739	P736-G738 PolarHBondContact O-N 3.43Å; P736-S739 WeakPolarHBondContact CD-OG 3.46Å; P736-S739 WeakPolarHBondContact CG-OG 3.37Å; P736-S739 WeakPolarHBondContact O-CB 3.08Å; P736-S739 PolarHBondContact O-N 3.01Å; P736-S739 PolarHBondContact O-OG 2.85Å
737	D	39.6	Very low	66.8	Low	174 Å²	174	53.7 Å²	53.7	93%	0.93	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	136.3	-176.8	-64.4	-53.7	0	0	0	112.8	S739	D737-S739 VanDerWaalsContact C-N 3.3Å; D737-S739 PolarHBondContact O-N 2.8Å
738	G	46.9	Very low	66.4	Low	61 Å²	61	54.4 Å²	54.4	63%	0.629	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.8	14.1	-173.4	0	0	0	0	0	114.7	P736 P749 A750	P736-G738 PolarHBondContact O-N 3.43Å; G738-P749 CarbonylContact O-C 3.59Å; G738-A750 WeakPolarHBondContact O-CB 3.22Å; G738-A750 PolarHBondContact O-N 3Å
739	S	64.6	Low	65.6	Low	26 Å²	26	55.8 Å²	55.8	18%	0.182	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	157.7	174	75	0	0	0	0	113.1	C735 P736 D737 L748	C735-S739 WeakPolarHBondContact CB-OG 3.44Å; P736-S739 WeakPolarHBondContact CD-OG 3.46Å; P736-S739 WeakPolarHBondContact CG-OG 3.37Å; P736-S739 WeakPolarHBondContact O-CB 3.08Å; P736-S739 PolarHBondContact O-N 3.01Å; P736-S739 PolarHBondContact O-OG 2.85Å; D737-S739 VanDerWaalsContact C-N 3.3Å; D737-S739 PolarHBondContact O-N 2.8Å; S739-L748 CarbonylContact C-O 3.41Å; S739-L748 VanDerWaalsContact CA-O 3.22Å; S739-L748 WeakPolarHBondContact CA-O 3.45Å; S739-L748 WeakPolarHBondContact CB-O 3.18Å
740	R	63.2	Low	64.6	Low	51 Å²	51	57.8 Å²	57.8	19%	0.192	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	152.2	-169.6	-60.8	176.4	70.7	-166	-1.9	109.5	C735 C747 L748 A750 F753 M770	C735-R740 VanDerWaalsContact SG-C 3.58Å; R740-C747 WeakPolarHBondContact O-CA 3.18Å; R740-L748 PolarHBondContact N-O 2.86Å; R740-L748 PolarHBondContact O-N 3.16Å; R740-A750 HydrophobicContact CG-CB 3.92Å; R740-F753 HydrophobicContact CB-CD2 3.8Å; R740-F753 HydrophobicContact CB-CE1 4.46Å; R740-F753 HydrophobicContact CB-CE2 3.49Å; R740-F753 VanDerWaalsContact CB-CE2 3.49Å; R740-F753 HydrophobicContact CB-CG 4.44Å; R740-F753 HydrophobicContact CB-CZ 3.87Å; R740-M770 PolarHBondContact NH2-O 2.98Å
741	R	65.9	Low	63.8	Low	33 Å²	33	58.9 Å²	58.9	13%	0.125	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	132.2	-175.4	-141.8	-172.2	85.2	163.1	5.4	114.4	P654 D733 C735 G745 Q746	P654-R741 VanDerWaalsContact CG-NH1 3.31Å; D733-R741 HydrophobicContact CB-CB 4.26Å; D733-R741 VanDerWaalsContact CG-CD 3.41Å; D733-R741 VanDerWaalsContact CG-CZ 3.45Å; D733-R741 VanDerWaalsContact CG-NE 3.31Å; D733-R741 WeakPolarHBondContact OD1-CD 3.34Å; D733-R741 IonicContact OD1-CZ 3.6Å; D733-R741 IonicContact OD1-NE 2.65Å; D733-R741 PolarHBondContact OD1-NE 2.83Å; D733-R741 IonicContact OD1-NH1 2.74Å; D733-R741 PolarHBondContact OD1-NH1 2.84Å; D733-R741 IonicContact OD1-NH2 3.77Å; D733-R741 IonicContact OD2-CZ 2.65Å; D733-R741 VanDerWaalsContact OD2-CZ 3.24Å; D733-R741 IonicContact OD2-NE 3.05Å; D733-R741 PolarHBondContact OD2-NE 3.3Å; D733-R741 VanDerWaalsContact OD2-NE 3.08Å; D733-R741 IonicContact OD2-NH1 2.67Å; D733-R741 IonicContact OD2-NH2 2.69Å; C735-R741 WeakPolarHBondContact SG-CB 3.26Å; C735-R741 VanDerWaalsContact SG-CG 3.51Å; R741-G745 WeakPolarHBondContact CD-O 3.32Å; R741-G745 VanDerWaalsContact CZ-CA 3.42Å; R741-Q746 WeakPolarHBondContact CA-O 3.28Å; R741-Q746 WeakPolarHBondContact CG-O 3.25Å
742	C	78.2	Confident	64.1	Low	0 Å²	0	63.4 Å²	63.4	0%	0	37%	0.368	C	S	.	.			trans	-59.7	145.6	158.9	-54.6	0	0	0	0	110.4	S744 G745 Q746 C760 S764	C742-S744 WeakPolarHBondContact CB-OG 3.46Å; C742-S744 PolarHBondContact O-N 2.71Å; C742-G745 PolarHBondContact O-N 2.82Å; C742-G745 VanDerWaalsContact O-N 3.1Å; C742-Q746 HydrophobicContact CB-CB 4.08Å; C742-Q746 WeakPolarHBondContact CB-O 3.46Å; C742-Q746 PolarHBondContact N-O 3.14Å; C742-Q746 PolarHBondContact SG-O 3.49Å; C742-Q746 VanDerWaalsContact SG-O 3.33Å; C742-C760 VanDerWaalsContact CA-SG 3.59Å; C742-C760 HydrophobicContact CB-CB 3.69Å; C742-C760 WeakPolarHBondContact CB-SG 3.38Å; C742-C760 WeakPolarHBondContact SG-CA 3.24Å; C742-C760 WeakPolarHBondContact SG-CB 3.29Å; C742-C760 CovalentContact SG-SG 2.02Å; C742-C760 PolarHBondContact SG-SG 2.89Å; C742-S764 WeakPolarHBondContact CA-OG 3.34Å
743	R	73.1	Confident	64.5	Low	137 Å²	137	59.7 Å²	59.7	52%	0.517	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-26.1	167.4	169.9	-165.8	-54.7	153.4	5.1	111.4	G745 D762 S764 D767	R743-G745 PolarHBondContact O-N 3.15Å; R743-D762 WeakPolarHBondContact CB-OD2 3.34Å; R743-D762 WeakPolarHBondContact CD-OD2 3.25Å; R743-D762 WeakPolarHBondContact CG-OD2 3.17Å; R743-S764 WeakPolarHBondContact CB-OG 3.36Å; R743-S764 PolarHBondContact N-OG 2.89Å; R743-D767 IonicContact CZ-OD2 3.95Å; R743-D767 IonicContact NH1-OD2 2.63Å; R743-D767 IonicContact NH2-OD2 3.66Å; R743-D767 PolarHBondContact NH2-OD2 2.93Å
744	S	74.2	Confident	65.3	Low	46 Å²	46	58.1 Å²	58.1	32%	0.322	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-30.9	172.4	66.8	0	0	0	0	116	C742 D762	C742-S744 WeakPolarHBondContact CB-OG 3.46Å; C742-S744 PolarHBondContact O-N 2.71Å; S744-D762 PolarHBondContact N-OD1 2.03Å; S744-D762 PolarHBondContact N-OD2 3.06Å
745	G	64.9	Low	66.2	Low	35 Å²	35	57.2 Å²	57.2	36%	0.361	34%	0.341	S	S	.	.	S	Bend	trans	129	-26.4	-168.9	0	0	0	0	0	115.1	R741 C742 R743	R741-G745 WeakPolarHBondContact CD-O 3.32Å; R741-G745 VanDerWaalsContact CZ-CA 3.42Å; C742-G745 PolarHBondContact O-N 2.82Å; C742-G745 VanDerWaalsContact O-N 3.1Å; R743-G745 PolarHBondContact O-N 3.15Å
746	Q	74.4	Confident	66.8	Low	61 Å²	61	59.3 Å²	59.3	29%	0.285	37%	0.367	S	S	.	.			trans	-78	132.8	-170.8	-179.7	-175.6	1	0	0	112.1	R741 C742 L748 D759 D761	R741-Q746 WeakPolarHBondContact CA-O 3.28Å; R741-Q746 WeakPolarHBondContact CG-O 3.25Å; C742-Q746 HydrophobicContact CB-CB 4.08Å; C742-Q746 WeakPolarHBondContact CB-O 3.46Å; C742-Q746 PolarHBondContact N-O 3.14Å; C742-Q746 PolarHBondContact SG-O 3.49Å; C742-Q746 VanDerWaalsContact SG-O 3.33Å; Q746-L748 HydrophobicContact CG-CD2 4.18Å; Q746-L748 HydrophobicContact CG-CG 4.42Å; Q746-D759 PolarHBondContact NE2-O 3.33Å; Q746-D759 PolarHBondContact OE1-O 2.83Å; Q746-D761 VanDerWaalsContact OE1-N 3.09Å
747	C	74.4	Confident	68.4	Low	48 Å²	48	57.2 Å²	57.2	32%	0.324	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	134.6	167.8	-67.4	0	0	0	0	110.1	C735 R740	C735-C747 WeakPolarHBondContact CA-SG 3.41Å; C735-C747 HydrophobicContact CB-CB 3.91Å; C735-C747 WeakPolarHBondContact CB-SG 3Å; C735-C747 WeakPolarHBondContact SG-CB 3.41Å; C735-C747 CovalentContact SG-SG 2.05Å; C735-C747 PolarHBondContact SG-SG 3.35Å; R740-C747 WeakPolarHBondContact O-CA 3.18Å
748	L	73	Confident	70.7	Confident	15 Å²	15	57.1 Å²	57.1	8%	0.079	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	148.8	174	-60.3	172	0	0	0	109.9	S739 R740 Q746 R752 F753 D759 C760	S739-L748 CarbonylContact C-O 3.41Å; S739-L748 VanDerWaalsContact CA-O 3.22Å; S739-L748 WeakPolarHBondContact CA-O 3.45Å; S739-L748 WeakPolarHBondContact CB-O 3.18Å; R740-L748 PolarHBondContact N-O 2.86Å; R740-L748 PolarHBondContact O-N 3.16Å; Q746-L748 HydrophobicContact CG-CD2 4.18Å; Q746-L748 HydrophobicContact CG-CG 4.42Å; L748-R752 HydrophobicContact CB-CB 3.89Å; L748-R752 HydrophobicContact CD1-CB 4.27Å; L748-F753 HydrophobicContact CB-CE2 4.15Å; L748-F753 HydrophobicContact CD1-CE2 4.29Å; L748-D759 HydrophobicContact CD1-CB 3.59Å; L748-D759 HydrophobicContact CD2-CB 4.03Å; L748-D759 HydrophobicContact CG-CB 4.47Å; L748-C760 VanDerWaalsContact CD1-SG 3.58Å
749	P	72.2	Confident	72.6	Confident	83 Å²	83	56.5 Å²	56.5	54%	0.539	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-48.9	145.9	169.6	-27.2	35.3	0	0	0	112.3	G738 G751 R752	G738-P749 CarbonylContact O-C 3.59Å; P749-G751 PolarHBondContact O-N 3.03Å; P749-R752 HydrophobicContact CB-CG 4.35Å; P749-R752 HydrophobicContact CG-CG 4.49Å; P749-R752 WeakPolarHBondContact O-CB 3.37Å; P749-R752 PolarHBondContact O-N 2.69Å
750	A	60.8	Low	73.5	Confident	42 Å²	42	55.4 Å²	55.4	35%	0.347	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-26.5	-168.9	0	0	0	0	0	114.1	G738 R740 R752	G738-A750 WeakPolarHBondContact O-CB 3.22Å; G738-A750 PolarHBondContact O-N 3Å; R740-A750 HydrophobicContact CG-CB 3.92Å; A750-R752 VanDerWaalsContact C-N 3.31Å
751	G	64	Low	74.4	Confident	50 Å²	50	59.5 Å²	59.5	52%	0.515	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	3.3	173.4	0	0	0	0	0	115.8	P749 F753	P749-G751 PolarHBondContact O-N 3.03Å; G751-F753 VanDerWaalsContact C-N 3.32Å
752	R	77.9	Confident	75.2	Confident	108 Å²	108	60.3 Å²	60.3	41%	0.408	35%	0.35	S	S	.	.	S	Bend	trans	-98.3	27.2	170	-68.1	-66	-158.1	133.9	8.6	112.2	L748 P749 A750 D755 D759	L748-R752 HydrophobicContact CB-CB 3.89Å; L748-R752 HydrophobicContact CD1-CB 4.27Å; P749-R752 HydrophobicContact CB-CG 4.35Å; P749-R752 HydrophobicContact CG-CG 4.49Å; P749-R752 WeakPolarHBondContact O-CB 3.37Å; P749-R752 PolarHBondContact O-N 2.69Å; A750-R752 VanDerWaalsContact C-N 3.31Å; R752-D755 VanDerWaalsContact CD-OD2 3.24Å; R752-D755 WeakPolarHBondContact CD-OD2 3.37Å; R752-D759 WeakPolarHBondContact CD-OD2 3.36Å; R752-D759 IonicContact CZ-OD1 2.72Å; R752-D759 IonicContact CZ-OD2 3.15Å; R752-D759 IonicContact NE-OD2 2.74Å; R752-D759 IonicContact NH1-OD1 2.72Å; R752-D759 PolarHBondContact NH1-OD1 2.81Å; R752-D759 IonicContact NH1-OD2 2.8Å; R752-D759 PolarHBondContact NH1-OD2 2.88Å
753	F	70.5	Confident	75.5	Confident	15 Å²	15	61.4 Å²	61.4	7%	0.066	36%	0.361	C	S	.	.	S	Bend	trans	-124.1	125	172.8	-88.1	-108.8	0	0	0	106.3	R740 L748 G751 D755 D765 M770	R740-F753 HydrophobicContact CB-CD2 3.8Å; R740-F753 HydrophobicContact CB-CE1 4.46Å; R740-F753 HydrophobicContact CB-CE2 3.49Å; R740-F753 VanDerWaalsContact CB-CE2 3.49Å; R740-F753 HydrophobicContact CB-CG 4.44Å; R740-F753 HydrophobicContact CB-CZ 3.87Å; L748-F753 HydrophobicContact CB-CE2 4.15Å; L748-F753 HydrophobicContact CD1-CE2 4.29Å; G751-F753 VanDerWaalsContact C-N 3.32Å; F753-D755 VanDerWaalsContact C-N 3.28Å; F753-D755 PolarHBondContact O-N 3.23Å; F753-D765 HydrophobicContact CD1-CB 4.36Å; F753-D765 HydrophobicContact CE1-CB 4.5Å; F753-D765 HydrophobicContact CG-CB 4.42Å; F753-M770 HydrophobicContact CD1-CB 4.36Å; F753-M770 HydrophobicContact CE1-CB 4.4Å
754	C	73.2	Confident	75.9	Confident	48 Å²	48	54.9 Å²	54.9	32%	0.324	34%	0.336	S	S	.	.	S	Bend	trans	66.4	32.3	179	-35.1	0	0	0	0	112.3	E766 C771	C754-E766 WeakPolarHBondContact CA-OE1 2.98Å; C754-E766 PolarHBondContact N-OE1 3.24Å; C754-C771 HydrophobicContact CB-CB 4.08Å; C754-C771 WeakPolarHBondContact CB-SG 3.05Å; C754-C771 WeakPolarHBondContact SG-CA 3.12Å; C754-C771 WeakPolarHBondContact SG-CB 3.3Å; C754-C771 CovalentContact SG-SG 2.03Å; C754-C771 PolarHBondContact SG-SG 2.71Å
755	D	74.7	Confident	76.1	Confident	63 Å²	63	52.7 Å²	52.7	34%	0.337	32%	0.321	S	S	.	.	S	Bend	trans	-95.2	-4.2	174.9	76.8	-1.6	0	0	0	112.8	R752 F753 A757 E766	R752-D755 VanDerWaalsContact CD-OD2 3.24Å; R752-D755 WeakPolarHBondContact CD-OD2 3.37Å; F753-D755 VanDerWaalsContact C-N 3.28Å; F753-D755 PolarHBondContact O-N 3.23Å; D755-A757 VanDerWaalsContact OD1-CB 3.29Å; D755-A757 WeakPolarHBondContact OD1-CB 3.43Å; D755-A757 PolarHBondContact OD1-N 2.92Å; D755-E766 PolarHBondContact N-OE1 3.35Å
756	G	73.4	Confident	77	Confident	66 Å²	66	54.1 Å²	54.1	68%	0.68	32%	0.319	S	S	*	.	S	Bend	trans	88	-3.6	179.8	0	0	0	0	0	114.5	E766	G756-E766 VanDerWaalsContact CA-OE2 3.28Å; G756-E766 WeakPolarHBondContact CA-OE2 3.37Å; G756-E766 PolarHBondContact N-OE2 2.84Å
757	A	77.8	Confident	77.1	Confident	39 Å²	39	52.9 Å²	52.9	32%	0.322	31%	0.314	S	S	.	.	S	Bend	trans	-90.9	170.1	169.2	0	0	0	0	0	111.2	D755 E766	D755-A757 VanDerWaalsContact OD1-CB 3.29Å; D755-A757 WeakPolarHBondContact OD1-CB 3.43Å; D755-A757 PolarHBondContact OD1-N 2.92Å; A757-E766 WeakPolarHBondContact O-CG 3.43Å
758	R	88.5	Confident	76.8	Confident	173 Å²	173	55.3 Å²	55.3	65%	0.653	33%	0.329	S	S	*	.			trans	-119.9	79.5	172.9	-166.8	-166.1	-174.8	-177.3	8	108.6	D762	R758-D762 PolarHBondContact NH2-O 2.81Å
759	D	85.6	Confident	76.1	Confident	47 Å²	47	63 Å²	63	25%	0.251	36%	0.362	S	S	.	.			trans	-85.2	-23.1	179.9	-74.4	-72.2	0	0	0	112.5	Q746 L748 R752 D765	Q746-D759 PolarHBondContact NE2-O 3.33Å; Q746-D759 PolarHBondContact OE1-O 2.83Å; L748-D759 HydrophobicContact CD1-CB 3.59Å; L748-D759 HydrophobicContact CD2-CB 4.03Å; L748-D759 HydrophobicContact CG-CB 4.47Å; R752-D759 WeakPolarHBondContact CD-OD2 3.36Å; R752-D759 IonicContact CZ-OD1 2.72Å; R752-D759 IonicContact CZ-OD2 3.15Å; R752-D759 IonicContact NE-OD2 2.74Å; R752-D759 IonicContact NH1-OD1 2.72Å; R752-D759 PolarHBondContact NH1-OD1 2.81Å; R752-D759 IonicContact NH1-OD2 2.8Å; R752-D759 PolarHBondContact NH1-OD2 2.88Å; D759-D765 PolarHBondContact N-OD2 2.94Å
760	C	84.6	Confident	75.6	Confident	3 Å²	3	62.2 Å²	62.2	2%	0.02	35%	0.352	C	S	.	.	S	Bend	trans	-75.7	130.3	169.5	-71.4	0	0	0	0	111.5	C742 L748 D762 G763 D765	C742-C760 VanDerWaalsContact CA-SG 3.59Å; C742-C760 HydrophobicContact CB-CB 3.69Å; C742-C760 WeakPolarHBondContact CB-SG 3.38Å; C742-C760 WeakPolarHBondContact SG-CA 3.24Å; C742-C760 WeakPolarHBondContact SG-CB 3.29Å; C742-C760 CovalentContact SG-SG 2.02Å; C742-C760 PolarHBondContact SG-SG 2.89Å; L748-C760 VanDerWaalsContact CD1-SG 3.58Å; C760-D762 PolarHBondContact O-N 2.6Å; C760-G763 PolarHBondContact O-N 2.99Å; C760-D765 HydrophobicContact CB-CB 4.26Å; C760-D765 WeakPolarHBondContact CB-OD2 3.37Å; C760-D765 PolarHBondContact N-OD2 3.17Å; C760-D765 VanDerWaalsContact SG-CB 3.55Å; C760-D765 VanDerWaalsContact SG-CG 3.57Å; C760-D765 PolarHBondContact SG-N 3.05Å
761	D	82.2	Confident	75.7	Confident	137 Å²	137	62.3 Å²	62.3	73%	0.733	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.3	-35	172.3	-78.5	-39.3	0	0	0	113.9	Q746	Q746-D761 VanDerWaalsContact OE1-N 3.09Å
762	D	82	Confident	75.2	Confident	51 Å²	51	66 Å²	66	27%	0.273	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-7.9	179	76.3	-28.5	0	0	0	114.8	R743 S744 R758 C760 S764	R743-D762 WeakPolarHBondContact CB-OD2 3.34Å; R743-D762 WeakPolarHBondContact CD-OD2 3.25Å; R743-D762 WeakPolarHBondContact CG-OD2 3.17Å; S744-D762 PolarHBondContact N-OD1 2.03Å; S744-D762 PolarHBondContact N-OD2 3.06Å; R758-D762 PolarHBondContact NH2-O 2.81Å; C760-D762 PolarHBondContact O-N 2.6Å; D762-S764 WeakPolarHBondContact OD1-CB 3.49Å; D762-S764 PolarHBondContact OD1-N 2.89Å; D762-S764 PolarHBondContact OD1-OG 2.89Å; D762-S764 PolarHBondContact OD2-OG 2.93Å
763	G	83.6	Confident	73.7	Confident	22 Å²	22	67.2 Å²	67.2	23%	0.227	37%	0.37	C	S	.	.	S	Bend	trans	69.7	39.6	-176.6	0	0	0	0	0	114.6	C760 D765	C760-G763 PolarHBondContact O-N 2.99Å; G763-D765 WeakPolarHBondContact CA-OD1 3.24Å
764	S	82.4	Confident	72.9	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	40%	0.395	C	S	.	.			trans	-94.7	-11.2	177.8	54.1	0	0	0	0	114.6	C742 R743 D762 E766 D767 M770	C742-S764 WeakPolarHBondContact CA-OG 3.34Å; R743-S764 WeakPolarHBondContact CB-OG 3.36Å; R743-S764 PolarHBondContact N-OG 2.89Å; D762-S764 WeakPolarHBondContact OD1-CB 3.49Å; D762-S764 PolarHBondContact OD1-N 2.89Å; D762-S764 PolarHBondContact OD1-OG 2.89Å; D762-S764 PolarHBondContact OD2-OG 2.93Å; S764-E766 VanDerWaalsContact C-N 3.33Å; S764-D767 PolarHBondContact O-N 2.84Å; S764-M770 WeakPolarHBondContact O-CB 3.48Å; S764-M770 VanDerWaalsContact O-CG 3.3Å; S764-M770 WeakPolarHBondContact O-CG 3.45Å
