A0A5K4EAZ5_SCHMA Loading...

Low-density lipoprotein receptor (Ldl)

AlphaFold DB , UniProt , Accession A0A5K4EAZ5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 859 aa.

						>A0A5K4EAZ5_SCHMA|A0A5K4EAZ5
MSILIHSILYLTLFCCILINGQRDIVEDDISMAGGDRNSEPTIVLNPGDPGPLDVNFGELLYSRCSVLDSNQYSYRWIQRAPDGTIKEISSDARLYITNFGPEHLQYPIRCEVTRLSDDETFEKVLNLRLASSGDLSTDDEYKTLNLTIKPLPNEDFRQGTIMRQCLFENDPEINELFDFRWIDQNGRIVTNGDTLYLLIEDPSELSNYTCEATNRQTGVIYQAKYRVSMLNGQQAMQHIVNIRPITGDVIIGRPYEMVCEVEPPPEEPISFVWYHNAKVVHREASLRLTSLSYRDIGMYICRAEWTPRYSRTAISANATAELSLALTRETKIEMSPPPGSVMVSLPGETRELHCEFPVANPRDVRWYFENQLLENHPTINATGKVYRIDRLRVSIVTIRGIEQDHGGTYECRIGRDIKQTHLVVRAEEGLEINPKSDTVDEGEAVEFHCRVHGMNGNINRQLEWYYRPFYSSTRVRLDVDTPDGFMRHDDLVAQHTSFISKARARVADQGEYICRLPSQNEEIVGKLFVRAVRSYVLTITPQRLTVRPYQPVEFECFAASEDGQPASFTPRFQVRDSRISFETTRVSENRVRFVLQRGLGPDQNGTVVECLSDEPSRPASAIITVEDICPDGSRRCRSGQCLPAGRFCDGARDCDDGSDEDPKMCNICDPLSRKCEYYQGREPIKSTFMVHWTCDGESDCGNGFDESNCEARASERCQDRMFNCKRDGRQIPMAFVCDKDRDCSDGEDELTCAPPMIAEPRTTRYSVRRGDTVVLVCEVTGNPVPYVIWRFNWGCLPDEPSRFRISNVPRNCDSPMPTVVSTLTISNVRPGDDGIYNCEGLSGATRALSNDLVVMIGG
					

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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	38.7	Very low	38.1	Very low	244 Å²	244	145.9 Å²	145.9	100%	1.202	76%	0.755	S	S	*	*				0	137	0	-176.7	167.4	170.3	0	0	107.6
2	S	29.3	Very low	38	Very low	100 Å²	100	142 Å²	142	70%	0.699	74%	0.743	S	S	*	*			trans	-38.8	152	165.3	-64.3	0	0	0	0	114.3
3	I	40.3	Very low	37.9	Very low	137 Å²	137	140.8 Å²	140.8	70%	0.703	74%	0.737	S	S	*	*			cis	176.4	176.5	1.4	-165.5	173.6	0	0	0	110.6
4	L	36.5	Very low	37.9	Very low	133 Å²	133	143.1 Å²	143.1	70%	0.696	74%	0.738	S	S	*	*			trans	77.6	156.1	157.2	-58.9	173.2	0	0	0	118
5	I	40.4	Very low	37.9	Very low	120 Å²	120	141.5 Å²	141.5	62%	0.615	74%	0.742	S	S	*	*			cis	-153.2	151.3	3.1	-133.3	162.6	0	0	0	115.5
6	H	37.5	Very low	37.5	Very low	150 Å²	150	139.7 Å²	139.7	69%	0.694	74%	0.743	S	S	*	*			trans	39.1	149.7	157.9	-55.8	-27.1	0	0	0	122.3
7	S	40.4	Very low	37.6	Very low	106 Å²	106	141.6 Å²	141.6	74%	0.741	75%	0.752	S	S	*	*				-170.7	170	52	-96.2	0	0	0	0	111.6
8	I	39.8	Very low	37.2	Very low	130 Å²	130	142.6 Å²	142.6	67%	0.667	76%	0.756	S	S	*	*			cis	-170.9	165.3	-30.5	-121.5	171.9	0	0	0	109.2
9	L	41.5	Very low	37.1	Very low	145 Å²	145	144.1 Å²	144.1	76%	0.759	76%	0.762	S	S	*	*			trans	67.6	118.1	179.3	-87.5	129.1	0	0	0	116.4
10	Y	36.5	Very low	36.7	Very low	193 Å²	193	145.1 Å²	145.1	76%	0.757	77%	0.768	S	S	*	*			cis	83.5	143.6	47.9	-77.1	-57.9	0	0	0	113.7	T12	Y10-T12 HydrophobicContact CD1-CG2 4.45Å
11	L	38	Very low	36.2	Very low	147 Å²	147	141.4 Å²	141.4	77%	0.77	77%	0.765	S	S	*	*			cis	-161	156.8	19.5	-153.5	109.7	0	0	0	107.7
12	T	37.4	Very low	35.7	Very low	99 Å²	99	139.5 Å²	139.5	61%	0.607	75%	0.753	S	S	*	*			cis	-170.4	-177.1	-31.2	40.7	0	0	0	0	105.9	Y10	Y10-T12 HydrophobicContact CD1-CG2 4.45Å
13	L	36.7	Very low	35.6	Very low	127 Å²	127	145.2 Å²	145.2	67%	0.665	76%	0.759	S	S	*	*			cis	-166	179.2	5.4	-132.5	172.2	0	0	0	109
14	F	37.5	Very low	35	Very low	173 Å²	173	146.4 Å²	146.4	76%	0.759	77%	0.767	S	S	*	*			trans	71.9	132.1	165	-62.6	-62.9	0	0	0	119.4
15	C	38.1	Very low	34.6	Very low	118 Å²	118	145.9 Å²	145.9	80%	0.797	76%	0.764	S	S	*	*			cis	-147	161.9	-5.7	-156.4	0	0	0	0	111.8
16	C	32.1	Very low	34	Very low	113 Å²	113	146.2 Å²	146.2	76%	0.764	77%	0.771	S	S	*	*			trans	-105.1	157.4	-168.5	-49.1	0	0	0	0	113.8
17	I	38.7	Very low	33.6	Very low	172 Å²	172	146.6 Å²	146.6	88%	0.882	77%	0.773	S	S	*	*				-155.7	147.8	129.6	-100.6	151.8	0	0	0	108.4
18	L	29.7	Very low	33	Very low	159 Å²	159	148.6 Å²	148.6	83%	0.832	78%	0.776	S	S	*	*			trans	-119.1	150.4	179.6	-77.9	155.6	0	0	0	109.7
19	I	35.8	Very low	32.4	Very low	171 Å²	171	149.9 Å²	149.9	88%	0.877	78%	0.784	S	S	*	*			trans	-174.3	151	139.1	-97.7	151.3	0	0	0	109.6
20	N	28.7	Very low	31.7	Very low	165 Å²	165	149.8 Å²	149.8	88%	0.882	78%	0.783	S	S	*	*			trans	-64.4	143.7	-174.5	-53.4	-56.5	0	0	0	113.9
21	G	27	Very low	31.2	Very low	68 Å²	68	145.6 Å²	145.6	70%	0.701	78%	0.782	S	S	*	*			trans	-178.4	125.8	163.4	0	0	0	0	0	115.1
22	Q	28.3	Very low	30.7	Very low	203 Å²	203	143.8 Å²	143.8	95%	0.949	77%	0.771	S	S	*	*			trans	65.6	167.4	162.9	-76.2	168.8	-114.6	0	0	119.5
23	R	27.6	Very low	30.3	Very low	220 Å²	220	143.9 Å²	143.9	83%	0.83	78%	0.782	S	S	*	*			trans	-94.4	134	173	-61.3	166.1	174	158.8	-6.3	107.1	I25	R23-I25 VanDerWaalsContact C-N 3.31Å; R23-I25 PolarHBondContact O-N 2.79Å
24	D	27.3	Very low	29.8	Very low	162 Å²	162	141.5 Å²	141.5	87%	0.866	79%	0.788	S	S	*	*			trans	-74.3	93.9	158.4	-61.9	-43.3	0	0	0	107.6	V26	D24-V26 PolarHBondContact O-N 3.08Å
25	I	27.8	Very low	29.6	Very low	122 Å²	122	136 Å²	136	63%	0.626	78%	0.779	S	S	*	*			trans	-69.4	110.1	149.7	-58.4	174.8	0	0	0	103.4	R23 E27	R23-I25 VanDerWaalsContact C-N 3.31Å; R23-I25 PolarHBondContact O-N 2.79Å; I25-E27 HydrophobicContact CB-CG 4.44Å; I25-E27 HydrophobicContact CG2-CG 3.75Å; I25-E27 PolarHBondContact O-N 2.63Å
26	V	28.1	Very low	29.7	Very low	127 Å²	127	135.7 Å²	135.7	77%	0.77	77%	0.77	S	S	*	*			trans	-70.9	95	160.1	-179.5	0	0	0	0	104.4	D24 D28	D24-V26 PolarHBondContact O-N 3.08Å; V26-D28 PolarHBondContact O-N 2.75Å
27	E	28.7	Very low	30.4	Very low	158 Å²	158	140.9 Å²	140.9	74%	0.738	77%	0.774	S	S	*	*			trans	-64.9	129.2	166.8	-65.8	-177.1	128.1	0	0	106.3	I25 D29	I25-E27 HydrophobicContact CB-CG 4.44Å; I25-E27 HydrophobicContact CG2-CG 3.75Å; I25-E27 PolarHBondContact O-N 2.63Å; E27-D29 PolarHBondContact O-N 3.18Å
28	D	28.3	Very low	31	Very low	148 Å²	148	138.8 Å²	138.8	79%	0.791	76%	0.764	S	S	*	*			trans	-64.5	103	173.4	-72.1	-61.4	0	0	0	107.5	V26 I30	V26-D28 PolarHBondContact O-N 2.75Å; D28-I30 VanDerWaalsContact C-N 3.33Å; D28-I30 PolarHBondContact O-N 2.7Å
29	D	26.8	Very low	32.5	Very low	158 Å²	158	134.3 Å²	134.3	85%	0.845	75%	0.746	S	S	*	*			trans	-61.5	96.5	171.1	-100.5	-32.6	0	0	0	108	E27 S31	E27-D29 PolarHBondContact O-N 3.18Å; D29-S31 PolarHBondContact O-N 3.41Å
30	I	27.1	Very low	34.2	Very low	143 Å²	143	133.3 Å²	133.3	73%	0.733	74%	0.738	S	S	*	*			trans	-70.4	71.4	169.6	-54.8	177.9	0	0	0	107.5	D28 M32	D28-I30 VanDerWaalsContact C-N 3.33Å; D28-I30 PolarHBondContact O-N 2.7Å; I30-M32 PolarHBondContact O-N 3.26Å
31	S	26	Very low	36.5	Very low	105 Å²	105	125.8 Å²	125.8	73%	0.734	70%	0.698	S	S	*	*			trans	-77.1	108.7	174.1	-161.8	0	0	0	0	107.7	D29 A33	D29-S31 PolarHBondContact O-N 3.41Å; S31-A33 PolarHBondContact O-N 3.25Å
32	M	26.3	Very low	39.1	Very low	108 Å²	108	126 Å²	126	53%	0.532	69%	0.685	S	S	.	*			trans	-44.7	129.3	173.3	-70.7	-167	-71.9	0	0	109.9	I30 G34 D202	I30-M32 PolarHBondContact O-N 3.26Å; M32-G34 PolarHBondContact O-N 3.27Å; M32-D202 HydrophobicContact CE-CB 3.84Å
33	A	29.7	Very low	41.9	Very low	102 Å²	102	116.9 Å²	116.9	84%	0.843	64%	0.643	S	S	*	*			trans	-57.8	100.1	-164.3	0	0	0	0	0	112.6	S31 G35	S31-A33 PolarHBondContact O-N 3.25Å; A33-G35 PolarHBondContact O-N 3.11Å
34	G	27.3	Very low	44.6	Very low	77 Å²	77	106.7 Å²	106.7	79%	0.794	61%	0.606	S	S	*	*			trans	-63.3	102	164.3	0	0	0	0	0	108.2	M32	M32-G34 PolarHBondContact O-N 3.27Å
35	G	31.8	Very low	47.4	Very low	56 Å²	56	99 Å²	99	58%	0.577	56%	0.564	S	S	*	*			trans	-53.1	147.8	-172	0	0	0	0	0	113.2	A33 R37	A33-G35 PolarHBondContact O-N 3.11Å; G35-R37 PolarHBondContact O-N 2.79Å
36	D	41.3	Very low	49.6	Very low	112 Å²	112	93.3 Å²	93.3	60%	0.599	54%	0.535	S	S	*	.			trans	-54.1	124.2	169.8	-176.1	-6.8	0	0	0	108.5	N38 S39	D36-N38 PolarHBondContact O-N 3.24Å; D36-N38 PolarHBondContact OD1-N 3.45Å; D36-S39 PolarHBondContact O-N 3.32Å; D36-S39 VanDerWaalsContact O-N 3.13Å; D36-S39 PolarHBondContact O-OG 3.15Å; D36-S39 VanDerWaalsContact O-OG 3.13Å
37	R	45.9	Very low	51.9	Low	223 Å²	223	87.3 Å²	87.3	84%	0.842	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-14.2	-177.2	-70.5	-174.8	172.7	-167.7	-3.1	112.8	G35	G35-R37 PolarHBondContact O-N 2.79Å
38	N	52.7	Low	54	Low	127 Å²	127	79.8 Å²	79.8	68%	0.679	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104	7.2	-178.8	-60.2	-11.9	0	0	0	114	D36	D36-N38 PolarHBondContact O-N 3.24Å; D36-N38 PolarHBondContact OD1-N 3.45Å
39	S	59.6	Low	56.2	Low	66 Å²	66	73.8 Å²	73.8	46%	0.462	43%	0.432	S	S	.	.	S	Bend	trans	-75.8	138	176.4	66.4	0	0	0	0	112.3	D36	D36-S39 PolarHBondContact O-N 3.32Å; D36-S39 VanDerWaalsContact O-N 3.13Å; D36-S39 PolarHBondContact O-OG 3.15Å; D36-S39 VanDerWaalsContact O-OG 3.13Å
40	E	71.5	Confident	57.8	Low	149 Å²	149	72 Å²	72	70%	0.696	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-62.5	129.2	171.7	178.3	167.2	-154.4	0	0	111.1	F122	E40-F122 HydrophobicContact CB-CD1 4.45Å; E40-F122 HydrophobicContact CB-CE1 4.15Å; E40-F122 HydrophobicContact CG-CD1 3.77Å; E40-F122 HydrophobicContact CG-CE1 3.98Å
41	P	78.4	Confident	59.6	Low	8 Å²	8	66.6 Å²	66.6	5%	0.052	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-73.1	144.8	-176.3	26.5	-33	0	0	0	113.6	I43 V67 Y73 F122	P41-I43 PolarHBondContact O-N 3.43Å; P41-V67 HydrophobicContact CB-CG1 3.6Å; P41-V67 HydrophobicContact CB-CG2 4.14Å; P41-Y73 HydrophobicContact CB-CE1 4.39Å; P41-Y73 HydrophobicContact CB-CE2 4.36Å; P41-Y73 WeakPolarHBondContact CB-OH 3.16Å; P41-Y73 HydrophobicContact CG-CE1 4.02Å; P41-F122 VanDerWaalsContact CD-CE2 3.49Å; P41-F122 VanDerWaalsContact CD-CZ 3.5Å; P41-F122 HydrophobicContact CG-CB 4.22Å; P41-F122 HydrophobicContact CG-CD1 4.28Å; P41-F122 HydrophobicContact CG-CD2 3.46Å; P41-F122 VanDerWaalsContact CG-CD2 3.46Å; P41-F122 HydrophobicContact CG-CE2 3.8Å; P41-F122 HydrophobicContact CG-CG 3.71Å; P41-F122 HydrophobicContact CG-CZ 4.31Å
42	T	81.6	Confident	61.9	Low	71 Å²	71	64.9 Å²	64.9	44%	0.436	40%	0.395	S	S	.	.			trans	-76.8	95.4	175.9	-52.9	0	0	0	0	110.7	V44 V67 L68 D69	T42-V44 HydrophobicContact CG2-CG2 4.46Å; T42-V67 WeakPolarHBondContact O-CA 3.45Å; T42-L68 HydrophobicContact CG2-CD1 3.59Å; T42-L68 HydrophobicContact CG2-CG 4Å; T42-L68 PolarHBondContact O-N 3.39Å; T42-D69 PolarHBondContact N-OD2 2.99Å
43	I	86.4	Confident	64.4	Low	13 Å²	13	60 Å²	60	7%	0.067	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	132.8	174.4	-57.3	171.4	0	0	0	110.5	P41 L45 S66 V67 V113 F122 K124	P41-I43 PolarHBondContact O-N 3.43Å; I43-L45 HydrophobicContact CG2-CD2 4.12Å; I43-S66 CarbonylContact C-O 3.43Å; I43-S66 WeakPolarHBondContact CA-O 3.31Å; I43-V67 HydrophobicContact CG1-CG2 4.13Å; I43-V113 HydrophobicContact CD1-CB 4.2Å; I43-V113 HydrophobicContact CD1-CG2 3.8Å; I43-V113 HydrophobicContact CG1-CG2 4.14Å; I43-V113 HydrophobicContact CG2-CG2 4.42Å; I43-F122 HydrophobicContact CD1-CB 3.82Å; I43-K124 HydrophobicContact CB-CB 4.08Å; I43-K124 HydrophobicContact CB-CD 3.97Å; I43-K124 HydrophobicContact CD1-CB 4.26Å; I43-K124 HydrophobicContact CG2-CB 3.68Å; I43-K124 HydrophobicContact CG2-CD 3.89Å; I43-K124 HydrophobicContact CG2-CG 4.43Å; I43-K124 VanDerWaalsContact O-CD 3.27Å; I43-K124 WeakPolarHBondContact O-CD 3.42Å; I43-K124 PolarHBondContact O-NZ 3.08Å
44	V	84.2	Confident	66.6	Low	6 Å²	6	56.6 Å²	56.6	4%	0.036	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	129.4	177.9	174.9	0	0	0	0	110.4	T42 C65 S66 L68 I189 N192	T42-V44 HydrophobicContact CG2-CG2 4.46Å; V44-C65 CarbonylContact O-C 3.58Å; V44-C65 WeakPolarHBondContact O-CA 3.38Å; V44-S66 PolarHBondContact N-O 2.9Å; V44-S66 PolarHBondContact O-N 3Å; V44-S66 PolarHBondContact O-OG 3.04Å; V44-L68 HydrophobicContact CG2-CD2 3.89Å; V44-L68 HydrophobicContact CG2-CG 4.2Å; V44-I189 HydrophobicContact CB-CD1 4.48Å; V44-I189 HydrophobicContact CG1-CD1 4.22Å; V44-N192 HydrophobicContact CG1-CB 4.22Å; V44-N192 VanDerWaalsContact CG1-CG 3.49Å; V44-N192 VanDerWaalsContact CG1-OD1 3.29Å; V44-N192 WeakPolarHBondContact CG1-OD1 3.39Å; V44-N192 HydrophobicContact CG2-CB 4.49Å
45	L	85.8	Confident	69	Low	0 Å²	0	53.3 Å²	53.3	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	118.7	174.5	-46.7	-177.9	0	0	0	108.7	I43 G48 D49 C65 W77 C111 K124 L126	I43-L45 HydrophobicContact CG2-CD2 4.12Å; L45-G48 CarbonylContact O-C 3.57Å; L45-D49 PolarHBondContact N-OD2 3.11Å; L45-D49 WeakPolarHBondContact O-CB 3.46Å; L45-D49 PolarHBondContact O-N 3.34Å; L45-D49 VanDerWaalsContact O-N 3.1Å; L45-C65 HydrophobicContact CD2-CB 3.88Å; L45-W77 HydrophobicContact CD1-CH2 4.26Å; L45-W77 HydrophobicContact CD2-CH2 3.82Å; L45-W77 HydrophobicContact CD2-CZ2 4.3Å; L45-W77 HydrophobicContact CG-CH2 4.47Å; L45-C111 HydrophobicContact CD2-CB 3.82Å; L45-K124 HydrophobicContact CD1-CD 4.49Å; L45-K124 HydrophobicContact CD1-CG 4.24Å; L45-K124 HydrophobicContact CG-CD 4.22Å; L45-K124 HydrophobicContact CG-CG 4.46Å; L45-L126 HydrophobicContact CB-CD1 4.47Å; L45-L126 HydrophobicContact CD1-CB 3.93Å; L45-L126 HydrophobicContact CD1-CD1 4.08Å
46	N	74	Confident	71.1	Confident	2 Å²	2	53 Å²	53	1%	0.011	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	124.2	173.6	165.7	-40.8	0	0	0	110.6	R64 D179 R181 T214	N46-R64 PolarHBondContact N-O 3.47Å; N46-R64 PolarHBondContact O-N 2.75Å; N46-D179 PolarHBondContact ND2-O 2.97Å; N46-R181 PolarHBondContact O-NH2 2.8Å; N46-R181 PolarHBondContact OD1-NH2 3Å; N46-T214 PolarHBondContact OD1-OG1 3.2Å
47	P	76.4	Confident	73	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.006	28%	0.282	C	S	.	.	S	Bend	cis	-72.1	160.6	-4.6	32.9	-39.8	0	0	0	112.5	L53 Y62 S63 D179 T214	P47-L53 HydrophobicContact CB-CD1 3.65Å; P47-L53 HydrophobicContact CG-CD1 3.86Å; P47-L53 HydrophobicContact CG-CD2 4.16Å; P47-Y62 HydrophobicContact CG-CD1 4.38Å; P47-Y62 WeakPolarHBondContact CG-O 3.47Å; P47-S63 PolarHBondContact O-OG 2.67Å; P47-D179 WeakPolarHBondContact CA-OD2 2.98Å; P47-D179 HydrophobicContact CB-CB 4.1Å; P47-D179 WeakPolarHBondContact CB-OD2 3.42Å; P47-T214 HydrophobicContact CB-CG2 4.47Å; P47-T214 HydrophobicContact CG-CG2 3.95Å
48	G	72.2	Confident	74.3	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.01	26%	0.264	C	S	.	.	S	Bend	trans	113.5	20.3	175.7	0	0	0	0	0	118.6	L45 G51 D179	L45-G48 CarbonylContact O-C 3.57Å; G48-G51 CarbonylContact C-O 3.54Å; G48-D179 PolarHBondContact N-OD2 2.8Å
49	D	74.5	Confident	75.4	Confident	21 Å²	21	42.2 Å²	42.2	11%	0.112	25%	0.25	C	S	.	.	S	Bend	trans	-135.6	141	165	-94.3	-55.2	0	0	0	109.9	L45 K124	L45-D49 PolarHBondContact N-OD2 3.11Å; L45-D49 WeakPolarHBondContact O-CB 3.46Å; L45-D49 PolarHBondContact O-N 3.34Å; L45-D49 VanDerWaalsContact O-N 3.1Å; D49-K124 WeakPolarHBondContact OD1-CE 3.38Å; D49-K124 IonicContact OD1-NZ 2.76Å; D49-K124 PolarHBondContact OD1-NZ 2.94Å; D49-K124 WeakPolarHBondContact OD2-CE 3.46Å; D49-K124 IonicContact OD2-NZ 3.15Å; D49-K124 PolarHBondContact OD2-NZ 3.49Å
50	P	61.4	Low	76.1	Confident	120 Å²	120	41.5 Å²	41.5	78%	0.779	24%	0.241	S	C	*	.	S	Bend	cis	-86.5	-3.7	-3.7	35.3	-36.2	0	0	0	113.7
51	G	64.1	Low	76.7	Confident	31 Å²	31	34.5 Å²	34.5	32%	0.32	21%	0.208	S	C	.	.	S	Bend	trans	-92.7	165	-178.6	0	0	0	0	0	113.8	G48	G48-G51 CarbonylContact C-O 3.54Å
52	P	75.6	Confident	77	Confident	68 Å²	68	35 Å²	35	44%	0.442	21%	0.21	S	C	.	.	P	Polyproline II helix	trans	-68.3	139	171.4	31.2	-34.8	0	0	0	111	N127 R129	P52-N127 CarbonylContact C-O 3.42Å; P52-N127 WeakPolarHBondContact CA-O 3.49Å; P52-N127 HydrophobicContact CB-CB 4.01Å; P52-R129 HydrophobicContact CB-CB 4.1Å; P52-R129 HydrophobicContact CG-CB 4.34Å
53	L	78.2	Confident	77.2	Confident	5 Å²	5	31.6 Å²	31.6	3%	0.026	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	125.9	177	-172.6	60	0	0	0	110.7	P47 L61 Y62 L126 N127 L128 R129 R216	P47-L53 HydrophobicContact CB-CD1 3.65Å; P47-L53 HydrophobicContact CG-CD1 3.86Å; P47-L53 HydrophobicContact CG-CD2 4.16Å; L53-L61 HydrophobicContact CD2-CD1 3.55Å; L53-Y62 WeakPolarHBondContact CD2-O 3.48Å; L53-L126 HydrophobicContact CD2-CD1 4.38Å; L53-N127 PolarHBondContact N-O 2.94Å; L53-L128 HydrophobicContact CB-CD2 3.96Å; L53-L128 HydrophobicContact CD2-CD2 4.3Å; L53-L128 CarbonylContact O-C 3.53Å; L53-L128 WeakPolarHBondContact O-CA 3.32Å; L53-R129 PolarHBondContact O-N 2.88Å; L53-R216 HydrophobicContact CD1-CB 4.34Å; L53-R216 WeakPolarHBondContact CD1-O 3.41Å
54	D	76.6	Confident	77.1	Confident	32 Å²	32	33.7 Å²	33.7	17%	0.171	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	130.7	176.6	-81.1	-44	0	0	0	111.4	R129 Q217	D54-R129 WeakPolarHBondContact CA-O 3.32Å; D54-R129 VanDerWaalsContact CG-NH2 3.27Å; D54-R129 IonicContact OD1-CZ 3.89Å; D54-R129 VanDerWaalsContact OD1-CZ 3.26Å; D54-R129 IonicContact OD1-NE 3.94Å; D54-R129 PolarHBondContact OD1-NE 2.87Å; D54-R129 IonicContact OD1-NH2 3.82Å; D54-R129 PolarHBondContact OD1-NH2 2.94Å; D54-R129 IonicContact OD2-CZ 3.15Å; D54-R129 IonicContact OD2-NE 2.74Å; D54-R129 IonicContact OD2-NH2 2.79Å; D54-R129 PolarHBondContact OD2-NH2 3.21Å; D54-Q217 HydrophobicContact CB-CG 4.5Å
55	V	76.3	Confident	77.3	Confident	7 Å²	7	33.5 Å²	33.5	4%	0.042	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	143.2	-178.4	-70	0	0	0	0	111.8	L61 F100 L128 R129 L130 A131	V55-L61 HydrophobicContact CG1-CB 4.46Å; V55-L61 HydrophobicContact CG1-CD1 3.98Å; V55-F100 HydrophobicContact CB-CD1 4.13Å; V55-F100 HydrophobicContact CB-CE1 4.01Å; V55-F100 HydrophobicContact CG2-CD1 4.19Å; V55-F100 HydrophobicContact CG2-CE1 3.55Å; V55-F100 HydrophobicContact CG2-CZ 3.94Å; V55-L128 HydrophobicContact CG1-CD2 4.24Å; V55-L128 HydrophobicContact CG2-CB 4.25Å; V55-R129 WeakPolarHBondContact CG2-O 3.32Å; V55-R129 PolarHBondContact N-O 2.81Å; V55-L130 WeakPolarHBondContact O-CA 3.31Å; V55-A131 PolarHBondContact O-N 3.47Å