765	D	78.6	Confident	72.2	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.6	-49.8	160.3	38.9	6.2	0	0	0	111.9	F753 D759 C760 G763 D767	F753-D765 HydrophobicContact CD1-CB 4.36Å; F753-D765 HydrophobicContact CE1-CB 4.5Å; F753-D765 HydrophobicContact CG-CB 4.42Å; D759-D765 PolarHBondContact N-OD2 2.94Å; C760-D765 HydrophobicContact CB-CB 4.26Å; C760-D765 WeakPolarHBondContact CB-OD2 3.37Å; C760-D765 PolarHBondContact N-OD2 3.17Å; C760-D765 VanDerWaalsContact SG-CB 3.55Å; C760-D765 VanDerWaalsContact SG-CG 3.57Å; C760-D765 PolarHBondContact SG-N 3.05Å; G763-D765 WeakPolarHBondContact CA-OD1 3.24Å; D765-D767 VanDerWaalsContact C-N 3.32Å; D765-D767 PolarHBondContact O-N 2.68Å
766	E	84	Confident	71.5	Confident	66 Å²	66	69.6 Å²	69.6	31%	0.308	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	14	-176.5	-60.5	-59.2	105.7	0	0	113.9	C754 D755 G756 A757 S764 P768	C754-E766 WeakPolarHBondContact CA-OE1 2.98Å; C754-E766 PolarHBondContact N-OE1 3.24Å; D755-E766 PolarHBondContact N-OE1 3.35Å; G756-E766 VanDerWaalsContact CA-OE2 3.28Å; G756-E766 WeakPolarHBondContact CA-OE2 3.37Å; G756-E766 PolarHBondContact N-OE2 2.84Å; A757-E766 WeakPolarHBondContact O-CG 3.43Å; S764-E766 VanDerWaalsContact C-N 3.33Å; E766-P768 WeakPolarHBondContact O-CD 3.37Å
767	D	74.9	Confident	71.1	Confident	35 Å²	35	68.3 Å²	68.3	19%	0.187	37%	0.365	C	S	.	.			trans	-75.6	120.7	173.2	-170.2	-38.1	0	0	0	109.5	R743 S764 D765 K769 M770 C771	R743-D767 IonicContact CZ-OD2 3.95Å; R743-D767 IonicContact NH1-OD2 2.63Å; R743-D767 IonicContact NH2-OD2 3.66Å; R743-D767 PolarHBondContact NH2-OD2 2.93Å; S764-D767 PolarHBondContact O-N 2.84Å; D765-D767 VanDerWaalsContact C-N 3.32Å; D765-D767 PolarHBondContact O-N 2.68Å; D767-K769 PolarHBondContact O-N 2.99Å; D767-K769 WeakPolarHBondContact OD1-CB 3.47Å; D767-K769 PolarHBondContact OD1-N 3.36Å; D767-M770 HydrophobicContact CB-CB 4.37Å; D767-M770 HydrophobicContact CB-CG 4.16Å; D767-M770 WeakPolarHBondContact O-CA 3.49Å; D767-M770 PolarHBondContact O-N 3.04Å; D767-C771 PolarHBondContact O-N 3.49Å
768	P	68.3	Low	70.8	Confident	98 Å²	98	68.1 Å²	68.1	64%	0.636	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-11.1	179.2	-26	36	0	0	0	114.9	E766 N772	E766-P768 WeakPolarHBondContact O-CD 3.37Å; P768-N772 PolarHBondContact O-ND2 3.34Å
769	K	58.8	Low	70.1	Confident	176 Å²	176	65 Å²	65	77%	0.765	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-28.4	170.3	-63	176.8	179	177.4	0	113.2	D767	D767-K769 PolarHBondContact O-N 2.99Å; D767-K769 WeakPolarHBondContact OD1-CB 3.47Å; D767-K769 PolarHBondContact OD1-N 3.36Å
770	M	62.5	Low	69.5	Low	67 Å²	67	70 Å²	70	33%	0.33	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-23.4	173.5	-67.6	-59	-170.4	0	0	112.1	R740 F753 S764 D767 N772	R740-M770 PolarHBondContact NH2-O 2.98Å; F753-M770 HydrophobicContact CD1-CB 4.36Å; F753-M770 HydrophobicContact CE1-CB 4.4Å; S764-M770 WeakPolarHBondContact O-CB 3.48Å; S764-M770 VanDerWaalsContact O-CG 3.3Å; S764-M770 WeakPolarHBondContact O-CG 3.45Å; D767-M770 HydrophobicContact CB-CB 4.37Å; D767-M770 HydrophobicContact CB-CG 4.16Å; D767-M770 WeakPolarHBondContact O-CA 3.49Å; D767-M770 PolarHBondContact O-N 3.04Å; M770-N772 PolarHBondContact O-N 2.9Å; M770-N772 VanDerWaalsContact O-N 3.16Å
771	C	63.4	Low	69.4	Low	44 Å²	44	70 Å²	70	30%	0.297	37%	0.369	S	S	.	.	S	Bend	trans	-68.2	-10.2	-177.5	-66.3	0	0	0	0	116.8	C754 D767 I773	C754-C771 HydrophobicContact CB-CB 4.08Å; C754-C771 WeakPolarHBondContact CB-SG 3.05Å; C754-C771 WeakPolarHBondContact SG-CA 3.12Å; C754-C771 WeakPolarHBondContact SG-CB 3.3Å; C754-C771 CovalentContact SG-SG 2.03Å; C754-C771 PolarHBondContact SG-SG 2.71Å; D767-C771 PolarHBondContact O-N 3.49Å; C771-I773 PolarHBondContact O-N 2.58Å
772	N	52.1	Low	69.4	Low	129 Å²	129	69 Å²	69	69%	0.69	36%	0.36	S	S	*	.			trans	-100.8	38.6	-163.2	-52.5	-39.4	0	0	0	114.6	P768 M770	P768-N772 PolarHBondContact O-ND2 3.34Å; M770-N772 PolarHBondContact O-N 2.9Å; M770-N772 VanDerWaalsContact O-N 3.16Å
773	I	47.3	Very low	69.6	Low	132 Å²	132	73.8 Å²	73.8	68%	0.677	38%	0.375	S	S	*	.			trans	-105	114.9	172.6	-58.6	-174.8	0	0	0	108.6	C771	C771-I773 PolarHBondContact O-N 2.58Å
774	C	53.1	Low	69.8	Low	86 Å²	86	76 Å²	76	58%	0.581	38%	0.377	S	S	*	.			trans	-89.7	130	-176.7	177.2	0	0	0	0	111.3	C901	C774-C901 HydrophobicContact CB-CB 3.81Å; C774-C901 WeakPolarHBondContact CB-SG 3.33Å; C774-C901 PolarHBondContact O-SG 3.25Å; C774-C901 VanDerWaalsContact O-SG 3.37Å; C774-C901 WeakPolarHBondContact SG-CB 3.24Å; C774-C901 CovalentContact SG-SG 2.04Å; C774-C901 PolarHBondContact SG-SG 3.16Å
775	D	58.9	Low	69.9	Low	72 Å²	72	83.4 Å²	83.4	39%	0.385	41%	0.411	S	S	.	.			trans	-97.2	123.3	166.2	159.5	38	0	0	0	109.2	L777 S778	D775-L777 PolarHBondContact O-N 3.12Å; D775-L777 WeakPolarHBondContact OD1-CB 3.07Å; D775-L777 PolarHBondContact OD1-N 2.97Å; D775-S778 PolarHBondContact O-N 2.88Å; D775-S778 VanDerWaalsContact OD2-CB 3.24Å; D775-S778 WeakPolarHBondContact OD2-CB 3.26Å; D775-S778 PolarHBondContact OD2-N 2.96Å; D775-S778 VanDerWaalsContact OD2-N 3.16Å; D775-S778 PolarHBondContact OD2-OG 2.8Å
776	P	60.1	Low	70.2	Confident	18 Å²	18	86 Å²	86	12%	0.117	44%	0.438	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-10.9	-178.3	28.7	-35.6	0	0	0	114	I894 R896	P776-I894 HydrophobicContact CB-CG2 4.48Å; P776-R896 HydrophobicContact CB-CG 4.39Å; P776-R896 HydrophobicContact CG-CG 4.23Å
777	L	65.1	Low	70.3	Confident	40 Å²	40	90.9 Å²	90.9	21%	0.209	45%	0.454	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-8.6	-179.5	-65.2	177.5	0	0	0	114.3	D775 M795 V796 I894 L947	D775-L777 PolarHBondContact O-N 3.12Å; D775-L777 WeakPolarHBondContact OD1-CB 3.07Å; D775-L777 PolarHBondContact OD1-N 2.97Å; L777-M795 CarbonylContact O-C 3.58Å; L777-M795 WeakPolarHBondContact O-CA 3.16Å; L777-V796 WeakPolarHBondContact O-CG2 2.99Å; L777-V796 PolarHBondContact O-N 2.68Å; L777-I894 HydrophobicContact CD2-CD1 3.7Å; L777-L947 HydrophobicContact CD2-CD1 4.33Å
778	S	71.6	Confident	70.7	Confident	34 Å²	34	96.4 Å²	96.4	24%	0.238	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	158.9	179.6	60.6	0	0	0	0	113.9	D775 F794	D775-S778 PolarHBondContact O-N 2.88Å; D775-S778 VanDerWaalsContact OD2-CB 3.24Å; D775-S778 WeakPolarHBondContact OD2-CB 3.26Å; D775-S778 PolarHBondContact OD2-N 2.96Å; D775-S778 VanDerWaalsContact OD2-N 3.16Å; D775-S778 PolarHBondContact OD2-OG 2.8Å; S778-F794 CarbonylContact C-O 3.33Å; S778-F794 VanDerWaalsContact CA-O 3.3Å; S778-F794 WeakPolarHBondContact CA-O 3.33Å
779	R	73.6	Confident	71.4	Confident	108 Å²	108	93.2 Å²	93.2	41%	0.408	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	146.5	176.8	-55.7	-171.4	69.1	-131.9	-10.3	109	T793 F794 V796	R779-T793 CarbonylContact O-C 3.58Å; R779-T793 WeakPolarHBondContact O-CA 3.41Å; R779-T793 VanDerWaalsContact O-CB 3.32Å; R779-T793 WeakPolarHBondContact O-CB 3.12Å; R779-F794 HydrophobicContact CB-CD1 4.05Å; R779-F794 HydrophobicContact CB-CE1 3.61Å; R779-F794 HydrophobicContact CB-CZ 3.92Å; R779-F794 PolarHBondContact N-O 3.04Å; R779-F794 WeakPolarHBondContact O-CD1 3.36Å; R779-F794 PolarHBondContact O-N 3.46Å; R779-V796 HydrophobicContact CG-CB 4.44Å; R779-V796 HydrophobicContact CG-CG2 3.56Å
780	K	72	Confident	72.6	Confident	152 Å²	152	91.5 Å²	91.5	66%	0.661	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.1	134.8	174.7	-174	165.8	-175.2	169.4	0	110.5	F810	K780-F810 WeakPolarHBondContact O-CE1 3.46Å
781	C	83.5	Confident	73.3	Confident	4 Å²	4	93.1 Å²	93.1	3%	0.027	46%	0.461	C	S	.	.			trans	-77.8	132.8	166.4	-69.6	0	0	0	0	109.9	P789 K791 S792 C806	C781-P789 HydrophobicContact CB-CB 3.53Å; C781-P789 HydrophobicContact CB-CG 3.74Å; C781-K791 WeakPolarHBondContact CB-O 3.46Å; C781-K791 PolarHBondContact SG-O 2.03Å; C781-K791 VanDerWaalsContact SG-O 3.35Å; C781-S792 PolarHBondContact N-O 3Å; C781-C806 VanDerWaalsContact CA-SG 3.57Å; C781-C806 HydrophobicContact CB-CB 3.62Å; C781-C806 WeakPolarHBondContact CB-SG 3.48Å; C781-C806 WeakPolarHBondContact SG-CA 3.27Å; C781-C806 WeakPolarHBondContact SG-CB 3.05Å; C781-C806 CovalentContact SG-SG 2.03Å; C781-C806 PolarHBondContact SG-SG 3.14Å
782	E	82.4	Confident	73.8	Confident	115 Å²	115	94.2 Å²	94.2	54%	0.537	47%	0.469	S	S	.	.			trans	-111.6	171.3	178.3	-57	-177.5	-178.9	0	0	112.1	Y784 N808 F810	E782-Y784 PolarHBondContact O-N 2.78Å; E782-N808 PolarHBondContact O-ND2 3.24Å; E782-F810 HydrophobicContact CB-CD1 4.29Å; E782-F810 HydrophobicContact CB-CD2 4.02Å; E782-F810 HydrophobicContact CB-CE1 3.92Å; E782-F810 HydrophobicContact CB-CE2 3.64Å; E782-F810 HydrophobicContact CB-CG 4.31Å; E782-F810 HydrophobicContact CB-CZ 3.57Å; E782-F810 HydrophobicContact CG-CE1 3.85Å; E782-F810 HydrophobicContact CG-CE2 4.14Å; E782-F810 HydrophobicContact CG-CZ 3.56Å; E782-F810 VanDerWaalsContact N-CD1 3.32Å
783	Y	85.3	Confident	74.9	Confident	151 Å²	151	91.1 Å²	91.1	59%	0.592	45%	0.454	S	S	*	.			trans	-75.8	112.5	-177.8	-167.1	-88.6	0	0	0	110.9	G786 E788	Y783-G786 PolarHBondContact OH-O 3.38Å; Y783-E788 HydrophobicContact CD2-CB 3.93Å; Y783-E788 HydrophobicContact CD2-CG 4.26Å; Y783-E788 HydrophobicContact CE2-CB 3.88Å
784	Y	87.1	Confident	76.4	Confident	69 Å²	69	84.9 Å²	84.9	27%	0.271	42%	0.422	S	S	.	.	B	Isolated β-bridge	trans	-121.8	136.2	-170.7	-172	-118.9	0	0	0	112	E782 G786 R787 N808 G809 F810 S813	E782-Y784 PolarHBondContact O-N 2.78Å; Y784-G786 PolarHBondContact O-N 3.16Å; Y784-R787 PolarHBondContact N-O 3.08Å; Y784-R787 WeakPolarHBondContact O-CB 3.21Å; Y784-R787 PolarHBondContact O-N 3.33Å; Y784-N808 WeakPolarHBondContact CD1-O 3.49Å; Y784-N808 PolarHBondContact N-ND2 3.1Å; Y784-G809 WeakPolarHBondContact CD1-O 3.43Å; Y784-G809 VanDerWaalsContact CE1-O 3.29Å; Y784-G809 WeakPolarHBondContact CE1-O 3.34Å; Y784-F810 HydrophobicContact CD2-CD2 4.34Å; Y784-F810 HydrophobicContact CG-CB 4.33Å; Y784-F810 HydrophobicContact CG-CD2 4.42Å; Y784-S813 VanDerWaalsContact CE2-CB 3.5Å; Y784-S813 VanDerWaalsContact CZ-CB 3.43Å
785	Q	85.5	Confident	77.5	Confident	155 Å²	155	84.4 Å²	84.4	72%	0.724	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.5	34.3	178.8	-59.9	-171.3	18.7	0	0	116.1
786	G	84.4	Confident	78.3	Confident	54 Å²	54	81.7 Å²	81.7	56%	0.557	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.9	16.5	-178.4	0	0	0	0	0	114.6	Y783 Y784	Y783-G786 PolarHBondContact OH-O 3.38Å; Y784-G786 PolarHBondContact O-N 3.16Å
787	R	86.8	Confident	78.9	Confident	169 Å²	169	84 Å²	84	64%	0.638	41%	0.408	S	S	*	.	B	Isolated β-bridge	trans	-126.4	129.7	179.4	-62.2	-178.6	-176.5	-175.1	2.3	110.9	Y784 N808	Y784-R787 PolarHBondContact N-O 3.08Å; Y784-R787 WeakPolarHBondContact O-CB 3.21Å; Y784-R787 PolarHBondContact O-N 3.33Å; R787-N808 HydrophobicContact CB-CB 3.82Å; R787-N808 PolarHBondContact O-ND2 3.4Å
788	E	82.7	Confident	79.6	Confident	152 Å²	152	85.5 Å²	85.5	71%	0.71	41%	0.411	S	S	*	.			trans	-69.3	142.5	168.2	-159.1	157.4	-136.9	0	0	109.5	Y783	Y783-E788 HydrophobicContact CD2-CB 3.93Å; Y783-E788 HydrophobicContact CD2-CG 4.26Å; Y783-E788 HydrophobicContact CE2-CB 3.88Å
789	P	83.9	Confident	79.9	Confident	30 Å²	30	84 Å²	84	20%	0.195	40%	0.4	C	S	.	.			trans	-73.7	149.1	178.6	32	-36.2	0	0	0	111.5	C781 K791 C806	C781-P789 HydrophobicContact CB-CB 3.53Å; C781-P789 HydrophobicContact CB-CG 3.74Å; P789-K791 WeakPolarHBondContact CB-O 3.34Å; P789-C806 CarbonylContact C-O 3.5Å; P789-C806 WeakPolarHBondContact CA-O 3.06Å; P789-C806 HydrophobicContact CB-CB 3.99Å; P789-C806 VanDerWaalsContact CB-O 3.28Å; P789-C806 WeakPolarHBondContact CB-O 3.24Å
790	I	82.6	Confident	80.2	Confident	141 Å²	141	79.5 Å²	79.5	72%	0.723	39%	0.385	S	S	*	.	S	Bend	trans	-83.5	-33.9	-179.1	-55.7	-178.7	0	0	0	111	C806	I790-C806 PolarHBondContact N-O 2.94Å
791	K	77.5	Confident	80.5	Confident	101 Å²	101	73 Å²	73	44%	0.439	36%	0.358	S	S	.	.	S	Bend	trans	-102.4	141.9	168.5	-55.2	-174	-159.5	174	0	108.6	C781 P789 T793 D805	C781-K791 WeakPolarHBondContact CB-O 3.46Å; C781-K791 PolarHBondContact SG-O 2.03Å; C781-K791 VanDerWaalsContact SG-O 3.35Å; P789-K791 WeakPolarHBondContact CB-O 3.34Å; K791-T793 VanDerWaalsContact C-N 3.33Å; K791-T793 WeakPolarHBondContact CB-O 3.49Å; K791-D805 WeakPolarHBondContact CD-O 3.47Å; K791-D805 WeakPolarHBondContact CE-O 3.45Å; K791-D805 VanDerWaalsContact CG-O 3.27Å; K791-D805 WeakPolarHBondContact CG-O 3.46Å; K791-D805 IonicContact NZ-OD1 3.59Å; K791-D805 PolarHBondContact NZ-OD1 2.99Å
792	S	73.7	Confident	80.3	Confident	66 Å²	66	73.6 Å²	73.6	46%	0.462	37%	0.365	S	S	.	.	S	Bend	trans	-74.1	-25.5	176.6	52.9	0	0	0	0	112.8	C781	C781-S792 PolarHBondContact N-O 3Å
793	T	76.2	Confident	80.4	Confident	64 Å²	64	72.2 Å²	72.2	39%	0.393	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	162	178.5	55	0	0	0	0	111.8	R779 K791	R779-T793 CarbonylContact O-C 3.58Å; R779-T793 WeakPolarHBondContact O-CA 3.41Å; R779-T793 VanDerWaalsContact O-CB 3.32Å; R779-T793 WeakPolarHBondContact O-CB 3.12Å; K791-T793 VanDerWaalsContact C-N 3.33Å; K791-T793 WeakPolarHBondContact CB-O 3.49Å
794	F	79.1	Confident	80.5	Confident	1 Å²	1	67.7 Å²	67.7	0%	0.004	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	156.2	171.2	68.6	-71.2	0	0	0	109.7	S778 R779 W798 T799 D805 C806 F810 D811	S778-F794 CarbonylContact C-O 3.33Å; S778-F794 VanDerWaalsContact CA-O 3.3Å; S778-F794 WeakPolarHBondContact CA-O 3.33Å; R779-F794 HydrophobicContact CB-CD1 4.05Å; R779-F794 HydrophobicContact CB-CE1 3.61Å; R779-F794 HydrophobicContact CB-CZ 3.92Å; R779-F794 PolarHBondContact N-O 3.04Å; R779-F794 WeakPolarHBondContact O-CD1 3.36Å; R779-F794 PolarHBondContact O-N 3.46Å; F794-W798 HydrophobicContact CB-CE3 4.4Å; F794-W798 HydrophobicContact CD2-CB 4.42Å; F794-T799 WeakPolarHBondContact CE2-OG1 3.24Å; F794-D805 HydrophobicContact CB-CB 3.9Å; F794-C806 WeakPolarHBondContact CD1-SG 3.03Å; F794-F810 HydrophobicContact CE1-CD1 4.2Å; F794-F810 HydrophobicContact CE1-CE1 4.28Å; F794-D811 HydrophobicContact CD2-CB 3.67Å; F794-D811 HydrophobicContact CE1-CB 4.46Å; F794-D811 HydrophobicContact CE2-CB 3.6Å; F794-D811 HydrophobicContact CG-CB 4.13Å; F794-D811 HydrophobicContact CZ-CB 4.02Å
795	M	75.3	Confident	80.4	Confident	77 Å²	77	65 Å²	65	38%	0.379	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	145.6	178	-78.1	55.3	157.2	0	0	110.7	L777 H797 W798	L777-M795 CarbonylContact O-C 3.58Å; L777-M795 WeakPolarHBondContact O-CA 3.16Å; M795-H797 PolarHBondContact O-N 2.69Å; M795-W798 HydrophobicContact CB-CD2 3.67Å; M795-W798 HydrophobicContact CB-CE3 3.73Å; M795-W798 HydrophobicContact CB-CG 4.1Å; M795-W798 HydrophobicContact CB-CZ2 4.46Å; M795-W798 HydrophobicContact CB-CZ3 4.2Å; M795-W798 HydrophobicContact CE-CH2 3.69Å; M795-W798 HydrophobicContact CE-CZ2 4.34Å; M795-W798 HydrophobicContact CE-CZ3 4.08Å; M795-W798 HydrophobicContact CG-CD2 4.33Å; M795-W798 HydrophobicContact CG-CE3 4.17Å; M795-W798 HydrophobicContact CG-CH2 4.17Å; M795-W798 HydrophobicContact CG-CZ2 4.29Å; M795-W798 HydrophobicContact CG-CZ3 4.11Å; M795-W798 PolarHBondContact O-N 2.88Å; M795-W798 HydrophobicContact SD-CE3 3.85Å; M795-W798 HydrophobicContact SD-CH2 3.54Å; M795-W798 VanDerWaalsContact SD-CH2 3.54Å; M795-W798 HydrophobicContact SD-CZ2 4.25Å; M795-W798 HydrophobicContact SD-CZ3 3.31Å; M795-W798 WeakPolarHBondContact SD-CZ3 3.25Å
796	V	75.5	Confident	80.5	Confident	14 Å²	14	57.6 Å²	57.6	9%	0.085	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-56.2	-36.8	-178.1	170.1	0	0	0	0	112.1	L777 R779 W798 T799 Y892 I894	L777-V796 WeakPolarHBondContact O-CG2 2.99Å; L777-V796 PolarHBondContact O-N 2.68Å; R779-V796 HydrophobicContact CG-CB 4.44Å; R779-V796 HydrophobicContact CG-CG2 3.56Å; V796-W798 VanDerWaalsContact C-N 3.35Å; V796-T799 WeakPolarHBondContact O-CB 3.33Å; V796-T799 PolarHBondContact O-N 2.88Å; V796-T799 PolarHBondContact O-OG1 3.09Å; V796-Y892 HydrophobicContact CG1-CD1 4.14Å; V796-Y892 HydrophobicContact CG1-CE1 3.38Å; V796-Y892 HydrophobicContact CG1-CE2 4.25Å; V796-Y892 VanDerWaalsContact CG1-CZ 3.45Å; V796-Y892 WeakPolarHBondContact CG1-OH 2.96Å; V796-I894 HydrophobicContact CB-CD1 3.86Å; V796-I894 HydrophobicContact CG1-CD1 3.75Å; V796-I894 HydrophobicContact CG1-CG1 4.05Å; V796-I894 HydrophobicContact CG2-CD1 4.42Å
797	H	73.2	Confident	80.5	Confident	67 Å²	67	56.4 Å²	56.4	31%	0.31	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-72.5	-23.8	179.8	61.3	-87.9	0	0	0	113.8	M795 T799 Y892 L947	M795-H797 PolarHBondContact O-N 2.69Å; H797-T799 PolarHBondContact O-N 2.88Å; H797-T799 VanDerWaalsContact O-N 3.14Å; H797-Y892 HydrophobicContact CB-CD2 4.47Å; H797-Y892 HydrophobicContact CB-CG 4.41Å; H797-L947 HydrophobicContact CB-CD1 4.02Å
798	W	79.6	Confident	80.6	Confident	71 Å²	71	49 Å²	49	27%	0.269	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-75.9	13.2	171.4	-53	-30.6	0	0	0	113.5	F794 M795 V796 C800 D801 D805	F794-W798 HydrophobicContact CB-CE3 4.4Å; F794-W798 HydrophobicContact CD2-CB 4.42Å; M795-W798 HydrophobicContact CB-CD2 3.67Å; M795-W798 HydrophobicContact CB-CE3 3.73Å; M795-W798 HydrophobicContact CB-CG 4.1Å; M795-W798 HydrophobicContact CB-CZ2 4.46Å; M795-W798 HydrophobicContact CB-CZ3 4.2Å; M795-W798 HydrophobicContact CE-CH2 3.69Å; M795-W798 HydrophobicContact CE-CZ2 4.34Å; M795-W798 HydrophobicContact CE-CZ3 4.08Å; M795-W798 HydrophobicContact CG-CD2 4.33Å; M795-W798 HydrophobicContact CG-CE3 4.17Å; M795-W798 HydrophobicContact CG-CH2 4.17Å; M795-W798 HydrophobicContact CG-CZ2 4.29Å; M795-W798 HydrophobicContact CG-CZ3 4.11Å; M795-W798 PolarHBondContact O-N 2.88Å; M795-W798 HydrophobicContact SD-CE3 3.85Å; M795-W798 HydrophobicContact SD-CH2 3.54Å; M795-W798 VanDerWaalsContact SD-CH2 3.54Å; M795-W798 HydrophobicContact SD-CZ2 4.25Å; M795-W798 HydrophobicContact SD-CZ3 3.31Å; M795-W798 WeakPolarHBondContact SD-CZ3 3.25Å; V796-W798 VanDerWaalsContact C-N 3.35Å; W798-C800 PolarHBondContact O-N 2.86Å; W798-D801 VanDerWaalsContact CA-OD2 3.28Å; W798-D801 WeakPolarHBondContact CA-OD2 3.48Å; W798-D801 WeakPolarHBondContact CB-OD2 3.49Å; W798-D801 VanDerWaalsContact CD1-OD2 3.26Å; W798-D805 VanDerWaalsContact CD2-OD2 3.32Å; W798-D805 HydrophobicContact CE3-CB 4.23Å; W798-D805 VanDerWaalsContact CZ3-OD1 3.23Å; W798-D805 WeakPolarHBondContact CZ3-OD1 2.97Å
799	T	78.2	Confident	80.9	Confident	4 Å²	4	42.5 Å²	42.5	3%	0.025	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	106.7	171.3	-53.2	0	0	0	0	109.3	F794 V796 H797 R822	F794-T799 WeakPolarHBondContact CE2-OG1 3.24Å; V796-T799 WeakPolarHBondContact O-CB 3.33Å; V796-T799 PolarHBondContact O-N 2.88Å; V796-T799 PolarHBondContact O-OG1 3.09Å; H797-T799 PolarHBondContact O-N 2.88Å; H797-T799 VanDerWaalsContact O-N 3.14Å; T799-R822 PolarHBondContact O-NH1 2.89Å; T799-R822 PolarHBondContact O-NH2 3.24Å; T799-R822 VanDerWaalsContact O-NH2 3.07Å
800	C	79.4	Confident	81.1	Confident	13 Å²	13	42.6 Å²	42.6	9%	0.088	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.7	41.7	179.3	-47.1	0	0	0	0	115.4	W798 E812 C815	W798-C800 PolarHBondContact O-N 2.86Å; C800-E812 WeakPolarHBondContact CA-OE1 2.95Å; C800-C815 VanDerWaalsContact CA-SG 3.56Å; C800-C815 HydrophobicContact CB-CB 3.7Å; C800-C815 WeakPolarHBondContact CB-SG 3.43Å; C800-C815 VanDerWaalsContact SG-CA 3.53Å; C800-C815 WeakPolarHBondContact SG-CB 3.06Å; C800-C815 CovalentContact SG-SG 2.02Å; C800-C815 PolarHBondContact SG-SG 3.42Å
801	D	77.9	Confident	81.2	Confident	15 Å²	15	36 Å²	36	8%	0.08	20%	0.202	C	C	.	.	S	Bend	trans	-99.3	-10.7	178.8	71	8.9	0	0	0	115	W798 E803 E812 M839 A840	W798-D801 VanDerWaalsContact CA-OD2 3.28Å; W798-D801 WeakPolarHBondContact CA-OD2 3.48Å; W798-D801 WeakPolarHBondContact CB-OD2 3.49Å; W798-D801 VanDerWaalsContact CD1-OD2 3.26Å; D801-E803 PolarHBondContact OD1-N 2.72Å; D801-E812 PolarHBondContact N-OE1 2.76Å; D801-M839 WeakPolarHBondContact O-CA 3.06Å; D801-M839 WeakPolarHBondContact O-CB 3.04Å; D801-M839 PolarHBondContact O-N 3.01Å; D801-A840 HydrophobicContact CB-CB 4.38Å; D801-A840 PolarHBondContact O-N 2.74Å
802	G	80.4	Confident	81.7	Confident	17 Å²	17	32.8 Å²	32.8	18%	0.175	19%	0.188	C	C	.	.	S	Bend	trans	102.2	-7.5	176.5	0	0	0	0	0	116.1	E812	G802-E812 PolarHBondContact N-OE1 2.96Å
803	E	84.4	Confident	82.2	Confident	86 Å²	86	30.7 Å²	30.7	40%	0.402	17%	0.174	S	C	.	.	S	Bend	trans	-81	-169.7	166.3	-86.4	-75.2	109	0	0	110.7	D801 E812 P838 A840 F841	D801-E803 PolarHBondContact OD1-N 2.72Å; E803-E812 WeakPolarHBondContact O-CG 3.27Å; E803-P838 HydrophobicContact CG-CB 4.34Å; E803-A840 HydrophobicContact CG-CB 4.11Å; E803-F841 HydrophobicContact CG-CE1 4.45Å; E803-F841 HydrophobicContact CG-CZ 4.07Å
804	S	87.7	Confident	82.3	Confident	55 Å²	55	33.6 Å²	33.6	39%	0.385	19%	0.187	S	C	.	.			trans	-136.2	72.7	173.5	163.5	0	0	0	0	109.5	C806 G807 G809 D811	S804-C806 PolarHBondContact O-N 2.8Å; S804-G807 WeakPolarHBondContact O-CA 3.35Å; S804-G807 PolarHBondContact O-N 2.69Å; S804-G809 PolarHBondContact OG-N 3.48Å; S804-D811 VanDerWaalsContact CA-OD2 3.32Å; S804-D811 WeakPolarHBondContact CA-OD2 3.14Å
805	D	85	Confident	82	Confident	13 Å²	13	33.7 Å²	33.7	7%	0.07	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-42.1	-169.1	-115.4	-67.8	0	0	0	113.5	K791 F794 W798 G807 D811	K791-D805 WeakPolarHBondContact CD-O 3.47Å; K791-D805 WeakPolarHBondContact CE-O 3.45Å; K791-D805 VanDerWaalsContact CG-O 3.27Å; K791-D805 WeakPolarHBondContact CG-O 3.46Å; K791-D805 IonicContact NZ-OD1 3.59Å; K791-D805 PolarHBondContact NZ-OD1 2.99Å; F794-D805 HydrophobicContact CB-CB 3.9Å; W798-D805 VanDerWaalsContact CD2-OD2 3.32Å; W798-D805 HydrophobicContact CE3-CB 4.23Å; W798-D805 VanDerWaalsContact CZ3-OD1 3.23Å; W798-D805 WeakPolarHBondContact CZ3-OD1 2.97Å; D805-G807 PolarHBondContact O-N 3Å; D805-G807 VanDerWaalsContact O-N 3.14Å; D805-D811 PolarHBondContact N-OD2 3.2Å
806	C	86.4	Confident	81.1	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-4.1	173.3	-63.3	0	0	0	0	112.7	C781 P789 I790 F794 S804 N808 F810 D811	C781-C806 VanDerWaalsContact CA-SG 3.57Å; C781-C806 HydrophobicContact CB-CB 3.62Å; C781-C806 WeakPolarHBondContact CB-SG 3.48Å; C781-C806 WeakPolarHBondContact SG-CA 3.27Å; C781-C806 WeakPolarHBondContact SG-CB 3.05Å; C781-C806 CovalentContact SG-SG 2.03Å; C781-C806 PolarHBondContact SG-SG 3.14Å; P789-C806 CarbonylContact C-O 3.5Å; P789-C806 WeakPolarHBondContact CA-O 3.06Å; P789-C806 HydrophobicContact CB-CB 3.99Å; P789-C806 VanDerWaalsContact CB-O 3.28Å; P789-C806 WeakPolarHBondContact CB-O 3.24Å; I790-C806 PolarHBondContact N-O 2.94Å; F794-C806 WeakPolarHBondContact CD1-SG 3.03Å; S804-C806 PolarHBondContact O-N 2.8Å; C806-N808 VanDerWaalsContact CB-OD1 3.24Å; C806-N808 WeakPolarHBondContact CB-OD1 3.3Å; C806-N808 PolarHBondContact O-N 2.8Å; C806-F810 HydrophobicContact CB-CB 4.17Å; C806-D811 WeakPolarHBondContact CB-OD1 3.49Å; C806-D811 PolarHBondContact N-OD1 3.37Å; C806-D811 PolarHBondContact SG-OD1 3.19Å
807	G	85.9	Confident	79.9	Confident	29 Å²	29	41 Å²	41	30%	0.299	23%	0.232	S	C	.	.	S	Bend	trans	68.1	-9.5	-178.8	0	0	0	0	0	115.4	S804 D805	S804-G807 WeakPolarHBondContact O-CA 3.35Å; S804-G807 PolarHBondContact O-N 2.69Å; D805-G807 PolarHBondContact O-N 3Å; D805-G807 VanDerWaalsContact O-N 3.14Å
808	N	89	Confident	79	Confident	14 Å²	14	42.1 Å²	42.1	8%	0.075	23%	0.233	C	C	.	.	S	Bend	trans	-111.2	-4.7	172.1	69.1	-6.8	0	0	0	113.5	E782 Y784 R787 C806 F810	E782-N808 PolarHBondContact O-ND2 3.24Å; Y784-N808 WeakPolarHBondContact CD1-O 3.49Å; Y784-N808 PolarHBondContact N-ND2 3.1Å; R787-N808 HydrophobicContact CB-CB 3.82Å; R787-N808 PolarHBondContact O-ND2 3.4Å; C806-N808 VanDerWaalsContact CB-OD1 3.24Å; C806-N808 WeakPolarHBondContact CB-OD1 3.3Å; C806-N808 PolarHBondContact O-N 2.8Å; N808-F810 VanDerWaalsContact OD1-CB 3.29Å; N808-F810 WeakPolarHBondContact OD1-CB 3.4Å; N808-F810 PolarHBondContact OD1-N 2.04Å; N808-F810 VanDerWaalsContact OD1-N 3.1Å
809	G	87.3	Confident	77.5	Confident	14 Å²	14	40.7 Å²	40.7	14%	0.144	24%	0.237	C	C	.	.	S	Bend	trans	78.8	22.4	-178.1	0	0	0	0	0	115	Y784 S804 S813	Y784-G809 WeakPolarHBondContact CD1-O 3.43Å; Y784-G809 VanDerWaalsContact CE1-O 3.29Å; Y784-G809 WeakPolarHBondContact CE1-O 3.34Å; S804-G809 PolarHBondContact OG-N 3.48Å; G809-S813 PolarHBondContact O-N 2.88Å
810	F	89.7	Confident	75.9	Confident	32 Å²	32	46.4 Å²	46.4	14%	0.14	28%	0.277	C	S	.	.	S	Bend	trans	-67.2	-39.3	175.3	175.4	-107.6	0	0	0	112.8	K780 E782 Y784 F794 C806 N808 E812 S813	K780-F810 WeakPolarHBondContact O-CE1 3.46Å; E782-F810 HydrophobicContact CB-CD1 4.29Å; E782-F810 HydrophobicContact CB-CD2 4.02Å; E782-F810 HydrophobicContact CB-CE1 3.92Å; E782-F810 HydrophobicContact CB-CE2 3.64Å; E782-F810 HydrophobicContact CB-CG 4.31Å; E782-F810 HydrophobicContact CB-CZ 3.57Å; E782-F810 HydrophobicContact CG-CE1 3.85Å; E782-F810 HydrophobicContact CG-CE2 4.14Å; E782-F810 HydrophobicContact CG-CZ 3.56Å; E782-F810 VanDerWaalsContact N-CD1 3.32Å; Y784-F810 HydrophobicContact CD2-CD2 4.34Å; Y784-F810 HydrophobicContact CG-CB 4.33Å; Y784-F810 HydrophobicContact CG-CD2 4.42Å; F794-F810 HydrophobicContact CE1-CD1 4.2Å; F794-F810 HydrophobicContact CE1-CE1 4.28Å; C806-F810 HydrophobicContact CB-CB 4.17Å; N808-F810 VanDerWaalsContact OD1-CB 3.29Å; N808-F810 WeakPolarHBondContact OD1-CB 3.4Å; N808-F810 PolarHBondContact OD1-N 2.04Å; N808-F810 VanDerWaalsContact OD1-N 3.1Å; F810-E812 VanDerWaalsContact C-N 3.34Å; F810-S813 WeakPolarHBondContact O-CB 3.33Å; F810-S813 PolarHBondContact O-N 3.22Å; F810-S813 VanDerWaalsContact O-N 3.08Å; F810-S813 PolarHBondContact O-OG 2.93Å
811	D	84.3	Confident	74.8	Confident	2 Å²	2	51.5 Å²	51.5	1%	0.011	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-39.4	174	45.3	-67.7	0	0	0	112.9	F794 S804 D805 C806 S813	F794-D811 HydrophobicContact CD2-CB 3.67Å; F794-D811 HydrophobicContact CE1-CB 4.46Å; F794-D811 HydrophobicContact CE2-CB 3.6Å; F794-D811 HydrophobicContact CG-CB 4.13Å; F794-D811 HydrophobicContact CZ-CB 4.02Å; S804-D811 VanDerWaalsContact CA-OD2 3.32Å; S804-D811 WeakPolarHBondContact CA-OD2 3.14Å; D805-D811 PolarHBondContact N-OD2 3.2Å; C806-D811 WeakPolarHBondContact CB-OD1 3.49Å; C806-D811 PolarHBondContact N-OD1 3.37Å; C806-D811 PolarHBondContact SG-OD1 3.19Å; D811-S813 VanDerWaalsContact C-N 3.29Å; D811-S813 PolarHBondContact O-N 3.49Å
812	E	87.2	Confident	73.8	Confident	34 Å²	34	53.9 Å²	53.9	16%	0.159	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	2.6	172.4	-78.8	-61	120.5	0	0	115	C800 D801 G802 E803 F810 C815 R826	C800-E812 WeakPolarHBondContact CA-OE1 2.95Å; D801-E812 PolarHBondContact N-OE1 2.76Å; G802-E812 PolarHBondContact N-OE1 2.96Å; E803-E812 WeakPolarHBondContact O-CG 3.27Å; F810-E812 VanDerWaalsContact C-N 3.34Å; E812-C815 PolarHBondContact O-SG 3.12Å; E812-R826 PolarHBondContact O-NH1 3.48Å; E812-R826 VanDerWaalsContact O-NH1 3.17Å; E812-R826 WeakPolarHBondContact OE2-CD 3.04Å; E812-R826 IonicContact OE2-CZ 3.66Å; E812-R826 IonicContact OE2-NE 3.58Å; E812-R826 IonicContact OE2-NH1 2.91Å; E812-R826 PolarHBondContact OE2-NH1 2.62Å
813	S	85.1	Confident	73.2	Confident	22 Å²	22	54.8 Å²	54.8	15%	0.154	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	149.3	-179.4	83.2	0	0	0	0	112.7	Y784 G809 F810 D811 C815	Y784-S813 VanDerWaalsContact CE2-CB 3.5Å; Y784-S813 VanDerWaalsContact CZ-CB 3.43Å; G809-S813 PolarHBondContact O-N 2.88Å; F810-S813 WeakPolarHBondContact O-CB 3.33Å; F810-S813 PolarHBondContact O-N 3.22Å; F810-S813 VanDerWaalsContact O-N 3.08Å; F810-S813 PolarHBondContact O-OG 2.93Å; D811-S813 VanDerWaalsContact C-N 3.29Å; D811-S813 PolarHBondContact O-N 3.49Å; S813-C815 PolarHBondContact O-N 3.41Å; S813-C815 VanDerWaalsContact O-N 3.16Å
814	N	76.8	Confident	72.3	Confident	125 Å²	125	53.3 Å²	53.3	67%	0.668	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	59	24.1	176.8	-162.5	32.7	0	0	0	115.5
815	C	73.5	Confident	71.4	Confident	4 Å²	4	56.3 Å²	56.3	3%	0.027	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-78.1	-17.2	-179.6	-62.2	0	0	0	0	114.7	C800 E812 S813 A817 R818 A819 R826	C800-C815 VanDerWaalsContact CA-SG 3.56Å; C800-C815 HydrophobicContact CB-CB 3.7Å; C800-C815 WeakPolarHBondContact CB-SG 3.43Å; C800-C815 VanDerWaalsContact SG-CA 3.53Å; C800-C815 WeakPolarHBondContact SG-CB 3.06Å; C800-C815 CovalentContact SG-SG 2.02Å; C800-C815 PolarHBondContact SG-SG 3.42Å; E812-C815 PolarHBondContact O-SG 3.12Å; S813-C815 PolarHBondContact O-N 3.41Å; S813-C815 VanDerWaalsContact O-N 3.16Å; C815-A817 VanDerWaalsContact C-N 3.26Å; C815-A817 PolarHBondContact O-N 3.29Å; C815-R818 PolarHBondContact O-N 2.89Å; C815-A819 PolarHBondContact O-N 2.91Å; C815-R826 VanDerWaalsContact CB-CZ 3.43Å
816	E	57.2	Low	70.9	Confident	173 Å²	173	59.7 Å²	59.7	81%	0.808	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-61.6	-30.4	-174.8	-63.9	-173.7	146.9	0	0	113.6	R818	E816-R818 VanDerWaalsContact C-N 3.28Å; E816-R818 PolarHBondContact O-N 3.06Å
817	A	50.6	Low	70.6	Confident	70 Å²	70	63 Å²	63	58%	0.579	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-73.1	-18.8	175	0	0	0	0	0	113.6	C815	C815-A817 VanDerWaalsContact C-N 3.26Å; C815-A817 PolarHBondContact O-N 3.29Å
818	R	53.1	Low	70.6	Confident	91 Å²	91	63.9 Å²	63.9	34%	0.343	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.3	-16.2	-167.8	-69.6	174.1	171.4	163.2	-3.7	114.8	C815 E816 S820 E821 R822	C815-R818 PolarHBondContact O-N 2.89Å; E816-R818 VanDerWaalsContact C-N 3.28Å; E816-R818 PolarHBondContact O-N 3.06Å; R818-S820 PolarHBondContact O-N 2.68Å; R818-E821 CarbonylContact O-C 3.59Å; R818-E821 WeakPolarHBondContact O-CA 3.46Å; R818-E821 WeakPolarHBondContact O-CB 3.46Å; R818-E821 PolarHBondContact O-N 3.09Å; R818-R822 PolarHBondContact O-N 2.76Å
819	A	47.7	Very low	70.5	Confident	42 Å²	42	67.1 Å²	67.1	35%	0.347	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-59.2	-49	-178.6	0	0	0	0	0	111.7	C815 E821 R822	C815-A819 PolarHBondContact O-N 2.91Å; A819-E821 PolarHBondContact O-N 3.15Å; A819-E821 VanDerWaalsContact O-N 3.14Å; A819-R822 PolarHBondContact O-N 3.32Å
820	S	45.9	Very low	70.5	Confident	124 Å²	124	66.5 Å²	66.5	87%	0.867	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-67.2	-10.1	174.4	-53.2	0	0	0	0	114.2	R818	R818-S820 PolarHBondContact O-N 2.68Å
821	E	54.7	Low	70.3	Confident	120 Å²	120	72.7 Å²	72.7	56%	0.561	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-100.2	7	178.8	-57.1	-172.6	136.9	0	0	113	R818 A819 P915	R818-E821 CarbonylContact O-C 3.59Å; R818-E821 WeakPolarHBondContact O-CA 3.46Å; R818-E821 WeakPolarHBondContact O-CB 3.46Å; R818-E821 PolarHBondContact O-N 3.09Å; A819-E821 PolarHBondContact O-N 3.15Å; A819-E821 VanDerWaalsContact O-N 3.14Å; E821-P915 WeakPolarHBondContact O-CD 3.32Å; E821-P915 WeakPolarHBondContact O-CG 3.34Å
822	R	58.8	Low	70.2	Confident	64 Å²	64	80.7 Å²	80.7	24%	0.242	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.1	-0.3	-171.5	-78.8	-169.7	178	-176.6	3.6	117.3	T799 R818 A819 Q824	T799-R822 PolarHBondContact O-NH1 2.89Å; T799-R822 PolarHBondContact O-NH2 3.24Å; T799-R822 VanDerWaalsContact O-NH2 3.07Å; R818-R822 PolarHBondContact O-N 2.76Å; A819-R822 PolarHBondContact O-N 3.32Å; R822-Q824 PolarHBondContact O-N 3.1Å