56	N	75.7	Confident	77.2	Confident	50 Å²	50	34 Å²	34	27%	0.267	20%	0.198	S	C	.	.			trans	-108.5	158.4	164.8	-59.6	-77.9	0	0	0	111.3	G58 E59	N56-G58 PolarHBondContact O-N 3.31Å; N56-E59 HydrophobicContact CB-CG 4.09Å; N56-E59 VanDerWaalsContact CB-OE2 3.3Å; N56-E59 WeakPolarHBondContact CB-OE2 3.48Å; N56-E59 PolarHBondContact ND2-OE2 3.2Å; N56-E59 PolarHBondContact O-N 3.14Å
57	F	81.5	Confident	77.6	Confident	105 Å²	105	34.1 Å²	34.1	46%	0.461	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	130.6	171.4	-66.7	-54.7	0	0	0	111.3	F100 P102 L105 L130	F57-F100 CarbonylContact C-O 3.42Å; F57-F100 VanDerWaalsContact CA-O 3.26Å; F57-F100 WeakPolarHBondContact CA-O 3.19Å; F57-F100 HydrophobicContact CD1-CD1 4.1Å; F57-F100 HydrophobicContact CD1-CE1 4.26Å; F57-F100 HydrophobicContact CE1-CD1 4.49Å; F57-F100 HydrophobicContact CE1-CE1 4.2Å; F57-P102 HydrophobicContact CD1-CG 4.16Å; F57-P102 HydrophobicContact CE1-CB 4.18Å; F57-P102 HydrophobicContact CE1-CG 3.78Å; F57-P102 HydrophobicContact CZ-CB 4.38Å; F57-P102 HydrophobicContact CZ-CG 3.99Å; F57-L105 HydrophobicContact CE1-CD1 3.8Å; F57-L105 HydrophobicContact CZ-CD1 3.86Å; F57-L130 HydrophobicContact CD1-CD2 4.31Å; F57-L130 HydrophobicContact CD2-CD2 4.11Å; F57-L130 HydrophobicContact CE1-CD2 3.94Å; F57-L130 HydrophobicContact CE2-CD1 4.06Å; F57-L130 HydrophobicContact CE2-CD2 3.74Å; F57-L130 HydrophobicContact CG-CD2 4.39Å; F57-L130 HydrophobicContact CZ-CD1 3.8Å; F57-L130 HydrophobicContact CZ-CD2 3.65Å; F57-L130 HydrophobicContact CZ-CG 4.36Å
58	G	74.7	Confident	77.3	Confident	45 Å²	45	36.6 Å²	36.6	46%	0.464	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	94.6	-8.9	-177.7	0	0	0	0	0	115.2	N56 N99 F100	N56-G58 PolarHBondContact O-N 3.31Å; G58-N99 WeakPolarHBondContact CA-OD1 3.39Å; G58-F100 PolarHBondContact N-O 2.84Å
59	E	74.8	Confident	76.8	Confident	85 Å²	85	41.2 Å²	41.2	40%	0.397	24%	0.236	S	C	.	.	S	Bend	trans	-90.6	173.6	179.3	-70.1	-176.1	162.4	0	0	113	N56 L61 F100	N56-E59 HydrophobicContact CB-CG 4.09Å; N56-E59 VanDerWaalsContact CB-OE2 3.3Å; N56-E59 WeakPolarHBondContact CB-OE2 3.48Å; N56-E59 PolarHBondContact ND2-OE2 3.2Å; N56-E59 PolarHBondContact O-N 3.14Å; E59-L61 PolarHBondContact O-N 3.34Å; E59-F100 WeakPolarHBondContact O-CB 2.98Å; E59-F100 PolarHBondContact O-N 2.91Å
60	L	74.7	Confident	76.1	Confident	51 Å²	51	41.9 Å²	41.9	27%	0.267	24%	0.243	S	C	.	.			trans	-80.1	109.7	176	171.3	62.6	0	0	0	110.4	Y62 Y96 I97 T98	L60-Y62 PolarHBondContact O-N 3.47Å; L60-Y96 HydrophobicContact CD1-CD1 4.18Å; L60-Y96 HydrophobicContact CD1-CD2 3.89Å; L60-Y96 HydrophobicContact CD1-CE1 3.94Å; L60-Y96 HydrophobicContact CD1-CE2 3.61Å; L60-Y96 HydrophobicContact CD1-CG 4.15Å; L60-Y96 HydrophobicContact CD2-CE2 3.77Å; L60-Y96 HydrophobicContact CG-CE2 4.29Å; L60-I97 WeakPolarHBondContact CA-O 3.37Å; L60-T98 HydrophobicContact CD1-CG2 4.49Å
61	L	83.9	Confident	75.8	Confident	2 Å²	2	39.9 Å²	39.9	1%	0.01	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	110.1	164.4	167.7	54.9	0	0	0	109.4	L53 V55 E59 L95 I97 F100 I109 L126 L128	L53-L61 HydrophobicContact CD2-CD1 3.55Å; V55-L61 HydrophobicContact CG1-CB 4.46Å; V55-L61 HydrophobicContact CG1-CD1 3.98Å; E59-L61 PolarHBondContact O-N 3.34Å; L61-L95 HydrophobicContact CD1-CD2 4.26Å; L61-L95 HydrophobicContact CD2-CD2 3.98Å; L61-L95 HydrophobicContact CG-CD2 3.89Å; L61-I97 HydrophobicContact CB-CB 4.25Å; L61-I97 HydrophobicContact CD2-CD1 3.94Å; L61-I97 HydrophobicContact CG-CD1 4.33Å; L61-I97 PolarHBondContact N-O 3.17Å; L61-I97 PolarHBondContact O-N 3.05Å; L61-F100 HydrophobicContact CB-CB 4.24Å; L61-F100 HydrophobicContact CB-CD2 3.88Å; L61-F100 HydrophobicContact CB-CG 4.27Å; L61-F100 HydrophobicContact CD2-CD2 3.5Å; L61-F100 HydrophobicContact CD2-CE2 3.44Å; L61-F100 VanDerWaalsContact CD2-CE2 3.44Å; L61-F100 HydrophobicContact CD2-CZ 4.43Å; L61-F100 HydrophobicContact CG-CD2 4.35Å; L61-I109 HydrophobicContact CD2-CD1 4.04Å; L61-L126 HydrophobicContact CD1-CD2 4.26Å; L61-L128 HydrophobicContact CD1-CD2 4Å; L61-L128 HydrophobicContact CD2-CD1 3.82Å; L61-L128 HydrophobicContact CD2-CD2 4.17Å
62	Y	83.7	Confident	76.4	Confident	19 Å²	19	44 Å²	44	8%	0.075	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	137.4	169.9	175.3	-112.4	0	0	0	111.5	P47 L53 L60 R64 R94 L95 Y96 T214 I221	P47-Y62 HydrophobicContact CG-CD1 4.38Å; P47-Y62 WeakPolarHBondContact CG-O 3.47Å; L53-Y62 WeakPolarHBondContact CD2-O 3.48Å; L60-Y62 PolarHBondContact O-N 3.47Å; Y62-R64 WeakPolarHBondContact OH-CB 3.42Å; Y62-R94 HydrophobicContact CE2-CB 4.43Å; Y62-L95 WeakPolarHBondContact CA-O 3.27Å; Y62-L95 WeakPolarHBondContact CD2-O 3.43Å; Y62-Y96 AromaticContact CD2-CD2 3.94Å; Y62-Y96 HydrophobicContact CD2-CD2 3.94Å; Y62-T214 HydrophobicContact CD1-CG2 3.96Å; Y62-T214 HydrophobicContact CE1-CG2 4.02Å; Y62-I221 HydrophobicContact CE1-CD1 3.7Å; Y62-I221 HydrophobicContact CE1-CG1 4.12Å
63	S	86.2	Confident	76.8	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	153.4	162.1	-172.6	0	0	0	0	109.8	P47 L95	P47-S63 PolarHBondContact O-OG 2.67Å; S63-L95 PolarHBondContact N-O 3.08Å; S63-L95 VanDerWaalsContact N-O 3.14Å; S63-L95 PolarHBondContact O-N 2.87Å
64	R	85.7	Confident	77.3	Confident	57 Å²	57	44.1 Å²	44.1	22%	0.215	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	121.8	175.1	177	179.2	173.8	-158.7	-6	111.4	N46 Y62 A93 R94 R181	N46-R64 PolarHBondContact N-O 3.47Å; N46-R64 PolarHBondContact O-N 2.75Å; Y62-R64 WeakPolarHBondContact OH-CB 3.42Å; R64-A93 WeakPolarHBondContact CA-O 3.36Å; R64-R94 HydrophobicContact CG-CG 4.29Å; R64-R181 PolarHBondContact O-NH1 3.25Å
65	C	87.9	Confident	77.9	Confident	2 Å²	2	45 Å²	45	1%	0.014	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	151	174.6	-170.2	0	0	0	0	111.4	V44 L45 Y75 W77 A93 C111	V44-C65 CarbonylContact O-C 3.58Å; V44-C65 WeakPolarHBondContact O-CA 3.38Å; L45-C65 HydrophobicContact CD2-CB 3.88Å; C65-Y75 HydrophobicContact CB-CD1 4.35Å; C65-W77 HydrophobicContact CB-CZ2 3.76Å; C65-A93 PolarHBondContact N-O 3.49Å; C65-C111 HydrophobicContact CB-CB 3.65Å; C65-C111 WeakPolarHBondContact CB-SG 3.37Å; C65-C111 WeakPolarHBondContact SG-CB 3.49Å; C65-C111 CovalentContact SG-SG 2.02Å; C65-C111 PolarHBondContact SG-SG 2.83Å
66	S	83.8	Confident	78.8	Confident	9 Å²	9	48.3 Å²	48.3	6%	0.063	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.8	153.5	-171.8	12	0	0	0	0	109.4	I43 V44 R181 I189	I43-S66 CarbonylContact C-O 3.43Å; I43-S66 WeakPolarHBondContact CA-O 3.31Å; V44-S66 PolarHBondContact N-O 2.9Å; V44-S66 PolarHBondContact O-N 3Å; V44-S66 PolarHBondContact O-OG 3.04Å; S66-R181 PolarHBondContact OG-NH1 2.81Å; S66-I189 VanDerWaalsContact CB-CD1 3.49Å; S66-I189 WeakPolarHBondContact OG-CD1 3.19Å
67	V	82.5	Confident	79.7	Confident	6 Å²	6	46 Å²	46	4%	0.036	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	141.1	167.4	168.6	0	0	0	0	108.5	P41 T42 I43 D69 Y73 Y75 V113	P41-V67 HydrophobicContact CB-CG1 3.6Å; P41-V67 HydrophobicContact CB-CG2 4.14Å; T42-V67 WeakPolarHBondContact O-CA 3.45Å; I43-V67 HydrophobicContact CG1-CG2 4.13Å; V67-D69 HydrophobicContact CG1-CB 4.34Å; V67-Y73 HydrophobicContact CB-CD2 4.01Å; V67-Y73 HydrophobicContact CB-CE2 4.1Å; V67-Y73 HydrophobicContact CG1-CD2 4.01Å; V67-Y73 HydrophobicContact CG1-CE2 3.58Å; V67-Y73 HydrophobicContact CG2-CD2 4.08Å; V67-Y73 HydrophobicContact CG2-CE2 4.25Å; V67-Y73 HydrophobicContact CG2-CG 4.41Å; V67-Y75 HydrophobicContact CG2-CE1 4.45Å; V67-V113 HydrophobicContact CG2-CG1 3.86Å
68	L	69.3	Low	80.3	Confident	53 Å²	53	41 Å²	41	28%	0.277	21%	0.214	S	C	.	.	S	Bend	trans	-68.5	-42.9	176.5	-58.4	-173.1	0	0	0	111.6	T42 V44 I189	T42-L68 HydrophobicContact CG2-CD1 3.59Å; T42-L68 HydrophobicContact CG2-CG 4Å; T42-L68 PolarHBondContact O-N 3.39Å; V44-L68 HydrophobicContact CG2-CD2 3.89Å; V44-L68 HydrophobicContact CG2-CG 4.2Å; L68-I189 HydrophobicContact CD2-CB 3.71Å; L68-I189 HydrophobicContact CD2-CG2 3.55Å
69	D	61.1	Low	81.2	Confident	98 Å²	98	39 Å²	39	52%	0.524	19%	0.193	S	C	.	.	S	Bend	trans	-90.2	-17.1	-154.7	-45	-71.6	0	0	0	115.7	T42 V67	T42-D69 PolarHBondContact N-OD2 2.99Å; V67-D69 HydrophobicContact CG1-CB 4.34Å
70	S	59.9	Low	81.9	Confident	35 Å²	35	38.9 Å²	38.9	25%	0.245	19%	0.189	C	C	.	.			trans	-163.5	155	179.1	-180	0	0	0	0	114.5	Q72 Y73	S70-Q72 PolarHBondContact OG-N 2.84Å; S70-Q72 VanDerWaalsContact OG-N 3.08Å; S70-Y73 WeakPolarHBondContact O-CD2 3.41Å
71	N	56.1	Low	82.5	Confident	77 Å²	77	37 Å²	37	41%	0.412	18%	0.181	S	C	.	.	S	Bend	trans	-82.7	-8.7	170.8	-63.8	65.1	0	0	0	113.3	Y73 N186 R188	N71-Y73 PolarHBondContact O-N 3.37Å; N71-N186 PolarHBondContact ND2-O 2.95Å; N71-R188 VanDerWaalsContact OD1-CG 3.29Å; N71-R188 WeakPolarHBondContact OD1-CG 3.44Å; N71-R188 PolarHBondContact OD1-NE 2.81Å; N71-R188 PolarHBondContact OD1-NH2 3.13Å
72	Q	75.4	Confident	82.5	Confident	117 Å²	117	42.8 Å²	42.8	55%	0.547	22%	0.218	S	C	.	.			trans	-87.6	53.3	-171.5	-63.1	-169.4	7.1	0	0	113	S70 L116	S70-Q72 PolarHBondContact OG-N 2.84Å; S70-Q72 VanDerWaalsContact OG-N 3.08Å; Q72-L116 HydrophobicContact CB-CB 4.41Å; Q72-L116 WeakPolarHBondContact O-CB 3.3Å; Q72-L116 PolarHBondContact O-N 3.3Å
73	Y	84.8	Confident	82.7	Confident	23 Å²	23	47.7 Å²	47.7	9%	0.09	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	142.1	176.1	-66.3	-80.3	0	0	0	111.2	P41 V67 S70 N71 Y75 V113 T114 R115 F122	P41-Y73 HydrophobicContact CB-CE1 4.39Å; P41-Y73 HydrophobicContact CB-CE2 4.36Å; P41-Y73 WeakPolarHBondContact CB-OH 3.16Å; P41-Y73 HydrophobicContact CG-CE1 4.02Å; V67-Y73 HydrophobicContact CB-CD2 4.01Å; V67-Y73 HydrophobicContact CB-CE2 4.1Å; V67-Y73 HydrophobicContact CG1-CD2 4.01Å; V67-Y73 HydrophobicContact CG1-CE2 3.58Å; V67-Y73 HydrophobicContact CG2-CD2 4.08Å; V67-Y73 HydrophobicContact CG2-CE2 4.25Å; V67-Y73 HydrophobicContact CG2-CG 4.41Å; S70-Y73 WeakPolarHBondContact O-CD2 3.41Å; N71-Y73 PolarHBondContact O-N 3.37Å; Y73-Y75 VanDerWaalsContact O-CE2 3.27Å; Y73-Y75 WeakPolarHBondContact O-CE2 3.34Å; Y73-V113 HydrophobicContact CD1-CG1 3.61Å; Y73-V113 HydrophobicContact CE1-CG1 4.48Å; Y73-V113 HydrophobicContact CG-CG1 3.73Å; Y73-T114 CarbonylContact C-O 3.51Å; Y73-T114 VanDerWaalsContact CA-O 3.27Å; Y73-T114 WeakPolarHBondContact CA-O 3.46Å; Y73-R115 VanDerWaalsContact CD1-CA 3.5Å; Y73-R115 HydrophobicContact CD1-CB 3.9Å; Y73-R115 HydrophobicContact CD1-CG 4.12Å; Y73-R115 HydrophobicContact CE1-CB 3.52Å; Y73-R115 HydrophobicContact CE1-CG 3.5Å; Y73-F122 HydrophobicContact CE1-CD2 4.45Å; Y73-F122 HydrophobicContact CE1-CE2 4.45Å
74	S	88.5	Confident	82.5	Confident	53 Å²	53	50 Å²	50	37%	0.371	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	158.4	157.2	61.7	0	0	0	0	109.8	V113 T114	S74-V113 WeakPolarHBondContact O-CA 3.31Å; S74-T114 PolarHBondContact N-O 3.45Å; S74-T114 PolarHBondContact O-N 3.29Å; S74-T114 WeakPolarHBondContact OG-CB 3.46Å
75	Y	90.4	Very high	82.7	Confident	51 Å²	51	51.1 Å²	51.1	20%	0.2	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	140.8	-171.4	-57.4	-99.3	0	0	0	109.6	C65 V67 Y73 S91 D92 A93 V113	C65-Y75 HydrophobicContact CB-CD1 4.35Å; V67-Y75 HydrophobicContact CG2-CE1 4.45Å; Y73-Y75 VanDerWaalsContact O-CE2 3.27Å; Y73-Y75 WeakPolarHBondContact O-CE2 3.34Å; Y75-S91 CarbonylContact O-C 3.54Å; Y75-D92 CarbonylContact O-C 3.57Å; Y75-D92 WeakPolarHBondContact O-CA 3.49Å; Y75-A93 HydrophobicContact CD1-CB 4.2Å; Y75-A93 HydrophobicContact CD2-CB 4.14Å; Y75-A93 HydrophobicContact CG-CB 3.83Å; Y75-V113 HydrophobicContact CD1-CG1 4.04Å; Y75-V113 HydrophobicContact CD1-CG2 3.96Å; Y75-V113 HydrophobicContact CE1-CG1 3.94Å; Y75-V113 HydrophobicContact CE1-CG2 4.32Å
76	R	93.8	Very high	82.7	Confident	77 Å²	77	54.8 Å²	54.8	29%	0.291	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	162.8	165.6	60.1	171.4	-179.9	177.1	-3.1	111.6	I78 E88 S90 C111 E112	R76-I78 HydrophobicContact CG-CG2 4.16Å; R76-E88 WeakPolarHBondContact CD-OE2 3.3Å; R76-E88 IonicContact CZ-OE2 2.71Å; R76-E88 IonicContact NE-OE2 2.65Å; R76-E88 IonicContact NH1-OE2 3.31Å; R76-E88 PolarHBondContact NH1-OE2 3.18Å; R76-S90 WeakPolarHBondContact CA-O 3.05Å; R76-S90 WeakPolarHBondContact CB-O 3.31Å; R76-C111 WeakPolarHBondContact O-CA 3.45Å; R76-E112 HydrophobicContact CG-CB 4.18Å; R76-E112 IonicContact CZ-OE1 3.85Å; R76-E112 PolarHBondContact N-O 2.73Å; R76-E112 IonicContact NE-OE1 2.89Å; R76-E112 PolarHBondContact NE-OE1 3.39Å; R76-E112 IonicContact NH2-OE1 2.74Å; R76-E112 PolarHBondContact NH2-OE1 3.26Å; R76-E112 PolarHBondContact O-N 2.75Å
77	W	94.8	Very high	83	Confident	0 Å²	0	59 Å²	59	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	127.9	176.4	-71.4	90.3	0	0	0	110.5	L45 C65 I89 S90 D92 A93 L95 I109 R110 C111 L126	L45-W77 HydrophobicContact CD1-CH2 4.26Å; L45-W77 HydrophobicContact CD2-CH2 3.82Å; L45-W77 HydrophobicContact CD2-CZ2 4.3Å; L45-W77 HydrophobicContact CG-CH2 4.47Å; C65-W77 HydrophobicContact CB-CZ2 3.76Å; W77-I89 HydrophobicContact CB-CB 4.27Å; W77-I89 PolarHBondContact O-N 2.8Å; W77-S90 PolarHBondContact N-O 3.16Å; W77-S90 PolarHBondContact O-N 3.23Å; W77-D92 VanDerWaalsContact CD1-O 3.28Å; W77-A93 VanDerWaalsContact NE1-C 3.32Å; W77-A93 PolarHBondContact NE1-O 3.46Å; W77-L95 HydrophobicContact CB-CD1 4.05Å; W77-L95 HydrophobicContact CD2-CB 3.8Å; W77-L95 HydrophobicContact CD2-CD1 4.23Å; W77-L95 HydrophobicContact CD2-CG 4.46Å; W77-L95 HydrophobicContact CE3-CB 4.27Å; W77-L95 HydrophobicContact CE3-CD1 4.37Å; W77-L95 HydrophobicContact CE3-CD2 4.31Å; W77-L95 HydrophobicContact CG-CB 4.08Å; W77-L95 HydrophobicContact CG-CD1 4.12Å; W77-L95 HydrophobicContact CH2-CB 4.4Å; W77-L95 HydrophobicContact CZ2-CB 3.99Å; W77-L95 HydrophobicContact CZ3-CD2 4.3Å; W77-I109 HydrophobicContact CE3-CG2 3.61Å; W77-I109 HydrophobicContact CZ3-CG2 3.92Å; W77-R110 CarbonylContact C-O 3.59Å; W77-R110 VanDerWaalsContact CA-O 3.3Å; W77-R110 WeakPolarHBondContact CA-O 3.2Å; W77-C111 HydrophobicContact CD2-CB 4.23Å; W77-C111 HydrophobicContact CE3-CB 4.1Å; W77-C111 HydrophobicContact CH2-CB 4.21Å; W77-C111 HydrophobicContact CZ2-CB 4.29Å; W77-C111 HydrophobicContact CZ3-CB 4.07Å; W77-L126 HydrophobicContact CH2-CB 4.35Å; W77-L126 HydrophobicContact CH2-CD2 4.21Å; W77-L126 HydrophobicContact CZ3-CB 3.88Å; W77-L126 HydrophobicContact CZ3-CD2 4.08Å
78	I	94.2	Very high	83.5	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	155.8	-173	64.8	171.3	0	0	0	113.2	R76 I86 K87 E88 R110 E112	R76-I78 HydrophobicContact CG-CG2 4.16Å; I78-I86 HydrophobicContact CB-CG2 3.85Å; I78-I86 HydrophobicContact CD1-CG2 4.07Å; I78-I86 HydrophobicContact CG2-CG2 3.83Å; I78-K87 CarbonylContact C-O 3.59Å; I78-K87 WeakPolarHBondContact CA-O 3.44Å; I78-E88 HydrophobicContact CG2-CG 4.44Å; I78-R110 HydrophobicContact CG1-CB 4.1Å; I78-R110 PolarHBondContact N-O 2.93Å; I78-R110 PolarHBondContact O-N 3.1Å; I78-E112 HydrophobicContact CD1-CB 4.02Å; I78-E112 HydrophobicContact CD1-CG 4.38Å; I78-E112 VanDerWaalsContact CD1-OE2 3.29Å; I78-E112 WeakPolarHBondContact CD1-OE2 3.49Å; I78-E112 HydrophobicContact CG1-CB 4.34Å
79	Q	92.7	Very high	84.5	Confident	3 Å²	3	62.8 Å²	62.8	1%	0.014	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	131	159.8	-85.2	175	-45.8	0	0	108.4	K87 I89 H104 Y107 I109	Q79-K87 HydrophobicContact CB-CB 4.34Å; Q79-K87 PolarHBondContact N-O 3.22Å; Q79-K87 PolarHBondContact O-N 3.32Å; Q79-I89 HydrophobicContact CG-CD1 3.95Å; Q79-H104 PolarHBondContact NE2-O 2.86Å; Q79-Y107 PolarHBondContact NE2-O 2.86Å; Q79-I109 HydrophobicContact CG-CG1 4.16Å
80	R	91.1	Very high	85.9	Confident	84 Å²	84	59.3 Å²	59.3	32%	0.317	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	119.3	177.5	-161.8	-174.4	-54.2	-86.8	0.6	109.3	I86 E112 E123	R80-I86 HydrophobicContact CG-CG1 4.4Å; R80-I86 VanDerWaalsContact NH1-CD1 3.33Å; R80-E112 IonicContact NH2-OE2 3.15Å; R80-E112 PolarHBondContact NH2-OE2 2.89Å; R80-E112 VanDerWaalsContact NH2-OE2 3.07Å; R80-E123 IonicContact NE-OE2 3.49Å; R80-E123 IonicContact NH2-OE2 3.62Å; R80-E123 PolarHBondContact NH2-OE2 3.3Å
81	A	86.6	Confident	87.3	Confident	11 Å²	11	62.1 Å²	62.1	9%	0.091	34%	0.338	C	S	.	.			trans	-82.6	161.4	178.7	0	0	0	0	0	111.8	D83 G84 T85 Y107	A81-D83 WeakPolarHBondContact CB-OD1 3.4Å; A81-D83 PolarHBondContact O-N 2.83Å; A81-D83 VanDerWaalsContact O-N 3.13Å; A81-G84 PolarHBondContact O-N 2.94Å; A81-T85 WeakPolarHBondContact CB-OG1 3.39Å; A81-T85 PolarHBondContact N-O 3.1Å; A81-Y107 HydrophobicContact CB-CD2 4.03Å; A81-Y107 HydrophobicContact CB-CE1 4.21Å; A81-Y107 HydrophobicContact CB-CE2 3.55Å
82	P	83.5	Confident	88.7	Confident	123 Å²	123	61.9 Å²	61.9	80%	0.799	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-17.6	-179.7	-26.9	35.3	0	0	0	116.1	G84 Y107	P82-G84 VanDerWaalsContact C-N 3.29Å; P82-Y107 HydrophobicContact CG-CE1 4.14Å
83	D	87.6	Confident	89.3	Confident	123 Å²	123	57.2 Å²	57.2	66%	0.658	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	0.2	173.5	65.7	-1.5	0	0	0	113.3	A81 T85	A81-D83 WeakPolarHBondContact CB-OD1 3.4Å; A81-D83 PolarHBondContact O-N 2.83Å; A81-D83 VanDerWaalsContact O-N 3.13Å; D83-T85 WeakPolarHBondContact OD1-CB 3.48Å; D83-T85 WeakPolarHBondContact OD1-CG2 3.45Å; D83-T85 PolarHBondContact OD1-N 2.79Å; D83-T85 PolarHBondContact OD1-OG1 3.42Å
84	G	83.3	Confident	89.4	Confident	48 Å²	48	62.5 Å²	62.5	50%	0.495	34%	0.338	S	S	.	.	S	Bend	trans	87.7	-3.2	-176.9	0	0	0	0	0	114.7	A81 P82	A81-G84 PolarHBondContact O-N 2.94Å; P82-G84 VanDerWaalsContact C-N 3.29Å