823	C	66.5	Low	69.8	Low	37 Å²	37	82.6 Å²	82.6	25%	0.25	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.8	10.4	-174.1	-57.4	0	0	0	0	115.8	V890 P915 C918	C823-V890 HydrophobicContact CB-CG2 3.92Å; C823-P915 VanDerWaalsContact SG-CB 3.59Å; C823-C918 HydrophobicContact CB-CB 3.48Å; C823-C918 VanDerWaalsContact CB-CB 3.48Å; C823-C918 WeakPolarHBondContact CB-SG 3.3Å; C823-C918 WeakPolarHBondContact SG-CA 3.15Å; C823-C918 WeakPolarHBondContact SG-CB 3.49Å; C823-C918 CovalentContact SG-SG 2.03Å; C823-C918 PolarHBondContact SG-SG 3.1Å
824	Q	65.4	Low	69.8	Low	54 Å²	54	84.3 Å²	84.3	25%	0.252	44%	0.44	S	S	.	.			trans	-136.9	138.9	-177.7	-85	177	-78.4	0	0	111.6	R822 M839 V890	R822-Q824 PolarHBondContact O-N 3.1Å; Q824-M839 HydrophobicContact CB-CE 4.49Å; Q824-M839 HydrophobicContact CG-CE 4.45Å; Q824-M839 PolarHBondContact NE2-SD 2.82Å; Q824-V890 HydrophobicContact CG-CG2 3.8Å; Q824-V890 VanDerWaalsContact OE1-CG2 3.26Å; Q824-V890 VanDerWaalsContact OE1-N 3.14Å
825	D	70.4	Confident	70.3	Confident	119 Å²	119	83.9 Å²	83.9	64%	0.636	43%	0.429	S	S	*	.			trans	-72.3	161.7	159.7	-74	-50	0	0	0	110.5	M827 M839	D825-M827 PolarHBondContact O-N 3.45Å; D825-M839 WeakPolarHBondContact O-CE 3.38Å
826	R	73.6	Confident	71	Confident	83 Å²	83	89.6 Å²	89.6	31%	0.313	46%	0.455	S	S	.	.	S	Bend	trans	-74.3	-5.3	174.5	-65.3	-166.6	-110.5	-175.7	-1.8	114.3	E812 C815 M839	E812-R826 PolarHBondContact O-NH1 3.48Å; E812-R826 VanDerWaalsContact O-NH1 3.17Å; E812-R826 WeakPolarHBondContact OE2-CD 3.04Å; E812-R826 IonicContact OE2-CZ 3.66Å; E812-R826 IonicContact OE2-NE 3.58Å; E812-R826 IonicContact OE2-NH1 2.91Å; E812-R826 PolarHBondContact OE2-NH1 2.62Å; C815-R826 VanDerWaalsContact CB-CZ 3.43Å; R826-M839 PolarHBondContact O-N 2.83Å
827	M	81	Confident	72.4	Confident	71 Å²	71	81.4 Å²	81.4	35%	0.35	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	124.9	-174.7	-70.1	-76.2	164.5	0	0	109.3	D825 Q836 I837 P838	D825-M827 PolarHBondContact O-N 3.45Å; M827-Q836 HydrophobicContact CB-CB 4.41Å; M827-Q836 HydrophobicContact SD-CB 4.41Å; M827-I837 CarbonylContact C-O 3.55Å; M827-I837 VanDerWaalsContact CA-O 3.29Å; M827-I837 WeakPolarHBondContact CA-O 3.05Å; M827-P838 HydrophobicContact CE-CG 4.44Å
828	F	83.9	Confident	74	Confident	46 Å²	46	79 Å²	79	20%	0.202	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	137.1	169.5	-177.1	-95.3	0	0	0	109.8	Q836 I837 M839 V842 D854	F828-Q836 WeakPolarHBondContact O-CA 2.99Å; F828-I837 HydrophobicContact CB-CD1 4.49Å; F828-I837 HydrophobicContact CB-CG1 3.88Å; F828-I837 HydrophobicContact CD1-CD1 4Å; F828-I837 HydrophobicContact CD1-CG1 4.11Å; F828-I837 HydrophobicContact CG-CG1 4.49Å; F828-I837 PolarHBondContact N-O 2.95Å; F828-I837 PolarHBondContact O-N 3.21Å; F828-M839 HydrophobicContact CB-CE 4.04Å; F828-M839 HydrophobicContact CB-SD 4.16Å; F828-V842 HydrophobicContact CB-CG2 3.66Å; F828-V842 HydrophobicContact CD1-CG2 4.38Å; F828-V842 HydrophobicContact CD2-CG2 4.16Å; F828-V842 HydrophobicContact CG-CG2 3.85Å; F828-D854 HydrophobicContact CD1-CB 4.41Å; F828-D854 HydrophobicContact CE1-CB 4.07Å
829	N	87.3	Confident	75.4	Confident	82 Å²	82	76.1 Å²	76.1	44%	0.439	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	107.5	-177.8	-63.7	-38.4	0	0	0	109.9	K831 Q836	N829-K831 PolarHBondContact O-N 3.18Å; N829-K831 VanDerWaalsContact O-N 3.1Å; N829-Q836 WeakPolarHBondContact OD1-CG 3.18Å; N829-Q836 PolarHBondContact OD1-NE2 3.25Å
830	C	88.5	Confident	76.9	Confident	2 Å²	2	75.6 Å²	75.6	1%	0.014	38%	0.382	C	S	.	.			trans	-59	113.2	171.2	-55.7	0	0	0	0	109.3	R832 D833 G834 R835 C849 E853	C830-R832 PolarHBondContact O-N 3.33Å; C830-D833 HydrophobicContact CB-CB 4.47Å; C830-G834 WeakPolarHBondContact O-CA 3.5Å; C830-G834 PolarHBondContact O-N 3.19Å; C830-R835 HydrophobicContact CB-CB 4.23Å; C830-R835 WeakPolarHBondContact CB-O 3.39Å; C830-R835 PolarHBondContact N-O 2.97Å; C830-R835 PolarHBondContact SG-O 3.49Å; C830-C849 VanDerWaalsContact CA-SG 3.54Å; C830-C849 HydrophobicContact CB-CB 3.69Å; C830-C849 WeakPolarHBondContact CB-SG 3.36Å; C830-C849 WeakPolarHBondContact SG-CA 3.46Å; C830-C849 WeakPolarHBondContact SG-CB 3.3Å; C830-C849 CovalentContact SG-SG 2.03Å; C830-C849 PolarHBondContact SG-SG 3.33Å; C830-E853 VanDerWaalsContact C-OE1 3.3Å; C830-E853 WeakPolarHBondContact CA-OE1 3.39Å
831	K	85.2	Confident	78.8	Confident	161 Å²	161	72.2 Å²	72.2	70%	0.7	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-30.3	-173.3	-58	175.4	-155.7	85.7	0	112.2	N829 E853	N829-K831 PolarHBondContact O-N 3.18Å; N829-K831 VanDerWaalsContact O-N 3.1Å; K831-E853 VanDerWaalsContact CB-OE2 3.27Å; K831-E853 WeakPolarHBondContact CB-OE2 3.2Å; K831-E853 WeakPolarHBondContact CD-OE2 3.13Å; K831-E853 WeakPolarHBondContact CG-OE2 3.43Å; K831-E853 VanDerWaalsContact N-CD 3.31Å; K831-E853 PolarHBondContact N-OE1 3.25Å; K831-E853 PolarHBondContact N-OE2 2.93Å; K831-E853 IonicContact NZ-OE2 3.13Å; K831-E853 PolarHBondContact NZ-OE2 2.03Å
832	R	82.7	Confident	80.3	Confident	170 Å²	170	67.1 Å²	67.1	64%	0.642	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-45.8	-177.7	-174.7	164.7	-179.5	174.3	-9.4	113.7	C830 D851 E853	C830-R832 PolarHBondContact O-N 3.33Å; R832-D851 WeakPolarHBondContact CD-OD2 3.26Å; R832-D851 IonicContact CZ-OD1 3.92Å; R832-D851 IonicContact CZ-OD2 2.9Å; R832-D851 IonicContact NE-OD2 3.24Å; R832-D851 IonicContact NH1-OD1 3.18Å; R832-D851 PolarHBondContact NH1-OD1 3.31Å; R832-D851 IonicContact NH1-OD2 3.15Å; R832-D851 PolarHBondContact NH1-OD2 2.73Å; R832-E853 PolarHBondContact N-OE1 3.32Å
833	D	78.5	Confident	81.6	Confident	75 Å²	75	64.8 Å²	64.8	40%	0.401	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-18.7	-171.3	-57.1	-40.7	0	0	0	113	C830 R835 S850	C830-D833 HydrophobicContact CB-CB 4.47Å; D833-R835 HydrophobicContact CB-CB 4.22Å; D833-R835 PolarHBondContact O-N 2.88Å; D833-S850 VanDerWaalsContact CG-OG 3.3Å; D833-S850 PolarHBondContact OD1-OG 2.73Å; D833-S850 WeakPolarHBondContact OD2-CB 3.23Å; D833-S850 PolarHBondContact OD2-N 2.02Å; D833-S850 VanDerWaalsContact OD2-N 3.11Å; D833-S850 PolarHBondContact OD2-OG 3.07Å
834	G	83.8	Confident	82.4	Confident	58 Å²	58	65.4 Å²	65.4	60%	0.598	32%	0.323	S	S	*	.			trans	68.5	7	-168.1	0	0	0	0	0	113.7	C830 Q836	C830-G834 WeakPolarHBondContact O-CA 3.5Å; C830-G834 PolarHBondContact O-N 3.19Å; G834-Q836 PolarHBondContact O-N 3.16Å
835	R	87.5	Confident	83.3	Confident	116 Å²	116	70.1 Å²	70.1	44%	0.438	34%	0.342	S	S	.	.			trans	-62.8	132.3	172.1	-176.4	-178.6	178.2	-161.8	-8.8	108.8	C830 D833 I837 D848	C830-R835 HydrophobicContact CB-CB 4.23Å; C830-R835 WeakPolarHBondContact CB-O 3.39Å; C830-R835 PolarHBondContact N-O 2.97Å; C830-R835 PolarHBondContact SG-O 3.49Å; D833-R835 HydrophobicContact CB-CB 4.22Å; D833-R835 PolarHBondContact O-N 2.88Å; R835-I837 HydrophobicContact CG-CG2 3.89Å; R835-D848 IonicContact CZ-OD1 2.71Å; R835-D848 PolarHBondContact NH1-O 2.98Å; R835-D848 IonicContact NH1-OD1 2.61Å; R835-D848 PolarHBondContact NH1-OD1 3.46Å; R835-D848 IonicContact NH2-OD1 3.66Å; R835-D848 PolarHBondContact NH2-OD1 2.94Å
836	Q	88	Confident	84.1	Confident	124 Å²	124	70 Å²	70	58%	0.579	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96	133.6	167.5	-50.7	-161.6	-92	0	0	108.2	M827 F828 N829 G834	M827-Q836 HydrophobicContact CB-CB 4.41Å; M827-Q836 HydrophobicContact SD-CB 4.41Å; F828-Q836 WeakPolarHBondContact O-CA 2.99Å; N829-Q836 WeakPolarHBondContact OD1-CG 3.18Å; N829-Q836 PolarHBondContact OD1-NE2 3.25Å; G834-Q836 PolarHBondContact O-N 3.16Å
837	I	86.5	Confident	84.8	Confident	1 Å²	1	75.4 Å²	75.4	1%	0.005	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	144.5	176.9	66.4	-179.9	0	0	0	109.5	M827 F828 R835 F841 V842 D848 D854	M827-I837 CarbonylContact C-O 3.55Å; M827-I837 VanDerWaalsContact CA-O 3.29Å; M827-I837 WeakPolarHBondContact CA-O 3.05Å; F828-I837 HydrophobicContact CB-CD1 4.49Å; F828-I837 HydrophobicContact CB-CG1 3.88Å; F828-I837 HydrophobicContact CD1-CD1 4Å; F828-I837 HydrophobicContact CD1-CG1 4.11Å; F828-I837 HydrophobicContact CG-CG1 4.49Å; F828-I837 PolarHBondContact N-O 2.95Å; F828-I837 PolarHBondContact O-N 3.21Å; R835-I837 HydrophobicContact CG-CG2 3.89Å; I837-F841 HydrophobicContact CB-CD2 4.45Å; I837-F841 HydrophobicContact CD1-CB 4.29Å; I837-F841 WeakPolarHBondContact CD1-O 3.39Å; I837-V842 HydrophobicContact CD1-CG2 4.47Å; I837-D848 HydrophobicContact CD1-CB 3.97Å; I837-D848 HydrophobicContact CG2-CB 4.31Å; I837-D854 HydrophobicContact CD1-CB 3.97Å
838	P	85.8	Confident	85.2	Confident	19 Å²	19	74.1 Å²	74.1	12%	0.123	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-48.3	147.8	168.5	-30.6	36.1	0	0	0	112.3	E803 M827 A840 F841	E803-P838 HydrophobicContact CG-CB 4.34Å; M827-P838 HydrophobicContact CE-CG 4.44Å; P838-A840 HydrophobicContact CB-CB 4.37Å; P838-A840 PolarHBondContact O-N 2.88Å; P838-F841 HydrophobicContact CB-CD2 4.15Å; P838-F841 HydrophobicContact CB-CE2 4.17Å; P838-F841 HydrophobicContact CG-CD2 4.06Å; P838-F841 HydrophobicContact CG-CE2 3.76Å; P838-F841 PolarHBondContact O-N 3.06Å; P838-F841 VanDerWaalsContact O-N 3.08Å
839	M	81.2	Confident	85.5	Confident	31 Å²	31	72.1 Å²	72.1	15%	0.153	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-11.9	177.6	-159.3	59.7	70.6	0	0	112.7	D801 Q824 D825 R826 F828 F841 V842	D801-M839 WeakPolarHBondContact O-CA 3.06Å; D801-M839 WeakPolarHBondContact O-CB 3.04Å; D801-M839 PolarHBondContact O-N 3.01Å; Q824-M839 HydrophobicContact CB-CE 4.49Å; Q824-M839 HydrophobicContact CG-CE 4.45Å; Q824-M839 PolarHBondContact NE2-SD 2.82Å; D825-M839 WeakPolarHBondContact O-CE 3.38Å; R826-M839 PolarHBondContact O-N 2.83Å; F828-M839 HydrophobicContact CB-CE 4.04Å; F828-M839 HydrophobicContact CB-SD 4.16Å; M839-F841 VanDerWaalsContact C-N 3.28Å; M839-V842 HydrophobicContact SD-CB 4.17Å; M839-V842 HydrophobicContact SD-CG1 4.48Å; M839-V842 HydrophobicContact SD-CG2 3.76Å
840	A	79.6	Confident	85.3	Confident	30 Å²	30	72.6 Å²	72.6	25%	0.248	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-34.4	166.3	0	0	0	0	0	113.1	D801 E803 P838 V842	D801-A840 HydrophobicContact CB-CB 4.38Å; D801-A840 PolarHBondContact O-N 2.74Å; E803-A840 HydrophobicContact CG-CB 4.11Å; P838-A840 HydrophobicContact CB-CB 4.37Å; P838-A840 PolarHBondContact O-N 2.88Å; A840-V842 VanDerWaalsContact C-N 3.27Å; A840-V842 PolarHBondContact O-N 3.05Å
841	F	86.1	Confident	85.1	Confident	54 Å²	54	76.7 Å²	76.7	24%	0.237	38%	0.38	C	S	.	.	S	Bend	trans	-92.3	46.8	-179.7	-49	-37.9	0	0	0	111.6	E803 I837 P838 M839 D848	E803-F841 HydrophobicContact CG-CE1 4.45Å; E803-F841 HydrophobicContact CG-CZ 4.07Å; I837-F841 HydrophobicContact CB-CD2 4.45Å; I837-F841 HydrophobicContact CD1-CB 4.29Å; I837-F841 WeakPolarHBondContact CD1-O 3.39Å; P838-F841 HydrophobicContact CB-CD2 4.15Å; P838-F841 HydrophobicContact CB-CE2 4.17Å; P838-F841 HydrophobicContact CG-CD2 4.06Å; P838-F841 HydrophobicContact CG-CE2 3.76Å; P838-F841 PolarHBondContact O-N 3.06Å; P838-F841 VanDerWaalsContact O-N 3.08Å; M839-F841 VanDerWaalsContact C-N 3.28Å; F841-D848 HydrophobicContact CB-CB 4.39Å
842	V	86.2	Confident	85.2	Confident	13 Å²	13	69.2 Å²	69.2	8%	0.079	35%	0.348	C	S	.	.	S	Bend	trans	-139.4	114.9	177.5	-178	0	0	0	0	108.7	F828 I837 M839 A840 P889	F828-V842 HydrophobicContact CB-CG2 3.66Å; F828-V842 HydrophobicContact CD1-CG2 4.38Å; F828-V842 HydrophobicContact CD2-CG2 4.16Å; F828-V842 HydrophobicContact CG-CG2 3.85Å; I837-V842 HydrophobicContact CD1-CG2 4.47Å; M839-V842 HydrophobicContact SD-CB 4.17Å; M839-V842 HydrophobicContact SD-CG1 4.48Å; M839-V842 HydrophobicContact SD-CG2 3.76Å; A840-V842 VanDerWaalsContact C-N 3.27Å; A840-V842 PolarHBondContact O-N 3.05Å; V842-P889 HydrophobicContact CG1-CG 4.13Å
843	C	86.8	Confident	85.5	Confident	14 Å²	14	62 Å²	62	10%	0.095	32%	0.322	C	S	.	.	S	Bend	trans	64.1	39.2	-171.1	-51.3	0	0	0	0	113	E855 C858 P889 A950	C843-E855 WeakPolarHBondContact CA-OE1 3.39Å; C843-E855 PolarHBondContact N-OE1 3.11Å; C843-C858 VanDerWaalsContact CA-SG 3.5Å; C843-C858 HydrophobicContact CB-CB 3.77Å; C843-C858 WeakPolarHBondContact CB-SG 3.23Å; C843-C858 WeakPolarHBondContact SG-CA 3.43Å; C843-C858 WeakPolarHBondContact SG-CB 3.28Å; C843-C858 CovalentContact SG-SG 2.03Å; C843-C858 PolarHBondContact SG-SG 3.26Å; C843-P889 HydrophobicContact CB-CG 4.18Å; C843-A950 PolarHBondContact O-N 3.36Å; C843-A950 VanDerWaalsContact O-N 3.1Å
844	D	83.5	Confident	85.9	Confident	51 Å²	51	58.5 Å²	58.5	27%	0.273	30%	0.303	S	S	.	.	S	Bend	trans	-97.6	-14.9	174.2	78.5	-0.7	0	0	0	113.4	D846 E855	D844-D846 PolarHBondContact OD1-N 2.92Å; D844-E855 PolarHBondContact N-OE1 2.81Å
845	K	84.2	Confident	86.2	Confident	152 Å²	152	58 Å²	58	66%	0.661	29%	0.285	S	S	*	.	S	Bend	trans	91.2	-3.1	179.4	-51.7	162.4	-168.2	167.2	0	116.8	E855	K845-E855 VanDerWaalsContact CA-OE2 3.25Å; K845-E855 WeakPolarHBondContact CA-OE2 3.48Å; K845-E855 PolarHBondContact N-OE1 2.62Å; K845-E855 PolarHBondContact N-OE2 3.16Å; K845-E855 VanDerWaalsContact N-OE2 3.16Å
846	D	85.3	Confident	86.1	Confident	117 Å²	117	57.7 Å²	57.7	63%	0.626	29%	0.292	S	S	*	.	S	Bend	trans	-90	-169.2	167.6	-85.3	-45.2	0	0	0	110.6	D844 E855	D844-D846 PolarHBondContact OD1-N 2.92Å; D846-E855 WeakPolarHBondContact O-CG 3.43Å
847	R	89.1	Confident	86	Confident	196 Å²	196	56.8 Å²	56.8	74%	0.74	30%	0.295	S	S	*	.			trans	-138.2	102.3	-179.2	-69.9	-173.6	-175.3	-178.3	2	111.4
848	D	88.8	Confident	86	Confident	45 Å²	45	59.1 Å²	59.1	24%	0.241	31%	0.311	C	S	.	.			trans	-101.8	-19.3	-176.6	-106.2	-77.2	0	0	0	113.7	R835 I837 F841 D854	R835-D848 IonicContact CZ-OD1 2.71Å; R835-D848 PolarHBondContact NH1-O 2.98Å; R835-D848 IonicContact NH1-OD1 2.61Å; R835-D848 PolarHBondContact NH1-OD1 3.46Å; R835-D848 IonicContact NH2-OD1 3.66Å; R835-D848 PolarHBondContact NH2-OD1 2.94Å; I837-D848 HydrophobicContact CD1-CB 3.97Å; I837-D848 HydrophobicContact CG2-CB 4.31Å; F841-D848 HydrophobicContact CB-CB 4.39Å; D848-D854 PolarHBondContact N-OD2 3.3Å
849	C	90	Very high	86.1	Confident	3 Å²	3	59.1 Å²	59.1	2%	0.02	31%	0.312	C	S	.	.	S	Bend	trans	-90.1	146.9	159.9	-56.5	0	0	0	0	111	C830 D851 G852 E853 D854	C830-C849 VanDerWaalsContact CA-SG 3.54Å; C830-C849 HydrophobicContact CB-CB 3.69Å; C830-C849 WeakPolarHBondContact CB-SG 3.36Å; C830-C849 WeakPolarHBondContact SG-CA 3.46Å; C830-C849 WeakPolarHBondContact SG-CB 3.3Å; C830-C849 CovalentContact SG-SG 2.03Å; C830-C849 PolarHBondContact SG-SG 3.33Å; C849-D851 PolarHBondContact O-N 3.37Å; C849-G852 PolarHBondContact O-N 2.91Å; C849-E853 HydrophobicContact CB-CG 3.6Å; C849-D854 WeakPolarHBondContact CB-OD1 3.24Å; C849-D854 PolarHBondContact N-OD1 3.14Å; C849-D854 VanDerWaalsContact N-OD1 3.16Å; C849-D854 PolarHBondContact N-OD2 2.83Å
850	S	85.1	Confident	86.4	Confident	93 Å²	93	61.4 Å²	61.4	65%	0.65	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-23.5	-171.1	-55.9	0	0	0	0	115.4	D833	D833-S850 VanDerWaalsContact CG-OG 3.3Å; D833-S850 PolarHBondContact OD1-OG 2.73Å; D833-S850 WeakPolarHBondContact OD2-CB 3.23Å; D833-S850 PolarHBondContact OD2-N 2.02Å; D833-S850 VanDerWaalsContact OD2-N 3.11Å; D833-S850 PolarHBondContact OD2-OG 3.07Å
851	D	83.7	Confident	86.9	Confident	87 Å²	87	60.3 Å²	60.3	47%	0.465	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-5	174.8	-76.5	-22.1	0	0	0	113.3	R832 C849	R832-D851 WeakPolarHBondContact CD-OD2 3.26Å; R832-D851 IonicContact CZ-OD1 3.92Å; R832-D851 IonicContact CZ-OD2 2.9Å; R832-D851 IonicContact NE-OD2 3.24Å; R832-D851 IonicContact NH1-OD1 3.18Å; R832-D851 PolarHBondContact NH1-OD1 3.31Å; R832-D851 IonicContact NH1-OD2 3.15Å; R832-D851 PolarHBondContact NH1-OD2 2.73Å; C849-D851 PolarHBondContact O-N 3.37Å
852	G	86.4	Confident	87.1	Confident	4 Å²	4	63.5 Å²	63.5	4%	0.041	34%	0.337	C	S	.	.			trans	70.6	33.7	-171.3	0	0	0	0	0	113.7	C849 D854 E855	C849-G852 PolarHBondContact O-N 2.91Å; G852-D854 VanDerWaalsContact C-N 3.29Å; G852-D854 WeakPolarHBondContact CA-OD1 3.29Å; G852-E855 PolarHBondContact O-N 3.03Å
853	E	89.4	Confident	87.4	Confident	19 Å²	19	64.6 Å²	64.6	9%	0.089	34%	0.342	C	S	.	.			trans	-77.3	-13.9	-177.2	61.4	171.4	137.4	0	0	114.9	C830 K831 R832 C849 L856	C830-E853 VanDerWaalsContact C-OE1 3.3Å; C830-E853 WeakPolarHBondContact CA-OE1 3.39Å; K831-E853 VanDerWaalsContact CB-OE2 3.27Å; K831-E853 WeakPolarHBondContact CB-OE2 3.2Å; K831-E853 WeakPolarHBondContact CD-OE2 3.13Å; K831-E853 WeakPolarHBondContact CG-OE2 3.43Å; K831-E853 VanDerWaalsContact N-CD 3.31Å; K831-E853 PolarHBondContact N-OE1 3.25Å; K831-E853 PolarHBondContact N-OE2 2.93Å; K831-E853 IonicContact NZ-OE2 3.13Å; K831-E853 PolarHBondContact NZ-OE2 2.03Å; R832-E853 PolarHBondContact N-OE1 3.32Å; C849-E853 HydrophobicContact CB-CG 3.6Å; E853-L856 HydrophobicContact CB-CD1 4.31Å
854	D	88	Confident	87.5	Confident	2 Å²	2	66.3 Å²	66.3	1%	0.011	36%	0.357	C	S	.	.	S	Bend	trans	-64.2	-39.8	164.8	41.1	-43.7	0	0	0	112.2	F828 I837 D848 C849 G852 L856	F828-D854 HydrophobicContact CD1-CB 4.41Å; F828-D854 HydrophobicContact CE1-CB 4.07Å; I837-D854 HydrophobicContact CD1-CB 3.97Å; D848-D854 PolarHBondContact N-OD2 3.3Å; C849-D854 WeakPolarHBondContact CB-OD1 3.24Å; C849-D854 PolarHBondContact N-OD1 3.14Å; C849-D854 VanDerWaalsContact N-OD1 3.16Å; C849-D854 PolarHBondContact N-OD2 2.83Å; G852-D854 VanDerWaalsContact C-N 3.29Å; G852-D854 WeakPolarHBondContact CA-OD1 3.29Å; D854-L856 VanDerWaalsContact C-N 3.31Å; D854-L856 PolarHBondContact O-N 2.84Å
855	E	89.8	Confident	87.4	Confident	46 Å²	46	71.9 Å²	71.9	22%	0.215	38%	0.382	C	S	.	.	S	Bend	trans	-87.8	8.3	175.5	-68.7	-58.7	113.7	0	0	114	C843 D844 K845 D846 G852	C843-E855 WeakPolarHBondContact CA-OE1 3.39Å; C843-E855 PolarHBondContact N-OE1 3.11Å; D844-E855 PolarHBondContact N-OE1 2.81Å; K845-E855 VanDerWaalsContact CA-OE2 3.25Å; K845-E855 WeakPolarHBondContact CA-OE2 3.48Å; K845-E855 PolarHBondContact N-OE1 2.62Å; K845-E855 PolarHBondContact N-OE2 3.16Å; K845-E855 VanDerWaalsContact N-OE2 3.16Å; D846-E855 WeakPolarHBondContact O-CG 3.43Å; G852-E855 PolarHBondContact O-N 3.03Å
856	L	84.6	Confident	87.2	Confident	110 Å²	110	66 Å²	66	58%	0.576	36%	0.359	S	S	*	.	S	Bend	trans	-92.1	144.4	175.8	-63.6	-178.8	0	0	0	111.1	E853 D854 C858	E853-L856 HydrophobicContact CB-CD1 4.31Å; D854-L856 VanDerWaalsContact C-N 3.31Å; D854-L856 PolarHBondContact O-N 2.84Å; L856-C858 PolarHBondContact O-N 3.24Å
857	T	85.3	Confident	86.9	Confident	106 Å²	106	72.6 Å²	72.6	65%	0.65	38%	0.375	S	S	*	.	S	Bend	trans	67	8.1	-179.6	69.7	0	0	0	0	116.4	A859 N888	T857-A859 PolarHBondContact O-N 3.43Å; T857-N888 PolarHBondContact O-ND2 2.83Å; T857-N888 PolarHBondContact OG1-ND2 3.21Å
858	C	87.2	Confident	86.5	Confident	50 Å²	50	66.4 Å²	66.4	34%	0.338	36%	0.359	S	S	.	.			trans	-52	134.6	169.4	-58.4	0	0	0	0	112.3	C843 L856	C843-C858 VanDerWaalsContact CA-SG 3.5Å; C843-C858 HydrophobicContact CB-CB 3.77Å; C843-C858 WeakPolarHBondContact CB-SG 3.23Å; C843-C858 WeakPolarHBondContact SG-CA 3.43Å; C843-C858 WeakPolarHBondContact SG-CB 3.28Å; C843-C858 CovalentContact SG-SG 2.03Å; C843-C858 PolarHBondContact SG-SG 3.26Å; L856-C858 PolarHBondContact O-N 3.24Å
859	A	88.3	Confident	86.1	Confident	18 Å²	18	67.2 Å²	67.2	15%	0.149	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	130.3	179	0	0	0	0	0	111.2	T857 N888 M922 S948	T857-A859 PolarHBondContact O-N 3.43Å; A859-N888 HydrophobicContact CB-CB 4.13Å; A859-N888 PolarHBondContact N-O 2.78Å; A859-N888 PolarHBondContact O-N 2.79Å; A859-N888 VanDerWaalsContact O-O 3.08Å; A859-M922 HydrophobicContact CB-CE 3.97Å; A859-M922 HydrophobicContact CB-SD 3.31Å; A859-M922 WeakPolarHBondContact CB-SD 3.46Å; A859-S948 PolarHBondContact O-OG 2.97Å
860	P	87.2	Confident	85.6	Confident	80 Å²	80	71 Å²	71	52%	0.519	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	153.7	-178.4	29	-35.7	0	0	0	111.1	M862	P860-M862 PolarHBondContact O-N 2.72Å
861	P	89.9	Confident	85.4	Confident	7 Å²	7	68.9 Å²	68.9	5%	0.045	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	132.2	177.6	29.9	-30.2	0	0	0	109	V885 T886 G946 T951 A953	P861-V885 HydrophobicContact CB-CG1 3.96Å; P861-T886 CarbonylContact C-O 3.2Å; P861-T886 VanDerWaalsContact CA-O 3.32Å; P861-T886 WeakPolarHBondContact CA-O 3.44Å; P861-G946 VanDerWaalsContact CG-O 3.25Å; P861-G946 WeakPolarHBondContact CG-O 3.42Å; P861-T951 WeakPolarHBondContact CD-OG1 3.38Å; P861-A953 HydrophobicContact CB-CB 4.41Å; P861-A953 HydrophobicContact CG-CB 4.08Å; P861-A953 WeakPolarHBondContact O-CB 3.31Å
862	M	91.5	Very high	85.3	Confident	120 Å²	120	69.5 Å²	69.5	59%	0.591	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.1	128.2	173.8	-61.1	-178.1	69.6	0	0	108	P860 V885 T886	P860-M862 PolarHBondContact O-N 2.72Å; M862-V885 CarbonylContact O-C 3.5Å; M862-V885 WeakPolarHBondContact O-CA 3.11Å; M862-T886 PolarHBondContact N-O 3.47Å; M862-T886 PolarHBondContact O-N 2.94Å; M862-T886 PolarHBondContact O-OG1 3.08Å
863	I	92.1	Very high	84.8	Confident	36 Å²	36	70.3 Å²	70.3	19%	0.185	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	126.6	-179.6	-52.6	-171.2	0	0	0	108.3	E884 V885 A953	I863-E884 WeakPolarHBondContact CA-O 3.39Å; I863-V885 HydrophobicContact CD1-CG2 4.3Å; I863-V885 HydrophobicContact CG1-CG1 4.15Å; I863-V885 HydrophobicContact CG1-CG2 3.95Å; I863-V885 HydrophobicContact CG2-CG2 4.41Å; I863-A953 HydrophobicContact CD1-CB 4.37Å; I863-A953 HydrophobicContact CG1-CB 4.18Å
864	A	89.3	Confident	84.5	Confident	51 Å²	51	78.1 Å²	78.1	42%	0.421	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-68.4	142.4	177.1	0	0	0	0	0	110.9	E884	A864-E884 HydrophobicContact CB-CB 4.14Å; A864-E884 PolarHBondContact N-O 3.49Å
865	E	81.3	Confident	84	Confident	167 Å²	167	85.8 Å²	85.8	78%	0.78	43%	0.431	S	S	*	.	P	Polyproline II helix	trans	-63.6	128.9	179.8	-66.7	-165.9	144.8	0	0	111.4	R867	E865-R867 PolarHBondContact O-N 2.9Å
866	P	78.5	Confident	83.6	Confident	29 Å²	29	85.5 Å²	85.5	19%	0.188	44%	0.44	C	S	.	.	P	Polyproline II helix	trans	-71.3	131	-177.4	29.2	-35.3	0	0	0	110.4	T868 T869 L958	P866-T868 PolarHBondContact O-N 3.39Å; P866-T869 HydrophobicContact CG-CG2 3.84Å; P866-L958 HydrophobicContact CB-CD2 3.75Å; P866-L958 HydrophobicContact CG-CD2 3.62Å
867	R	79	Confident	83.8	Confident	255 Å²	255	83.6 Å²	83.6	96%	0.962	43%	0.43	S	S	*	.	S	Bend	trans	-59.2	-13.3	177.1	-61.8	-175.2	-175.6	-155.7	-0.1	114.3	E865	E865-R867 PolarHBondContact O-N 2.9Å
868	T	80.7	Confident	84.1	Confident	67 Å²	67	82.2 Å²	82.2	41%	0.411	42%	0.422	S	S	.	.			trans	-151.3	120.7	-179.2	-58.9	0	0	0	0	108.3	P866 R870 Y871	P866-T868 PolarHBondContact O-N 3.39Å; T868-R870 VanDerWaalsContact CG2-O 3.23Å; T868-R870 WeakPolarHBondContact CG2-O 3.21Å; T868-Y871 HydrophobicContact CG2-CD1 4.49Å; T868-Y871 HydrophobicContact CG2-CD2 4.36Å; T868-Y871 HydrophobicContact CG2-CE1 4.19Å; T868-Y871 HydrophobicContact CG2-CE2 4.03Å; T868-Y871 WeakPolarHBondContact O-CE2 3.42Å; T868-Y871 PolarHBondContact O-OH 3.34Å
869	T	81	Confident	84.2	Confident	61 Å²	61	80 Å²	80	37%	0.374	41%	0.407	S	S	.	.	S	Bend	trans	-101.6	-6	176.3	50	0	0	0	0	113.4	P866 L958 V959	P866-T869 HydrophobicContact CG-CG2 3.84Å; T869-L958 HydrophobicContact CG2-CD2 4.35Å; T869-L958 WeakPolarHBondContact O-CA 3.45Å; T869-V959 PolarHBondContact O-N 3.15Å
870	R	79.1	Confident	84.5	Confident	84 Å²	84	82.5 Å²	82.5	32%	0.317	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	121.4	-178.4	-66.9	-177.2	-179.5	-98.7	2	110.8	T868 V959 M961	T868-R870 VanDerWaalsContact CG2-O 3.23Å; T868-R870 WeakPolarHBondContact CG2-O 3.21Å; R870-V959 WeakPolarHBondContact CA-O 3.36Å; R870-M961 HydrophobicContact CB-CE 4.15Å
871	Y	81.5	Confident	84.7	Confident	48 Å²	48	78.7 Å²	78.7	19%	0.188	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	100.3	-176.4	-66.7	-99.1	0	0	0	110.1	T868 V879 L881 L958 V959 M961	T868-Y871 HydrophobicContact CG2-CD1 4.49Å; T868-Y871 HydrophobicContact CG2-CD2 4.36Å; T868-Y871 HydrophobicContact CG2-CE1 4.19Å; T868-Y871 HydrophobicContact CG2-CE2 4.03Å; T868-Y871 WeakPolarHBondContact O-CE2 3.42Å; T868-Y871 PolarHBondContact O-OH 3.34Å; Y871-V879 HydrophobicContact CD1-CG1 4.45Å; Y871-L881 HydrophobicContact CD1-CD2 3.96Å; Y871-L881 HydrophobicContact CD2-CD2 3.55Å; Y871-L881 HydrophobicContact CE1-CD2 3.8Å; Y871-L881 HydrophobicContact CE2-CD2 3.39Å; Y871-L881 HydrophobicContact CG-CD2 3.84Å; Y871-L958 HydrophobicContact CE2-CB 4.4Å; Y871-L958 HydrophobicContact CE2-CD2 4.44Å; Y871-V959 PolarHBondContact N-O 2.96Å; Y871-M961 PolarHBondContact O-N 2.81Å
872	S	80.8	Confident	84.9	Confident	99 Å²	99	81 Å²	81	69%	0.692	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.8	111.8	173.6	-59.9	0	0	0	0	110.1	M961	S872-M961 WeakPolarHBondContact CA-O 3.22Å
873	V	77.2	Confident	85	Confident	22 Å²	22	75.6 Å²	75.6	13%	0.133	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	158.4	-175.3	-71.3	0	0	0	0	112.2	D877 V879 V934 V960 M961 I962 G963	V873-D877 HydrophobicContact CB-CB 4.25Å; V873-V879 HydrophobicContact CB-CG2 4.11Å; V873-V879 HydrophobicContact CG1-CG2 3.58Å; V873-V879 HydrophobicContact CG2-CG2 3.63Å; V873-V934 HydrophobicContact CG2-CG1 4.05Å; V873-V960 HydrophobicContact CG2-CG1 4.09Å; V873-M961 PolarHBondContact N-O 2.82Å; V873-I962 CarbonylContact O-C 3.51Å; V873-I962 WeakPolarHBondContact O-CA 3.28Å; V873-G963 PolarHBondContact O-N 3.25Å
874	R	81.7	Confident	85	Confident	182 Å²	182	78.3 Å²	78.3	69%	0.687	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.3	161.1	177.7	-59.4	177.8	175.5	178.4	-1.8	111.2	G876 D877	R874-G876 PolarHBondContact O-N 2.81Å; R874-D877 WeakPolarHBondContact CA-OD2 3.35Å; R874-D877 WeakPolarHBondContact CB-OD2 3.18Å; R874-D877 PolarHBondContact N-OD2 3.18Å; R874-D877 VanDerWaalsContact O-CB 3.3Å; R874-D877 WeakPolarHBondContact O-CB 3.42Å; R874-D877 PolarHBondContact O-N 3.23Å
875	R	78.2	Confident	85.2	Confident	164 Å²	164	75.9 Å²	75.9	62%	0.619	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	124.8	172.9	-63.1	178	-178.2	-175.4	-0.9	110.1	V934 I962	R875-V934 CarbonylContact C-O 3.5Å; R875-V934 WeakPolarHBondContact CA-O 3Å; R875-I962 HydrophobicContact CG-CG2 3.64Å
876	G	81.8	Confident	85.7	Confident	39 Å²	39	70 Å²	70	40%	0.402	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.6	-9.5	-175.8	0	0	0	0	0	115.5	R874 V934	R874-G876 PolarHBondContact O-N 2.81Å; G876-V934 PolarHBondContact N-O 3.45Å
877	D	87.9	Confident	86.2	Confident	70 Å²	70	68.6 Å²	68.6	37%	0.374	34%	0.341	S	S	.	.			trans	-66.9	176	173	-71.4	-14.9	0	0	0	111.3	V873 R874 N933 V934	V873-D877 HydrophobicContact CB-CB 4.25Å; R874-D877 WeakPolarHBondContact CA-OD2 3.35Å; R874-D877 WeakPolarHBondContact CB-OD2 3.18Å; R874-D877 PolarHBondContact N-OD2 3.18Å; R874-D877 VanDerWaalsContact O-CB 3.3Å; R874-D877 WeakPolarHBondContact O-CB 3.42Å; R874-D877 PolarHBondContact O-N 3.23Å; D877-N933 WeakPolarHBondContact O-CA 3.17Å; D877-N933 PolarHBondContact O-N 3.03Å; D877-V934 PolarHBondContact O-N 3.08Å
878	T	92.4	Very high	86.5	Confident	78 Å²	78	58.1 Å²	58.1	48%	0.479	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	118.7	171.8	-63	0	0	0	0	109.7	V880 T930 I931	T878-V880 HydrophobicContact CG2-CG2 4.48Å; T878-T930 HydrophobicContact CG2-CG2 3.57Å; T878-I931 CarbonylContact C-O 3.56Å; T878-I931 VanDerWaalsContact CA-O 3.29Å; T878-I931 WeakPolarHBondContact CA-O 2.99Å
879	V	89.6	Confident	86.7	Confident	3 Å²	3	55.4 Å²	55.4	2%	0.018	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	142.6	171.6	172.8	0	0	0	0	108.9	Y871 V873 L881 T930 I931 V934 V960	Y871-V879 HydrophobicContact CD1-CG1 4.45Å; V873-V879 HydrophobicContact CB-CG2 4.11Å; V873-V879 HydrophobicContact CG1-CG2 3.58Å; V873-V879 HydrophobicContact CG2-CG2 3.63Å; V879-L881 HydrophobicContact CG1-CD2 3.48Å; V879-L881 VanDerWaalsContact CG1-CD2 3.48Å; V879-L881 HydrophobicContact CG1-CG 3.74Å; V879-T930 WeakPolarHBondContact O-CA 3.11Å; V879-I931 HydrophobicContact CB-CB 4.22Å; V879-I931 HydrophobicContact CB-CD1 4.39Å; V879-I931 HydrophobicContact CG1-CD1 4.37Å; V879-I931 PolarHBondContact N-O 2.03Å; V879-I931 PolarHBondContact O-N 2.65Å; V879-V934 HydrophobicContact CB-CG2 4.48Å; V879-V934 HydrophobicContact CG2-CG2 3.89Å; V879-V960 HydrophobicContact CG1-CG2 4.25Å; V879-V960 HydrophobicContact CG2-CG1 4Å
880	V	93.1	Very high	86.9	Confident	70 Å²	70	53.6 Å²	53.6	42%	0.424	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	109.9	168.6	-176.8	0	0	0	0	107.9	T878 V882 T928 L929 T930	T878-V880 HydrophobicContact CG2-CG2 4.48Å; V880-V882 HydrophobicContact CG1-CG2 4.33Å; V880-T928 HydrophobicContact CG1-CG2 3.47Å; V880-T928 VanDerWaalsContact CG1-CG2 3.47Å; V880-L929 WeakPolarHBondContact CA-O 3.29Å; V880-T930 HydrophobicContact CG2-CG2 4.33Å
881	L	92.6	Very high	87.3	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	141	172.9	-52.1	-176.4	0	0	0	108.9	Y871 V879 W895 T928 L929 Y942 L958 V960	Y871-L881 HydrophobicContact CD1-CD2 3.96Å; Y871-L881 HydrophobicContact CD2-CD2 3.55Å; Y871-L881 HydrophobicContact CE1-CD2 3.8Å; Y871-L881 HydrophobicContact CE2-CD2 3.39Å; Y871-L881 HydrophobicContact CG-CD2 3.84Å; V879-L881 HydrophobicContact CG1-CD2 3.48Å; V879-L881 VanDerWaalsContact CG1-CD2 3.48Å; V879-L881 HydrophobicContact CG1-CG 3.74Å; L881-W895 HydrophobicContact CB-CH2 3.43Å; L881-W895 VanDerWaalsContact CB-CH2 3.43Å; L881-W895 HydrophobicContact CB-CZ2 4.31Å; L881-W895 HydrophobicContact CB-CZ3 3.67Å; L881-W895 HydrophobicContact CD1-CH2 4.46Å; L881-W895 HydrophobicContact CD1-CZ3 3.82Å; L881-W895 HydrophobicContact CG-CZ3 4.4Å; L881-T928 CarbonylContact O-C 3.58Å; L881-T928 WeakPolarHBondContact O-CA 3.46Å; L881-L929 HydrophobicContact CB-CB 4.4Å; L881-L929 HydrophobicContact CD1-CD2 4.38Å; L881-L929 PolarHBondContact N-O 2.03Å; L881-L929 PolarHBondContact O-N 3.45Å; L881-Y942 HydrophobicContact CD1-CD1 4.28Å; L881-Y942 HydrophobicContact CD1-CD2 4.17Å; L881-Y942 HydrophobicContact CD1-CG 3.74Å; L881-L958 HydrophobicContact CB-CD1 4.09Å; L881-L958 HydrophobicContact CD1-CB 4.39Å; L881-L958 HydrophobicContact CD1-CD1 4.17Å; L881-L958 HydrophobicContact CD2-CD1 4.37Å; L881-L958 HydrophobicContact CG-CD1 4.45Å; L881-V960 HydrophobicContact CD1-CG2 4.26Å; L881-V960 HydrophobicContact CD2-CG2 4.24Å
882	V	93.5	Very high	87.4	Confident	57 Å²	57	50.4 Å²	50.4	35%	0.345	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	137.3	-178.2	-176.2	0	0	0	0	109.5	V880 E884 V926 S927 T928	V880-V882 HydrophobicContact CG1-CG2 4.33Å; V882-E884 HydrophobicContact CG1-CG 4.28Å; V882-V926 HydrophobicContact CG1-CG1 3.95Å; V882-S927 WeakPolarHBondContact CA-O 3.06Å; V882-T928 HydrophobicContact CG2-CG2 4.34Å
883	C	93.1	Very high	87.8	Confident	5 Å²	5	45.8 Å²	45.8	3%	0.034	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	114.8	-178.6	171.6	0	0	0	0	108.2	W895 S927 C944	C883-W895 HydrophobicContact CB-CH2 3.92Å; C883-W895 HydrophobicContact CB-CZ2 3.53Å; C883-S927 PolarHBondContact N-O 2.9Å; C883-S927 PolarHBondContact O-N 2.71Å; C883-C944 HydrophobicContact CB-CB 3.76Å; C883-C944 WeakPolarHBondContact CB-SG 3.07Å; C883-C944 WeakPolarHBondContact SG-CB 3.27Å; C883-C944 CovalentContact SG-SG 2.03Å; C883-C944 PolarHBondContact SG-SG 3.45Å
884	E	93.5	Very high	88.4	Confident	94 Å²	94	45.3 Å²	45.3	44%	0.439	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	122.8	179.2	-52.1	-167	157.2	0	0	109.2	I863 A864 V882 V926	I863-E884 WeakPolarHBondContact CA-O 3.39Å; A864-E884 HydrophobicContact CB-CB 4.14Å; A864-E884 PolarHBondContact N-O 3.49Å; V882-E884 HydrophobicContact CG1-CG 4.28Å; E884-V926 HydrophobicContact CG-CG1 4.24Å; E884-V926 HydrophobicContact CG-CG2 4.03Å