85	T	88.5	Confident	89.4	Confident	81 Å²	81	60 Å²	60	50%	0.497	32%	0.321	S	S	.	.			trans	-66.5	137.4	177.5	57.9	0	0	0	0	111.5	A81 D83	A81-T85 WeakPolarHBondContact CB-OG1 3.39Å; A81-T85 PolarHBondContact N-O 3.1Å; D83-T85 WeakPolarHBondContact OD1-CB 3.48Å; D83-T85 WeakPolarHBondContact OD1-CG2 3.45Å; D83-T85 PolarHBondContact OD1-N 2.79Å; D83-T85 PolarHBondContact OD1-OG1 3.42Å
86	I	89	Confident	89.2	Confident	78 Å²	78	64.5 Å²	64.5	40%	0.4	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	124.4	-177.7	-52.8	176.3	0	0	0	108.7	I78 R80	I78-I86 HydrophobicContact CB-CG2 3.85Å; I78-I86 HydrophobicContact CD1-CG2 4.07Å; I78-I86 HydrophobicContact CG2-CG2 3.83Å; R80-I86 HydrophobicContact CG-CG1 4.4Å; R80-I86 VanDerWaalsContact NH1-CD1 3.33Å
87	K	90.8	Very high	88.9	Confident	97 Å²	97	61.5 Å²	61.5	42%	0.422	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	115.7	170	172.3	-170.9	164.2	-155	0	108.1	I78 Q79	I78-K87 CarbonylContact C-O 3.59Å; I78-K87 WeakPolarHBondContact CA-O 3.44Å; Q79-K87 HydrophobicContact CB-CB 4.34Å; Q79-K87 PolarHBondContact N-O 3.22Å; Q79-K87 PolarHBondContact O-N 3.32Å
88	E	91.4	Very high	88.3	Confident	94 Å²	94	66.3 Å²	66.3	44%	0.439	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	141.9	172.7	-159.5	165	101.4	0	0	110.4	R76 I78	R76-E88 WeakPolarHBondContact CD-OE2 3.3Å; R76-E88 IonicContact CZ-OE2 2.71Å; R76-E88 IonicContact NE-OE2 2.65Å; R76-E88 IonicContact NH1-OE2 3.31Å; R76-E88 PolarHBondContact NH1-OE2 3.18Å; I78-E88 HydrophobicContact CG2-CG 4.44Å
89	I	90.7	Very high	87.7	Confident	45 Å²	45	71.2 Å²	71.2	23%	0.231	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	-40	-177.7	-41.4	173.5	0	0	0	110.4	W77 Q79 L95 I97 I109	W77-I89 HydrophobicContact CB-CB 4.27Å; W77-I89 PolarHBondContact O-N 2.8Å; Q79-I89 HydrophobicContact CG-CD1 3.95Å; I89-L95 HydrophobicContact CB-CD1 4.23Å; I89-L95 HydrophobicContact CD1-CD1 4.31Å; I89-L95 HydrophobicContact CG2-CD1 3.75Å; I89-I97 HydrophobicContact CG2-CD1 4.09Å; I89-I97 HydrophobicContact CG2-CG1 4.16Å; I89-I109 HydrophobicContact CD1-CB 4.29Å; I89-I109 HydrophobicContact CD1-CD1 4.16Å; I89-I109 HydrophobicContact CD1-CG1 3.83Å; I89-I109 HydrophobicContact CD1-CG2 3.8Å
90	S	90.3	Very high	87.2	Confident	26 Å²	26	71.1 Å²	71.1	18%	0.182	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	143.5	171.2	-179.6	0	0	0	0	109.4	R76 W77 D92 R94	R76-S90 WeakPolarHBondContact CA-O 3.05Å; R76-S90 WeakPolarHBondContact CB-O 3.31Å; W77-S90 PolarHBondContact N-O 3.16Å; W77-S90 PolarHBondContact O-N 3.23Å; S90-D92 PolarHBondContact OG-N 3.09Å; S90-D92 PolarHBondContact OG-OD1 3.24Å; S90-R94 WeakPolarHBondContact CB-O 3.28Å; S90-R94 PolarHBondContact OG-O 3.18Å
91	S	88.9	Confident	86.8	Confident	93 Å²	93	67.5 Å²	67.5	65%	0.65	37%	0.372	S	S	*	.	S	Bend	trans	-97.4	16.4	178.2	69.6	0	0	0	0	112.8	Y75	Y75-S91 CarbonylContact O-C 3.54Å
92	D	87.3	Confident	86.6	Confident	73 Å²	73	70.8 Å²	70.8	39%	0.39	39%	0.393	S	S	.	.	S	Bend	trans	-136.2	-174.4	174.3	83.6	3.8	0	0	0	111.7	Y75 W77 S90 R94	Y75-D92 CarbonylContact O-C 3.57Å; Y75-D92 WeakPolarHBondContact O-CA 3.49Å; W77-D92 VanDerWaalsContact CD1-O 3.28Å; S90-D92 PolarHBondContact OG-N 3.09Å; S90-D92 PolarHBondContact OG-OD1 3.24Å; D92-R94 PolarHBondContact O-N 3.47Å; D92-R94 VanDerWaalsContact O-N 3.15Å; D92-R94 WeakPolarHBondContact OD1-CA 3.22Å; D92-R94 WeakPolarHBondContact OD1-CB 3.48Å; D92-R94 PolarHBondContact OD1-N 3.22Å
93	A	86.4	Confident	86.6	Confident	19 Å²	19	69.4 Å²	69.4	16%	0.157	38%	0.376	C	S	.	.	S	Bend	trans	-67.5	-7.9	-178.5	0	0	0	0	0	114.8	R64 C65 Y75 W77	R64-A93 WeakPolarHBondContact CA-O 3.36Å; C65-A93 PolarHBondContact N-O 3.49Å; Y75-A93 HydrophobicContact CD1-CB 4.2Å; Y75-A93 HydrophobicContact CD2-CB 4.14Å; Y75-A93 HydrophobicContact CG-CB 3.83Å; W77-A93 VanDerWaalsContact NE1-C 3.32Å; W77-A93 PolarHBondContact NE1-O 3.46Å
94	R	87.3	Confident	86.5	Confident	133 Å²	133	64.8 Å²	64.8	50%	0.502	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	124	-172.1	-59.3	167.8	177.9	171.9	-1.8	110.9	Y62 R64 S90 D92	Y62-R94 HydrophobicContact CE2-CB 4.43Å; R64-R94 HydrophobicContact CG-CG 4.29Å; S90-R94 WeakPolarHBondContact CB-O 3.28Å; S90-R94 PolarHBondContact OG-O 3.18Å; D92-R94 PolarHBondContact O-N 3.47Å; D92-R94 VanDerWaalsContact O-N 3.15Å; D92-R94 WeakPolarHBondContact OD1-CA 3.22Å; D92-R94 WeakPolarHBondContact OD1-CB 3.48Å; D92-R94 PolarHBondContact OD1-N 3.22Å
95	L	89.1	Confident	86.5	Confident	0 Å²	0	66 Å²	66	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	126.7	162.6	-173.3	69.5	0	0	0	107.9	L61 Y62 S63 W77 I89 I97 I109 L126	L61-L95 HydrophobicContact CD1-CD2 4.26Å; L61-L95 HydrophobicContact CD2-CD2 3.98Å; L61-L95 HydrophobicContact CG-CD2 3.89Å; Y62-L95 WeakPolarHBondContact CA-O 3.27Å; Y62-L95 WeakPolarHBondContact CD2-O 3.43Å; S63-L95 PolarHBondContact N-O 3.08Å; S63-L95 VanDerWaalsContact N-O 3.14Å; S63-L95 PolarHBondContact O-N 2.87Å; W77-L95 HydrophobicContact CB-CD1 4.05Å; W77-L95 HydrophobicContact CD2-CB 3.8Å; W77-L95 HydrophobicContact CD2-CD1 4.23Å; W77-L95 HydrophobicContact CD2-CG 4.46Å; W77-L95 HydrophobicContact CE3-CB 4.27Å; W77-L95 HydrophobicContact CE3-CD1 4.37Å; W77-L95 HydrophobicContact CE3-CD2 4.31Å; W77-L95 HydrophobicContact CG-CB 4.08Å; W77-L95 HydrophobicContact CG-CD1 4.12Å; W77-L95 HydrophobicContact CH2-CB 4.4Å; W77-L95 HydrophobicContact CZ2-CB 3.99Å; W77-L95 HydrophobicContact CZ3-CD2 4.3Å; I89-L95 HydrophobicContact CB-CD1 4.23Å; I89-L95 HydrophobicContact CD1-CD1 4.31Å; I89-L95 HydrophobicContact CG2-CD1 3.75Å; L95-I97 HydrophobicContact CD1-CD1 3.82Å; L95-I97 HydrophobicContact CD1-CG1 4.22Å; L95-I97 HydrophobicContact CD2-CD1 4.38Å; L95-I97 HydrophobicContact CG-CD1 4.12Å; L95-I97 HydrophobicContact CG-CG1 4.48Å; L95-I109 HydrophobicContact CD1-CG2 4.2Å; L95-I109 HydrophobicContact CD2-CD1 4.38Å; L95-I109 HydrophobicContact CD2-CG2 3.9Å; L95-L126 HydrophobicContact CD2-CD2 3.5Å
96	Y	86.9	Confident	86.2	Confident	146 Å²	146	68.1 Å²	68.1	57%	0.573	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.5	88.4	179	-164.9	-93.3	0	0	0	110.1	L60 Y62 T98	L60-Y96 HydrophobicContact CD1-CD1 4.18Å; L60-Y96 HydrophobicContact CD1-CD2 3.89Å; L60-Y96 HydrophobicContact CD1-CE1 3.94Å; L60-Y96 HydrophobicContact CD1-CE2 3.61Å; L60-Y96 HydrophobicContact CD1-CG 4.15Å; L60-Y96 HydrophobicContact CD2-CE2 3.77Å; L60-Y96 HydrophobicContact CG-CE2 4.29Å; Y62-Y96 AromaticContact CD2-CD2 3.94Å; Y62-Y96 HydrophobicContact CD2-CD2 3.94Å; Y96-T98 HydrophobicContact CD1-CG2 3.85Å; Y96-T98 HydrophobicContact CE1-CG2 3.42Å; Y96-T98 VanDerWaalsContact CE1-CG2 3.42Å
97	I	86.5	Confident	86.2	Confident	14 Å²	14	67.8 Å²	67.8	7%	0.072	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	103.5	-179.2	-62.8	158.3	0	0	0	107.9	L60 L61 I89 L95 N99 I109	L60-I97 WeakPolarHBondContact CA-O 3.37Å; L61-I97 HydrophobicContact CB-CB 4.25Å; L61-I97 HydrophobicContact CD2-CD1 3.94Å; L61-I97 HydrophobicContact CG-CD1 4.33Å; L61-I97 PolarHBondContact N-O 3.17Å; L61-I97 PolarHBondContact O-N 3.05Å; I89-I97 HydrophobicContact CG2-CD1 4.09Å; I89-I97 HydrophobicContact CG2-CG1 4.16Å; L95-I97 HydrophobicContact CD1-CD1 3.82Å; L95-I97 HydrophobicContact CD1-CG1 4.22Å; L95-I97 HydrophobicContact CD2-CD1 4.38Å; L95-I97 HydrophobicContact CG-CD1 4.12Å; L95-I97 HydrophobicContact CG-CG1 4.48Å; I97-N99 PolarHBondContact O-N 3.35Å; I97-I109 HydrophobicContact CD1-CD1 4.07Å
98	T	81.5	Confident	86.2	Confident	102 Å²	102	66.7 Å²	66.7	63%	0.626	35%	0.346	S	S	*	.	S	Bend	trans	-71.3	-8	-173.1	48.8	0	0	0	0	115.9	L60 Y96	L60-T98 HydrophobicContact CD1-CG2 4.49Å; Y96-T98 HydrophobicContact CD1-CG2 3.85Å; Y96-T98 HydrophobicContact CE1-CG2 3.42Å; Y96-T98 VanDerWaalsContact CE1-CG2 3.42Å
99	N	81.4	Confident	86.2	Confident	102 Å²	102	62.4 Å²	62.4	55%	0.545	33%	0.326	S	S	.	.	S	Bend	trans	-154.1	84.7	-178.6	177.1	24.8	0	0	0	107.7	G58 I97 G101	G58-N99 WeakPolarHBondContact CA-OD1 3.39Å; I97-N99 PolarHBondContact O-N 3.35Å; N99-G101 PolarHBondContact O-N 2.86Å; N99-G101 VanDerWaalsContact O-N 3.08Å
100	F	82.7	Confident	86.4	Confident	1 Å²	1	63.1 Å²	63.1	0%	0.004	33%	0.326	C	S	.	.			trans	-70.3	102.5	-176.7	-177.9	-104.9	0	0	0	111.1	V55 F57 G58 E59 L61 H104 L105 L128	V55-F100 HydrophobicContact CB-CD1 4.13Å; V55-F100 HydrophobicContact CB-CE1 4.01Å; V55-F100 HydrophobicContact CG2-CD1 4.19Å; V55-F100 HydrophobicContact CG2-CE1 3.55Å; V55-F100 HydrophobicContact CG2-CZ 3.94Å; F57-F100 CarbonylContact C-O 3.42Å; F57-F100 VanDerWaalsContact CA-O 3.26Å; F57-F100 WeakPolarHBondContact CA-O 3.19Å; F57-F100 HydrophobicContact CD1-CD1 4.1Å; F57-F100 HydrophobicContact CD1-CE1 4.26Å; F57-F100 HydrophobicContact CE1-CD1 4.49Å; F57-F100 HydrophobicContact CE1-CE1 4.2Å; G58-F100 PolarHBondContact N-O 2.84Å; E59-F100 WeakPolarHBondContact O-CB 2.98Å; E59-F100 PolarHBondContact O-N 2.91Å; L61-F100 HydrophobicContact CB-CB 4.24Å; L61-F100 HydrophobicContact CB-CD2 3.88Å; L61-F100 HydrophobicContact CB-CG 4.27Å; L61-F100 HydrophobicContact CD2-CD2 3.5Å; L61-F100 HydrophobicContact CD2-CE2 3.44Å; L61-F100 VanDerWaalsContact CD2-CE2 3.44Å; L61-F100 HydrophobicContact CD2-CZ 4.43Å; L61-F100 HydrophobicContact CG-CD2 4.35Å; F100-H104 HydrophobicContact CD2-CB 3.72Å; F100-H104 HydrophobicContact CE2-CB 3.44Å; F100-H104 VanDerWaalsContact CE2-CB 3.44Å; F100-H104 HydrophobicContact CZ-CB 4.29Å; F100-L105 HydrophobicContact CE1-CD1 4.26Å; F100-L105 HydrophobicContact CE1-CG 4.25Å; F100-L105 HydrophobicContact CZ-CD1 4.23Å; F100-L105 HydrophobicContact CZ-CD2 3.77Å; F100-L105 HydrophobicContact CZ-CG 3.73Å; F100-L128 HydrophobicContact CE2-CD1 3.79Å; F100-L128 HydrophobicContact CZ-CD1 3.73Å
101	G	83.3	Confident	86.6	Confident	8 Å²	8	61.9 Å²	61.9	8%	0.082	32%	0.317	C	S	.	.			trans	-104.4	167.8	173.9	0	0	0	0	0	114.4	N99 E103 H104	N99-G101 PolarHBondContact O-N 2.86Å; N99-G101 VanDerWaalsContact O-N 3.08Å; G101-E103 VanDerWaalsContact C-CD 3.47Å; G101-E103 VanDerWaalsContact C-OE2 3.26Å; G101-E103 WeakPolarHBondContact CA-OE1 3.12Å; G101-E103 PolarHBondContact N-OE1 2.9Å; G101-E103 PolarHBondContact O-N 3Å; G101-E103 VanDerWaalsContact O-N 3.08Å; G101-H104 PolarHBondContact N-ND1 3.12Å; G101-H104 WeakPolarHBondContact O-CB 3.48Å; G101-H104 PolarHBondContact O-N 2.83Å; G101-H104 PolarHBondContact O-ND1 3.28Å; G101-H104 VanDerWaalsContact O-ND1 3.09Å
102	P	82	Confident	86.8	Confident	81 Å²	81	58 Å²	58	53%	0.526	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-55.3	-26.4	-176.3	-26.1	35	0	0	0	115.8	F57 H104 L105	F57-P102 HydrophobicContact CD1-CG 4.16Å; F57-P102 HydrophobicContact CE1-CB 4.18Å; F57-P102 HydrophobicContact CE1-CG 3.78Å; F57-P102 HydrophobicContact CZ-CB 4.38Å; F57-P102 HydrophobicContact CZ-CG 3.99Å; P102-H104 PolarHBondContact O-N 3.2Å; P102-L105 PolarHBondContact O-N 3.48Å
103	E	84	Confident	87	Confident	93 Å²	93	54.5 Å²	54.5	44%	0.435	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-60.6	-20.2	173.8	66.2	-68.7	157	0	0	114	G101 L105	G101-E103 VanDerWaalsContact C-CD 3.47Å; G101-E103 VanDerWaalsContact C-OE2 3.26Å; G101-E103 WeakPolarHBondContact CA-OE1 3.12Å; G101-E103 PolarHBondContact N-OE1 2.9Å; G101-E103 PolarHBondContact O-N 3Å; G101-E103 VanDerWaalsContact O-N 3.08Å; E103-L105 VanDerWaalsContact C-N 3.35Å
104	H	85.3	Confident	87.1	Confident	27 Å²	27	54.7 Å²	54.7	13%	0.125	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-80.6	-15.6	173.2	-59.4	93	0	0	0	113.1	Q79 F100 G101 P102 I109	Q79-H104 PolarHBondContact NE2-O 2.86Å; F100-H104 HydrophobicContact CD2-CB 3.72Å; F100-H104 HydrophobicContact CE2-CB 3.44Å; F100-H104 VanDerWaalsContact CE2-CB 3.44Å; F100-H104 HydrophobicContact CZ-CB 4.29Å; G101-H104 PolarHBondContact N-ND1 3.12Å; G101-H104 WeakPolarHBondContact O-CB 3.48Å; G101-H104 PolarHBondContact O-N 2.83Å; G101-H104 PolarHBondContact O-ND1 3.28Å; G101-H104 VanDerWaalsContact O-ND1 3.09Å; P102-H104 PolarHBondContact O-N 3.2Å; H104-I109 HydrophobicContact CB-CD1 4.48Å
105	L	83.6	Confident	87.1	Confident	73 Å²	73	49 Å²	49	38%	0.382	25%	0.248	S	C	.	.	S	Bend	trans	-95.3	-3.1	175	-68.5	172.6	0	0	0	113.5	F57 F100 P102 E103 Y107 L128 L130	F57-L105 HydrophobicContact CE1-CD1 3.8Å; F57-L105 HydrophobicContact CZ-CD1 3.86Å; F100-L105 HydrophobicContact CE1-CD1 4.26Å; F100-L105 HydrophobicContact CE1-CG 4.25Å; F100-L105 HydrophobicContact CZ-CD1 4.23Å; F100-L105 HydrophobicContact CZ-CD2 3.77Å; F100-L105 HydrophobicContact CZ-CG 3.73Å; P102-L105 PolarHBondContact O-N 3.48Å; E103-L105 VanDerWaalsContact C-N 3.35Å; L105-Y107 VanDerWaalsContact C-N 3.3Å; L105-Y107 PolarHBondContact O-N 2.86Å; L105-L128 HydrophobicContact CD2-CD1 4.15Å; L105-L130 HydrophobicContact CD1-CD1 3.75Å; L105-L130 HydrophobicContact CD1-CD2 4.34Å; L105-L130 HydrophobicContact CD1-CG 4.09Å
106	Q	82.7	Confident	86.9	Confident	126 Å²	126	53.9 Å²	53.9	59%	0.589	27%	0.273	S	S	*	.	S	Bend	trans	-60.3	-39	-178.1	-173	179.2	2.5	0	0	112.7
107	Y	88.6	Confident	86.6	Confident	71 Å²	71	50.9 Å²	50.9	28%	0.278	27%	0.273	S	S	.	.	S	Bend	trans	-138.3	150.4	175.2	-53.3	-56.7	0	0	0	109.6	Q79 A81 P82 L105 I109	Q79-Y107 PolarHBondContact NE2-O 2.86Å; A81-Y107 HydrophobicContact CB-CD2 4.03Å; A81-Y107 HydrophobicContact CB-CE1 4.21Å; A81-Y107 HydrophobicContact CB-CE2 3.55Å; P82-Y107 HydrophobicContact CG-CE1 4.14Å; L105-Y107 VanDerWaalsContact C-N 3.3Å; L105-Y107 PolarHBondContact O-N 2.86Å; Y107-I109 PolarHBondContact O-N 3.24Å
108	P	89.8	Confident	86.5	Confident	74 Å²	74	54.1 Å²	54.1	48%	0.481	29%	0.291	S	S	.	.			trans	-57.9	133.5	179.4	-23.8	33.9	0	0	0	112.2	V125	P108-V125 HydrophobicContact CB-CG1 3.92Å
109	I	92.5	Very high	86.7	Confident	3 Å²	3	55.2 Å²	55.2	2%	0.015	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	132.4	172.4	-63.9	-179.4	0	0	0	108.4	L61 W77 Q79 I89 L95 I97 H104 Y107 L126 L128	L61-I109 HydrophobicContact CD2-CD1 4.04Å; W77-I109 HydrophobicContact CE3-CG2 3.61Å; W77-I109 HydrophobicContact CZ3-CG2 3.92Å; Q79-I109 HydrophobicContact CG-CG1 4.16Å; I89-I109 HydrophobicContact CD1-CB 4.29Å; I89-I109 HydrophobicContact CD1-CD1 4.16Å; I89-I109 HydrophobicContact CD1-CG1 3.83Å; I89-I109 HydrophobicContact CD1-CG2 3.8Å; L95-I109 HydrophobicContact CD1-CG2 4.2Å; L95-I109 HydrophobicContact CD2-CD1 4.38Å; L95-I109 HydrophobicContact CD2-CG2 3.9Å; I97-I109 HydrophobicContact CD1-CD1 4.07Å; H104-I109 HydrophobicContact CB-CD1 4.48Å; Y107-I109 PolarHBondContact O-N 3.24Å; I109-L126 HydrophobicContact CG2-CB 4.46Å; I109-L126 HydrophobicContact CG2-CD2 4.49Å; I109-L126 PolarHBondContact O-N 2.88Å; I109-L128 HydrophobicContact CD1-CD1 4.36Å
110	R	94	Very high	86.9	Confident	61 Å²	61	54.6 Å²	54.6	23%	0.23	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	139.3	-177.8	-59.2	-178.1	171	-153.1	-13.3	110.5	W77 I78 E123 K124 V125	W77-R110 CarbonylContact C-O 3.59Å; W77-R110 VanDerWaalsContact CA-O 3.3Å; W77-R110 WeakPolarHBondContact CA-O 3.2Å; I78-R110 HydrophobicContact CG1-CB 4.1Å; I78-R110 PolarHBondContact N-O 2.93Å; I78-R110 PolarHBondContact O-N 3.1Å; R110-E123 WeakPolarHBondContact CD-OE2 3.46Å; R110-E123 IonicContact CZ-OE1 2.72Å; R110-E123 IonicContact CZ-OE2 3.26Å; R110-E123 IonicContact NE-OE2 3.01Å; R110-E123 IonicContact NH1-OE1 3.49Å; R110-E123 PolarHBondContact NH1-OE1 2.77Å; R110-E123 IonicContact NH1-OE2 3.78Å; R110-E123 PolarHBondContact NH1-OE2 3.42Å; R110-K124 CarbonylContact C-O 3.57Å; R110-K124 VanDerWaalsContact CA-O 3.3Å; R110-K124 WeakPolarHBondContact CA-O 3.47Å; R110-V125 HydrophobicContact CG-CG2 4.16Å
111	C	94.1	Very high	87.1	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	130.3	155.9	179.9	0	0	0	0	108.2	L45 C65 R76 W77 V113 E123 K124	L45-C111 HydrophobicContact CD2-CB 3.82Å; C65-C111 HydrophobicContact CB-CB 3.65Å; C65-C111 WeakPolarHBondContact CB-SG 3.37Å; C65-C111 WeakPolarHBondContact SG-CB 3.49Å; C65-C111 CovalentContact SG-SG 2.02Å; C65-C111 PolarHBondContact SG-SG 2.83Å; R76-C111 WeakPolarHBondContact O-CA 3.45Å; W77-C111 HydrophobicContact CD2-CB 4.23Å; W77-C111 HydrophobicContact CE3-CB 4.1Å; W77-C111 HydrophobicContact CH2-CB 4.21Å; W77-C111 HydrophobicContact CZ2-CB 4.29Å; W77-C111 HydrophobicContact CZ3-CB 4.07Å; C111-V113 WeakPolarHBondContact SG-CG2 3.14Å; C111-E123 CarbonylContact O-C 3.59Å; C111-E123 VanDerWaalsContact O-CA 3.23Å; C111-E123 WeakPolarHBondContact O-CA 3.23Å; C111-K124 PolarHBondContact N-O 3.38Å; C111-K124 PolarHBondContact O-N 2.66Å
112	E	93.7	Very high	87.5	Confident	11 Å²	11	58.9 Å²	58.9	5%	0.051	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	131.9	167.9	-164	-177.6	74.4	0	0	107.6	R76 I78 R80 F122	R76-E112 HydrophobicContact CG-CB 4.18Å; R76-E112 IonicContact CZ-OE1 3.85Å; R76-E112 PolarHBondContact N-O 2.73Å; R76-E112 IonicContact NE-OE1 2.89Å; R76-E112 PolarHBondContact NE-OE1 3.39Å; R76-E112 IonicContact NH2-OE1 2.74Å; R76-E112 PolarHBondContact NH2-OE1 3.26Å; R76-E112 PolarHBondContact O-N 2.75Å; I78-E112 HydrophobicContact CD1-CB 4.02Å; I78-E112 HydrophobicContact CD1-CG 4.38Å; I78-E112 VanDerWaalsContact CD1-OE2 3.29Å; I78-E112 WeakPolarHBondContact CD1-OE2 3.49Å; I78-E112 HydrophobicContact CG1-CB 4.34Å; R80-E112 IonicContact NH2-OE2 3.15Å; R80-E112 PolarHBondContact NH2-OE2 2.89Å; R80-E112 VanDerWaalsContact NH2-OE2 3.07Å; E112-F122 CarbonylContact C-O 3.6Å; E112-F122 WeakPolarHBondContact CA-O 3.3Å