885	V	92.5	Very high	88.7	Confident	0 Å²	0	37 Å²	37	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	121.2	-172.5	-170.3	0	0	0	0	110.4	P861 M862 I863 P891 V893 T924 V925	P861-V885 HydrophobicContact CB-CG1 3.96Å; M862-V885 CarbonylContact O-C 3.5Å; M862-V885 WeakPolarHBondContact O-CA 3.11Å; I863-V885 HydrophobicContact CD1-CG2 4.3Å; I863-V885 HydrophobicContact CG1-CG1 4.15Å; I863-V885 HydrophobicContact CG1-CG2 3.95Å; I863-V885 HydrophobicContact CG2-CG2 4.41Å; V885-P891 HydrophobicContact CB-CB 4.21Å; V885-P891 HydrophobicContact CG1-CB 3.61Å; V885-P891 HydrophobicContact CG1-CG 3.96Å; V885-V893 HydrophobicContact CB-CG2 3.93Å; V885-V893 HydrophobicContact CG2-CG1 4.11Å; V885-V893 HydrophobicContact CG2-CG2 3.56Å; V885-T924 CarbonylContact O-C 3.59Å; V885-T924 WeakPolarHBondContact O-CA 3.22Å; V885-V925 PolarHBondContact N-O 2.89Å; V885-V925 PolarHBondContact O-N 2.65Å
886	T	92.6	Very high	88.8	Confident	42 Å²	42	30.9 Å²	30.9	26%	0.258	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	141.6	173.9	57.9	0	0	0	0	111	P861 M862 P923 T924	P861-T886 CarbonylContact C-O 3.2Å; P861-T886 VanDerWaalsContact CA-O 3.32Å; P861-T886 WeakPolarHBondContact CA-O 3.44Å; M862-T886 PolarHBondContact N-O 3.47Å; M862-T886 PolarHBondContact O-N 2.94Å; M862-T886 PolarHBondContact O-OG1 3.08Å; T886-P923 WeakPolarHBondContact CA-O 3.38Å; T886-T924 HydrophobicContact CG2-CG2 3.71Å
887	G	88.3	Confident	88.5	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177.5	174.3	175.4	0	0	0	0	0	111	P889 P923	G887-P889 CarbonylContact C-O 3.55Å; G887-P889 VanDerWaalsContact C-O 3.29Å; G887-P923 PolarHBondContact N-O 3.08Å; G887-P923 WeakPolarHBondContact O-CD 3.33Å; G887-P923 VanDerWaalsContact O-CG 3.28Å; G887-P923 WeakPolarHBondContact O-CG 3.46Å
888	N	86.4	Confident	87.4	Confident	35 Å²	35	31 Å²	31	19%	0.187	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	118.1	174	-171.7	34.3	0	0	0	108.9	T857 A859 S948	T857-N888 PolarHBondContact O-ND2 2.83Å; T857-N888 PolarHBondContact OG1-ND2 3.21Å; A859-N888 HydrophobicContact CB-CB 4.13Å; A859-N888 PolarHBondContact N-O 2.78Å; A859-N888 PolarHBondContact O-N 2.79Å; A859-N888 VanDerWaalsContact O-O 3.08Å; N888-S948 PolarHBondContact O-OG 2.05Å
889	P	83.9	Confident	86	Confident	11 Å²	11	33.7 Å²	33.7	7%	0.071	17%	0.166	C	C	.	.	S	Bend	cis	-61.3	175.6	6.5	-23.7	36.9	0	0	0	115.7	V842 C843 G887 P891 S948	V842-P889 HydrophobicContact CG1-CG 4.13Å; C843-P889 HydrophobicContact CB-CG 4.18Å; G887-P889 CarbonylContact C-O 3.55Å; G887-P889 VanDerWaalsContact C-O 3.29Å; P889-P891 VanDerWaalsContact O-CD 3.26Å; P889-P891 WeakPolarHBondContact O-CD 3.18Å; P889-S948 WeakPolarHBondContact CD-OG 3.44Å; P889-S948 VanDerWaalsContact N-OG 3.17Å; P889-S948 PolarHBondContact O-OG 3.06Å; P889-S948 VanDerWaalsContact O-OG 3.04Å
890	V	85.3	Confident	84.6	Confident	23 Å²	23	34.8 Å²	34.8	14%	0.139	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-64.2	119.1	-173	-176.1	0	0	0	0	109.8	C823 Q824 Y892 P915 P923 V925	C823-V890 HydrophobicContact CB-CG2 3.92Å; Q824-V890 HydrophobicContact CG-CG2 3.8Å; Q824-V890 VanDerWaalsContact OE1-CG2 3.26Å; Q824-V890 VanDerWaalsContact OE1-N 3.14Å; V890-Y892 PolarHBondContact O-N 3.02Å; V890-P915 HydrophobicContact CG1-CB 4.36Å; V890-P923 HydrophobicContact CB-CG 4.38Å; V890-P923 HydrophobicContact CG2-CB 4.1Å; V890-P923 HydrophobicContact CG2-CG 3.73Å; V890-V925 HydrophobicContact CG1-CG2 3.58Å
891	P	86.5	Confident	83.3	Confident	4 Å²	4	32.9 Å²	32.9	3%	0.026	17%	0.168	C	C	.	.	P	Polyproline II helix	trans	-65.1	128.7	-167.6	-27	35.4	0	0	0	114.8	V885 P889 V925 L947	V885-P891 HydrophobicContact CB-CB 4.21Å; V885-P891 HydrophobicContact CG1-CB 3.61Å; V885-P891 HydrophobicContact CG1-CG 3.96Å; P889-P891 VanDerWaalsContact O-CD 3.26Å; P889-P891 WeakPolarHBondContact O-CD 3.18Å; P891-V925 VanDerWaalsContact O-CG2 3.26Å; P891-V925 WeakPolarHBondContact O-CG2 2.95Å; P891-L947 CarbonylContact C-O 3.58Å; P891-L947 WeakPolarHBondContact CA-O 3.16Å
892	Y	85.6	Confident	82.4	Confident	61 Å²	61	34.5 Å²	34.5	24%	0.239	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	128.2	165.6	-159.7	-64.5	0	0	0	109	V796 H797 V890 I894 G946 L947	V796-Y892 HydrophobicContact CG1-CD1 4.14Å; V796-Y892 HydrophobicContact CG1-CE1 3.38Å; V796-Y892 HydrophobicContact CG1-CE2 4.25Å; V796-Y892 VanDerWaalsContact CG1-CZ 3.45Å; V796-Y892 WeakPolarHBondContact CG1-OH 2.96Å; H797-Y892 HydrophobicContact CB-CD2 4.47Å; H797-Y892 HydrophobicContact CB-CG 4.41Å; V890-Y892 PolarHBondContact O-N 3.02Å; Y892-I894 HydrophobicContact CD1-CD1 4.39Å; Y892-I894 HydrophobicContact CD1-CG1 3.79Å; Y892-I894 HydrophobicContact CE1-CG1 3.89Å; Y892-G946 WeakPolarHBondContact O-CA 3.47Å; Y892-L947 PolarHBondContact N-O 2.02Å; Y892-L947 PolarHBondContact O-N 3.29Å
893	V	88.8	Confident	81.1	Confident	2 Å²	2	33.8 Å²	33.8	1%	0.012	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	127.3	179.3	-167.1	0	0	0	0	111.6	V885 N913 V925 S927 C944 E945	V885-V893 HydrophobicContact CB-CG2 3.93Å; V885-V893 HydrophobicContact CG2-CG1 4.11Å; V885-V893 HydrophobicContact CG2-CG2 3.56Å; V893-N913 PolarHBondContact O-ND2 2.61Å; V893-V925 HydrophobicContact CG2-CB 4.06Å; V893-V925 HydrophobicContact CG2-CG1 3.8Å; V893-S927 VanDerWaalsContact CG1-CB 3.48Å; V893-C944 HydrophobicContact CG1-CB 4.05Å; V893-E945 WeakPolarHBondContact CA-O 3.14Å
894	I	88.2	Confident	79.9	Confident	12 Å²	12	40.9 Å²	40.9	6%	0.062	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	149.9	179.8	-60.7	176	0	0	0	108.7	P776 L777 V796 Y892 C944 E945 L947	P776-I894 HydrophobicContact CB-CG2 4.48Å; L777-I894 HydrophobicContact CD2-CD1 3.7Å; V796-I894 HydrophobicContact CB-CD1 3.86Å; V796-I894 HydrophobicContact CG1-CD1 3.75Å; V796-I894 HydrophobicContact CG1-CG1 4.05Å; V796-I894 HydrophobicContact CG2-CD1 4.42Å; Y892-I894 HydrophobicContact CD1-CD1 4.39Å; Y892-I894 HydrophobicContact CD1-CG1 3.79Å; Y892-I894 HydrophobicContact CE1-CG1 3.89Å; I894-C944 CarbonylContact O-C 3.53Å; I894-C944 WeakPolarHBondContact O-CA 3.16Å; I894-C944 WeakPolarHBondContact O-CB 3.14Å; I894-E945 PolarHBondContact N-O 3.26Å; I894-E945 PolarHBondContact O-N 2.69Å; I894-L947 HydrophobicContact CD1-CD1 3.73Å
895	W	89	Confident	79	Confident	7 Å²	7	39.2 Å²	39.2	3%	0.027	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	135.9	175.1	-75.5	85	0	0	0	111.2	L881 C883 L902 I911 S927 L929 C944 L958	L881-W895 HydrophobicContact CB-CH2 3.43Å; L881-W895 VanDerWaalsContact CB-CH2 3.43Å; L881-W895 HydrophobicContact CB-CZ2 4.31Å; L881-W895 HydrophobicContact CB-CZ3 3.67Å; L881-W895 HydrophobicContact CD1-CH2 4.46Å; L881-W895 HydrophobicContact CD1-CZ3 3.82Å; L881-W895 HydrophobicContact CG-CZ3 4.4Å; C883-W895 HydrophobicContact CB-CH2 3.92Å; C883-W895 HydrophobicContact CB-CZ2 3.53Å; W895-L902 HydrophobicContact CB-CD1 3.71Å; W895-L902 HydrophobicContact CB-CG 4.43Å; W895-I911 HydrophobicContact CB-CD1 4.13Å; W895-I911 HydrophobicContact CG-CD1 4.36Å; W895-I911 HydrophobicContact CG-CG1 4.47Å; W895-S927 PolarHBondContact NE1-OG 3.43Å; W895-L929 HydrophobicContact CB-CD2 4.2Å; W895-L929 HydrophobicContact CD2-CB 3.61Å; W895-L929 HydrophobicContact CD2-CD2 3.82Å; W895-L929 HydrophobicContact CD2-CG 4.33Å; W895-L929 HydrophobicContact CE3-CB 3.96Å; W895-L929 HydrophobicContact CE3-CD2 3.62Å; W895-L929 HydrophobicContact CE3-CG 4.45Å; W895-L929 HydrophobicContact CG-CB 4.05Å; W895-L929 HydrophobicContact CG-CD2 4.08Å; W895-L929 HydrophobicContact CH2-CB 4.26Å; W895-L929 HydrophobicContact CZ2-CB 3.91Å; W895-L929 HydrophobicContact CZ3-CB 4.27Å; W895-L929 HydrophobicContact CZ3-CD2 4.3Å; W895-C944 HydrophobicContact CD2-CB 4.15Å; W895-C944 HydrophobicContact CE3-CB 4.31Å; W895-C944 HydrophobicContact CZ2-CB 4.37Å; W895-C944 HydrophobicContact CZ3-CB 4.48Å; W895-L958 HydrophobicContact CH2-CD1 4Å; W895-L958 HydrophobicContact CZ3-CD1 3.9Å
896	R	80.6	Confident	78	Confident	35 Å²	35	43.8 Å²	43.8	13%	0.132	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	156.3	176	-63	169.5	171.3	-100	3.7	110.3	P776 W899 G900 Y942 N943 E945	P776-R896 HydrophobicContact CB-CG 4.39Å; P776-R896 HydrophobicContact CG-CG 4.23Å; R896-W899 PolarHBondContact NH1-O 2.7Å; R896-G900 CarbonylContact C-O 3.52Å; R896-G900 VanDerWaalsContact CA-O 3.27Å; R896-G900 WeakPolarHBondContact CA-O 2.97Å; R896-G900 WeakPolarHBondContact CB-O 3.48Å; R896-Y942 WeakPolarHBondContact O-CA 3Å; R896-N943 WeakPolarHBondContact CB-OD1 3.35Å; R896-N943 WeakPolarHBondContact CD-OD1 3.34Å; R896-N943 PolarHBondContact N-O 2.6Å; R896-N943 PolarHBondContact O-N 3.46Å; R896-E945 IonicContact CZ-OE2 3.51Å; R896-E945 VanDerWaalsContact CZ-OE2 3.23Å; R896-E945 IonicContact NE-OE2 3.39Å; R896-E945 PolarHBondContact NE-OE2 3.34Å; R896-E945 IonicContact NH2-OE2 2.72Å; R896-E945 PolarHBondContact NH2-OE2 3.47Å
897	F	76.2	Confident	77.4	Confident	28 Å²	28	45.4 Å²	45.4	12%	0.123	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	126.1	171.8	170.1	-117.6	0	0	0	109.5	W899 G900 L902 P903 I941 Y942	F897-W899 PolarHBondContact O-N 2.67Å; F897-W899 VanDerWaalsContact O-N 3.17Å; F897-G900 PolarHBondContact N-O 3.23Å; F897-G900 CarbonylContact O-C 3.53Å; F897-G900 PolarHBondContact O-N 3.45Å; F897-L902 HydrophobicContact CB-CD2 3.97Å; F897-P903 HydrophobicContact CD1-CG 4.41Å; F897-I941 CarbonylContact C-O 3.54Å; F897-I941 WeakPolarHBondContact CA-O 3.11Å; F897-Y942 HydrophobicContact CB-CD1 4.1Å; F897-Y942 HydrophobicContact CB-CE1 3.86Å; F897-Y942 AromaticContact CD2-CD1 3.99Å; F897-Y942 HydrophobicContact CD2-CD1 3.99Å; F897-Y942 HydrophobicContact CD2-CD2 4.11Å; F897-Y942 AromaticContact CD2-CE1 3.47Å; F897-Y942 HydrophobicContact CD2-CE1 3.47Å; F897-Y942 VanDerWaalsContact CD2-CE1 3.47Å; F897-Y942 AromaticContact CD2-CE2 3.6Å; F897-Y942 HydrophobicContact CD2-CE2 3.6Å; F897-Y942 HydrophobicContact CD2-CG 4.28Å; F897-Y942 AromaticContact CD2-CZ 3.24Å; F897-Y942 WeakPolarHBondContact CD2-OH 3.34Å; F897-Y942 HydrophobicContact CE2-CE1 4.26Å; F897-Y942 AromaticContact CE2-CE2 3.75Å; F897-Y942 HydrophobicContact CE2-CE2 3.75Å; F897-Y942 AromaticContact CE2-CZ 3.58Å; F897-Y942 WeakPolarHBondContact CE2-OH 3.34Å; F897-Y942 HydrophobicContact CG-CD1 4.48Å; F897-Y942 AromaticContact CG-CE1 3.92Å; F897-Y942 HydrophobicContact CG-CE1 3.92Å
898	N	64.9	Low	77.2	Confident	84 Å²	84	46.2 Å²	46.2	45%	0.449	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	44	47	-171.8	-64.9	-25.6	0	0	0	111.5	G900 I941	N898-G900 PolarHBondContact O-N 2.61Å; N898-I941 PolarHBondContact N-O 2.78Å; N898-I941 PolarHBondContact OD1-N 2.79Å
899	W	62.3	Low	77.3	Confident	134 Å²	134	45.2 Å²	45.2	51%	0.508	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.2	-9.9	-176.1	-62.7	82.1	0	0	0	117.3	R896 F897 L954	R896-W899 PolarHBondContact NH1-O 2.7Å; F897-W899 PolarHBondContact O-N 2.67Å; F897-W899 VanDerWaalsContact O-N 3.17Å; W899-L954 HydrophobicContact CH2-CD2 3.45Å; W899-L954 VanDerWaalsContact CH2-CD2 3.45Å; W899-L954 HydrophobicContact CZ3-CD2 3.43Å; W899-L954 VanDerWaalsContact CZ3-CD2 3.43Å
900	G	60.1	Low	77.5	Confident	27 Å²	27	51.8 Å²	51.8	28%	0.278	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	-162.4	174	0	0	0	0	0	114.6	R896 F897 N898	R896-G900 CarbonylContact C-O 3.52Å; R896-G900 VanDerWaalsContact CA-O 3.27Å; R896-G900 WeakPolarHBondContact CA-O 2.97Å; R896-G900 WeakPolarHBondContact CB-O 3.48Å; F897-G900 PolarHBondContact N-O 3.23Å; F897-G900 CarbonylContact O-C 3.53Å; F897-G900 PolarHBondContact O-N 3.45Å; N898-G900 PolarHBondContact O-N 2.61Å
901	C	65.4	Low	77.7	Confident	30 Å²	30	54.6 Å²	54.6	20%	0.203	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	149.6	175.2	-65.9	0	0	0	0	113.1	C774	C774-C901 HydrophobicContact CB-CB 3.81Å; C774-C901 WeakPolarHBondContact CB-SG 3.33Å; C774-C901 PolarHBondContact O-SG 3.25Å; C774-C901 VanDerWaalsContact O-SG 3.37Å; C774-C901 WeakPolarHBondContact SG-CB 3.24Å; C774-C901 CovalentContact SG-SG 2.04Å; C774-C901 PolarHBondContact SG-SG 3.16Å
902	L	73.2	Confident	77.8	Confident	33 Å²	33	57.5 Å²	57.5	17%	0.173	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-60	148.8	160.1	-73.4	167.3	0	0	0	110.8	W895 F897 F909 I911 L929 Y942	W895-L902 HydrophobicContact CB-CD1 3.71Å; W895-L902 HydrophobicContact CB-CG 4.43Å; F897-L902 HydrophobicContact CB-CD2 3.97Å; L902-F909 HydrophobicContact CD2-CD1 3.94Å; L902-F909 HydrophobicContact CD2-CE1 4.18Å; L902-I911 HydrophobicContact CD1-CD1 3.91Å; L902-I911 HydrophobicContact CD1-CG1 4.33Å; L902-L929 HydrophobicContact CD1-CD1 3.99Å; L902-L929 HydrophobicContact CD1-CD2 4.14Å; L902-L929 HydrophobicContact CD2-CD2 3.85Å; L902-Y942 HydrophobicContact CD2-CD1 3.93Å; L902-Y942 HydrophobicContact CD2-CE1 3.57Å
903	P	67	Low	77.9	Confident	42 Å²	42	57.2 Å²	57.2	27%	0.273	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-61.3	136.8	172.4	-20.6	32.4	0	0	0	111.9	F897 E905 F909	F897-P903 HydrophobicContact CD1-CG 4.41Å; P903-E905 PolarHBondContact O-N 3.16Å; P903-F909 HydrophobicContact CB-CD2 4.23Å; P903-F909 HydrophobicContact CB-CE2 3.71Å; P903-F909 HydrophobicContact CB-CZ 4.39Å; P903-F909 HydrophobicContact CG-CD2 4.46Å; P903-F909 HydrophobicContact CG-CE2 3.65Å; P903-F909 HydrophobicContact CG-CZ 3.81Å; P903-F909 WeakPolarHBondContact O-CD2 3.02Å
904	D	68.8	Low	77.9	Confident	154 Å²	154	60.3 Å²	60.3	82%	0.824	32%	0.321	S	S	*	.	S	Bend	trans	-74.6	69.3	-179.4	-171.9	21.8	0	0	0	112.4
905	E	72.8	Confident	77.8	Confident	60 Å²	60	61 Å²	61	28%	0.28	33%	0.327	S	S	.	.			trans	-130.8	73.1	172.9	-70.3	-176.1	-151.6	0	0	109.9	P903 S907 R908 F909 R935	P903-E905 PolarHBondContact O-N 3.16Å; E905-S907 PolarHBondContact O-N 3.24Å; E905-R908 PolarHBondContact O-N 2.79Å; E905-R908 IonicContact OE2-CZ 2.67Å; E905-R908 IonicContact OE2-NE 2.66Å; E905-R908 PolarHBondContact OE2-NE 2.65Å; E905-R908 IonicContact OE2-NH2 3.95Å; E905-R908 PolarHBondContact OE2-NH2 2.87Å; E905-F909 HydrophobicContact CB-CD2 4.25Å; E905-F909 PolarHBondContact O-N 2.72Å; E905-R935 VanDerWaalsContact CD-NH1 3.33Å; E905-R935 IonicContact OE1-CZ 3.68Å; E905-R935 VanDerWaalsContact OE1-CZ 3.3Å; E905-R935 IonicContact OE1-NH1 3.3Å; E905-R935 PolarHBondContact OE1-NH1 3.44Å; E905-R935 IonicContact OE1-NH2 2.85Å; E905-R935 PolarHBondContact OE1-NH2 3.14Å; E905-R935 IonicContact OE2-CZ 3.08Å; E905-R935 IonicContact OE2-NH1 3Å; E905-R935 PolarHBondContact OE2-NH1 2.8Å; E905-R935 IonicContact OE2-NH2 3.72Å
906	P	73.3	Confident	77.8	Confident	96 Å²	96	67.3 Å²	67.3	62%	0.623	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-9.1	-175.8	25.3	-35.6	0	0	0	114.4	F909	P906-F909 WeakPolarHBondContact CA-O 3.11Å
907	S	78.6	Confident	78	Confident	76 Å²	76	70.7 Å²	70.7	53%	0.531	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-35.7	167.7	56.9	0	0	0	0	112.3	E905 R910	E905-S907 PolarHBondContact O-N 3.24Å; S907-R910 PolarHBondContact O-NE 2.74Å; S907-R910 VanDerWaalsContact O-NE 3.09Å; S907-R910 PolarHBondContact O-NH2 2.79Å