113	V	90.9	Very high	87.9	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	116.9	-170.5	-171.7	0	0	0	0	108.7	I43 V67 Y73 S74 Y75 C111 T121 F122	I43-V113 HydrophobicContact CD1-CB 4.2Å; I43-V113 HydrophobicContact CD1-CG2 3.8Å; I43-V113 HydrophobicContact CG1-CG2 4.14Å; I43-V113 HydrophobicContact CG2-CG2 4.42Å; V67-V113 HydrophobicContact CG2-CG1 3.86Å; Y73-V113 HydrophobicContact CD1-CG1 3.61Å; Y73-V113 HydrophobicContact CE1-CG1 4.48Å; Y73-V113 HydrophobicContact CG-CG1 3.73Å; S74-V113 WeakPolarHBondContact O-CA 3.31Å; Y75-V113 HydrophobicContact CD1-CG1 4.04Å; Y75-V113 HydrophobicContact CD1-CG2 3.96Å; Y75-V113 HydrophobicContact CE1-CG1 3.94Å; Y75-V113 HydrophobicContact CE1-CG2 4.32Å; C111-V113 WeakPolarHBondContact SG-CG2 3.14Å; V113-T121 WeakPolarHBondContact O-CA 3.39Å; V113-F122 PolarHBondContact N-O 2.92Å; V113-F122 PolarHBondContact O-N 2.88Å
114	T	90.2	Very high	88.2	Confident	22 Å²	22	57.7 Å²	57.7	14%	0.135	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	126.4	-174.7	-47.7	0	0	0	0	110.8	Y73 S74 L116 D119 E120 T121	Y73-T114 CarbonylContact C-O 3.51Å; Y73-T114 VanDerWaalsContact CA-O 3.27Å; Y73-T114 WeakPolarHBondContact CA-O 3.46Å; S74-T114 PolarHBondContact N-O 3.45Å; S74-T114 PolarHBondContact O-N 3.29Å; S74-T114 WeakPolarHBondContact OG-CB 3.46Å; T114-L116 PolarHBondContact O-N 2.66Å; T114-D119 HydrophobicContact CG2-CB 4.33Å; T114-E120 CarbonylContact C-O 3.54Å; T114-E120 WeakPolarHBondContact CA-O 3.26Å; T114-T121 HydrophobicContact CG2-CG2 3.97Å
115	R	86.6	Confident	88.6	Confident	15 Å²	15	58.8 Å²	58.8	6%	0.057	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	121.3	-178.4	-161.4	164.7	58.2	-145	-3.7	111	Y73 S117 D118 D119 E120 F122	Y73-R115 VanDerWaalsContact CD1-CA 3.5Å; Y73-R115 HydrophobicContact CD1-CB 3.9Å; Y73-R115 HydrophobicContact CD1-CG 4.12Å; Y73-R115 HydrophobicContact CE1-CB 3.52Å; Y73-R115 HydrophobicContact CE1-CG 3.5Å; R115-S117 WeakPolarHBondContact CG-OG 3.2Å; R115-S117 PolarHBondContact O-N 2.87Å; R115-S117 VanDerWaalsContact O-N 3.1Å; R115-D118 WeakPolarHBondContact CG-OD1 3.32Å; R115-D118 IonicContact CZ-OD1 2.99Å; R115-D118 IonicContact CZ-OD2 3.09Å; R115-D118 IonicContact NE-OD1 2.89Å; R115-D118 PolarHBondContact NE-OD1 3.01Å; R115-D118 IonicContact NE-OD2 2.66Å; R115-D118 PolarHBondContact NE-OD2 3.21Å; R115-D118 IonicContact NH2-OD1 3.18Å; R115-D118 IonicContact NH2-OD2 2.7Å; R115-D118 PolarHBondContact NH2-OD2 2.58Å; R115-D118 PolarHBondContact O-N 3.43Å; R115-D119 WeakPolarHBondContact O-CA 3.46Å; R115-D119 PolarHBondContact O-N 2.9Å; R115-E120 IonicContact CZ-OE2 2.88Å; R115-E120 PolarHBondContact N-O 3.2Å; R115-E120 IonicContact NH1-OE2 2.75Å; R115-E120 PolarHBondContact NH1-OE2 3.07Å; R115-E120 IonicContact NH2-OE2 3.34Å; R115-E120 PolarHBondContact NH2-OE2 2.77Å; R115-F122 HydrophobicContact CB-CE2 4.46Å
116	L	84	Confident	88.9	Confident	101 Å²	101	55.6 Å²	55.6	53%	0.529	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-2.6	-171.1	-62.7	178	0	0	0	114.8	Q72 T114	Q72-L116 HydrophobicContact CB-CB 4.41Å; Q72-L116 WeakPolarHBondContact O-CB 3.3Å; Q72-L116 PolarHBondContact O-N 3.3Å; T114-L116 PolarHBondContact O-N 2.66Å
117	S	81.8	Confident	89.1	Confident	83 Å²	83	53.4 Å²	53.4	58%	0.58	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-25.9	176.8	39.9	0	0	0	0	114.1	R115	R115-S117 WeakPolarHBondContact CG-OG 3.2Å; R115-S117 PolarHBondContact O-N 2.87Å; R115-S117 VanDerWaalsContact O-N 3.1Å
118	D	84.2	Confident	88.9	Confident	83 Å²	83	52 Å²	52	44%	0.444	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-160.3	6	-160.1	55.7	-38.6	0	0	0	114.1	R115 E120	R115-D118 WeakPolarHBondContact CG-OD1 3.32Å; R115-D118 IonicContact CZ-OD1 2.99Å; R115-D118 IonicContact CZ-OD2 3.09Å; R115-D118 IonicContact NE-OD1 2.89Å; R115-D118 PolarHBondContact NE-OD1 3.01Å; R115-D118 IonicContact NE-OD2 2.66Å; R115-D118 PolarHBondContact NE-OD2 3.21Å; R115-D118 IonicContact NH2-OD1 3.18Å; R115-D118 IonicContact NH2-OD2 2.7Å; R115-D118 PolarHBondContact NH2-OD2 2.58Å; R115-D118 PolarHBondContact O-N 3.43Å; D118-E120 PolarHBondContact O-N 2.86Å
119	D	84.7	Confident	88.5	Confident	124 Å²	124	55.1 Å²	55.1	66%	0.663	28%	0.28	S	S	*	.			trans	58.8	18.7	177.9	-63.7	-44.9	0	0	0	115.7	T114 R115	T114-D119 HydrophobicContact CG2-CB 4.33Å; R115-D119 WeakPolarHBondContact O-CA 3.46Å; R115-D119 PolarHBondContact O-N 2.9Å
120	E	86.6	Confident	87.7	Confident	90 Å²	90	59 Å²	59	42%	0.421	30%	0.3	S	S	.	.			trans	-68.3	132.2	174.6	-171.4	165.7	-130	0	0	111.4	T114 R115 D118 F122	T114-E120 CarbonylContact C-O 3.54Å; T114-E120 WeakPolarHBondContact CA-O 3.26Å; R115-E120 IonicContact CZ-OE2 2.88Å; R115-E120 PolarHBondContact N-O 3.2Å; R115-E120 IonicContact NH1-OE2 2.75Å; R115-E120 PolarHBondContact NH1-OE2 3.07Å; R115-E120 IonicContact NH2-OE2 3.34Å; R115-E120 PolarHBondContact NH2-OE2 2.77Å; D118-E120 PolarHBondContact O-N 2.86Å; E120-F122 HydrophobicContact CB-CE2 4.22Å; E120-F122 HydrophobicContact CB-CZ 4.32Å; E120-F122 HydrophobicContact CG-CE1 4.21Å; E120-F122 HydrophobicContact CG-CE2 3.92Å; E120-F122 HydrophobicContact CG-CZ 3.64Å; E120-F122 VanDerWaalsContact OE2-CZ 3.24Å; E120-F122 WeakPolarHBondContact OE2-CZ 3.45Å
121	T	87.4	Confident	86.2	Confident	80 Å²	80	57.7 Å²	57.7	49%	0.491	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	125.9	-172.7	57.1	0	0	0	0	112.5	V113 T114	V113-T121 WeakPolarHBondContact O-CA 3.39Å; T114-T121 HydrophobicContact CG2-CG2 3.97Å
122	F	90.1	Very high	84.2	Confident	19 Å²	19	63.3 Å²	63.3	8%	0.083	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	149.3	175.4	-53.9	-81.6	0	0	0	109.8	E40 P41 I43 Y73 E112 V113 R115 E120	E40-F122 HydrophobicContact CB-CD1 4.45Å; E40-F122 HydrophobicContact CB-CE1 4.15Å; E40-F122 HydrophobicContact CG-CD1 3.77Å; E40-F122 HydrophobicContact CG-CE1 3.98Å; P41-F122 VanDerWaalsContact CD-CE2 3.49Å; P41-F122 VanDerWaalsContact CD-CZ 3.5Å; P41-F122 HydrophobicContact CG-CB 4.22Å; P41-F122 HydrophobicContact CG-CD1 4.28Å; P41-F122 HydrophobicContact CG-CD2 3.46Å; P41-F122 VanDerWaalsContact CG-CD2 3.46Å; P41-F122 HydrophobicContact CG-CE2 3.8Å; P41-F122 HydrophobicContact CG-CG 3.71Å; P41-F122 HydrophobicContact CG-CZ 4.31Å; I43-F122 HydrophobicContact CD1-CB 3.82Å; Y73-F122 HydrophobicContact CE1-CD2 4.45Å; Y73-F122 HydrophobicContact CE1-CE2 4.45Å; E112-F122 CarbonylContact C-O 3.6Å; E112-F122 WeakPolarHBondContact CA-O 3.3Å; V113-F122 PolarHBondContact N-O 2.92Å; V113-F122 PolarHBondContact O-N 2.88Å; R115-F122 HydrophobicContact CB-CE2 4.46Å; E120-F122 HydrophobicContact CB-CE2 4.22Å; E120-F122 HydrophobicContact CB-CZ 4.32Å; E120-F122 HydrophobicContact CG-CE1 4.21Å; E120-F122 HydrophobicContact CG-CE2 3.92Å; E120-F122 HydrophobicContact CG-CZ 3.64Å; E120-F122 VanDerWaalsContact OE2-CZ 3.24Å; E120-F122 WeakPolarHBondContact OE2-CZ 3.45Å
123	E	91.5	Very high	81.8	Confident	86 Å²	86	68.4 Å²	68.4	40%	0.402	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	142.1	-178.2	57	171.6	-170.3	0	0	113.5	R80 R110 C111	R80-E123 IonicContact NE-OE2 3.49Å; R80-E123 IonicContact NH2-OE2 3.62Å; R80-E123 PolarHBondContact NH2-OE2 3.3Å; R110-E123 WeakPolarHBondContact CD-OE2 3.46Å; R110-E123 IonicContact CZ-OE1 2.72Å; R110-E123 IonicContact CZ-OE2 3.26Å; R110-E123 IonicContact NE-OE2 3.01Å; R110-E123 IonicContact NH1-OE1 3.49Å; R110-E123 PolarHBondContact NH1-OE1 2.77Å; R110-E123 IonicContact NH1-OE2 3.78Å; R110-E123 PolarHBondContact NH1-OE2 3.42Å; C111-E123 CarbonylContact O-C 3.59Å; C111-E123 VanDerWaalsContact O-CA 3.23Å; C111-E123 WeakPolarHBondContact O-CA 3.23Å
124	K	90.9	Very high	79.3	Confident	62 Å²	62	71.6 Å²	71.6	27%	0.27	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	133.8	173.7	-163.7	170.8	-172.4	-173.2	0	111.4	I43 L45 D49 R110 C111	I43-K124 HydrophobicContact CB-CB 4.08Å; I43-K124 HydrophobicContact CB-CD 3.97Å; I43-K124 HydrophobicContact CD1-CB 4.26Å; I43-K124 HydrophobicContact CG2-CB 3.68Å; I43-K124 HydrophobicContact CG2-CD 3.89Å; I43-K124 HydrophobicContact CG2-CG 4.43Å; I43-K124 VanDerWaalsContact O-CD 3.27Å; I43-K124 WeakPolarHBondContact O-CD 3.42Å; I43-K124 PolarHBondContact O-NZ 3.08Å; L45-K124 HydrophobicContact CD1-CD 4.49Å; L45-K124 HydrophobicContact CD1-CG 4.24Å; L45-K124 HydrophobicContact CG-CD 4.22Å; L45-K124 HydrophobicContact CG-CG 4.46Å; D49-K124 WeakPolarHBondContact OD1-CE 3.38Å; D49-K124 IonicContact OD1-NZ 2.76Å; D49-K124 PolarHBondContact OD1-NZ 2.94Å; D49-K124 WeakPolarHBondContact OD2-CE 3.46Å; D49-K124 IonicContact OD2-NZ 3.15Å; D49-K124 PolarHBondContact OD2-NZ 3.49Å; R110-K124 CarbonylContact C-O 3.57Å; R110-K124 VanDerWaalsContact CA-O 3.3Å; R110-K124 WeakPolarHBondContact CA-O 3.47Å; C111-K124 PolarHBondContact N-O 3.38Å; C111-K124 PolarHBondContact O-N 2.66Å
125	V	92.7	Very high	76.4	Confident	51 Å²	51	78.5 Å²	78.5	31%	0.309	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	130.3	-179.4	-175.1	0	0	0	0	110	P108 R110 N127	P108-V125 HydrophobicContact CB-CG1 3.92Å; R110-V125 HydrophobicContact CG-CG2 4.16Å; V125-N127 PolarHBondContact O-N 3.5Å
126	L	90.1	Very high	74	Confident	5 Å²	5	85.7 Å²	85.7	3%	0.026	49%	0.487	C	S	.	.			trans	-81.8	110.4	166.9	179.6	63.5	0	0	0	108.9	L45 L53 L61 W77 L95 I109 L128	L45-L126 HydrophobicContact CB-CD1 4.47Å; L45-L126 HydrophobicContact CD1-CB 3.93Å; L45-L126 HydrophobicContact CD1-CD1 4.08Å; L53-L126 HydrophobicContact CD2-CD1 4.38Å; L61-L126 HydrophobicContact CD1-CD2 4.26Å; W77-L126 HydrophobicContact CH2-CB 4.35Å; W77-L126 HydrophobicContact CH2-CD2 4.21Å; W77-L126 HydrophobicContact CZ3-CB 3.88Å; W77-L126 HydrophobicContact CZ3-CD2 4.08Å; L95-L126 HydrophobicContact CD2-CD2 3.5Å; I109-L126 HydrophobicContact CG2-CB 4.46Å; I109-L126 HydrophobicContact CG2-CD2 4.49Å; I109-L126 PolarHBondContact O-N 2.88Å; L126-L128 HydrophobicContact CD2-CD2 3.89Å; L126-L128 HydrophobicContact CG-CD2 3.81Å; L126-L128 HydrophobicContact CG-CG 4.45Å
127	N	85.8	Confident	71.5	Confident	81 Å²	81	86.3 Å²	86.3	43%	0.433	50%	0.5	S	S	.	.			trans	-75.1	128.5	175.1	-64.1	-53.2	0	0	0	109.3	P52 L53 V125	P52-N127 CarbonylContact C-O 3.42Å; P52-N127 WeakPolarHBondContact CA-O 3.49Å; P52-N127 HydrophobicContact CB-CB 4.01Å; L53-N127 PolarHBondContact N-O 2.94Å; V125-N127 PolarHBondContact O-N 3.5Å
128	L	84.9	Confident	69.4	Low	42 Å²	42	85.3 Å²	85.3	22%	0.22	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	142.6	178.9	-59.9	-178.4	0	0	0	110.3	L53 V55 L61 F100 L105 I109 L126	L53-L128 HydrophobicContact CB-CD2 3.96Å; L53-L128 HydrophobicContact CD2-CD2 4.3Å; L53-L128 CarbonylContact O-C 3.53Å; L53-L128 WeakPolarHBondContact O-CA 3.32Å; V55-L128 HydrophobicContact CG1-CD2 4.24Å; V55-L128 HydrophobicContact CG2-CB 4.25Å; L61-L128 HydrophobicContact CD1-CD2 4Å; L61-L128 HydrophobicContact CD2-CD1 3.82Å; L61-L128 HydrophobicContact CD2-CD2 4.17Å; F100-L128 HydrophobicContact CE2-CD1 3.79Å; F100-L128 HydrophobicContact CZ-CD1 3.73Å; L105-L128 HydrophobicContact CD2-CD1 4.15Å; I109-L128 HydrophobicContact CD1-CD1 4.36Å; L126-L128 HydrophobicContact CD2-CD2 3.89Å; L126-L128 HydrophobicContact CG-CD2 3.81Å; L126-L128 HydrophobicContact CG-CG 4.45Å
129	R	81	Confident	67.2	Low	138 Å²	138	88.9 Å²	88.9	52%	0.521	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	127.1	170.7	-176.3	172.3	69.4	173.9	1.1	109.1	P52 L53 D54 V55 A131	P52-R129 HydrophobicContact CB-CB 4.1Å; P52-R129 HydrophobicContact CG-CB 4.34Å; L53-R129 PolarHBondContact O-N 2.88Å; D54-R129 WeakPolarHBondContact CA-O 3.32Å; D54-R129 VanDerWaalsContact CG-NH2 3.27Å; D54-R129 IonicContact OD1-CZ 3.89Å; D54-R129 VanDerWaalsContact OD1-CZ 3.26Å; D54-R129 IonicContact OD1-NE 3.94Å; D54-R129 PolarHBondContact OD1-NE 2.87Å; D54-R129 IonicContact OD1-NH2 3.82Å; D54-R129 PolarHBondContact OD1-NH2 2.94Å; D54-R129 IonicContact OD2-CZ 3.15Å; D54-R129 IonicContact OD2-NE 2.74Å; D54-R129 IonicContact OD2-NH2 2.79Å; D54-R129 PolarHBondContact OD2-NH2 3.21Å; V55-R129 WeakPolarHBondContact CG2-O 3.32Å; V55-R129 PolarHBondContact N-O 2.81Å; R129-A131 PolarHBondContact O-N 3.18Å
130	L	76.2	Confident	65.3	Low	84 Å²	84	88.8 Å²	88.8	44%	0.44	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	119.4	169.5	-82.8	164.8	0	0	0	109	V55 F57 L105	V55-L130 WeakPolarHBondContact O-CA 3.31Å; F57-L130 HydrophobicContact CD1-CD2 4.31Å; F57-L130 HydrophobicContact CD2-CD2 4.11Å; F57-L130 HydrophobicContact CE1-CD2 3.94Å; F57-L130 HydrophobicContact CE2-CD1 4.06Å; F57-L130 HydrophobicContact CE2-CD2 3.74Å; F57-L130 HydrophobicContact CG-CD2 4.39Å; F57-L130 HydrophobicContact CZ-CD1 3.8Å; F57-L130 HydrophobicContact CZ-CD2 3.65Å; F57-L130 HydrophobicContact CZ-CG 4.36Å; L105-L130 HydrophobicContact CD1-CD1 3.75Å; L105-L130 HydrophobicContact CD1-CD2 4.34Å; L105-L130 HydrophobicContact CD1-CG 4.09Å
131	A	63.2	Low	63.4	Low	35 Å²	35	91.3 Å²	91.3	29%	0.289	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-69	138.6	173.1	0	0	0	0	0	110	V55 R129	V55-A131 PolarHBondContact O-N 3.47Å; R129-A131 PolarHBondContact O-N 3.18Å
132	S	50.9	Low	61.6	Low	117 Å²	117	91.8 Å²	91.8	82%	0.818	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-84.2	124	174.4	179.5	0	0	0	0	108.8	G134	S132-G134 PolarHBondContact O-N 3.46Å
133	S	44.6	Very low	59.5	Low	118 Å²	118	98 Å²	98	83%	0.825	54%	0.541	S	S	*	.			trans	-56.2	108.4	179.6	59.1	0	0	0	0	111.8
134	G	37.5	Very low	57.7	Low	68 Å²	68	99.6 Å²	99.6	70%	0.701	56%	0.557	S	S	*	*			trans	-123.9	140.6	167.6	0	0	0	0	0	109.4	S132 L136	S132-G134 PolarHBondContact O-N 3.46Å; G134-L136 PolarHBondContact O-N 3.35Å
135	D	30.3	Very low	56.5	Low	167 Å²	167	98.3 Å²	98.3	89%	0.893	55%	0.553	S	S	*	*			trans	-61.8	124.2	-178.4	-70.3	-61.9	0	0	0	112
136	L	35.6	Very low	55.5	Low	165 Å²	165	102 Å²	102	86%	0.864	57%	0.571	S	S	*	*			trans	-165.1	127.6	145	-108.1	162	0	0	0	110.5	G134	G134-L136 PolarHBondContact O-N 3.35Å
137	S	31.9	Very low	54.9	Low	115 Å²	115	103 Å²	103	80%	0.804	58%	0.576	S	S	*	*			trans	-116.4	104.8	-174.6	60.1	0	0	0	0	112
138	T	36.6	Very low	54.7	Low	62 Å²	62	100.4 Å²	100.4	38%	0.38	56%	0.563	S	S	.	*			trans	-142.1	44.9	179.3	45.1	0	0	0	0	113.4	D140 E141	T138-D140 PolarHBondContact O-N 2.89Å; T138-E141 PolarHBondContact O-N 3.18Å
139	D	38.8	Very low	54.7	Low	158 Å²	158	100.1 Å²	100.1	85%	0.845	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	22.9	-174.9	-156.2	16.2	0	0	0	116	K143	D139-K143 PolarHBondContact O-NZ 2.88Å; D139-K143 VanDerWaalsContact O-NZ 3.08Å
140	D	44.1	Very low	54.8	Low	121 Å²	121	96.9 Å²	96.9	65%	0.647	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.8	-15	179.9	-109.9	-37.4	0	0	0	114.7	T138 K143	T138-D140 PolarHBondContact O-N 2.89Å; D140-K143 WeakPolarHBondContact OD1-CD 3.11Å; D140-K143 IonicContact OD1-NZ 2.63Å; D140-K143 PolarHBondContact OD1-NZ 3.06Å
141	E	48.5	Very low	55	Low	144 Å²	144	95.4 Å²	95.4	67%	0.673	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-80.4	-28.4	-168.1	-166.6	152.7	-151.7	0	0	114	T138 K143	T138-E141 PolarHBondContact O-N 3.18Å; E141-K143 PolarHBondContact O-N 2.94Å; E141-K143 VanDerWaalsContact O-N 3.14Å
142	Y	48.5	Very low	55.7	Low	90 Å²	90	95.6 Å²	95.6	35%	0.353	54%	0.543	S	S	.	.	G	3₁₀ helix	trans	-72.5	-5.2	-176.7	-62.2	-68.7	0	0	0	115.2	T144 L145 Y222	Y142-T144 PolarHBondContact O-N 2.82Å; Y142-T144 VanDerWaalsContact O-N 3.08Å; Y142-L145 HydrophobicContact CD1-CD1 3.89Å; Y142-L145 HydrophobicContact CD1-CG 4.43Å; Y142-L145 PolarHBondContact O-N 2.97Å; Y142-Y222 PolarHBondContact O-OH 2.74Å; Y142-Y222 VanDerWaalsContact O-OH 3.05Å
143	K	46.3	Very low	56.7	Low	148 Å²	148	96.1 Å²	96.1	64%	0.643	54%	0.543	S	S	*	.	G	3₁₀ helix	trans	-70.8	-2.8	-172.5	-75.6	160.7	178.2	138.7	0	115.1	D139 D140 E141	D139-K143 PolarHBondContact O-NZ 2.88Å; D139-K143 VanDerWaalsContact O-NZ 3.08Å; D140-K143 WeakPolarHBondContact OD1-CD 3.11Å; D140-K143 IonicContact OD1-NZ 2.63Å; D140-K143 PolarHBondContact OD1-NZ 3.06Å; E141-K143 PolarHBondContact O-N 2.94Å; E141-K143 VanDerWaalsContact O-N 3.14Å
144	T	54.4	Low	57.6	Low	121 Å²	121	96.4 Å²	96.4	74%	0.742	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-132.9	27.1	178.4	55.9	0	0	0	0	114.6	Y142 N146	Y142-T144 PolarHBondContact O-N 2.82Å; Y142-T144 VanDerWaalsContact O-N 3.08Å; T144-N146 PolarHBondContact O-N 2.78Å
145	L	64	Low	58.9	Low	34 Å²	34	94.7 Å²	94.7	18%	0.178	51%	0.509	C	S	.	.			trans	-70.8	118.3	172.2	-71.7	-171.9	0	0	0	112	Y142 F168 I174 F178 Y222	Y142-L145 HydrophobicContact CD1-CD1 3.89Å; Y142-L145 HydrophobicContact CD1-CG 4.43Å; Y142-L145 PolarHBondContact O-N 2.97Å; L145-F168 HydrophobicContact CB-CD1 3.89Å; L145-F168 HydrophobicContact CB-CE1 3.74Å; L145-F168 HydrophobicContact CD1-CD1 4.32Å; L145-F168 HydrophobicContact CD1-CE1 4.14Å; L145-F168 HydrophobicContact CD1-CZ 4.37Å; L145-F168 HydrophobicContact CD2-CD1 4.5Å; L145-F168 HydrophobicContact CG-CD1 4.48Å; L145-I174 HydrophobicContact CD1-CG2 3.89Å; L145-I174 HydrophobicContact CD2-CD1 3.98Å; L145-I174 HydrophobicContact CD2-CG2 4.18Å; L145-F178 HydrophobicContact CD1-CE2 4.28Å; L145-F178 HydrophobicContact CD1-CZ 3.89Å; L145-Y222 HydrophobicContact CB-CD1 4.46Å; L145-Y222 HydrophobicContact CB-CE1 3.79Å
146	N	72	Confident	60.7	Low	129 Å²	129	89 Å²	89	69%	0.69	48%	0.479	S	S	*	.			trans	-94.8	110.6	171.4	-76.8	-25.4	0	0	0	110.2	T144 F168	T144-N146 PolarHBondContact O-N 2.78Å; N146-F168 WeakPolarHBondContact O-CD1 3.45Å
147	L	77.4	Confident	62.2	Low	25 Å²	25	86 Å²	86	13%	0.131	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	126.1	169.3	-174.8	63.2	0	0	0	109.5	C166 F168 F180 A213 A224	L147-C166 VanDerWaalsContact CD1-SG 3.56Å; L147-F168 HydrophobicContact CB-CD1 4.31Å; L147-F168 HydrophobicContact CB-CE1 3.77Å; L147-F168 HydrophobicContact CB-CZ 4.27Å; L147-F168 HydrophobicContact CD1-CD1 4.36Å; L147-F168 HydrophobicContact CD1-CD2 4.4Å; L147-F168 HydrophobicContact CD1-CE1 4.01Å; L147-F168 HydrophobicContact CD1-CE2 4.06Å; L147-F168 HydrophobicContact CD1-CZ 3.86Å; L147-F168 HydrophobicContact CG-CE1 4.48Å; L147-F180 HydrophobicContact CD1-CE1 3.86Å; L147-A213 HydrophobicContact CD1-CB 3.93Å; L147-A213 HydrophobicContact CD2-CB 3.85Å; L147-A224 HydrophobicContact CB-CB 4.36Å; L147-A224 HydrophobicContact CD2-CB 3.98Å; L147-A224 HydrophobicContact CG-CB 3.94Å
148	T	82.2	Confident	63.7	Low	28 Å²	28	91.9 Å²	91.9	17%	0.172	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	162.9	-173.4	69.7	0	0	0	0	112.1	C166 L167 E169	T148-C166 CarbonylContact O-C 3.1Å; T148-C166 VanDerWaalsContact O-CA 3.29Å; T148-C166 WeakPolarHBondContact O-CA 3.27Å; T148-L167 WeakPolarHBondContact CA-O 3.35Å; T148-L167 PolarHBondContact N-O 2.96Å; T148-L167 PolarHBondContact O-N 3.28Å; T148-L167 PolarHBondContact OG1-O 2.85Å; T148-E169 HydrophobicContact CG2-CG 3.62Å; T148-E169 WeakPolarHBondContact CG2-OE1 3.45Å; T148-E169 WeakPolarHBondContact OG1-CG 3.27Å; T148-E169 PolarHBondContact OG1-OE1 2.87Å
149	I	84.2	Confident	65	Low	35 Å²	35	95.7 Å²	95.7	18%	0.179	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	108.6	-176.5	-70	170.2	0	0	0	108.4	R164 Q165 C166 W182 C211 A224 Y226	I149-R164 HydrophobicContact CG2-CB 4.11Å; I149-R164 HydrophobicContact CG2-CG 4.33Å; I149-Q165 CarbonylContact C-O 3.59Å; I149-Q165 WeakPolarHBondContact CA-O 3.43Å; I149-C166 HydrophobicContact CG1-CB 4.43Å; I149-W182 HydrophobicContact CB-CH2 4.37Å; I149-W182 HydrophobicContact CD1-CH2 3.58Å; I149-W182 HydrophobicContact CD1-CZ2 4.49Å; I149-W182 HydrophobicContact CD1-CZ3 3.92Å; I149-W182 HydrophobicContact CG1-CH2 3.76Å; I149-W182 HydrophobicContact CG1-CZ2 4.28Å; I149-W182 HydrophobicContact CG2-CH2 3.7Å; I149-W182 HydrophobicContact CG2-CZ2 4.35Å; I149-C211 HydrophobicContact CD1-CB 4.18Å; I149-C211 HydrophobicContact CG1-CB 4.5Å; I149-A224 HydrophobicContact CD1-CB 3.59Å; I149-A224 HydrophobicContact CG1-CB 3.99Å; I149-Y226 HydrophobicContact CG2-CD2 4.12Å
150	K	84.1	Confident	66.2	Low	71 Å²	71	88.9 Å²	88.9	31%	0.309	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	145.5	-176.3	-66.4	-168.4	176.8	-179.8	0	112.1	R164 Q165 L167 E169	K150-R164 CarbonylContact O-C 3.6Å; K150-R164 WeakPolarHBondContact O-CA 3.4Å; K150-R164 WeakPolarHBondContact O-CD 3.21Å; K150-Q165 PolarHBondContact N-O 3.03Å; K150-Q165 PolarHBondContact O-N 3.25Å; K150-L167 HydrophobicContact CD-CD1 4.22Å; K150-L167 HydrophobicContact CD-CD2 4.34Å; K150-E169 WeakPolarHBondContact CE-OE1 3.36Å; K150-E169 WeakPolarHBondContact CE-OE2 3.35Å; K150-E169 IonicContact NZ-OE1 2.81Å; K150-E169 IonicContact NZ-OE2 2.69Å; K150-E169 PolarHBondContact NZ-OE2 3.33Å
151	P	80.9	Confident	67.5	Low	52 Å²	52	84 Å²	84	34%	0.338	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	147.3	168	30.6	-33.9	0	0	0	110.7	E155	P151-E155 WeakPolarHBondContact CB-OE1 3.46Å
152	L	77.9	Confident	68.8	Low	40 Å²	40	77.4 Å²	77.4	21%	0.209	39%	0.388	C	S	.	.			trans	-99.5	156.9	169.9	-72.1	170.9	0	0	0	111.1	N154 E155 M163 Q165 T195	L152-N154 PolarHBondContact O-N 2.77Å; L152-E155 WeakPolarHBondContact O-CB 3.47Å; L152-E155 PolarHBondContact O-N 3.18Å; L152-E155 VanDerWaalsContact O-N 3.13Å; L152-M163 HydrophobicContact CB-CB 3.92Å; L152-M163 HydrophobicContact CD1-CB 4.31Å; L152-M163 HydrophobicContact CD1-CE 4.28Å; L152-M163 PolarHBondContact N-O 3.13Å; L152-Q165 HydrophobicContact CD1-CB 4.24Å; L152-Q165 HydrophobicContact CD2-CB 4.01Å; L152-Q165 HydrophobicContact CG-CB 4.09Å; L152-T195 HydrophobicContact CD1-CG2 3.63Å
153	P	70.1	Confident	70.3	Confident	127 Å²	127	75 Å²	75	83%	0.825	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-18.9	-170.7	-26.5	36.1	0	0	0	116.5
154	N	63.6	Low	72.2	Confident	124 Å²	124	69.3 Å²	69.3	66%	0.663	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	12.1	-177.8	-68	19.4	0	0	0	113.2	L152 D156 M163	L152-N154 PolarHBondContact O-N 2.77Å; N154-D156 PolarHBondContact O-N 2.91Å; N154-M163 HydrophobicContact CB-SD 3.66Å
155	E	65	Low	73.8	Confident	33 Å²	33	66.4 Å²	66.4	15%	0.154	33%	0.333	C	S	.	.			trans	-70.5	112	173.4	179.9	168.8	83	0	0	111.1	P151 L152 F157 M163 R164	P151-E155 WeakPolarHBondContact CB-OE1 3.46Å; L152-E155 WeakPolarHBondContact O-CB 3.47Å; L152-E155 PolarHBondContact O-N 3.18Å; L152-E155 VanDerWaalsContact O-N 3.13Å; E155-F157 HydrophobicContact CG-CD2 4.29Å; E155-F157 HydrophobicContact CG-CE1 4.28Å; E155-F157 HydrophobicContact CG-CE2 3.8Å; E155-F157 HydrophobicContact CG-CZ 3.81Å; E155-F157 WeakPolarHBondContact OE1-CE2 3.35Å; E155-F157 WeakPolarHBondContact OE1-CZ 3.44Å; E155-M163 HydrophobicContact CB-CB 4.26Å; E155-M163 PolarHBondContact OE2-N 2.61Å; E155-R164 IonicContact OE1-CZ 2.75Å; E155-R164 IonicContact OE1-NE 3.72Å; E155-R164 PolarHBondContact OE1-NE 2.79Å; E155-R164 IonicContact OE1-NH2 3.9Å; E155-R164 PolarHBondContact OE1-NH2 2.95Å; E155-R164 IonicContact OE2-CZ 3.27Å; E155-R164 IonicContact OE2-NE 2.69Å; E155-R164 PolarHBondContact OE2-NE 2.93Å; E155-R164 IonicContact OE2-NH2 2.97Å; E155-R164 PolarHBondContact OE2-NH2 2.79Å
156	D	68.8	Low	74.7	Confident	47 Å²	47	64.8 Å²	64.8	25%	0.251	32%	0.324	S	S	.	.	B	Isolated β-bridge	trans	-127.1	93.3	172.4	-172.8	6.5	0	0	0	111.9	N154 R158 Q159 G160 T161	N154-D156 PolarHBondContact O-N 2.91Å; D156-R158 PolarHBondContact O-N 2.96Å; D156-R158 WeakPolarHBondContact OD1-CB 3.26Å; D156-R158 VanDerWaalsContact OD1-CG 3.3Å; D156-R158 WeakPolarHBondContact OD1-CG 3.23Å; D156-R158 PolarHBondContact OD1-N 2.74Å; D156-Q159 PolarHBondContact O-N 3.1Å; D156-Q159 PolarHBondContact OD2-NE2 3.05Å; D156-G160 PolarHBondContact O-N 2.86Å; D156-T161 CarbonylContact C-O 3.58Å; D156-T161 VanDerWaalsContact C-O 3.26Å; D156-T161 PolarHBondContact N-O 3.32Å; D156-T161 PolarHBondContact O-N 2.78Å; D156-T161 VanDerWaalsContact O-N 3.09Å
157	F	66	Low	75.4	Confident	101 Å²	101	59.9 Å²	59.9	44%	0.443	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-53.6	-21.3	172.7	-58.5	-76.3	0	0	0	114.4	E155 Q159 G160 I162	E155-F157 HydrophobicContact CG-CD2 4.29Å; E155-F157 HydrophobicContact CG-CE1 4.28Å; E155-F157 HydrophobicContact CG-CE2 3.8Å; E155-F157 HydrophobicContact CG-CZ 3.81Å; E155-F157 WeakPolarHBondContact OE1-CE2 3.35Å; E155-F157 WeakPolarHBondContact OE1-CZ 3.44Å; F157-Q159 VanDerWaalsContact C-N 3.32Å; F157-G160 PolarHBondContact O-N 2.93Å; F157-I162 HydrophobicContact CD1-CD1 4.05Å; F157-I162 HydrophobicContact CD1-CG1 3.88Å; F157-I162 HydrophobicContact CE1-CD1 3.87Å; F157-I162 HydrophobicContact CE1-CG1 3.83Å
158	R	64	Low	75.7	Confident	239 Å²	239	59 Å²	59	90%	0.902	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-75.9	-22.9	178	-53.4	177.4	-174	-131.9	3.4	112.6	D156	D156-R158 PolarHBondContact O-N 2.96Å; D156-R158 WeakPolarHBondContact OD1-CB 3.26Å; D156-R158 VanDerWaalsContact OD1-CG 3.3Å; D156-R158 WeakPolarHBondContact OD1-CG 3.23Å; D156-R158 PolarHBondContact OD1-N 2.74Å
159	Q	63.4	Low	75.1	Confident	142 Å²	142	62.6 Å²	62.6	66%	0.664	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-103.4	9.9	176	-66.8	179.4	74.5	0	0	111.8	D156 F157 T161	D156-Q159 PolarHBondContact O-N 3.1Å; D156-Q159 PolarHBondContact OD2-NE2 3.05Å; F157-Q159 VanDerWaalsContact C-N 3.32Å; Q159-T161 PolarHBondContact O-N 3.15Å; Q159-T161 PolarHBondContact O-OG1 3.29Å
160	G	64.9	Low	74	Confident	16 Å²	16	68.9 Å²	68.9	17%	0.165	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.3	2.1	-175.2	0	0	0	0	0	114.4	D156 F157 I200	D156-G160 PolarHBondContact O-N 2.86Å; F157-G160 PolarHBondContact O-N 2.93Å; G160-I200 WeakPolarHBondContact O-CG1 3.13Å; G160-I200 PolarHBondContact O-N 3.45Å
161	T	71.7	Confident	72.9	Confident	19 Å²	19	68.1 Å²	68.1	12%	0.117	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	113.7	-172	-31.5	0	0	0	0	111	D156 Q159 Y197 L198 L199	D156-T161 CarbonylContact C-O 3.58Å; D156-T161 VanDerWaalsContact C-O 3.26Å; D156-T161 PolarHBondContact N-O 3.32Å; D156-T161 PolarHBondContact O-N 2.78Å; D156-T161 VanDerWaalsContact O-N 3.09Å; Q159-T161 PolarHBondContact O-N 3.15Å; Q159-T161 PolarHBondContact O-OG1 3.29Å; T161-Y197 HydrophobicContact CG2-CE2 3.86Å; T161-L198 WeakPolarHBondContact CA-O 3.34Å; T161-L199 HydrophobicContact CG2-CD1 4.47Å
162	I	74.4	Confident	72.2	Confident	5 Å²	5	68.9 Å²	68.9	3%	0.026	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	130.3	176.1	-64.8	-173	0	0	0	109.4	F157 R164 L198 I200 Y226 V228	F157-I162 HydrophobicContact CD1-CD1 4.05Å; F157-I162 HydrophobicContact CD1-CG1 3.88Å; F157-I162 HydrophobicContact CE1-CD1 3.87Å; F157-I162 HydrophobicContact CE1-CG1 3.83Å; I162-R164 HydrophobicContact CG2-CG 3.96Å; I162-L198 HydrophobicContact CB-CB 4.26Å; I162-L198 PolarHBondContact N-O 3.07Å; I162-L198 PolarHBondContact O-N 2.88Å; I162-I200 HydrophobicContact CD1-CD1 3.68Å; I162-I200 HydrophobicContact CG1-CD1 4.2Å; I162-Y226 HydrophobicContact CG2-CE1 3.92Å; I162-V228 HydrophobicContact CD1-CG1 3.98Å; I162-V228 HydrophobicContact CD1-CG2 3.84Å
163	M	80.4	Confident	71.7	Confident	38 Å²	38	71.5 Å²	71.5	19%	0.187	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	112.9	-178.8	-66.1	-165.5	66.1	0	0	110.9	L152 N154 E155 L196 Y197	L152-M163 HydrophobicContact CB-CB 3.92Å; L152-M163 HydrophobicContact CD1-CB 4.31Å; L152-M163 HydrophobicContact CD1-CE 4.28Å; L152-M163 PolarHBondContact N-O 3.13Å; N154-M163 HydrophobicContact CB-SD 3.66Å; E155-M163 HydrophobicContact CB-CB 4.26Å; E155-M163 PolarHBondContact OE2-N 2.61Å; M163-L196 WeakPolarHBondContact CA-O 3.46Å; M163-Y197 HydrophobicContact CE-CD2 4.06Å; M163-Y197 HydrophobicContact CG-CD2 3.75Å; M163-Y197 HydrophobicContact CG-CE2 4.18Å; M163-Y197 HydrophobicContact SD-CD2 3.9Å; M163-Y197 HydrophobicContact SD-CE2 4.05Å
164	R	86.3	Confident	71.9	Confident	29 Å²	29	66.9 Å²	66.9	11%	0.109	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	129.9	-170.3	-69.1	-73.2	163.8	159.6	-6.5	111.8	I149 K150 E155 I162 W182 T195 L196 Y226	I149-R164 HydrophobicContact CG2-CB 4.11Å; I149-R164 HydrophobicContact CG2-CG 4.33Å; K150-R164 CarbonylContact O-C 3.6Å; K150-R164 WeakPolarHBondContact O-CA 3.4Å; K150-R164 WeakPolarHBondContact O-CD 3.21Å; E155-R164 IonicContact OE1-CZ 2.75Å; E155-R164 IonicContact OE1-NE 3.72Å; E155-R164 PolarHBondContact OE1-NE 2.79Å; E155-R164 IonicContact OE1-NH2 3.9Å; E155-R164 PolarHBondContact OE1-NH2 2.95Å; E155-R164 IonicContact OE2-CZ 3.27Å; E155-R164 IonicContact OE2-NE 2.69Å; E155-R164 PolarHBondContact OE2-NE 2.93Å; E155-R164 IonicContact OE2-NH2 2.97Å; E155-R164 PolarHBondContact OE2-NH2 2.79Å; I162-R164 HydrophobicContact CG2-CG 3.96Å; R164-W182 HydrophobicContact CB-CH2 4.14Å; R164-W182 HydrophobicContact CB-CZ2 4.15Å; R164-T195 CarbonylContact O-C 3.53Å; R164-T195 WeakPolarHBondContact O-CA 3.26Å; R164-L196 HydrophobicContact CB-CB 4.28Å; R164-L196 PolarHBondContact N-O 2.8Å; R164-L196 PolarHBondContact O-N 3.01Å; R164-Y226 HydrophobicContact CG-CE1 4.17Å; R164-Y226 HydrophobicContact CG-CE2 4.2Å; R164-Y226 PolarHBondContact NE-OH 2.85Å
165	Q	88.7	Confident	72.8	Confident	60 Å²	60	62.3 Å²	62.3	28%	0.28	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	136	174.5	-162.5	-176.1	14.4	0	0	110.2	I149 K150 L152 L167 D194	I149-Q165 CarbonylContact C-O 3.59Å; I149-Q165 WeakPolarHBondContact CA-O 3.43Å; K150-Q165 PolarHBondContact N-O 3.03Å; K150-Q165 PolarHBondContact O-N 3.25Å; L152-Q165 HydrophobicContact CD1-CB 4.24Å; L152-Q165 HydrophobicContact CD2-CB 4.01Å; L152-Q165 HydrophobicContact CG-CB 4.09Å; Q165-L167 HydrophobicContact CB-CD2 4.35Å; Q165-L167 HydrophobicContact CG-CD2 4.02Å; Q165-D194 HydrophobicContact CG-CB 4.33Å; Q165-D194 VanDerWaalsContact CG-OD2 3.32Å; Q165-D194 WeakPolarHBondContact CG-OD2 3.44Å; Q165-D194 PolarHBondContact NE2-OD2 2.85Å
166	C	83.2	Confident	73.4	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	122.4	179.3	-168.6	0	0	0	0	110.7	L147 T148 I149 F180 W182 D194 C211	L147-C166 VanDerWaalsContact CD1-SG 3.56Å; T148-C166 CarbonylContact O-C 3.1Å; T148-C166 VanDerWaalsContact O-CA 3.29Å; T148-C166 WeakPolarHBondContact O-CA 3.27Å; I149-C166 HydrophobicContact CG1-CB 4.43Å; C166-F180 HydrophobicContact CB-CD1 4.38Å; C166-F180 WeakPolarHBondContact O-CE1 3.09Å; C166-W182 HydrophobicContact CB-CZ2 3.72Å; C166-D194 WeakPolarHBondContact CB-O 3.43Å; C166-D194 PolarHBondContact N-O 3.18Å; C166-C211 HydrophobicContact CB-CB 3.76Å; C166-C211 WeakPolarHBondContact CB-SG 3.48Å; C166-C211 WeakPolarHBondContact SG-CB 3.5Å; C166-C211 CovalentContact SG-SG 2.01Å; C166-C211 PolarHBondContact SG-SG 3.34Å
167	L	86.8	Confident	73.7	Confident	26 Å²	26	67.1 Å²	67.1	14%	0.136	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	159.1	-170.4	59.4	92.1	0	0	0	113.4	T148 K150 Q165 E169 N175	T148-L167 WeakPolarHBondContact CA-O 3.35Å; T148-L167 PolarHBondContact N-O 2.96Å; T148-L167 PolarHBondContact O-N 3.28Å; T148-L167 PolarHBondContact OG1-O 2.85Å; K150-L167 HydrophobicContact CD-CD1 4.22Å; K150-L167 HydrophobicContact CD-CD2 4.34Å; Q165-L167 HydrophobicContact CB-CD2 4.35Å; Q165-L167 HydrophobicContact CG-CD2 4.02Å; L167-E169 HydrophobicContact CD1-CB 4.35Å; L167-E169 HydrophobicContact CD1-CG 3.98Å; L167-N175 WeakPolarHBondContact CA-OD1 3.49Å
168	F	82.2	Confident	74.4	Confident	6 Å²	6	62.5 Å²	62.5	3%	0.026	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	117.8	165.4	-58.9	-78	0	0	0	108.7	L145 N146 L147 N170 I174 N175 F178 F180 A213 Y222	L145-F168 HydrophobicContact CB-CD1 3.89Å; L145-F168 HydrophobicContact CB-CE1 3.74Å; L145-F168 HydrophobicContact CD1-CD1 4.32Å; L145-F168 HydrophobicContact CD1-CE1 4.14Å; L145-F168 HydrophobicContact CD1-CZ 4.37Å; L145-F168 HydrophobicContact CD2-CD1 4.5Å; L145-F168 HydrophobicContact CG-CD1 4.48Å; N146-F168 WeakPolarHBondContact O-CD1 3.45Å; L147-F168 HydrophobicContact CB-CD1 4.31Å; L147-F168 HydrophobicContact CB-CE1 3.77Å; L147-F168 HydrophobicContact CB-CZ 4.27Å; L147-F168 HydrophobicContact CD1-CD1 4.36Å; L147-F168 HydrophobicContact CD1-CD2 4.4Å; L147-F168 HydrophobicContact CD1-CE1 4.01Å; L147-F168 HydrophobicContact CD1-CE2 4.06Å; L147-F168 HydrophobicContact CD1-CZ 3.86Å; L147-F168 HydrophobicContact CG-CE1 4.48Å; F168-N170 PolarHBondContact O-N 3.23Å; F168-I174 HydrophobicContact CB-CG2 4.34Å; F168-I174 HydrophobicContact CD2-CG2 4.08Å; F168-I174 HydrophobicContact CG-CG2 4.27Å; F168-N175 PolarHBondContact N-OD1 2.02Å; F168-N175 PolarHBondContact O-ND2 2.84Å; F168-N175 VanDerWaalsContact O-ND2 3.16Å; F168-F178 HydrophobicContact CD2-CD2 4.47Å; F168-F178 AromaticContact CE2-CD1 3.89Å; F168-F178 HydrophobicContact CE2-CD1 3.89Å; F168-F178 AromaticContact CE2-CD2 3.83Å; F168-F178 HydrophobicContact CE2-CD2 3.83Å; F168-F178 AromaticContact CE2-CE1 3.98Å; F168-F178 HydrophobicContact CE2-CE1 3.98Å; F168-F178 AromaticContact CE2-CE2 3.93Å; F168-F178 HydrophobicContact CE2-CE2 3.93Å; F168-F178 AromaticContact CE2-CG 3.83Å; F168-F178 HydrophobicContact CE2-CG 3.83Å; F168-F178 HydrophobicContact CE2-CZ 4.01Å; F168-F178 HydrophobicContact CZ-CD1 4.11Å; F168-F178 AromaticContact CZ-CE1 3.88Å; F168-F178 HydrophobicContact CZ-CE1 3.88Å; F168-F178 HydrophobicContact CZ-CE2 4.43Å; F168-F178 HydrophobicContact CZ-CZ 4.06Å; F168-F180 HydrophobicContact CD2-CZ 4.33Å; F168-F180 HydrophobicContact CE2-CE1 4.43Å; F168-F180 HydrophobicContact CE2-CZ 4.26Å; F168-A213 HydrophobicContact CE2-CB 4.32Å; F168-A213 HydrophobicContact CZ-CB 4.35Å; F168-Y222 HydrophobicContact CE1-CD1 4.21Å; F168-Y222 HydrophobicContact CE1-CG 4.26Å; F168-Y222 HydrophobicContact CZ-CD1 4.47Å; F168-Y222 HydrophobicContact CZ-CD2 4.25Å; F168-Y222 HydrophobicContact CZ-CG 4.07Å
169	E	69.2	Low	75.1	Confident	104 Å²	104	51.7 Å²	51.7	49%	0.486	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-30.2	-165.1	-57.2	-157.6	-169.7	0	0	115.8	T148 K150 L167	T148-E169 HydrophobicContact CG2-CG 3.62Å; T148-E169 WeakPolarHBondContact CG2-OE1 3.45Å; T148-E169 WeakPolarHBondContact OG1-CG 3.27Å; T148-E169 PolarHBondContact OG1-OE1 2.87Å; K150-E169 WeakPolarHBondContact CE-OE1 3.36Å; K150-E169 WeakPolarHBondContact CE-OE2 3.35Å; K150-E169 IonicContact NZ-OE1 2.81Å; K150-E169 IonicContact NZ-OE2 2.69Å; K150-E169 PolarHBondContact NZ-OE2 3.33Å; L167-E169 HydrophobicContact CD1-CB 4.35Å; L167-E169 HydrophobicContact CD1-CG 3.98Å
170	N	62.8	Low	76.1	Confident	167 Å²	167	45.9 Å²	45.9	89%	0.893	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-18.8	-162.9	-64.7	-19.4	0	0	0	113.3	F168	F168-N170 PolarHBondContact O-N 3.23Å
171	D	61.3	Low	76.9	Confident	55 Å²	55	45.2 Å²	45.2	29%	0.294	23%	0.228	S	C	.	.			trans	-151.6	116.7	-174.4	-169.2	-25.9	0	0	0	109.8	E173 I174 N175	D171-E173 WeakPolarHBondContact OD1-CB 3.42Å; D171-E173 PolarHBondContact OD1-N 2.92Å; D171-I174 HydrophobicContact CB-CB 4.16Å; D171-I174 HydrophobicContact CB-CD1 3.78Å; D171-I174 HydrophobicContact CB-CG1 3.82Å; D171-N175 PolarHBondContact O-ND2 2.88Å
172	P	65.7	Low	77.4	Confident	68 Å²	68	44.3 Å²	44.3	44%	0.442	22%	0.223	S	C	.	.	H	α-helix	trans	-67.9	-34.1	176.1	28.9	-34.1	0	0	0	112.6	I174 N175 Y471	P172-I174 VanDerWaalsContact C-N 3.26Å; P172-I174 PolarHBondContact O-N 2.88Å; P172-N175 WeakPolarHBondContact O-CB 3.29Å; P172-N175 PolarHBondContact O-N 2.95Å; P172-N175 PolarHBondContact O-ND2 2.87Å; P172-Y471 HydrophobicContact CB-CD1 3.7Å; P172-Y471 HydrophobicContact CB-CE1 3.82Å; P172-Y471 HydrophobicContact CG-CD1 3.71Å; P172-Y471 HydrophobicContact CG-CE1 4.16Å