908	R	85.6	Confident	78.1	Confident	16 Å²	16	72.5 Å²	72.5	6%	0.06	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	-47.8	-176.7	-59.5	-160.9	-53.5	119.1	3.2	114.1	E905 T930 S932 N933 D938	E905-R908 PolarHBondContact O-N 2.79Å; E905-R908 IonicContact OE2-CZ 2.67Å; E905-R908 IonicContact OE2-NE 2.66Å; E905-R908 PolarHBondContact OE2-NE 2.65Å; E905-R908 IonicContact OE2-NH2 3.95Å; E905-R908 PolarHBondContact OE2-NH2 2.87Å; R908-T930 VanDerWaalsContact O-O 3.08Å; R908-S932 PolarHBondContact O-N 2.81Å; R908-N933 PolarHBondContact NH1-O 3.43Å; R908-D938 IonicContact CZ-OD1 2.96Å; R908-D938 IonicContact CZ-OD2 2.74Å; R908-D938 VanDerWaalsContact NH1-CG 3.34Å; R908-D938 IonicContact NH1-OD1 2.89Å; R908-D938 PolarHBondContact NH1-OD1 3.17Å; R908-D938 IonicContact NH1-OD2 3.6Å; R908-D938 PolarHBondContact NH1-OD2 2.94Å; R908-D938 IonicContact NH2-OD1 3.65Å; R908-D938 PolarHBondContact NH2-OD1 2.95Å; R908-D938 IonicContact NH2-OD2 3.19Å
909	F	86.9	Confident	78.9	Confident	15 Å²	15	76.4 Å²	76.4	7%	0.066	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	114.4	176.8	-67.6	-80.7	0	0	0	108.9	L902 P903 E905 P906 L929 T930 I931 Y942	L902-F909 HydrophobicContact CD2-CD1 3.94Å; L902-F909 HydrophobicContact CD2-CE1 4.18Å; P903-F909 HydrophobicContact CB-CD2 4.23Å; P903-F909 HydrophobicContact CB-CE2 3.71Å; P903-F909 HydrophobicContact CB-CZ 4.39Å; P903-F909 HydrophobicContact CG-CD2 4.46Å; P903-F909 HydrophobicContact CG-CE2 3.65Å; P903-F909 HydrophobicContact CG-CZ 3.81Å; P903-F909 WeakPolarHBondContact O-CD2 3.02Å; E905-F909 HydrophobicContact CB-CD2 4.25Å; E905-F909 PolarHBondContact O-N 2.72Å; P906-F909 WeakPolarHBondContact CA-O 3.11Å; F909-L929 HydrophobicContact CD1-CD1 4.39Å; F909-T930 WeakPolarHBondContact CA-O 3.24Å; F909-I931 HydrophobicContact CD1-CB 4.37Å; F909-I931 HydrophobicContact CD1-CD1 4.4Å; F909-I931 HydrophobicContact CD1-CG1 3.84Å; F909-I931 HydrophobicContact CD1-CG2 3.98Å; F909-I931 HydrophobicContact CE1-CB 4.27Å; F909-I931 HydrophobicContact CE1-CD1 3.98Å; F909-I931 HydrophobicContact CE1-CG1 3.84Å; F909-I931 HydrophobicContact CE1-CG2 3.55Å; F909-I931 HydrophobicContact CZ-CG2 4.02Å; F909-Y942 HydrophobicContact CE1-CE1 4.28Å
910	R	89.5	Confident	79.8	Confident	149 Å²	149	72.2 Å²	72.2	56%	0.562	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.1	116.9	-178.2	-58.6	-174.9	-169.4	-167	3.9	110.4	S907 L929 T930	S907-R910 PolarHBondContact O-NE 2.74Å; S907-R910 VanDerWaalsContact O-NE 3.09Å; S907-R910 PolarHBondContact O-NH2 2.79Å; R910-L929 WeakPolarHBondContact O-CA 3.39Å; R910-T930 PolarHBondContact N-O 2.92Å; R910-T930 PolarHBondContact O-N 3.35Å
911	I	88.8	Confident	80.7	Confident	82 Å²	82	75.5 Å²	75.5	42%	0.421	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	133.5	172	-57.3	169	0	0	0	108.4	W895 L902 N913 T928 L929	W895-I911 HydrophobicContact CB-CD1 4.13Å; W895-I911 HydrophobicContact CG-CD1 4.36Å; W895-I911 HydrophobicContact CG-CG1 4.47Å; L902-I911 HydrophobicContact CD1-CD1 3.91Å; L902-I911 HydrophobicContact CD1-CG1 4.33Å; I911-N913 VanDerWaalsContact CG2-OD1 3.3Å; I911-N913 WeakPolarHBondContact CG2-OD1 3.47Å; I911-T928 CarbonylContact C-O 3.55Å; I911-T928 WeakPolarHBondContact CA-O 3.1Å; I911-L929 HydrophobicContact CG1-CD1 3.97Å
912	S	89.3	Confident	81.6	Confident	64 Å²	64	77 Å²	77	45%	0.448	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	116.2	167.6	-176	0	0	0	0	108.8	S927 T928	S912-S927 CarbonylContact O-C 3.52Å; S912-S927 WeakPolarHBondContact O-CA 3.34Å; S912-T928 PolarHBondContact N-O 3.33Å; S912-T928 PolarHBondContact O-N 3.1Å
913	N	86.9	Confident	82.3	Confident	55 Å²	55	75.5 Å²	75.5	29%	0.294	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	112.7	176.5	-70.8	-5.9	0	0	0	108	V893 I911 V925 S927	V893-N913 PolarHBondContact O-ND2 2.61Å; I911-N913 VanDerWaalsContact CG2-OD1 3.3Å; I911-N913 WeakPolarHBondContact CG2-OD1 3.47Å; N913-V925 HydrophobicContact CB-CG1 4.08Å; N913-S927 VanDerWaalsContact OD1-CB 3.26Å; N913-S927 WeakPolarHBondContact OD1-CB 3.47Å; N913-S927 PolarHBondContact OD1-OG 2.85Å
914	V	88.8	Confident	83.4	Confident	67 Å²	67	74.6 Å²	74.6	41%	0.406	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	110.2	-177.3	-178.8	0	0	0	0	109.3	V926	V914-V926 PolarHBondContact N-O 2.92Å; V914-V926 PolarHBondContact O-N 3.06Å
915	P	86.4	Confident	84.4	Confident	28 Å²	28	67.6 Å²	67.6	18%	0.182	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	156.8	175.4	36.4	-39.3	0	0	0	111.4	E821 C823 V890 T924 V925	E821-P915 WeakPolarHBondContact O-CD 3.32Å; E821-P915 WeakPolarHBondContact O-CG 3.34Å; C823-P915 VanDerWaalsContact SG-CB 3.59Å; V890-P915 HydrophobicContact CG1-CB 4.36Å; P915-T924 CarbonylContact C-O 3.48Å; P915-T924 WeakPolarHBondContact CA-O 3.17Å; P915-V925 HydrophobicContact CB-CG2 4.11Å
916	R	87.5	Confident	85.3	Confident	139 Å²	139	65.2 Å²	65.2	53%	0.525	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	154.8	-179.7	-57.6	-175.1	-178.3	-133.1	2	108.8	T924 V926	R916-T924 PolarHBondContact N-O 2.85Å; R916-T924 PolarHBondContact O-N 3.19Å; R916-V926 HydrophobicContact CG-CG2 4.42Å
917	N	85	Confident	86.3	Confident	106 Å²	106	60.6 Å²	60.6	57%	0.567	33%	0.328	S	S	*	.			trans	57	49	177.3	-45.3	-36	0	0	0	112.3	D919 S920	N917-D919 PolarHBondContact O-N 2.81Å; N917-D919 VanDerWaalsContact O-N 3.16Å; N917-S920 WeakPolarHBondContact O-CB 3.32Å; N917-S920 PolarHBondContact O-N 3.48Å
918	C	79.6	Confident	86.9	Confident	66 Å²	66	58.5 Å²	58.5	45%	0.446	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-36.7	-179.6	-60.3	0	0	0	0	113.2	C823 S920	C823-C918 HydrophobicContact CB-CB 3.48Å; C823-C918 VanDerWaalsContact CB-CB 3.48Å; C823-C918 WeakPolarHBondContact CB-SG 3.3Å; C823-C918 WeakPolarHBondContact SG-CA 3.15Å; C823-C918 WeakPolarHBondContact SG-CB 3.49Å; C823-C918 CovalentContact SG-SG 2.03Å; C823-C918 PolarHBondContact SG-SG 3.1Å; C918-S920 PolarHBondContact O-N 2.9Å
919	D	80.3	Confident	87.3	Confident	166 Å²	166	57.8 Å²	57.8	89%	0.888	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	4.8	-178.8	-40.9	-84.8	0	0	0	113.6	N917	N917-D919 PolarHBondContact O-N 2.81Å; N917-D919 VanDerWaalsContact O-N 3.16Å
920	S	81.4	Confident	87.7	Confident	45 Å²	45	58.9 Å²	58.9	32%	0.315	32%	0.318	S	S	.	.	S	Bend	trans	-83.7	146.4	176.3	-176.7	0	0	0	0	110.8	N917 C918 M922 P923	N917-S920 WeakPolarHBondContact O-CB 3.32Å; N917-S920 PolarHBondContact O-N 3.48Å; C918-S920 PolarHBondContact O-N 2.9Å; S920-M922 WeakPolarHBondContact CB-O 3.43Å; S920-M922 PolarHBondContact O-N 3.33Å; S920-M922 VanDerWaalsContact OG-C 3.26Å; S920-M922 PolarHBondContact OG-N 3.4Å; S920-M922 PolarHBondContact OG-O 3.45Å; S920-P923 WeakPolarHBondContact O-CD 3.48Å
921	P	79.5	Confident	87.8	Confident	97 Å²	97	51.9 Å²	51.9	63%	0.63	29%	0.291	S	S	*	.	S	Bend	trans	-66.4	-9.6	164	31	-36.5	0	0	0	113
922	M	83.6	Confident	87.9	Confident	60 Å²	60	49.5 Å²	49.5	30%	0.296	28%	0.282	S	S	.	.	S	Bend	trans	-130.7	82.7	171.1	-67.5	-65.5	-70.6	0	0	108.7	A859 S920	A859-M922 HydrophobicContact CB-CE 3.97Å; A859-M922 HydrophobicContact CB-SD 3.31Å; A859-M922 WeakPolarHBondContact CB-SD 3.46Å; S920-M922 WeakPolarHBondContact CB-O 3.43Å; S920-M922 PolarHBondContact O-N 3.33Å; S920-M922 VanDerWaalsContact OG-C 3.26Å; S920-M922 PolarHBondContact OG-N 3.4Å; S920-M922 PolarHBondContact OG-O 3.45Å
923	P	88.1	Confident	87.8	Confident	3 Å²	3	51 Å²	51	2%	0.019	29%	0.285	C	S	.	.			trans	-62.8	157.1	170.2	26	-33.6	0	0	0	111.1	T886 G887 V890 S920	T886-P923 WeakPolarHBondContact CA-O 3.38Å; G887-P923 PolarHBondContact N-O 3.08Å; G887-P923 WeakPolarHBondContact O-CD 3.33Å; G887-P923 VanDerWaalsContact O-CG 3.28Å; G887-P923 WeakPolarHBondContact O-CG 3.46Å; V890-P923 HydrophobicContact CB-CG 4.38Å; V890-P923 HydrophobicContact CG2-CB 4.1Å; V890-P923 HydrophobicContact CG2-CG 3.73Å; S920-P923 WeakPolarHBondContact O-CD 3.48Å
924	T	90.3	Very high	87.6	Confident	22 Å²	22	48.5 Å²	48.5	14%	0.135	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	119.9	-173.3	-42.1	0	0	0	0	111	V885 T886 P915 R916	V885-T924 CarbonylContact O-C 3.59Å; V885-T924 WeakPolarHBondContact O-CA 3.22Å; T886-T924 HydrophobicContact CG2-CG2 3.71Å; P915-T924 CarbonylContact C-O 3.48Å; P915-T924 WeakPolarHBondContact CA-O 3.17Å; R916-T924 PolarHBondContact N-O 2.85Å; R916-T924 PolarHBondContact O-N 3.19Å
925	V	90.5	Very high	86.9	Confident	7 Å²	7	50.1 Å²	50.1	4%	0.042	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	117.3	173.5	-178.3	0	0	0	0	110.1	V885 V890 P891 V893 N913 P915	V885-V925 PolarHBondContact N-O 2.89Å; V885-V925 PolarHBondContact O-N 2.65Å; V890-V925 HydrophobicContact CG1-CG2 3.58Å; P891-V925 VanDerWaalsContact O-CG2 3.26Å; P891-V925 WeakPolarHBondContact O-CG2 2.95Å; V893-V925 HydrophobicContact CG2-CB 4.06Å; V893-V925 HydrophobicContact CG2-CG1 3.8Å; N913-V925 HydrophobicContact CB-CG1 4.08Å; P915-V925 HydrophobicContact CB-CG2 4.11Å
926	V	92.5	Very high	85.7	Confident	10 Å²	10	52.2 Å²	52.2	6%	0.061	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	103.9	171.1	-179.3	0	0	0	0	107.7	V882 E884 V914 R916	V882-V926 HydrophobicContact CG1-CG1 3.95Å; E884-V926 HydrophobicContact CG-CG1 4.24Å; E884-V926 HydrophobicContact CG-CG2 4.03Å; V914-V926 PolarHBondContact N-O 2.92Å; V914-V926 PolarHBondContact O-N 3.06Å; R916-V926 HydrophobicContact CG-CG2 4.42Å
927	S	92.5	Very high	84.4	Confident	0 Å²	0	48 Å²	48	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	132.4	173.9	-170	0	0	0	0	110.6	V882 C883 V893 W895 S912 N913	V882-S927 WeakPolarHBondContact CA-O 3.06Å; C883-S927 PolarHBondContact N-O 2.9Å; C883-S927 PolarHBondContact O-N 2.71Å; V893-S927 VanDerWaalsContact CG1-CB 3.48Å; W895-S927 PolarHBondContact NE1-OG 3.43Å; S912-S927 CarbonylContact O-C 3.52Å; S912-S927 WeakPolarHBondContact O-CA 3.34Å; N913-S927 VanDerWaalsContact OD1-CB 3.26Å; N913-S927 WeakPolarHBondContact OD1-CB 3.47Å; N913-S927 PolarHBondContact OD1-OG 2.85Å
928	T	93.1	Very high	83.7	Confident	32 Å²	32	43 Å²	43	20%	0.196	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	116.4	180	-56.7	0	0	0	0	109.8	V880 L881 V882 I911 S912	V880-T928 HydrophobicContact CG1-CG2 3.47Å; V880-T928 VanDerWaalsContact CG1-CG2 3.47Å; L881-T928 CarbonylContact O-C 3.58Å; L881-T928 WeakPolarHBondContact O-CA 3.46Å; V882-T928 HydrophobicContact CG2-CG2 4.34Å; I911-T928 CarbonylContact C-O 3.55Å; I911-T928 WeakPolarHBondContact CA-O 3.1Å; S912-T928 PolarHBondContact N-O 3.33Å; S912-T928 PolarHBondContact O-N 3.1Å
929	L	93.3	Very high	83.3	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	112.7	170.4	172.2	60.8	0	0	0	109.5	V880 L881 W895 L902 F909 R910 I911 I931 Y942	V880-L929 WeakPolarHBondContact CA-O 3.29Å; L881-L929 HydrophobicContact CB-CB 4.4Å; L881-L929 HydrophobicContact CD1-CD2 4.38Å; L881-L929 PolarHBondContact N-O 2.03Å; L881-L929 PolarHBondContact O-N 3.45Å; W895-L929 HydrophobicContact CB-CD2 4.2Å; W895-L929 HydrophobicContact CD2-CB 3.61Å; W895-L929 HydrophobicContact CD2-CD2 3.82Å; W895-L929 HydrophobicContact CD2-CG 4.33Å; W895-L929 HydrophobicContact CE3-CB 3.96Å; W895-L929 HydrophobicContact CE3-CD2 3.62Å; W895-L929 HydrophobicContact CE3-CG 4.45Å; W895-L929 HydrophobicContact CG-CB 4.05Å; W895-L929 HydrophobicContact CG-CD2 4.08Å; W895-L929 HydrophobicContact CH2-CB 4.26Å; W895-L929 HydrophobicContact CZ2-CB 3.91Å; W895-L929 HydrophobicContact CZ3-CB 4.27Å; W895-L929 HydrophobicContact CZ3-CD2 4.3Å; L902-L929 HydrophobicContact CD1-CD1 3.99Å; L902-L929 HydrophobicContact CD1-CD2 4.14Å; L902-L929 HydrophobicContact CD2-CD2 3.85Å; F909-L929 HydrophobicContact CD1-CD1 4.39Å; R910-L929 WeakPolarHBondContact O-CA 3.39Å; I911-L929 HydrophobicContact CG1-CD1 3.97Å; L929-I931 HydrophobicContact CD1-CG1 4.47Å; L929-I931 HydrophobicContact CD2-CD1 4.47Å; L929-I931 HydrophobicContact CD2-CG1 4.46Å; L929-I931 HydrophobicContact CG-CG1 4.14Å; L929-Y942 HydrophobicContact CD2-CD1 3.85Å; L929-Y942 HydrophobicContact CD2-CE1 4.22Å
930	T	94	Very high	82.6	Confident	39 Å²	39	36.5 Å²	36.5	24%	0.239	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	130.5	170.7	-55.9	0	0	0	0	109.7	T878 V879 V880 R908 F909 R910	T878-T930 HydrophobicContact CG2-CG2 3.57Å; V879-T930 WeakPolarHBondContact O-CA 3.11Å; V880-T930 HydrophobicContact CG2-CG2 4.33Å; R908-T930 VanDerWaalsContact O-O 3.08Å; F909-T930 WeakPolarHBondContact CA-O 3.24Å; R910-T930 PolarHBondContact N-O 2.92Å; R910-T930 PolarHBondContact O-N 3.35Å
931	I	91.8	Very high	82.1	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.005	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	97.3	174.8	-46.3	172.4	0	0	0	107.3	T878 V879 F909 L929 V934 Y942	T878-I931 CarbonylContact C-O 3.56Å; T878-I931 VanDerWaalsContact CA-O 3.29Å; T878-I931 WeakPolarHBondContact CA-O 2.99Å; V879-I931 HydrophobicContact CB-CB 4.22Å; V879-I931 HydrophobicContact CB-CD1 4.39Å; V879-I931 HydrophobicContact CG1-CD1 4.37Å; V879-I931 PolarHBondContact N-O 2.03Å; V879-I931 PolarHBondContact O-N 2.65Å; F909-I931 HydrophobicContact CD1-CB 4.37Å; F909-I931 HydrophobicContact CD1-CD1 4.4Å; F909-I931 HydrophobicContact CD1-CG1 3.84Å; F909-I931 HydrophobicContact CD1-CG2 3.98Å; F909-I931 HydrophobicContact CE1-CB 4.27Å; F909-I931 HydrophobicContact CE1-CD1 3.98Å; F909-I931 HydrophobicContact CE1-CG1 3.84Å; F909-I931 HydrophobicContact CE1-CG2 3.55Å; F909-I931 HydrophobicContact CZ-CG2 4.02Å; L929-I931 HydrophobicContact CD1-CG1 4.47Å; L929-I931 HydrophobicContact CD2-CD1 4.47Å; L929-I931 HydrophobicContact CD2-CG1 4.46Å; L929-I931 HydrophobicContact CG-CG1 4.14Å; I931-V934 HydrophobicContact CB-CG2 4.49Å; I931-V934 HydrophobicContact CG2-CG2 4.15Å; I931-Y942 HydrophobicContact CD1-CD1 4.41Å; I931-Y942 HydrophobicContact CD1-CE1 3.75Å; I931-Y942 HydrophobicContact CD1-CE2 4.06Å
932	S	91.9	Very high	82.3	Confident	32 Å²	32	32.2 Å²	32.2	22%	0.224	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	141.4	-177.3	70.3	0	0	0	0	113	R908	R908-S932 PolarHBondContact O-N 2.81Å
933	N	86.8	Confident	82.4	Confident	96 Å²	96	29.4 Å²	29.4	51%	0.513	18%	0.176	S	C	.	.	S	Bend	trans	57.9	65.4	-177.4	-177.4	62.6	0	0	0	111.1	D877 R908	D877-N933 WeakPolarHBondContact O-CA 3.17Å; D877-N933 PolarHBondContact O-N 3.03Å; R908-N933 PolarHBondContact NH1-O 3.43Å
934	V	82.4	Confident	82.5	Confident	2 Å²	2	29.3 Å²	29.3	1%	0.012	18%	0.176	C	C	.	.			trans	-61.5	131.6	-179.4	172.7	0	0	0	0	111.1	V873 R875 G876 D877 V879 I931 D938 I962	V873-V934 HydrophobicContact CG2-CG1 4.05Å; R875-V934 CarbonylContact C-O 3.5Å; R875-V934 WeakPolarHBondContact CA-O 3Å; G876-V934 PolarHBondContact N-O 3.45Å; D877-V934 PolarHBondContact O-N 3.08Å; V879-V934 HydrophobicContact CB-CG2 4.48Å; V879-V934 HydrophobicContact CG2-CG2 3.89Å; I931-V934 HydrophobicContact CB-CG2 4.49Å; I931-V934 HydrophobicContact CG2-CG2 4.15Å; V934-D938 WeakPolarHBondContact CA-OD2 3.44Å; V934-D938 HydrophobicContact CG1-CB 4.35Å; V934-I962 HydrophobicContact CG1-CD1 3.45Å; V934-I962 VanDerWaalsContact CG1-CD1 3.45Å; V934-I962 HydrophobicContact CG1-CG1 3.57Å
935	R	75.4	Confident	82.5	Confident	101 Å²	101	28.6 Å²	28.6	38%	0.381	17%	0.171	S	C	.	.			trans	-134.5	157.3	-177.6	70.3	-176.4	-167.4	-144.9	-0.9	110.7	E905 G937 D938 I962	E905-R935 VanDerWaalsContact CD-NH1 3.33Å; E905-R935 IonicContact OE1-CZ 3.68Å; E905-R935 VanDerWaalsContact OE1-CZ 3.3Å; E905-R935 IonicContact OE1-NH1 3.3Å; E905-R935 PolarHBondContact OE1-NH1 3.44Å; E905-R935 IonicContact OE1-NH2 2.85Å; E905-R935 PolarHBondContact OE1-NH2 3.14Å; E905-R935 IonicContact OE2-CZ 3.08Å; E905-R935 IonicContact OE2-NH1 3Å; E905-R935 PolarHBondContact OE2-NH1 2.8Å; E905-R935 IonicContact OE2-NH2 3.72Å; R935-G937 PolarHBondContact O-N 3.46Å; R935-D938 WeakPolarHBondContact CG-OD2 3.2Å; R935-D938 PolarHBondContact N-OD2 3.24Å; R935-D938 WeakPolarHBondContact O-CB 3.28Å; R935-D938 PolarHBondContact O-N 2.87Å; R935-I962 VanDerWaalsContact C-CD1 3.43Å; R935-I962 WeakPolarHBondContact O-CD1 2.98Å