173	E	67.5	Low	77.7	Confident	95 Å²	95	44.6 Å²	44.6	44%	0.444	23%	0.225	S	C	.	.	H	α-helix	trans	-64.3	-34.4	-177.2	-59.4	177.2	-154.3	0	0	110.6	D171 N175 E176	D171-E173 WeakPolarHBondContact OD1-CB 3.42Å; D171-E173 PolarHBondContact OD1-N 2.92Å; E173-N175 PolarHBondContact O-N 3.33Å; E173-E176 PolarHBondContact O-N 2.81Å
174	I	74.8	Confident	77.5	Confident	30 Å²	30	43.8 Å²	43.8	15%	0.154	22%	0.221	C	C	.	.	H	α-helix	trans	-60	-30.5	174.3	-68.9	-176.4	0	0	0	112.3	L145 F168 D171 P172 E176 L177 F178	L145-I174 HydrophobicContact CD1-CG2 3.89Å; L145-I174 HydrophobicContact CD2-CD1 3.98Å; L145-I174 HydrophobicContact CD2-CG2 4.18Å; F168-I174 HydrophobicContact CB-CG2 4.34Å; F168-I174 HydrophobicContact CD2-CG2 4.08Å; F168-I174 HydrophobicContact CG-CG2 4.27Å; D171-I174 HydrophobicContact CB-CB 4.16Å; D171-I174 HydrophobicContact CB-CD1 3.78Å; D171-I174 HydrophobicContact CB-CG1 3.82Å; P172-I174 VanDerWaalsContact C-N 3.26Å; P172-I174 PolarHBondContact O-N 2.88Å; I174-E176 VanDerWaalsContact C-N 3.34Å; I174-E176 PolarHBondContact O-N 2.9Å; I174-L177 PolarHBondContact O-N 3.11Å; I174-F178 HydrophobicContact CG2-CE2 4Å; I174-F178 WeakPolarHBondContact O-CD2 3.49Å
175	N	80.9	Confident	76.9	Confident	28 Å²	28	47.6 Å²	47.6	15%	0.15	24%	0.24	C	C	.	.	H	α-helix	trans	-69.6	-30.8	-179.4	-64.1	-83.3	0	0	0	112.1	L167 F168 D171 P172 E173 L177 F178 F180	L167-N175 WeakPolarHBondContact CA-OD1 3.49Å; F168-N175 PolarHBondContact N-OD1 2.02Å; F168-N175 PolarHBondContact O-ND2 2.84Å; F168-N175 VanDerWaalsContact O-ND2 3.16Å; D171-N175 PolarHBondContact O-ND2 2.88Å; P172-N175 WeakPolarHBondContact O-CB 3.29Å; P172-N175 PolarHBondContact O-N 2.95Å; P172-N175 PolarHBondContact O-ND2 2.87Å; E173-N175 PolarHBondContact O-N 3.33Å; N175-L177 PolarHBondContact O-N 2.86Å; N175-L177 VanDerWaalsContact O-N 3.17Å; N175-F178 PolarHBondContact O-N 2.91Å; N175-F178 VanDerWaalsContact O-N 3.16Å; N175-F180 HydrophobicContact CB-CE2 4.29Å; N175-F180 HydrophobicContact CB-CZ 4.14Å; N175-F180 WeakPolarHBondContact O-CE2 3.46Å
176	E	78.6	Confident	75.8	Confident	128 Å²	128	49.1 Å²	49.1	60%	0.598	25%	0.25	S	C	*	.	H	α-helix	trans	-67	-16.7	178.5	-57.8	-165.9	172.2	0	0	113.3	E173 I174 F178 R216	E173-E176 PolarHBondContact O-N 2.81Å; I174-E176 VanDerWaalsContact C-N 3.34Å; I174-E176 PolarHBondContact O-N 2.9Å; E176-F178 VanDerWaalsContact C-N 3.29Å; E176-F178 PolarHBondContact O-N 3.45Å; E176-R216 PolarHBondContact O-NH1 2.82Å
177	L	74.7	Confident	75.1	Confident	53 Å²	53	50.9 Å²	50.9	28%	0.277	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-1.1	176.8	-56.6	176.7	0	0	0	113.6	I174 N175 N215 R216	I174-L177 PolarHBondContact O-N 3.11Å; N175-L177 PolarHBondContact O-N 2.86Å; N175-L177 VanDerWaalsContact O-N 3.17Å; L177-N215 WeakPolarHBondContact O-CA 3.44Å; L177-R216 PolarHBondContact O-N 3.37Å
178	F	80.4	Confident	73.9	Confident	5 Å²	5	55.2 Å²	55.2	2%	0.022	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	142.2	-173.4	-67.3	-108.5	0	0	0	113	L145 F168 I174 N175 E176 F180 A213 T214 N215 Y222	L145-F178 HydrophobicContact CD1-CE2 4.28Å; L145-F178 HydrophobicContact CD1-CZ 3.89Å; F168-F178 HydrophobicContact CD2-CD2 4.47Å; F168-F178 AromaticContact CE2-CD1 3.89Å; F168-F178 HydrophobicContact CE2-CD1 3.89Å; F168-F178 AromaticContact CE2-CD2 3.83Å; F168-F178 HydrophobicContact CE2-CD2 3.83Å; F168-F178 AromaticContact CE2-CE1 3.98Å; F168-F178 HydrophobicContact CE2-CE1 3.98Å; F168-F178 AromaticContact CE2-CE2 3.93Å; F168-F178 HydrophobicContact CE2-CE2 3.93Å; F168-F178 AromaticContact CE2-CG 3.83Å; F168-F178 HydrophobicContact CE2-CG 3.83Å; F168-F178 HydrophobicContact CE2-CZ 4.01Å; F168-F178 HydrophobicContact CZ-CD1 4.11Å; F168-F178 AromaticContact CZ-CE1 3.88Å; F168-F178 HydrophobicContact CZ-CE1 3.88Å; F168-F178 HydrophobicContact CZ-CE2 4.43Å; F168-F178 HydrophobicContact CZ-CZ 4.06Å; I174-F178 HydrophobicContact CG2-CE2 4Å; I174-F178 WeakPolarHBondContact O-CD2 3.49Å; N175-F178 PolarHBondContact O-N 2.91Å; N175-F178 VanDerWaalsContact O-N 3.16Å; E176-F178 VanDerWaalsContact C-N 3.29Å; E176-F178 PolarHBondContact O-N 3.45Å; F178-F180 HydrophobicContact CB-CD2 4.4Å; F178-F180 HydrophobicContact CB-CE2 3.86Å; F178-F180 HydrophobicContact CB-CZ 4.09Å; F178-F180 WeakPolarHBondContact O-CD2 3.5Å; F178-A213 HydrophobicContact CB-CB 4.37Å; F178-A213 HydrophobicContact CD1-CB 4.13Å; F178-T214 CarbonylContact C-O 3.54Å; F178-T214 VanDerWaalsContact CA-O 3.25Å; F178-T214 WeakPolarHBondContact CA-O 3.48Å; F178-N215 HydrophobicContact CD1-CB 3.91Å; F178-N215 VanDerWaalsContact CD1-N 3.28Å; F178-N215 HydrophobicContact CE1-CB 3.55Å; F178-N215 HydrophobicContact CZ-CB 3.9Å; F178-Y222 HydrophobicContact CD1-CD2 4.45Å; F178-Y222 AromaticContact CE1-CD2 3.59Å; F178-Y222 HydrophobicContact CE1-CD2 3.59Å; F178-Y222 AromaticContact CE1-CE2 3.68Å; F178-Y222 HydrophobicContact CE1-CE2 3.68Å; F178-Y222 HydrophobicContact CZ-CD2 4.35Å; F178-Y222 HydrophobicContact CZ-CE2 4.05Å
179	D	78.9	Confident	73.3	Confident	11 Å²	11	55.4 Å²	55.4	6%	0.059	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	116	166.7	-74	-29.8	0	0	0	109.8	N46 P47 G48 T214 R216	N46-D179 PolarHBondContact ND2-O 2.97Å; P47-D179 WeakPolarHBondContact CA-OD2 2.98Å; P47-D179 HydrophobicContact CB-CB 4.1Å; P47-D179 WeakPolarHBondContact CB-OD2 3.42Å; G48-D179 PolarHBondContact N-OD2 2.8Å; D179-T214 PolarHBondContact N-O 2.92Å; D179-T214 PolarHBondContact O-N 3.09Å; D179-R216 IonicContact OD1-CZ 3.94Å; D179-R216 IonicContact OD1-NE 2.95Å; D179-R216 PolarHBondContact OD1-NE 2.96Å; D179-R216 IonicContact OD1-NH2 2.76Å; D179-R216 PolarHBondContact OD1-NH2 3.44Å; D179-R216 IonicContact OD2-NE 2.65Å
180	F	84.4	Confident	73.5	Confident	21 Å²	21	53 Å²	53	9%	0.092	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	145.2	-178.6	-61.7	-100	0	0	0	112	L147 C166 F168 N175 F178 G193 D194 E212 A213	L147-F180 HydrophobicContact CD1-CE1 3.86Å; C166-F180 HydrophobicContact CB-CD1 4.38Å; C166-F180 WeakPolarHBondContact O-CE1 3.09Å; F168-F180 HydrophobicContact CD2-CZ 4.33Å; F168-F180 HydrophobicContact CE2-CE1 4.43Å; F168-F180 HydrophobicContact CE2-CZ 4.26Å; N175-F180 HydrophobicContact CB-CE2 4.29Å; N175-F180 HydrophobicContact CB-CZ 4.14Å; N175-F180 WeakPolarHBondContact O-CE2 3.46Å; F178-F180 HydrophobicContact CB-CD2 4.4Å; F178-F180 HydrophobicContact CB-CE2 3.86Å; F178-F180 HydrophobicContact CB-CZ 4.09Å; F178-F180 WeakPolarHBondContact O-CD2 3.5Å; F180-G193 CarbonylContact C-O 3.55Å; F180-G193 WeakPolarHBondContact CB-O 2.97Å; F180-G193 CarbonylContact O-C 3.52Å; F180-G193 WeakPolarHBondContact O-CA 3.37Å; F180-G193 PolarHBondContact O-N 2.65Å; F180-D194 HydrophobicContact CB-CB 4.26Å; F180-D194 HydrophobicContact CD2-CB 4.38Å; F180-D194 HydrophobicContact CG-CB 4.17Å; F180-E212 CarbonylContact C-O 3.55Å; F180-E212 WeakPolarHBondContact CA-O 3.29Å; F180-A213 HydrophobicContact CD1-CB 3.57Å; F180-A213 HydrophobicContact CE1-CB 3.59Å; F180-A213 HydrophobicContact CG-CB 4.3Å; F180-A213 HydrophobicContact CZ-CB 4.32Å
181	R	82.2	Confident	74.1	Confident	1 Å²	1	46.6 Å²	46.6	0%	0.004	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	154.5	166.2	59.5	174.6	162.8	-141.3	-24.7	111.6	N46 R64 S66 I183 I189 C211 E212	N46-R181 PolarHBondContact O-NH2 2.8Å; N46-R181 PolarHBondContact OD1-NH2 3Å; R64-R181 PolarHBondContact O-NH1 3.25Å; S66-R181 PolarHBondContact OG-NH1 2.81Å; R181-I183 HydrophobicContact CG-CD1 4.27Å; R181-I183 HydrophobicContact CG-CG1 4.2Å; R181-I189 HydrophobicContact CB-CD1 4.49Å; R181-I189 VanDerWaalsContact CD-CD1 3.46Å; R181-C211 CarbonylContact O-C 3.41Å; R181-C211 WeakPolarHBondContact O-CA 3.28Å; R181-E212 HydrophobicContact CG-CB 4.07Å; R181-E212 IonicContact CZ-OE1 3.48Å; R181-E212 PolarHBondContact N-O 2.94Å; R181-E212 IonicContact NE-OE1 2.77Å; R181-E212 PolarHBondContact NE-OE1 2.81Å; R181-E212 IonicContact NH2-OE1 3.69Å; R181-E212 PolarHBondContact NH2-OE1 3.2Å; R181-E212 PolarHBondContact O-N 2.88Å
182	W	82.9	Confident	74.4	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	133.5	171.7	-73	88.6	0	0	0	111.3	I149 R164 C166 I189 V190 T191 D194 L196 C211	I149-W182 HydrophobicContact CB-CH2 4.37Å; I149-W182 HydrophobicContact CD1-CH2 3.58Å; I149-W182 HydrophobicContact CD1-CZ2 4.49Å; I149-W182 HydrophobicContact CD1-CZ3 3.92Å; I149-W182 HydrophobicContact CG1-CH2 3.76Å; I149-W182 HydrophobicContact CG1-CZ2 4.28Å; I149-W182 HydrophobicContact CG2-CH2 3.7Å; I149-W182 HydrophobicContact CG2-CZ2 4.35Å; R164-W182 HydrophobicContact CB-CH2 4.14Å; R164-W182 HydrophobicContact CB-CZ2 4.15Å; C166-W182 HydrophobicContact CB-CZ2 3.72Å; W182-I189 CarbonylContact O-C 3.56Å; W182-I189 WeakPolarHBondContact O-CA 3.37Å; W182-V190 PolarHBondContact O-N 3.34Å; W182-T191 VanDerWaalsContact CD1-OG1 3.3Å; W182-T191 PolarHBondContact N-O 2.86Å; W182-D194 PolarHBondContact NE1-O 2.95Å; W182-L196 HydrophobicContact CB-CD1 4.24Å; W182-L196 HydrophobicContact CD2-CB 3.62Å; W182-L196 HydrophobicContact CD2-CD2 4.21Å; W182-L196 HydrophobicContact CD2-CG 4.34Å; W182-L196 HydrophobicContact CE3-CB 4.12Å; W182-L196 HydrophobicContact CE3-CD2 3.82Å; W182-L196 HydrophobicContact CE3-CG 4.43Å; W182-L196 HydrophobicContact CG-CB 3.84Å; W182-L196 HydrophobicContact CG-CD1 4.38Å; W182-L196 HydrophobicContact CH2-CB 4.29Å; W182-L196 HydrophobicContact CH2-CD2 4.16Å; W182-L196 HydrophobicContact CZ2-CB 3.87Å; W182-L196 HydrophobicContact CZ3-CB 4.43Å; W182-L196 HydrophobicContact CZ3-CD2 3.8Å; W182-C211 HydrophobicContact CD2-CB 3.89Å; W182-C211 HydrophobicContact CE3-CB 3.86Å; W182-C211 HydrophobicContact CH2-CB 4.08Å; W182-C211 HydrophobicContact CZ2-CB 4.05Å; W182-C211 HydrophobicContact CZ3-CB 3.95Å
183	I	79.5	Confident	75.1	Confident	12 Å²	12	45.1 Å²	45.1	6%	0.062	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	133.5	-171.3	-46.9	179.3	0	0	0	109.9	R181 R188 Y209 T210 E212	R181-I183 HydrophobicContact CG-CD1 4.27Å; R181-I183 HydrophobicContact CG-CG1 4.2Å; I183-R188 CarbonylContact C-O 3.55Å; I183-R188 WeakPolarHBondContact CA-O 3.47Å; I183-R188 WeakPolarHBondContact CG2-O 3.44Å; I183-Y209 CarbonylContact O-C 3.55Å; I183-Y209 WeakPolarHBondContact O-CA 3.42Å; I183-T210 PolarHBondContact N-O 2.9Å; I183-T210 PolarHBondContact O-N 3.02Å; I183-E212 HydrophobicContact CD1-CB 4.04Å
184	D	76.3	Confident	76	Confident	20 Å²	20	43.1 Å²	43.1	11%	0.107	23%	0.23	C	C	.	.			trans	-78.4	177.6	175.8	89.4	-25.5	0	0	0	113	N186 G187 R188 V190 N208	D184-N186 VanDerWaalsContact CG-N 3.34Å; D184-N186 PolarHBondContact O-N 2.91Å; D184-N186 VanDerWaalsContact OD1-C 3.26Å; D184-N186 VanDerWaalsContact OD1-CA 3.28Å; D184-N186 WeakPolarHBondContact OD1-CA 3.47Å; D184-N186 WeakPolarHBondContact OD1-CB 3.34Å; D184-N186 PolarHBondContact OD1-N 2.85Å; D184-N186 WeakPolarHBondContact OD2-CB 3.43Å; D184-N186 PolarHBondContact OD2-ND2 3.33Å; D184-G187 PolarHBondContact O-N 2.77Å; D184-G187 VanDerWaalsContact O-N 3.15Å; D184-G187 PolarHBondContact OD1-N 3.06Å; D184-R188 PolarHBondContact N-O 2.93Å; D184-R188 WeakPolarHBondContact OD1-CB 3.37Å; D184-R188 PolarHBondContact OD1-N 2.93Å; D184-V190 HydrophobicContact CB-CG2 3.83Å; D184-N208 CarbonylContact C-O 3.51Å
185	Q	74	Confident	76.5	Confident	110 Å²	110	43.8 Å²	43.8	51%	0.514	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-16.3	177	73.4	-169.8	-17.1	0	0	114.6	S207 N208	Q185-S207 WeakPolarHBondContact CG-OG 3.29Å; Q185-S207 PolarHBondContact NE2-OG 3.21Å; Q185-N208 PolarHBondContact N-O 3.24Å
186	N	66.4	Low	76.4	Confident	91 Å²	91	42.4 Å²	42.4	49%	0.487	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	-2.2	178.8	-53.1	-67.5	0	0	0	112.6	N71 D184	N71-N186 PolarHBondContact ND2-O 2.95Å; D184-N186 VanDerWaalsContact CG-N 3.34Å; D184-N186 PolarHBondContact O-N 2.91Å; D184-N186 VanDerWaalsContact OD1-C 3.26Å; D184-N186 VanDerWaalsContact OD1-CA 3.28Å; D184-N186 WeakPolarHBondContact OD1-CA 3.47Å; D184-N186 WeakPolarHBondContact OD1-CB 3.34Å; D184-N186 PolarHBondContact OD1-N 2.85Å; D184-N186 WeakPolarHBondContact OD2-CB 3.43Å; D184-N186 PolarHBondContact OD2-ND2 3.33Å
187	G	66.6	Low	76.6	Confident	37 Å²	37	41.8 Å²	41.8	38%	0.381	22%	0.221	S	C	.	.	S	Bend	trans	86.1	8.3	-178.3	0	0	0	0	0	115.6	D184	D184-G187 PolarHBondContact O-N 2.77Å; D184-G187 VanDerWaalsContact O-N 3.15Å; D184-G187 PolarHBondContact OD1-N 3.06Å
188	R	63.4	Low	76.5	Confident	117 Å²	117	39.6 Å²	39.6	44%	0.442	21%	0.21	S	C	.	.			trans	-73.5	142.8	174	-60.8	176.9	174.1	-179	-2.1	110.1	N71 I183 D184	N71-R188 VanDerWaalsContact OD1-CG 3.29Å; N71-R188 WeakPolarHBondContact OD1-CG 3.44Å; N71-R188 PolarHBondContact OD1-NE 2.81Å; N71-R188 PolarHBondContact OD1-NH2 3.13Å; I183-R188 CarbonylContact C-O 3.55Å; I183-R188 WeakPolarHBondContact CA-O 3.47Å; I183-R188 WeakPolarHBondContact CG2-O 3.44Å; D184-R188 PolarHBondContact N-O 2.93Å; D184-R188 WeakPolarHBondContact OD1-CB 3.37Å; D184-R188 PolarHBondContact OD1-N 2.93Å
189	I	69.7	Low	76.1	Confident	11 Å²	11	42.5 Å²	42.5	6%	0.056	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	126.2	167.7	-65	-176.1	0	0	0	108.2	V44 S66 L68 R181 W182 T191 N192	V44-I189 HydrophobicContact CB-CD1 4.48Å; V44-I189 HydrophobicContact CG1-CD1 4.22Å; S66-I189 VanDerWaalsContact CB-CD1 3.49Å; S66-I189 WeakPolarHBondContact OG-CD1 3.19Å; L68-I189 HydrophobicContact CD2-CB 3.71Å; L68-I189 HydrophobicContact CD2-CG2 3.55Å; R181-I189 HydrophobicContact CB-CD1 4.49Å; R181-I189 VanDerWaalsContact CD-CD1 3.46Å; W182-I189 CarbonylContact O-C 3.56Å; W182-I189 WeakPolarHBondContact O-CA 3.37Å; I189-T191 WeakPolarHBondContact CG2-O 3.28Å; I189-N192 HydrophobicContact CG2-CB 4.45Å
190	V	71.7	Confident	75.5	Confident	53 Å²	53	44.1 Å²	44.1	32%	0.321	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	-43.3	-178.6	-176.6	0	0	0	0	110	W182 D184 L196 L198 Y209	W182-V190 PolarHBondContact O-N 3.34Å; D184-V190 HydrophobicContact CB-CG2 3.83Å; V190-L196 HydrophobicContact CB-CD1 4.28Å; V190-L196 HydrophobicContact CG1-CD1 3.7Å; V190-L198 HydrophobicContact CG1-CD2 3.96Å; V190-Y209 HydrophobicContact CB-CE1 4.48Å; V190-Y209 HydrophobicContact CG1-CE1 4.11Å; V190-Y209 HydrophobicContact CG2-CD1 3.97Å; V190-Y209 HydrophobicContact CG2-CE1 3.84Å
191	T	75.7	Confident	74.5	Confident	32 Å²	32	48.9 Å²	48.9	20%	0.196	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	142.7	168.2	60.9	0	0	0	0	110	W182 I189 T195	W182-T191 VanDerWaalsContact CD1-OG1 3.3Å; W182-T191 PolarHBondContact N-O 2.86Å; I189-T191 WeakPolarHBondContact CG2-O 3.28Å; T191-T195 VanDerWaalsContact CB-O 3.26Å; T191-T195 WeakPolarHBondContact CB-O 3.33Å; T191-T195 WeakPolarHBondContact CG2-O 3.37Å; T191-T195 PolarHBondContact OG1-O 2.84Å
192	N	67.5	Low	73.2	Confident	66 Å²	66	51.5 Å²	51.5	35%	0.353	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	98.6	171.2	-172.2	56	0	0	0	108.7	V44 I189	V44-N192 HydrophobicContact CG1-CB 4.22Å; V44-N192 VanDerWaalsContact CG1-CG 3.49Å; V44-N192 VanDerWaalsContact CG1-OD1 3.29Å; V44-N192 WeakPolarHBondContact CG1-OD1 3.39Å; V44-N192 HydrophobicContact CG2-CB 4.49Å; I189-N192 HydrophobicContact CG2-CB 4.45Å
193	G	80.7	Confident	72.1	Confident	26 Å²	26	56.1 Å²	56.1	27%	0.268	30%	0.3	S	S	.	.	S	Bend	trans	152.9	179.6	-169.3	0	0	0	0	0	111.6	F180 T195	F180-G193 CarbonylContact C-O 3.55Å; F180-G193 WeakPolarHBondContact CB-O 2.97Å; F180-G193 CarbonylContact O-C 3.52Å; F180-G193 WeakPolarHBondContact O-CA 3.37Å; F180-G193 PolarHBondContact O-N 2.65Å; G193-T195 VanDerWaalsContact C-N 3.29Å
194	D	85.8	Confident	71	Confident	53 Å²	53	59.4 Å²	59.4	28%	0.283	32%	0.324	S	S	.	.	S	Bend	trans	-72.7	-23.1	177.4	68.8	-17.2	0	0	0	113	Q165 C166 F180 W182	Q165-D194 HydrophobicContact CG-CB 4.33Å; Q165-D194 VanDerWaalsContact CG-OD2 3.32Å; Q165-D194 WeakPolarHBondContact CG-OD2 3.44Å; Q165-D194 PolarHBondContact NE2-OD2 2.85Å; C166-D194 WeakPolarHBondContact CB-O 3.43Å; C166-D194 PolarHBondContact N-O 3.18Å; F180-D194 HydrophobicContact CB-CB 4.26Å; F180-D194 HydrophobicContact CD2-CB 4.38Å; F180-D194 HydrophobicContact CG-CB 4.17Å; W182-D194 PolarHBondContact NE1-O 2.95Å
195	T	85.4	Confident	70.1	Confident	44 Å²	44	60.8 Å²	60.8	27%	0.27	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	126.6	-167.7	-61.9	0	0	0	0	112	L152 R164 T191 G193	L152-T195 HydrophobicContact CD1-CG2 3.63Å; R164-T195 CarbonylContact O-C 3.53Å; R164-T195 WeakPolarHBondContact O-CA 3.26Å; T191-T195 VanDerWaalsContact CB-O 3.26Å; T191-T195 WeakPolarHBondContact CB-O 3.33Å; T191-T195 WeakPolarHBondContact CG2-O 3.37Å; T191-T195 PolarHBondContact OG1-O 2.84Å; G193-T195 VanDerWaalsContact C-N 3.29Å
196	L	80.1	Confident	69.7	Low	0 Å²	0	57.9 Å²	57.9	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	129.4	167.1	174.7	67.5	0	0	0	109.2	M163 R164 W182 V190 L198 Y209 Y226	M163-L196 WeakPolarHBondContact CA-O 3.46Å; R164-L196 HydrophobicContact CB-CB 4.28Å; R164-L196 PolarHBondContact N-O 2.8Å; R164-L196 PolarHBondContact O-N 3.01Å; W182-L196 HydrophobicContact CB-CD1 4.24Å; W182-L196 HydrophobicContact CD2-CB 3.62Å; W182-L196 HydrophobicContact CD2-CD2 4.21Å; W182-L196 HydrophobicContact CD2-CG 4.34Å; W182-L196 HydrophobicContact CE3-CB 4.12Å; W182-L196 HydrophobicContact CE3-CD2 3.82Å; W182-L196 HydrophobicContact CE3-CG 4.43Å; W182-L196 HydrophobicContact CG-CB 3.84Å; W182-L196 HydrophobicContact CG-CD1 4.38Å; W182-L196 HydrophobicContact CH2-CB 4.29Å; W182-L196 HydrophobicContact CH2-CD2 4.16Å; W182-L196 HydrophobicContact CZ2-CB 3.87Å; W182-L196 HydrophobicContact CZ3-CB 4.43Å; W182-L196 HydrophobicContact CZ3-CD2 3.8Å; V190-L196 HydrophobicContact CB-CD1 4.28Å; V190-L196 HydrophobicContact CG1-CD1 3.7Å; L196-L198 HydrophobicContact CD1-CD1 4.25Å; L196-L198 HydrophobicContact CD1-CD2 4.07Å; L196-L198 HydrophobicContact CD1-CG 3.9Å; L196-L198 HydrophobicContact CD2-CD1 4.02Å; L196-L198 HydrophobicContact CD2-CG 4.42Å; L196-L198 HydrophobicContact CG-CD1 4.24Å; L196-L198 HydrophobicContact CG-CG 4.09Å; L196-Y209 HydrophobicContact CD1-CD1 4.11Å; L196-Y209 HydrophobicContact CD1-CE1 4.4Å; L196-Y209 HydrophobicContact CD2-CD1 4.31Å; L196-Y209 HydrophobicContact CD2-CG 4.2Å; L196-Y226 HydrophobicContact CD2-CD1 4.26Å