936	P	60.1	Low	82.4	Confident	73 Å²	73	28.2 Å²	28.2	47%	0.474	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	132	173.3	-26.2	35.8	0	0	0	111.8
937	G	61.3	Low	82.1	Confident	50 Å²	50	28.6 Å²	28.6	52%	0.515	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.7	-6.4	-167.7	0	0	0	0	0	114.9	R935 D939	R935-G937 PolarHBondContact O-N 3.46Å; G937-D939 PolarHBondContact N-OD1 3.5Å
938	D	70.4	Confident	81.6	Confident	2 Å²	2	28.8 Å²	28.8	1%	0.011	17%	0.171	C	C	.	.	S	Bend	trans	-94.2	-2.5	161.6	-51.6	-36.6	0	0	0	111.9	R908 V934 R935 Y942	R908-D938 IonicContact CZ-OD1 2.96Å; R908-D938 IonicContact CZ-OD2 2.74Å; R908-D938 VanDerWaalsContact NH1-CG 3.34Å; R908-D938 IonicContact NH1-OD1 2.89Å; R908-D938 PolarHBondContact NH1-OD1 3.17Å; R908-D938 IonicContact NH1-OD2 3.6Å; R908-D938 PolarHBondContact NH1-OD2 2.94Å; R908-D938 IonicContact NH2-OD1 3.65Å; R908-D938 PolarHBondContact NH2-OD1 2.95Å; R908-D938 IonicContact NH2-OD2 3.19Å; V934-D938 WeakPolarHBondContact CA-OD2 3.44Å; V934-D938 HydrophobicContact CG1-CB 4.35Å; R935-D938 WeakPolarHBondContact CG-OD2 3.2Å; R935-D938 PolarHBondContact N-OD2 3.24Å; R935-D938 WeakPolarHBondContact O-CB 3.28Å; R935-D938 PolarHBondContact O-N 2.87Å; D938-Y942 WeakPolarHBondContact O-CE2 3.46Å; D938-Y942 PolarHBondContact O-OH 2.77Å
939	D	69.3	Low	80.8	Confident	76 Å²	76	28.9 Å²	28.9	41%	0.406	18%	0.179	S	C	.	.			trans	-76.6	140	170.7	42	-51.1	0	0	0	111.5	G937 V960 I962	G937-D939 PolarHBondContact N-OD1 3.5Å; D939-V960 WeakPolarHBondContact CA-O 3.48Å; D939-I962 HydrophobicContact CB-CB 4.48Å; D939-I962 HydrophobicContact CB-CD1 3.97Å; D939-I962 HydrophobicContact CB-CG1 3.99Å; D939-I962 WeakPolarHBondContact OD1-CD1 3.29Å
940	G	66.7	Low	79.8	Confident	19 Å²	19	31.7 Å²	31.7	20%	0.196	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	148.2	-160.4	-176.4	0	0	0	0	0	114.3	V960	G940-V960 PolarHBondContact N-O 3.02Å; G940-V960 PolarHBondContact O-N 2.8Å
941	I	69.7	Low	79.2	Confident	51 Å²	51	32.4 Å²	32.4	26%	0.262	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	128.5	-178.6	-68.8	170.8	0	0	0	109.9	F897 N898 D957	F897-I941 CarbonylContact C-O 3.54Å; F897-I941 WeakPolarHBondContact CA-O 3.11Å; N898-I941 PolarHBondContact N-O 2.78Å; N898-I941 PolarHBondContact OD1-N 2.79Å; I941-D957 HydrophobicContact CG2-CB 3.75Å; I941-D957 VanDerWaalsContact CG2-OD1 3.28Å; I941-D957 WeakPolarHBondContact CG2-OD1 3.42Å
942	Y	84.3	Confident	79	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	133	170.2	-67.2	-94	0	0	0	109.4	L881 R896 F897 L902 F909 L929 I931 D938 L958 V960	L881-Y942 HydrophobicContact CD1-CD1 4.28Å; L881-Y942 HydrophobicContact CD1-CD2 4.17Å; L881-Y942 HydrophobicContact CD1-CG 3.74Å; R896-Y942 WeakPolarHBondContact O-CA 3Å; F897-Y942 HydrophobicContact CB-CD1 4.1Å; F897-Y942 HydrophobicContact CB-CE1 3.86Å; F897-Y942 AromaticContact CD2-CD1 3.99Å; F897-Y942 HydrophobicContact CD2-CD1 3.99Å; F897-Y942 HydrophobicContact CD2-CD2 4.11Å; F897-Y942 AromaticContact CD2-CE1 3.47Å; F897-Y942 HydrophobicContact CD2-CE1 3.47Å; F897-Y942 VanDerWaalsContact CD2-CE1 3.47Å; F897-Y942 AromaticContact CD2-CE2 3.6Å; F897-Y942 HydrophobicContact CD2-CE2 3.6Å; F897-Y942 HydrophobicContact CD2-CG 4.28Å; F897-Y942 AromaticContact CD2-CZ 3.24Å; F897-Y942 WeakPolarHBondContact CD2-OH 3.34Å; F897-Y942 HydrophobicContact CE2-CE1 4.26Å; F897-Y942 AromaticContact CE2-CE2 3.75Å; F897-Y942 HydrophobicContact CE2-CE2 3.75Å; F897-Y942 AromaticContact CE2-CZ 3.58Å; F897-Y942 WeakPolarHBondContact CE2-OH 3.34Å; F897-Y942 HydrophobicContact CG-CD1 4.48Å; F897-Y942 AromaticContact CG-CE1 3.92Å; F897-Y942 HydrophobicContact CG-CE1 3.92Å; L902-Y942 HydrophobicContact CD2-CD1 3.93Å; L902-Y942 HydrophobicContact CD2-CE1 3.57Å; F909-Y942 HydrophobicContact CE1-CE1 4.28Å; L929-Y942 HydrophobicContact CD2-CD1 3.85Å; L929-Y942 HydrophobicContact CD2-CE1 4.22Å; I931-Y942 HydrophobicContact CD1-CD1 4.41Å; I931-Y942 HydrophobicContact CD1-CE1 3.75Å; I931-Y942 HydrophobicContact CD1-CE2 4.06Å; D938-Y942 WeakPolarHBondContact O-CE2 3.46Å; D938-Y942 PolarHBondContact O-OH 2.77Å; Y942-L958 PolarHBondContact N-O 2.63Å; Y942-L958 WeakPolarHBondContact O-CA 3.29Å; Y942-L958 VanDerWaalsContact O-CB 3.25Å; Y942-L958 WeakPolarHBondContact O-CB 3.48Å; Y942-L958 PolarHBondContact O-N 2.98Å; Y942-V960 HydrophobicContact CD2-CB 4.03Å; Y942-V960 HydrophobicContact CD2-CG2 3.52Å; Y942-V960 HydrophobicContact CE2-CB 3.86Å; Y942-V960 HydrophobicContact CE2-CG2 3.71Å
943	N	86.4	Confident	78.7	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.005	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	157.8	169.7	58.1	43.2	0	0	0	110.4	R896 S955 D957	R896-N943 WeakPolarHBondContact CB-OD1 3.35Å; R896-N943 WeakPolarHBondContact CD-OD1 3.34Å; R896-N943 PolarHBondContact N-O 2.6Å; R896-N943 PolarHBondContact O-N 3.46Å; N943-S955 WeakPolarHBondContact CA-OG 3.24Å; N943-S955 WeakPolarHBondContact CB-OG 3.49Å; N943-D957 PolarHBondContact ND2-OD1 2.8Å
944	C	90.4	Very high	78.7	Confident	2 Å²	2	39.1 Å²	39.1	1%	0.014	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	143.6	176.3	60.7	0	0	0	0	110.9	C883 V893 I894 W895 L954 S955	C883-C944 HydrophobicContact CB-CB 3.76Å; C883-C944 WeakPolarHBondContact CB-SG 3.07Å; C883-C944 WeakPolarHBondContact SG-CB 3.27Å; C883-C944 CovalentContact SG-SG 2.03Å; C883-C944 PolarHBondContact SG-SG 3.45Å; V893-C944 HydrophobicContact CG1-CB 4.05Å; I894-C944 CarbonylContact O-C 3.53Å; I894-C944 WeakPolarHBondContact O-CA 3.16Å; I894-C944 WeakPolarHBondContact O-CB 3.14Å; W895-C944 HydrophobicContact CD2-CB 4.15Å; W895-C944 HydrophobicContact CE3-CB 4.31Å; W895-C944 HydrophobicContact CZ2-CB 4.37Å; W895-C944 HydrophobicContact CZ3-CB 4.48Å; C944-L954 WeakPolarHBondContact O-CA 3.35Å; C944-S955 PolarHBondContact N-OG 2.89Å; C944-S955 PolarHBondContact O-N 2.89Å; C944-S955 WeakPolarHBondContact SG-CB 3.2Å
945	E	90	Very high	79	Confident	6 Å²	6	39.7 Å²	39.7	3%	0.028	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	122.9	173.7	-166.6	169.8	-177.6	0	0	108.5	V893 I894 R896 L947 R952 A953 L954	V893-E945 WeakPolarHBondContact CA-O 3.14Å; I894-E945 PolarHBondContact N-O 3.26Å; I894-E945 PolarHBondContact O-N 2.69Å; R896-E945 IonicContact CZ-OE2 3.51Å; R896-E945 VanDerWaalsContact CZ-OE2 3.23Å; R896-E945 IonicContact NE-OE2 3.39Å; R896-E945 PolarHBondContact NE-OE2 3.34Å; R896-E945 IonicContact NH2-OE2 2.72Å; R896-E945 PolarHBondContact NH2-OE2 3.47Å; E945-L947 HydrophobicContact CG-CD2 4.02Å; E945-R952 VanDerWaalsContact OE1-CD 3.24Å; E945-R952 WeakPolarHBondContact OE1-CD 3.01Å; E945-R952 IonicContact OE1-NH1 2.77Å; E945-R952 PolarHBondContact OE1-NH1 2.92Å; E945-A953 CarbonylContact C-O 3.52Å; E945-A953 WeakPolarHBondContact CA-O 3.17Å; E945-L954 HydrophobicContact CB-CD1 3.84Å; E945-L954 HydrophobicContact CG-CD1 4.16Å
946	G	88.4	Confident	79.3	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	128.9	174.1	0	0	0	0	0	110.1	P861 Y892 R952 A953	P861-G946 VanDerWaalsContact CG-O 3.25Å; P861-G946 WeakPolarHBondContact CG-O 3.42Å; Y892-G946 WeakPolarHBondContact O-CA 3.47Å; G946-R952 CarbonylContact O-C 3.54Å; G946-R952 VanDerWaalsContact O-CA 3.25Å; G946-R952 WeakPolarHBondContact O-CA 2.99Å; G946-A953 PolarHBondContact N-O 3.19Å; G946-A953 PolarHBondContact O-N 2.84Å
947	L	85.2	Confident	80.4	Confident	17 Å²	17	38.3 Å²	38.3	9%	0.089	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	131.9	-179.1	-54	178.5	0	0	0	109.7	L777 H797 P891 Y892 I894 E945 R952	L777-L947 HydrophobicContact CD2-CD1 4.33Å; H797-L947 HydrophobicContact CB-CD1 4.02Å; P891-L947 CarbonylContact C-O 3.58Å; P891-L947 WeakPolarHBondContact CA-O 3.16Å; Y892-L947 PolarHBondContact N-O 2.02Å; Y892-L947 PolarHBondContact O-N 3.29Å; I894-L947 HydrophobicContact CD1-CD1 3.73Å; E945-L947 HydrophobicContact CG-CD2 4.02Å; L947-R952 HydrophobicContact CD2-CB 3.53Å
948	S	83.1	Confident	81.4	Confident	4 Å²	4	36 Å²	36	3%	0.028	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	115.5	177.6	169.6	0	0	0	0	109.4	A859 N888 P889 A950 T951	A859-S948 PolarHBondContact O-OG 2.97Å; N888-S948 PolarHBondContact O-OG 2.05Å; P889-S948 WeakPolarHBondContact CD-OG 3.44Å; P889-S948 VanDerWaalsContact N-OG 3.17Å; P889-S948 PolarHBondContact O-OG 3.06Å; P889-S948 VanDerWaalsContact O-OG 3.04Å; S948-A950 PolarHBondContact O-N 3.26Å; S948-T951 PolarHBondContact N-O 3.36Å; S948-T951 PolarHBondContact O-N 2.82Å; S948-T951 PolarHBondContact O-OG1 3.31Å
949	G	76	Confident	81.8	Confident	35 Å²	35	37.7 Å²	37.7	36%	0.361	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.7	-138.2	-168.6	0	0	0	0	0	111.4	T951	G949-T951 PolarHBondContact O-N 2.86Å; G949-T951 VanDerWaalsContact O-N 3.08Å
950	A	72.4	Confident	82.1	Confident	59 Å²	59	34.1 Å²	34.1	49%	0.488	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	19.4	174.5	0	0	0	0	0	115.3	C843 S948	C843-A950 PolarHBondContact O-N 3.36Å; C843-A950 VanDerWaalsContact O-N 3.1Å; S948-A950 PolarHBondContact O-N 3.26Å
951	T	82.1	Confident	82.2	Confident	54 Å²	54	35.2 Å²	35.2	33%	0.331	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	153.9	-174	66.5	0	0	0	0	113.9	P861 S948 G949	P861-T951 WeakPolarHBondContact CD-OG1 3.38Å; S948-T951 PolarHBondContact N-O 3.36Å; S948-T951 PolarHBondContact O-N 2.82Å; S948-T951 PolarHBondContact O-OG1 3.31Å; G949-T951 PolarHBondContact O-N 2.86Å; G949-T951 VanDerWaalsContact O-N 3.08Å
952	R	86.2	Confident	82	Confident	174 Å²	174	34.4 Å²	34.4	66%	0.657	19%	0.194	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-142.9	155	-174.7	63.2	170.1	173	-179.1	-3.7	113.6	E945 G946 L947	E945-R952 VanDerWaalsContact OE1-CD 3.24Å; E945-R952 WeakPolarHBondContact OE1-CD 3.01Å; E945-R952 IonicContact OE1-NH1 2.77Å; E945-R952 PolarHBondContact OE1-NH1 2.92Å; G946-R952 CarbonylContact O-C 3.54Å; G946-R952 VanDerWaalsContact O-CA 3.25Å; G946-R952 WeakPolarHBondContact O-CA 2.99Å; L947-R952 HydrophobicContact CD2-CB 3.53Å
953	A	86.8	Confident	80.7	Confident	26 Å²	26	36 Å²	36	22%	0.215	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	153	170	0	0	0	0	0	110.4	P861 I863 E945 G946	P861-A953 HydrophobicContact CB-CB 4.41Å; P861-A953 HydrophobicContact CG-CB 4.08Å; P861-A953 WeakPolarHBondContact O-CB 3.31Å; I863-A953 HydrophobicContact CD1-CB 4.37Å; I863-A953 HydrophobicContact CG1-CB 4.18Å; E945-A953 CarbonylContact C-O 3.52Å; E945-A953 WeakPolarHBondContact CA-O 3.17Å; G946-A953 PolarHBondContact N-O 3.19Å; G946-A953 PolarHBondContact O-N 2.84Å
954	L	87.2	Confident	78.6	Confident	69 Å²	69	42.4 Å²	42.4	36%	0.361	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	143.8	179.7	-165.8	77.4	0	0	0	109.5	W899 C944 E945	W899-L954 HydrophobicContact CH2-CD2 3.45Å; W899-L954 VanDerWaalsContact CH2-CD2 3.45Å; W899-L954 HydrophobicContact CZ3-CD2 3.43Å; W899-L954 VanDerWaalsContact CZ3-CD2 3.43Å; C944-L954 WeakPolarHBondContact O-CA 3.35Å; E945-L954 HydrophobicContact CB-CD1 3.84Å; E945-L954 HydrophobicContact CG-CD1 4.16Å
955	S	88.1	Confident	78	Confident	15 Å²	15	44.4 Å²	44.4	11%	0.105	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-76.2	164.3	176.5	72.7	0	0	0	0	112.5	N943 C944	N943-S955 WeakPolarHBondContact CA-OG 3.24Å; N943-S955 WeakPolarHBondContact CB-OG 3.49Å; C944-S955 PolarHBondContact N-OG 2.89Å; C944-S955 PolarHBondContact O-N 2.89Å; C944-S955 WeakPolarHBondContact SG-CB 3.2Å
956	N	81.5	Confident	77.4	Confident	89 Å²	89	46.4 Å²	46.4	48%	0.476	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-55.7	151.3	156.5	-67.8	-31.3	0	0	0	110.4
957	D	84.1	Confident	76.8	Confident	56 Å²	56	49 Å²	49	30%	0.299	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-69.5	127.9	178.2	-76.6	-24.1	0	0	0	111.9	I941 N943	I941-D957 HydrophobicContact CG2-CB 3.75Å; I941-D957 VanDerWaalsContact CG2-OD1 3.28Å; I941-D957 WeakPolarHBondContact CG2-OD1 3.42Å; N943-D957 PolarHBondContact ND2-OD1 2.8Å
958	L	82.2	Confident	76.3	Confident	2 Å²	2	50.9 Å²	50.9	1%	0.01	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	106.7	174.2	-52.9	178.7	0	0	0	108.8	P866 T869 Y871 L881 W895 Y942	P866-L958 HydrophobicContact CB-CD2 3.75Å; P866-L958 HydrophobicContact CG-CD2 3.62Å; T869-L958 HydrophobicContact CG2-CD2 4.35Å; T869-L958 WeakPolarHBondContact O-CA 3.45Å; Y871-L958 HydrophobicContact CE2-CB 4.4Å; Y871-L958 HydrophobicContact CE2-CD2 4.44Å; L881-L958 HydrophobicContact CB-CD1 4.09Å; L881-L958 HydrophobicContact CD1-CB 4.39Å; L881-L958 HydrophobicContact CD1-CD1 4.17Å; L881-L958 HydrophobicContact CD2-CD1 4.37Å; L881-L958 HydrophobicContact CG-CD1 4.45Å; W895-L958 HydrophobicContact CH2-CD1 4Å; W895-L958 HydrophobicContact CZ3-CD1 3.9Å; Y942-L958 PolarHBondContact N-O 2.63Å; Y942-L958 WeakPolarHBondContact O-CA 3.29Å; Y942-L958 VanDerWaalsContact O-CB 3.25Å; Y942-L958 WeakPolarHBondContact O-CB 3.48Å; Y942-L958 PolarHBondContact O-N 2.98Å
959	V	78.8	Confident	75.8	Confident	36 Å²	36	53.8 Å²	53.8	22%	0.218	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	116.6	-177	-169.9	0	0	0	0	109.8	T869 R870 Y871 M961	T869-V959 PolarHBondContact O-N 3.15Å; R870-V959 WeakPolarHBondContact CA-O 3.36Å; Y871-V959 PolarHBondContact N-O 2.96Å; V959-M961 HydrophobicContact CG1-CG 3.91Å; V959-M961 HydrophobicContact CG1-SD 4.4Å
960	V	74.7	Confident	75.8	Confident	2 Å²	2	55.1 Å²	55.1	1%	0.012	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	121.9	172.9	178.7	0	0	0	0	108.7	V873 V879 L881 D939 G940 Y942	V873-V960 HydrophobicContact CG2-CG1 4.09Å; V879-V960 HydrophobicContact CG1-CG2 4.25Å; V879-V960 HydrophobicContact CG2-CG1 4Å; L881-V960 HydrophobicContact CD1-CG2 4.26Å; L881-V960 HydrophobicContact CD2-CG2 4.24Å; D939-V960 WeakPolarHBondContact CA-O 3.48Å; G940-V960 PolarHBondContact N-O 3.02Å; G940-V960 PolarHBondContact O-N 2.8Å; Y942-V960 HydrophobicContact CD2-CB 4.03Å; Y942-V960 HydrophobicContact CD2-CG2 3.52Å; Y942-V960 HydrophobicContact CE2-CB 3.86Å; Y942-V960 HydrophobicContact CE2-CG2 3.71Å
961	M	69.4	Low	76.1	Confident	41 Å²	41	54.8 Å²	54.8	20%	0.202	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	127.3	-177.3	-63.1	177.2	-69	0	0	110	Y302 R870 Y871 S872 V873 V959	Y302-M961 HydrophobicContact CE2-SD 4.27Å; R870-M961 HydrophobicContact CB-CE 4.15Å; Y871-M961 PolarHBondContact O-N 2.81Å; S872-M961 WeakPolarHBondContact CA-O 3.22Å; V873-M961 PolarHBondContact N-O 2.82Å; V959-M961 HydrophobicContact CG1-CG 3.91Å; V959-M961 HydrophobicContact CG1-SD 4.4Å
962	I	65.5	Low	75.6	Confident	34 Å²	34	54.8 Å²	54.8	17%	0.174	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	107.6	179.2	-62.2	173.2	0	0	0	109.7	V873 R875 V934 R935 D939	V873-I962 CarbonylContact O-C 3.51Å; V873-I962 WeakPolarHBondContact O-CA 3.28Å; R875-I962 HydrophobicContact CG-CG2 3.64Å; V934-I962 HydrophobicContact CG1-CD1 3.45Å; V934-I962 VanDerWaalsContact CG1-CD1 3.45Å; V934-I962 HydrophobicContact CG1-CG1 3.57Å; R935-I962 VanDerWaalsContact C-CD1 3.43Å; R935-I962 WeakPolarHBondContact O-CD1 2.98Å; D939-I962 HydrophobicContact CB-CB 4.48Å; D939-I962 HydrophobicContact CB-CD1 3.97Å; D939-I962 HydrophobicContact CB-CG1 3.99Å; D939-I962 WeakPolarHBondContact OD1-CD1 3.29Å
963	G	55.5	Low	74.7	Confident	34 Å²	34	44.9 Å²	44.9	35%	0.351	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	144.6	170.8	0	0	0	0	0	112.2	V873	V873-G963 PolarHBondContact O-N 3.25Å
964	G	42.9	Very low	73.6	Confident	135 Å²	135	46.6 Å²	46.6	100%	1.392	33%	0.327	S	S	*	.			trans	-71.6	0	176.4	0	0	0	0	0	114.4

Retrieved 964 of 964 residues in 1035 ms (Link to these results)

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