197	Y	81.8	Confident	69.8	Low	115 Å²	115	53.7 Å²	53.7	45%	0.451	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	133.6	167.2	179.4	-89.1	0	0	0	108.1	T161 M163 L199	T161-Y197 HydrophobicContact CG2-CE2 3.86Å; M163-Y197 HydrophobicContact CE-CD2 4.06Å; M163-Y197 HydrophobicContact CG-CD2 3.75Å; M163-Y197 HydrophobicContact CG-CE2 4.18Å; M163-Y197 HydrophobicContact SD-CD2 3.9Å; M163-Y197 HydrophobicContact SD-CE2 4.05Å; Y197-L199 HydrophobicContact CE1-CB 4.23Å
198	L	73	Confident	70.3	Confident	7 Å²	7	54.7 Å²	54.7	4%	0.037	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	146.7	173.1	-62.3	168.7	0	0	0	109.5	T161 I162 V190 L196 Y209 V228	T161-L198 WeakPolarHBondContact CA-O 3.34Å; I162-L198 HydrophobicContact CB-CB 4.26Å; I162-L198 PolarHBondContact N-O 3.07Å; I162-L198 PolarHBondContact O-N 2.88Å; V190-L198 HydrophobicContact CG1-CD2 3.96Å; L196-L198 HydrophobicContact CD1-CD1 4.25Å; L196-L198 HydrophobicContact CD1-CD2 4.07Å; L196-L198 HydrophobicContact CD1-CG 3.9Å; L196-L198 HydrophobicContact CD2-CD1 4.02Å; L196-L198 HydrophobicContact CD2-CG 4.42Å; L196-L198 HydrophobicContact CG-CD1 4.24Å; L196-L198 HydrophobicContact CG-CG 4.09Å; L198-Y209 HydrophobicContact CD1-CD1 4.47Å; L198-Y209 HydrophobicContact CD1-CD2 4.23Å; L198-Y209 HydrophobicContact CD1-CE1 3.9Å; L198-Y209 HydrophobicContact CD1-CE2 3.63Å; L198-Y209 VanDerWaalsContact CD1-CZ 3.44Å; L198-Y209 HydrophobicContact CD2-CE1 3.77Å; L198-Y209 WeakPolarHBondContact CD2-OH 3.43Å; L198-Y209 HydrophobicContact CG-CE1 4.42Å; L198-V228 HydrophobicContact CD1-CG2 3.88Å
199	L	71.7	Confident	71.1	Confident	66 Å²	66	49.6 Å²	49.6	35%	0.346	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	95.1	174.2	-178.1	67.3	0	0	0	107.5	T161 Y197 E201	T161-L199 HydrophobicContact CG2-CD1 4.47Å; Y197-L199 HydrophobicContact CE1-CB 4.23Å; L199-E201 VanDerWaalsContact C-N 3.34Å; L199-E201 HydrophobicContact CG-CG 4.33Å; L199-E201 PolarHBondContact O-N 2.84Å
200	I	66.9	Low	71.8	Confident	45 Å²	45	50.1 Å²	50.1	23%	0.231	28%	0.276	C	S	.	.			trans	-74.2	86.4	-167.2	-56.5	169.3	0	0	0	110.6	G160 I162 L206 V228	G160-I200 WeakPolarHBondContact O-CG1 3.13Å; G160-I200 PolarHBondContact O-N 3.45Å; I162-I200 HydrophobicContact CD1-CD1 3.68Å; I162-I200 HydrophobicContact CG1-CD1 4.2Å; I200-L206 HydrophobicContact CD1-CD2 4.31Å; I200-L206 HydrophobicContact CG2-CD2 3.9Å; I200-V228 HydrophobicContact CD1-CG1 3.52Å
201	E	62.4	Low	72.5	Confident	121 Å²	121	47.6 Å²	47.6	57%	0.565	26%	0.261	S	S	*	.			trans	-90.8	-34.7	170.1	-63.4	-176.5	172.8	0	0	111.4	L199	L199-E201 VanDerWaalsContact C-N 3.34Å; L199-E201 HydrophobicContact CG-CG 4.33Å; L199-E201 PolarHBondContact O-N 2.84Å
202	D	56.6	Low	72.8	Confident	55 Å²	55	46.2 Å²	46.2	29%	0.294	25%	0.253	S	S	.	.	S	Bend	trans	-110.6	130	-179.6	-179.9	1.2	0	0	0	111.9	M32 S204 E205	M32-D202 HydrophobicContact CE-CB 3.84Å; D202-S204 PolarHBondContact O-N 2.85Å; D202-S204 PolarHBondContact OD1-N 3.5Å; D202-S204 VanDerWaalsContact OD2-CB 3.24Å; D202-S204 WeakPolarHBondContact OD2-CB 3.31Å; D202-S204 PolarHBondContact OD2-OG 3.33Å; D202-E205 PolarHBondContact O-N 3.01Å
203	P	59.7	Low	73.6	Confident	97 Å²	97	43.1 Å²	43.1	63%	0.63	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-50	-16.1	166	-29.4	36.7	0	0	0	116.6	E205 L206	P203-E205 VanDerWaalsContact C-N 3.27Å; P203-E205 PolarHBondContact O-N 2.91Å; P203-L206 HydrophobicContact CB-CD1 4.03Å; P203-L206 VanDerWaalsContact O-CB 3.31Å; P203-L206 WeakPolarHBondContact O-CB 3.31Å; P203-L206 WeakPolarHBondContact O-CD1 3.21Å; P203-L206 WeakPolarHBondContact O-CG 3.4Å; P203-L206 PolarHBondContact O-N 3.33Å
204	S	55.6	Low	73.3	Confident	81 Å²	81	41.9 Å²	41.9	57%	0.566	22%	0.223	S	C	*	.	G	3₁₀ helix	trans	-67.6	-22.1	172.8	80.9	0	0	0	0	114.1	D202 L206	D202-S204 PolarHBondContact O-N 2.85Å; D202-S204 PolarHBondContact OD1-N 3.5Å; D202-S204 VanDerWaalsContact OD2-CB 3.24Å; D202-S204 WeakPolarHBondContact OD2-CB 3.31Å; D202-S204 PolarHBondContact OD2-OG 3.33Å; S204-L206 PolarHBondContact O-N 3.17Å
205	E	57.6	Low	72.7	Confident	49 Å²	49	39.8 Å²	39.8	23%	0.229	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-74.8	-3.5	174	-58.5	-153.9	148.4	0	0	113.7	D202 P203 S207 Y209	D202-E205 PolarHBondContact O-N 3.01Å; P203-E205 VanDerWaalsContact C-N 3.27Å; P203-E205 PolarHBondContact O-N 2.91Å; E205-S207 PolarHBondContact O-N 3.46Å; E205-Y209 WeakPolarHBondContact O-CE2 3.34Å; E205-Y209 PolarHBondContact O-OH 3.16Å
206	L	65.3	Low	71.9	Confident	49 Å²	49	42.1 Å²	42.1	26%	0.257	22%	0.216	S	C	.	.			trans	-79.1	67.9	-177.9	-55.7	177	0	0	0	111.1	I200 P203 S204 V228 M230	I200-L206 HydrophobicContact CD1-CD2 4.31Å; I200-L206 HydrophobicContact CG2-CD2 3.9Å; P203-L206 HydrophobicContact CB-CD1 4.03Å; P203-L206 VanDerWaalsContact O-CB 3.31Å; P203-L206 WeakPolarHBondContact O-CB 3.31Å; P203-L206 WeakPolarHBondContact O-CD1 3.21Å; P203-L206 WeakPolarHBondContact O-CG 3.4Å; P203-L206 PolarHBondContact O-N 3.33Å; S204-L206 PolarHBondContact O-N 3.17Å; L206-V228 CarbonylContact C-O 3.57Å; L206-V228 VanDerWaalsContact C-O 3.25Å; L206-V228 HydrophobicContact CD2-CG1 3.84Å; L206-M230 HydrophobicContact CD1-CB 3.71Å; L206-M230 HydrophobicContact CD1-CG 3.46Å; L206-M230 VanDerWaalsContact CD1-CG 3.46Å; L206-M230 HydrophobicContact CD2-CB 4.35Å; L206-M230 HydrophobicContact CD2-CG 3.67Å; L206-M230 HydrophobicContact CG-CG 4.21Å
207	S	68.2	Low	70.9	Confident	4 Å²	4	46.6 Å²	46.6	3%	0.028	24%	0.237	C	C	.	.			trans	-122.5	169.5	-158.3	-168.1	0	0	0	0	113.7	Q185 E205 V228	Q185-S207 WeakPolarHBondContact CG-OG 3.29Å; Q185-S207 PolarHBondContact NE2-OG 3.21Å; E205-S207 PolarHBondContact O-N 3.46Å; S207-V228 PolarHBondContact N-O 2.88Å; S207-V228 PolarHBondContact O-N 3.44Å
208	N	78.4	Confident	69.9	Low	58 Å²	58	44.5 Å²	44.5	31%	0.31	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	110	168.9	-56.1	-95.7	0	0	0	108.2	D184 Q185 Y226 R227	D184-N208 CarbonylContact C-O 3.51Å; Q185-N208 PolarHBondContact N-O 3.24Å; N208-Y226 CarbonylContact C-O 3.55Å; N208-R227 VanDerWaalsContact OD1-CZ 3.31Å; N208-R227 PolarHBondContact OD1-NE 2.9Å; N208-R227 PolarHBondContact OD1-NH2 2.88Å
209	Y	80	Confident	69.1	Low	10 Å²	10	44.7 Å²	44.7	4%	0.039	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	140.5	175.4	-62.7	-96.7	0	0	0	109.5	I183 V190 L196 L198 E205 K225 Y226 V228	I183-Y209 CarbonylContact O-C 3.55Å; I183-Y209 WeakPolarHBondContact O-CA 3.42Å; V190-Y209 HydrophobicContact CB-CE1 4.48Å; V190-Y209 HydrophobicContact CG1-CE1 4.11Å; V190-Y209 HydrophobicContact CG2-CD1 3.97Å; V190-Y209 HydrophobicContact CG2-CE1 3.84Å; L196-Y209 HydrophobicContact CD1-CD1 4.11Å; L196-Y209 HydrophobicContact CD1-CE1 4.4Å; L196-Y209 HydrophobicContact CD2-CD1 4.31Å; L196-Y209 HydrophobicContact CD2-CG 4.2Å; L198-Y209 HydrophobicContact CD1-CD1 4.47Å; L198-Y209 HydrophobicContact CD1-CD2 4.23Å; L198-Y209 HydrophobicContact CD1-CE1 3.9Å; L198-Y209 HydrophobicContact CD1-CE2 3.63Å; L198-Y209 VanDerWaalsContact CD1-CZ 3.44Å; L198-Y209 HydrophobicContact CD2-CE1 3.77Å; L198-Y209 WeakPolarHBondContact CD2-OH 3.43Å; L198-Y209 HydrophobicContact CG-CE1 4.42Å; E205-Y209 WeakPolarHBondContact O-CE2 3.34Å; E205-Y209 PolarHBondContact O-OH 3.16Å; Y209-K225 WeakPolarHBondContact O-CA 3.09Å; Y209-Y226 PolarHBondContact N-O 3.44Å; Y209-Y226 PolarHBondContact O-N 2.96Å; Y209-Y226 VanDerWaalsContact O-O 3.05Å; Y209-V228 HydrophobicContact CD2-CB 4.35Å; Y209-V228 HydrophobicContact CD2-CG2 3.77Å; Y209-V228 HydrophobicContact CE2-CB 3.96Å; Y209-V228 HydrophobicContact CE2-CG2 3.58Å
210	T	83.3	Confident	68.6	Low	21 Å²	21	44.9 Å²	44.9	13%	0.129	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	113	176.2	-54.5	0	0	0	0	108.2	I183 Q223 A224 K225	I183-T210 PolarHBondContact N-O 2.9Å; I183-T210 PolarHBondContact O-N 3.02Å; T210-Q223 HydrophobicContact CG2-CB 4.02Å; T210-Q223 HydrophobicContact CG2-CG 4.05Å; T210-A224 CarbonylContact C-O 3.56Å; T210-A224 WeakPolarHBondContact CA-O 3.4Å; T210-K225 HydrophobicContact CG2-CG 4.09Å
211	C	85.8	Confident	68.5	Low	0 Å²	0	46 Å²	46	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	134.1	160.2	168.7	0	0	0	0	108.4	I149 C166 R181 W182 Q223 A224	I149-C211 HydrophobicContact CD1-CB 4.18Å; I149-C211 HydrophobicContact CG1-CB 4.5Å; C166-C211 HydrophobicContact CB-CB 3.76Å; C166-C211 WeakPolarHBondContact CB-SG 3.48Å; C166-C211 WeakPolarHBondContact SG-CB 3.5Å; C166-C211 CovalentContact SG-SG 2.01Å; C166-C211 PolarHBondContact SG-SG 3.34Å; R181-C211 CarbonylContact O-C 3.41Å; R181-C211 WeakPolarHBondContact O-CA 3.28Å; W182-C211 HydrophobicContact CD2-CB 3.89Å; W182-C211 HydrophobicContact CE3-CB 3.86Å; W182-C211 HydrophobicContact CH2-CB 4.08Å; W182-C211 HydrophobicContact CZ2-CB 4.05Å; W182-C211 HydrophobicContact CZ3-CB 3.95Å; C211-Q223 CarbonylContact O-C 3.59Å; C211-Q223 VanDerWaalsContact O-CA 3.28Å; C211-Q223 WeakPolarHBondContact O-CA 3.38Å; C211-A224 HydrophobicContact CB-CB 4.49Å; C211-A224 PolarHBondContact N-O 3.46Å; C211-A224 PolarHBondContact O-N 2.96Å
212	E	83.8	Confident	69.2	Low	4 Å²	4	42.6 Å²	42.6	2%	0.019	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	123.4	174.1	-172.9	174.1	89.6	0	0	108.5	F180 R181 I183 I221 Y222 Q223	F180-E212 CarbonylContact C-O 3.55Å; F180-E212 WeakPolarHBondContact CA-O 3.29Å; R181-E212 HydrophobicContact CG-CB 4.07Å; R181-E212 IonicContact CZ-OE1 3.48Å; R181-E212 PolarHBondContact N-O 2.94Å; R181-E212 IonicContact NE-OE1 2.77Å; R181-E212 PolarHBondContact NE-OE1 2.81Å; R181-E212 IonicContact NH2-OE1 3.69Å; R181-E212 PolarHBondContact NH2-OE1 3.2Å; R181-E212 PolarHBondContact O-N 2.88Å; I183-E212 HydrophobicContact CD1-CB 4.04Å; E212-I221 HydrophobicContact CG-CG2 3.31Å; E212-Y222 WeakPolarHBondContact CA-O 3.42Å; E212-Q223 HydrophobicContact CB-CG 4.26Å; E212-Q223 HydrophobicContact CG-CG 4.04Å; E212-Q223 PolarHBondContact OE2-NE2 2.97Å
213	A	83	Confident	70.4	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	114.4	177.1	0	0	0	0	0	108.8	L147 F168 F178 F180 Y222	L147-A213 HydrophobicContact CD1-CB 3.93Å; L147-A213 HydrophobicContact CD2-CB 3.85Å; F168-A213 HydrophobicContact CE2-CB 4.32Å; F168-A213 HydrophobicContact CZ-CB 4.35Å; F178-A213 HydrophobicContact CB-CB 4.37Å; F178-A213 HydrophobicContact CD1-CB 4.13Å; F180-A213 HydrophobicContact CD1-CB 3.57Å; F180-A213 HydrophobicContact CE1-CB 3.59Å; F180-A213 HydrophobicContact CG-CB 4.3Å; F180-A213 HydrophobicContact CZ-CB 4.32Å; A213-Y222 PolarHBondContact N-O 3.08Å; A213-Y222 PolarHBondContact O-N 2.97Å
214	T	75.6	Confident	71.2	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	123.7	-179.1	-44.8	0	0	0	0	111.1	N46 P47 Y62 F178 D179 R216 I221	N46-T214 PolarHBondContact OD1-OG1 3.2Å; P47-T214 HydrophobicContact CB-CG2 4.47Å; P47-T214 HydrophobicContact CG-CG2 3.95Å; Y62-T214 HydrophobicContact CD1-CG2 3.96Å; Y62-T214 HydrophobicContact CE1-CG2 4.02Å; F178-T214 CarbonylContact C-O 3.54Å; F178-T214 VanDerWaalsContact CA-O 3.25Å; F178-T214 WeakPolarHBondContact CA-O 3.48Å; D179-T214 PolarHBondContact N-O 2.92Å; D179-T214 PolarHBondContact O-N 3.09Å; T214-R216 PolarHBondContact O-N 2.76Å; T214-I221 HydrophobicContact CG2-CG1 3.92Å
215	N	72	Confident	72.4	Confident	9 Å²	9	44.9 Å²	44.9	5%	0.048	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64	127	176.2	-176.8	-89.6	0	0	0	110.6	L177 F178 Q217 T218 G219 V220	L177-N215 WeakPolarHBondContact O-CA 3.44Å; F178-N215 HydrophobicContact CD1-CB 3.91Å; F178-N215 VanDerWaalsContact CD1-N 3.28Å; F178-N215 HydrophobicContact CE1-CB 3.55Å; F178-N215 HydrophobicContact CZ-CB 3.9Å; N215-Q217 VanDerWaalsContact C-N 3.33Å; N215-Q217 PolarHBondContact O-N 2.71Å; N215-Q217 PolarHBondContact OD1-N 2.84Å; N215-T218 WeakPolarHBondContact CB-OG1 3.41Å; N215-T218 PolarHBondContact OD1-N 2.7Å; N215-T218 PolarHBondContact OD1-OG1 2.84Å; N215-G219 WeakPolarHBondContact O-CA 3.42Å; N215-G219 PolarHBondContact O-N 3.35Å; N215-V220 HydrophobicContact CB-CB 4.43Å; N215-V220 PolarHBondContact N-O 2.91Å
216	R	69	Low	73.5	Confident	94 Å²	94	43.9 Å²	43.9	36%	0.355	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-31.2	-173	-73.1	173.8	168.1	164.5	-5.5	114	L53 E176 L177 D179 T214	L53-R216 HydrophobicContact CD1-CB 4.34Å; L53-R216 WeakPolarHBondContact CD1-O 3.41Å; E176-R216 PolarHBondContact O-NH1 2.82Å; L177-R216 PolarHBondContact O-N 3.37Å; D179-R216 IonicContact OD1-CZ 3.94Å; D179-R216 IonicContact OD1-NE 2.95Å; D179-R216 PolarHBondContact OD1-NE 2.96Å; D179-R216 IonicContact OD1-NH2 2.76Å; D179-R216 PolarHBondContact OD1-NH2 3.44Å; D179-R216 IonicContact OD2-NE 2.65Å; T214-R216 PolarHBondContact O-N 2.76Å
217	Q	60	Low	74.1	Confident	94 Å²	94	48.8 Å²	48.8	44%	0.439	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-43.9	-176.3	-66.2	172.2	-10.5	0	0	112	D54 N215	D54-Q217 HydrophobicContact CB-CG 4.5Å; N215-Q217 VanDerWaalsContact C-N 3.33Å; N215-Q217 PolarHBondContact O-N 2.71Å; N215-Q217 PolarHBondContact OD1-N 2.84Å
218	T	59.8	Low	74.1	Confident	71 Å²	71	48.9 Å²	48.9	44%	0.436	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-11.4	-171.4	61.1	0	0	0	0	114.2	N215 V220	N215-T218 WeakPolarHBondContact CB-OG1 3.41Å; N215-T218 PolarHBondContact OD1-N 2.7Å; N215-T218 PolarHBondContact OD1-OG1 2.84Å; T218-V220 PolarHBondContact O-N 3.42Å; T218-V220 WeakPolarHBondContact OG1-CG2 3.41Å; T218-V220 PolarHBondContact OG1-N 2.87Å
219	G	55.7	Low	73.4	Confident	11 Å²	11	47.9 Å²	47.9	11%	0.113	23%	0.23	C	C	.	.			trans	67.1	7.6	-173.2	0	0	0	0	0	114.6	N215 I221	N215-G219 WeakPolarHBondContact O-CA 3.42Å; N215-G219 PolarHBondContact O-N 3.35Å; G219-I221 WeakPolarHBondContact O-CG1 3.17Å; G219-I221 PolarHBondContact O-N 2.91Å
220	V	61.2	Low	72.1	Confident	69 Å²	69	55 Å²	55	42%	0.418	27%	0.265	S	S	.	.			trans	-70	126.8	-178.4	176.2	0	0	0	0	110.5	N215 T218 Y222	N215-V220 HydrophobicContact CB-CB 4.43Å; N215-V220 PolarHBondContact N-O 2.91Å; T218-V220 PolarHBondContact O-N 3.42Å; T218-V220 WeakPolarHBondContact OG1-CG2 3.41Å; T218-V220 PolarHBondContact OG1-N 2.87Å; V220-Y222 HydrophobicContact CB-CE2 4.48Å; V220-Y222 HydrophobicContact CG1-CD2 4.26Å; V220-Y222 HydrophobicContact CG1-CE2 3.65Å
221	I	65.4	Low	70.5	Confident	69 Å²	69	57.7 Å²	57.7	35%	0.354	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	125.2	-173.9	-50	177.5	0	0	0	110.6	Y62 E212 T214 G219 Q223	Y62-I221 HydrophobicContact CE1-CD1 3.7Å; Y62-I221 HydrophobicContact CE1-CG1 4.12Å; E212-I221 HydrophobicContact CG-CG2 3.31Å; T214-I221 HydrophobicContact CG2-CG1 3.92Å; G219-I221 WeakPolarHBondContact O-CG1 3.17Å; G219-I221 PolarHBondContact O-N 2.91Å; I221-Q223 HydrophobicContact CG2-CG 4.26Å
222	Y	76.9	Confident	68.2	Low	50 Å²	50	66.6 Å²	66.6	20%	0.196	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	144.4	167.8	-65.3	-106.1	0	0	0	109.1	Y142 L145 F168 F178 E212 A213 V220	Y142-Y222 PolarHBondContact O-OH 2.74Å; Y142-Y222 VanDerWaalsContact O-OH 3.05Å; L145-Y222 HydrophobicContact CB-CD1 4.46Å; L145-Y222 HydrophobicContact CB-CE1 3.79Å; F168-Y222 HydrophobicContact CE1-CD1 4.21Å; F168-Y222 HydrophobicContact CE1-CG 4.26Å; F168-Y222 HydrophobicContact CZ-CD1 4.47Å; F168-Y222 HydrophobicContact CZ-CD2 4.25Å; F168-Y222 HydrophobicContact CZ-CG 4.07Å; F178-Y222 HydrophobicContact CD1-CD2 4.45Å; F178-Y222 AromaticContact CE1-CD2 3.59Å; F178-Y222 HydrophobicContact CE1-CD2 3.59Å; F178-Y222 AromaticContact CE1-CE2 3.68Å; F178-Y222 HydrophobicContact CE1-CE2 3.68Å; F178-Y222 HydrophobicContact CZ-CD2 4.35Å; F178-Y222 HydrophobicContact CZ-CE2 4.05Å; E212-Y222 WeakPolarHBondContact CA-O 3.42Å; A213-Y222 PolarHBondContact N-O 3.08Å; A213-Y222 PolarHBondContact O-N 2.97Å; V220-Y222 HydrophobicContact CB-CE2 4.48Å; V220-Y222 HydrophobicContact CG1-CD2 4.26Å; V220-Y222 HydrophobicContact CG1-CE2 3.65Å
223	Q	81.8	Confident	65.6	Low	106 Å²	106	68.6 Å²	68.6	50%	0.495	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	134.8	179.4	-74.1	-175.8	-8.8	0	0	111.9	T210 C211 E212 I221	T210-Q223 HydrophobicContact CG2-CB 4.02Å; T210-Q223 HydrophobicContact CG2-CG 4.05Å; C211-Q223 CarbonylContact O-C 3.59Å; C211-Q223 VanDerWaalsContact O-CA 3.28Å; C211-Q223 WeakPolarHBondContact O-CA 3.38Å; E212-Q223 HydrophobicContact CB-CG 4.26Å; E212-Q223 HydrophobicContact CG-CG 4.04Å; E212-Q223 PolarHBondContact OE2-NE2 2.97Å; I221-Q223 HydrophobicContact CG2-CG 4.26Å
224	A	76.6	Confident	63.1	Low	14 Å²	14	73.8 Å²	73.8	12%	0.116	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	136.9	174	0	0	0	0	0	109.5	L147 I149 T210 C211	L147-A224 HydrophobicContact CB-CB 4.36Å; L147-A224 HydrophobicContact CD2-CB 3.98Å; L147-A224 HydrophobicContact CG-CB 3.94Å; I149-A224 HydrophobicContact CD1-CB 3.59Å; I149-A224 HydrophobicContact CG1-CB 3.99Å; T210-A224 CarbonylContact C-O 3.56Å; T210-A224 WeakPolarHBondContact CA-O 3.4Å; C211-A224 HydrophobicContact CB-CB 4.49Å; C211-A224 PolarHBondContact N-O 3.46Å; C211-A224 PolarHBondContact O-N 2.96Å
225	K	80.4	Confident	61.2	Low	160 Å²	160	77.4 Å²	77.4	70%	0.696	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.1	129.7	-172.6	-67.4	-174.7	177.5	-178.6	0	111.9	Y209 T210	Y209-K225 WeakPolarHBondContact O-CA 3.09Å; T210-K225 HydrophobicContact CG2-CG 4.09Å
226	Y	81.7	Confident	59.6	Low	28 Å²	28	82 Å²	82	11%	0.11	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	140.1	177.2	-176.3	-110.3	0	0	0	109.3	I149 I162 R164 L196 N208 Y209 V228	I149-Y226 HydrophobicContact CG2-CD2 4.12Å; I162-Y226 HydrophobicContact CG2-CE1 3.92Å; R164-Y226 HydrophobicContact CG-CE1 4.17Å; R164-Y226 HydrophobicContact CG-CE2 4.2Å; R164-Y226 PolarHBondContact NE-OH 2.85Å; L196-Y226 HydrophobicContact CD2-CD1 4.26Å; N208-Y226 CarbonylContact C-O 3.55Å; Y209-Y226 PolarHBondContact N-O 3.44Å; Y209-Y226 PolarHBondContact O-N 2.96Å; Y209-Y226 VanDerWaalsContact O-O 3.05Å; Y226-V228 HydrophobicContact CD1-CG2 4.01Å; Y226-V228 HydrophobicContact CE1-CG2 3.57Å
227	R	77.4	Confident	58.5	Low	153 Å²	153	82.2 Å²	82.2	58%	0.577	44%	0.435	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.8	115.6	177.6	176	173.7	-69.6	177.8	-2	109.9	N208	N208-R227 VanDerWaalsContact OD1-CZ 3.31Å; N208-R227 PolarHBondContact OD1-NE 2.9Å; N208-R227 PolarHBondContact OD1-NH2 2.88Å
228	V	67.8	Low	58	Low	5 Å²	5	83.9 Å²	83.9	3%	0.03	44%	0.443	C	S	.	.			trans	-85.3	133	160.8	-177.9	0	0	0	0	107.3	I162 L198 I200 L206 S207 Y209 Y226	I162-V228 HydrophobicContact CD1-CG1 3.98Å; I162-V228 HydrophobicContact CD1-CG2 3.84Å; L198-V228 HydrophobicContact CD1-CG2 3.88Å; I200-V228 HydrophobicContact CD1-CG1 3.52Å; L206-V228 CarbonylContact C-O 3.57Å; L206-V228 VanDerWaalsContact C-O 3.25Å; L206-V228 HydrophobicContact CD2-CG1 3.84Å; S207-V228 PolarHBondContact N-O 2.88Å; S207-V228 PolarHBondContact O-N 3.44Å; Y209-V228 HydrophobicContact CD2-CB 4.35Å; Y209-V228 HydrophobicContact CD2-CG2 3.77Å; Y209-V228 HydrophobicContact CE2-CB 3.96Å; Y209-V228 HydrophobicContact CE2-CG2 3.58Å; Y226-V228 HydrophobicContact CD1-CG2 4.01Å; Y226-V228 HydrophobicContact CE1-CG2 3.57Å
229	S	63.5	Low	58.3	Low	37 Å²	37	82.6 Å²	82.6	26%	0.259	43%	0.431	S	S	.	.			trans	-162.2	124.3	175.8	52.6	0	0	0	0	109.6	L231	S229-L231 WeakPolarHBondContact O-CG 3.33Å; S229-L231 PolarHBondContact O-N 2.94Å; S229-L231 VanDerWaalsContact OG-CD1 3.26Å; S229-L231 WeakPolarHBondContact OG-CD1 3.37Å
230	M	52.4	Low	59.1	Low	159 Å²	159	86.4 Å²	86.4	78%	0.783	45%	0.448	S	S	*	.			trans	-61.2	111.5	169.7	-82.5	-81.7	-105.6	0	0	109.1	L206	L206-M230 HydrophobicContact CD1-CB 3.71Å; L206-M230 HydrophobicContact CD1-CG 3.46Å; L206-M230 VanDerWaalsContact CD1-CG 3.46Å; L206-M230 HydrophobicContact CD2-CB 4.35Å; L206-M230 HydrophobicContact CD2-CG 3.67Å; L206-M230 HydrophobicContact CG-CG 4.21Å
231	L	50.6	Low	59.9	Low	79 Å²	79	83.8 Å²	83.8	41%	0.414	43%	0.433	S	S	.	.			trans	-109.5	110.9	-173.4	-86.2	156.8	0	0	0	109.6	S229 G233 Q235	S229-L231 WeakPolarHBondContact O-CG 3.33Å; S229-L231 PolarHBondContact O-N 2.94Å; S229-L231 VanDerWaalsContact OG-CD1 3.26Å; S229-L231 WeakPolarHBondContact OG-CD1 3.37Å; L231-G233 WeakPolarHBondContact CB-O 3.5Å; L231-G233 WeakPolarHBondContact CD2-O 3.46Å; L231-G233 PolarHBondContact O-N 2.99Å; L231-Q235 HydrophobicContact CD1-CB 3.51Å; L231-Q235 HydrophobicContact CD1-CG 3.55Å
232	N	38.2	Very low	60.7	Low	186 Å²	186	83.4 Å²	83.4	100%	0.995	43%	0.431	S	S	*	.	S	Bend	trans	-66.2	69.6	160.5	-85.8	-24.2	0	0	0	109
233	G	29.1	Very low	60.9	Low	46 Å²	46	82.7 Å²	82.7	47%	0.474	43%	0.43	S	S	.	.	S	Bend	trans	83.3	153.2	-170	0	0	0	0	0	114.2	L231	L231-G233 WeakPolarHBondContact CB-O 3.5Å; L231-G233 WeakPolarHBondContact CD2-O 3.46Å; L231-G233 PolarHBondContact O-N 2.99Å
234	Q	31	Very low	61	Low	109 Å²	109	84.6 Å²	84.6	51%	0.509	43%	0.433	S	S	.	.			trans	68.1	58.7	163.9	-46.6	-162.1	-89.6	0	0	118.3	E267	Q234-E267 VanDerWaalsContact CD-OE1 3.26Å; Q234-E267 WeakPolarHBondContact CG-OE1 3.13Å; Q234-E267 PolarHBondContact NE2-OE1 2.02Å; Q234-E267 PolarHBondContact NE2-OE2 3.48Å
235	Q	34.6	Very low	61.1	Low	76 Å²	76	87.4 Å²	87.4	36%	0.355	45%	0.45	S	S	.	.			trans	-78.4	155.5	153.5	-153	164.7	17	0	0	110.1	L231 M237	L231-Q235 HydrophobicContact CD1-CB 3.51Å; L231-Q235 HydrophobicContact CD1-CG 3.55Å; Q235-M237 PolarHBondContact O-N 3.18Å
236	A	39.6	Very low	61.3	Low	106 Å²	106	84.3 Å²	84.3	88%	0.876	44%	0.44	S	S	*	.			trans	-71.3	75.7	172.2	0	0	0	0	0	109.8
237	M	44.4	Very low	61.2	Low	98 Å²	98	84.9 Å²	84.9	48%	0.483	45%	0.446	S	S	.	.			trans	-59.8	139.1	-176.2	-74.2	165.3	146.9	0	0	111.4	Q235 H239 P264	Q235-M237 PolarHBondContact O-N 3.18Å; M237-H239 PolarHBondContact O-CE1 3.1Å; M237-H239 PolarHBondContact O-N 3.18Å; M237-H239 PolarHBondContact O-ND1 2.84Å; M237-P264 HydrophobicContact CB-CG 3.49Å; M237-P264 VanDerWaalsContact CB-CG 3.49Å; M237-P264 HydrophobicContact CE-CB 3.79Å; M237-P264 HydrophobicContact CE-CG 3.72Å; M237-P264 HydrophobicContact CG-CG 3.55Å; M237-P264 HydrophobicContact SD-CB 3.75Å; M237-P264 HydrophobicContact SD-CG 3.33Å; M237-P264 WeakPolarHBondContact SD-CG 3.46Å
238	Q	50.6	Low	60.3	Low	130 Å²	130	81 Å²	81	61%	0.607	45%	0.454	S	S	*	.			trans	-79.9	101.7	168.9	-176.6	170.2	-6.8	0	0	108.2	I240	Q238-I240 PolarHBondContact O-N 2.86Å
239	H	66.4	Low	60.1	Low	43 Å²	43	86.3 Å²	86.3	20%	0.199	48%	0.483	C	S	.	.			trans	-79.3	103.7	-175	-67.4	77.2	0	0	0	110.3	M237 V262 P264 P266 W306	M237-H239 PolarHBondContact O-CE1 3.1Å; M237-H239 PolarHBondContact O-N 3.18Å; M237-H239 PolarHBondContact O-ND1 2.84Å; H239-V262 HydrophobicContact CB-CG1 3.72Å; H239-P264 PolarHBondContact CD2-O 2.83Å; H239-P266 VanDerWaalsContact CD2-CG 3.45Å; H239-P266 WeakPolarHBondContact CD2-CG 3.48Å; H239-P266 VanDerWaalsContact NE2-CA 3.3Å; H239-P266 WeakPolarHBondContact NE2-CA 3.49Å; H239-P266 WeakPolarHBondContact NE2-CB 3.13Å; H239-P266 WeakPolarHBondContact NE2-CG 3.1Å; H239-W306 HydrophobicContact CB-CH2 3.63Å; H239-W306 HydrophobicContact CB-CZ2 3.49Å; H239-W306 VanDerWaalsContact CB-CZ2 3.49Å; H239-W306 AromaticContact CG-CZ2 3.55Å; H239-W306 AromaticContact ND1-CZ2 3.93Å
240	I	72.5	Confident	60.3	Low	92 Å²	92	85.8 Å²	85.8	47%	0.472	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	130.8	173.9	-55.7	175.6	0	0	0	107.9	Q238 N242 V262 E263	Q238-I240 PolarHBondContact O-N 2.86Å; I240-N242 WeakPolarHBondContact CG2-OD1 3.39Å; I240-V262 CarbonylContact O-C 3.58Å; I240-V262 WeakPolarHBondContact O-CA 3.47Å; I240-E263 WeakPolarHBondContact CB-O 3.47Å; I240-E263 PolarHBondContact N-O 2.95Å; I240-E263 PolarHBondContact O-N 2.77Å
241	V	77.3	Confident	60.8	Low	14 Å²	14	82.2 Å²	82.2	9%	0.085	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	122.5	171.7	-172.9	0	0	0	0	107.8	C260 V262 A304 A317 A319	V241-C260 VanDerWaalsContact CG1-SG 3.51Å; V241-V262 HydrophobicContact CG2-CG2 4.33Å; V241-A304 HydrophobicContact CG1-CB 4.15Å; V241-A304 HydrophobicContact CG2-CB 3.89Å; V241-A317 HydrophobicContact CG2-CB 3.5Å; V241-A319 HydrophobicContact CB-CB 4.17Å; V241-A319 HydrophobicContact CG1-CB 3.76Å; V241-A319 WeakPolarHBondContact O-CB 3.49Å
242	N	81.4	Confident	61.7	Low	61 Å²	61	79.8 Å²	79.8	33%	0.326	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	142.3	-179.5	-75.8	-30.5	0	0	0	109.8	I240 C260 E261 E263	I240-N242 WeakPolarHBondContact CG2-OD1 3.39Å; N242-C260 WeakPolarHBondContact O-CA 3.41Å; N242-E261 PolarHBondContact N-O 2.75Å; N242-E261 PolarHBondContact O-N 2.69Å; N242-E263 PolarHBondContact ND2-OE2 3.02Å
243	I	82.4	Confident	63.1	Low	34 Å²	34	72.2 Å²	72.2	17%	0.174	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	123.3	167.9	-69.6	163	0	0	0	108.2	M258 V259 W274 C302 A319 A321	I243-M258 HydrophobicContact CG2-CB 4.41Å; I243-M258 HydrophobicContact CG2-SD 4.12Å; I243-V259 WeakPolarHBondContact CA-O 3.24Å; I243-W274 HydrophobicContact CD1-CH2 4.24Å; I243-W274 HydrophobicContact CD1-CZ3 3.88Å; I243-W274 HydrophobicContact CG1-CH2 3.96Å; I243-W274 HydrophobicContact CG1-CZ3 4.13Å; I243-W274 HydrophobicContact CG2-CH2 3.97Å; I243-W274 HydrophobicContact CG2-CZ3 4.33Å; I243-C302 HydrophobicContact CD1-CB 3.86Å; I243-C302 HydrophobicContact CG1-CB 3.97Å; I243-A319 HydrophobicContact CD1-CB 3.75Å; I243-A319 WeakPolarHBondContact CD1-O 3.49Å; I243-A319 HydrophobicContact CG1-CB 3.72Å; I243-A321 HydrophobicContact CB-CB 4.04Å; I243-A321 HydrophobicContact CD1-CB 3.88Å; I243-A321 HydrophobicContact CG2-CB 3.64Å
244	R	84.2	Confident	65.4	Low	146 Å²	146	78 Å²	78	55%	0.551	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.7	124.9	-179.1	-179	-179	179.8	174.1	2.7	110.4	I246 M258 V259 E261	R244-I246 PolarHBondContact O-N 2.93Å; R244-M258 CarbonylContact O-C 3.56Å; R244-M258 WeakPolarHBondContact O-CA 2.96Å; R244-V259 HydrophobicContact CB-CG1 3.97Å; R244-V259 PolarHBondContact N-O 3.33Å; R244-V259 PolarHBondContact O-N 2.8Å; R244-E261 WeakPolarHBondContact CD-OE2 3.41Å; R244-E261 IonicContact NH1-OE2 3.55Å
245	P	78.2	Confident	67.9	Low	73 Å²	73	75.9 Å²	75.9	47%	0.474	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	126.6	170.9	29	-33.2	0	0	0	110	Y256	P245-Y256 WeakPolarHBondContact CB-OH 3.49Å
246	I	83.3	Confident	70.3	Confident	96 Å²	96	73.1 Å²	73.1	49%	0.492	40%	0.403	S	S	.	.	S	Bend	trans	-84.5	-35	167.4	-69.3	175	0	0	0	109.2	R244 E257 V259	R244-I246 PolarHBondContact O-N 2.93Å; I246-E257 WeakPolarHBondContact CA-O 3.15Å; I246-E257 HydrophobicContact CB-CB 4.3Å; I246-E257 HydrophobicContact CB-CG 4.4Å; I246-E257 WeakPolarHBondContact CB-O 3.46Å; I246-E257 HydrophobicContact CD1-CG 4.23Å; I246-E257 HydrophobicContact CG2-CB 4.48Å; I246-E257 PolarHBondContact N-O 2.88Å; I246-V259 HydrophobicContact CD1-CB 3.82Å; I246-V259 HydrophobicContact CD1-CG1 3.9Å; I246-V259 HydrophobicContact CG1-CB 4.33Å; I246-V259 HydrophobicContact CG1-CG1 3.95Å
247	T	79.6	Confident	72.7	Confident	39 Å²	39	70.3 Å²	70.3	24%	0.239	37%	0.372	C	S	.	.	S	Bend	trans	-94.3	117.3	173.8	-51.5	0	0	0	0	110	Y256 E257	T247-Y256 HydrophobicContact CG2-CD2 3.68Å; T247-Y256 HydrophobicContact CG2-CE2 4.07Å; T247-Y256 WeakPolarHBondContact O-CE2 3.4Å; T247-Y256 PolarHBondContact O-OH 2.9Å; T247-E257 PolarHBondContact N-O 2.98Å; T247-E257 PolarHBondContact OG1-N 3.47Å
248	G	59.9	Low	74.9	Confident	72 Å²	72	65.9 Å²	65.9	74%	0.742	35%	0.351	S	S	*	.	S	Bend	trans	-70.9	-40.4	-178.4	0	0	0	0	0	114.3
249	D	62.3	Low	76.8	Confident	117 Å²	117	60.6 Å²	60.6	63%	0.626	33%	0.327	S	S	*	.	S	Bend	trans	-99.4	126	-176.5	-62.9	-56.1	0	0	0	112.2	I251	D249-I251 HydrophobicContact CB-CD1 3.84Å; D249-I251 HydrophobicContact CB-CG1 3.86Å; D249-I251 PolarHBondContact O-N 3.1Å
250	V	67.5	Low	77.9	Confident	26 Å²	26	58.7 Å²	58.7	16%	0.158	32%	0.318	C	S	.	.			trans	-85.6	87.8	178.3	-169.6	0	0	0	0	110	Y256 L292 L323 L325	V250-Y256 HydrophobicContact CB-CE2 4.47Å; V250-Y256 HydrophobicContact CG2-CE2 3.82Å; V250-L292 HydrophobicContact CG1-CD2 3.55Å; V250-L323 HydrophobicContact CB-CD1 4.35Å; V250-L323 HydrophobicContact CG1-CD1 3.66Å; V250-L323 HydrophobicContact CG1-CD2 4.49Å; V250-L323 HydrophobicContact CG1-CG 3.91Å; V250-L323 HydrophobicContact CG2-CD1 3.66Å; V250-L325 HydrophobicContact CG1-CD2 3.96Å
251	I	64.3	Low	78.7	Confident	83 Å²	83	57.3 Å²	57.3	43%	0.426	31%	0.31	S	S	.	.			trans	-114.6	117.7	-174.4	-52.2	177.2	0	0	0	111.2	D249 R254	D249-I251 HydrophobicContact CB-CD1 3.84Å; D249-I251 HydrophobicContact CB-CG1 3.86Å; D249-I251 PolarHBondContact O-N 3.1Å; I251-R254 HydrophobicContact CB-CB 4.17Å; I251-R254 HydrophobicContact CB-CG 3.86Å; I251-R254 HydrophobicContact CG2-CB 4.42Å; I251-R254 HydrophobicContact CG2-CG 3.66Å; I251-R254 WeakPolarHBondContact O-CB 3.37Å; I251-R254 PolarHBondContact O-N 2.9Å
252	I	68.9	Low	79	Confident	29 Å²	29	57 Å²	57	15%	0.149	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	139.3	173.3	-62.1	-69.7	0	0	0	110.8	R254 L292 Y294 I297 L325 V342	I252-R254 PolarHBondContact O-N 2.96Å; I252-L292 WeakPolarHBondContact CA-O 3.01Å; I252-L292 HydrophobicContact CD1-CD2 4.28Å; I252-L292 HydrophobicContact CD1-CG 4.14Å; I252-Y294 HydrophobicContact CD1-CD1 3.96Å; I252-Y294 HydrophobicContact CD1-CE1 3.92Å; I252-Y294 HydrophobicContact CD1-CG 4.48Å; I252-Y294 HydrophobicContact CG1-CD1 4.39Å; I252-Y294 HydrophobicContact CG1-CE1 3.83Å; I252-Y294 HydrophobicContact CG2-CE2 4.34Å; I252-I297 HydrophobicContact CD1-CD1 4.32Å; I252-L325 HydrophobicContact CD1-CD2 4.05Å; I252-L325 HydrophobicContact CG1-CD1 4.46Å; I252-L325 HydrophobicContact CG1-CD2 3.84Å; I252-V342 HydrophobicContact CB-CB 4.48Å; I252-V342 HydrophobicContact CB-CG2 3.62Å; I252-V342 HydrophobicContact CG1-CG1 4.5Å; I252-V342 HydrophobicContact CG1-CG2 3.97Å; I252-V342 HydrophobicContact CG2-CG2 3.97Å
253	G	68	Low	78.7	Confident	26 Å²	26	59 Å²	59	27%	0.268	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.6	-4.6	-178.1	0	0	0	0	0	114.9	S291 L292	G253-S291 WeakPolarHBondContact CA-OG 3.45Å; G253-S291 PolarHBondContact O-OG 3.35Å; G253-L292 PolarHBondContact N-O 3.38Å
254	R	76.4	Confident	78.5	Confident	167 Å²	167	59.6 Å²	59.6	63%	0.63	32%	0.322	S	S	*	.	S	Bend	trans	-97.6	156.2	169.1	-62.5	-61.2	-173.6	164.9	0.9	110.2	I251 I252 S291 L292	I251-R254 HydrophobicContact CB-CB 4.17Å; I251-R254 HydrophobicContact CB-CG 3.86Å; I251-R254 HydrophobicContact CG2-CB 4.42Å; I251-R254 HydrophobicContact CG2-CG 3.66Å; I251-R254 WeakPolarHBondContact O-CB 3.37Å; I251-R254 PolarHBondContact O-N 2.9Å; I252-R254 PolarHBondContact O-N 2.96Å; R254-S291 WeakPolarHBondContact O-CA 3.49Å; R254-L292 WeakPolarHBondContact O-CB 3.4Å; R254-L292 PolarHBondContact O-N 3.3Å
255	P	84.7	Confident	78.2	Confident	66 Å²	66	56.8 Å²	56.8	43%	0.429	32%	0.322	S	S	.	.			trans	-63.6	142.1	165.8	28.9	-34.7	0	0	0	109.8	L289	P255-L289 CarbonylContact C-O 3.53Å; P255-L289 WeakPolarHBondContact CA-O 3.38Å
256	Y	84.6	Confident	78.2	Confident	17 Å²	17	54.3 Å²	54.3	7%	0.067	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	137.2	173.1	-173.6	-89.2	0	0	0	109	P245 T247 V250 M258 L289 L323	P245-Y256 WeakPolarHBondContact CB-OH 3.49Å; T247-Y256 HydrophobicContact CG2-CD2 3.68Å; T247-Y256 HydrophobicContact CG2-CE2 4.07Å; T247-Y256 WeakPolarHBondContact O-CE2 3.4Å; T247-Y256 PolarHBondContact O-OH 2.9Å; V250-Y256 HydrophobicContact CB-CE2 4.47Å; V250-Y256 HydrophobicContact CG2-CE2 3.82Å; Y256-M258 HydrophobicContact CD1-CE 4.33Å; Y256-M258 HydrophobicContact CE1-CB 4.22Å; Y256-M258 HydrophobicContact CE1-CE 4.01Å; Y256-M258 HydrophobicContact CE1-CG 4.37Å; Y256-L289 PolarHBondContact N-O 3.03Å; Y256-L289 PolarHBondContact O-N 2.97Å; Y256-L323 HydrophobicContact CD1-CD1 4.06Å; Y256-L323 HydrophobicContact CD1-CD2 4.09Å; Y256-L323 HydrophobicContact CD2-CD1 4.49Å; Y256-L323 HydrophobicContact CE1-CD1 3.49Å; Y256-L323 VanDerWaalsContact CE1-CD1 3.49Å; Y256-L323 HydrophobicContact CE1-CD2 4.24Å; Y256-L323 HydrophobicContact CE2-CD1 3.98Å; Y256-L323 VanDerWaalsContact CZ-CD1 3.45Å
257	E	90.1	Very high	78.1	Confident	48 Å²	48	54.8 Å²	54.8	22%	0.224	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	133.3	-174.1	-165.9	163.4	176.8	0	0	111	I246 T247 S286 L287 R288	I246-E257 WeakPolarHBondContact CA-O 3.15Å; I246-E257 HydrophobicContact CB-CB 4.3Å; I246-E257 HydrophobicContact CB-CG 4.4Å; I246-E257 WeakPolarHBondContact CB-O 3.46Å; I246-E257 HydrophobicContact CD1-CG 4.23Å; I246-E257 HydrophobicContact CG2-CB 4.48Å; I246-E257 PolarHBondContact N-O 2.88Å; T247-E257 PolarHBondContact N-O 2.98Å; T247-E257 PolarHBondContact OG1-N 3.47Å; E257-S286 WeakPolarHBondContact CG-OG 3.35Å; E257-S286 PolarHBondContact OE1-OG 3.41Å; E257-L287 WeakPolarHBondContact CA-O 3.43Å; E257-R288 HydrophobicContact CB-CG 4.32Å; E257-R288 HydrophobicContact CG-CB 3.98Å; E257-R288 HydrophobicContact CG-CG 4.13Å; E257-R288 VanDerWaalsContact OE2-CD 3.26Å; E257-R288 WeakPolarHBondContact OE2-CD 3.28Å; E257-R288 IonicContact OE2-NE 2.7Å; E257-R288 PolarHBondContact OE2-NE 3.38Å
258	M	89.4	Confident	78.3	Confident	5 Å²	5	54.4 Å²	54.4	3%	0.025	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	140.7	176.4	57.2	176.8	124.9	0	0	109.8	I243 R244 Y256 W274 L287 Y300 L323	I243-M258 HydrophobicContact CG2-CB 4.41Å; I243-M258 HydrophobicContact CG2-SD 4.12Å; R244-M258 CarbonylContact O-C 3.56Å; R244-M258 WeakPolarHBondContact O-CA 2.96Å; Y256-M258 HydrophobicContact CD1-CE 4.33Å; Y256-M258 HydrophobicContact CE1-CB 4.22Å; Y256-M258 HydrophobicContact CE1-CE 4.01Å; Y256-M258 HydrophobicContact CE1-CG 4.37Å; M258-W274 HydrophobicContact CB-CH2 4.48Å; M258-W274 HydrophobicContact CG-CH2 3.73Å; M258-W274 HydrophobicContact CG-CZ2 4.42Å; M258-W274 HydrophobicContact CG-CZ3 4.13Å; M258-W274 HydrophobicContact SD-CH2 3.87Å; M258-W274 HydrophobicContact SD-CZ3 3.71Å; M258-L287 HydrophobicContact CE-CD2 3.87Å; M258-L287 HydrophobicContact CG-CB 4.14Å; M258-L287 HydrophobicContact CG-CD2 4.39Å; M258-L287 HydrophobicContact CG-CG 4.44Å; M258-L287 PolarHBondContact N-O 3.3Å; M258-L287 VanDerWaalsContact N-O 3.11Å; M258-L287 PolarHBondContact O-N 2.85Å; M258-L287 HydrophobicContact SD-CD2 4.39Å; M258-Y300 HydrophobicContact CE-CD1 4.22Å; M258-Y300 HydrophobicContact CE-CD2 3.77Å; M258-Y300 HydrophobicContact CE-CE1 4.43Å; M258-Y300 HydrophobicContact CE-CE2 3.99Å; M258-Y300 HydrophobicContact CE-CG 3.89Å; M258-L323 HydrophobicContact CE-CD2 4.32Å
259	V	92.4	Very high	79.6	Confident	19 Å²	19	56.9 Å²	56.9	12%	0.115	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	141.9	-178.9	62.6	0	0	0	0	110.6	I243 R244 I246 E261 A285	I243-V259 WeakPolarHBondContact CA-O 3.24Å; R244-V259 HydrophobicContact CB-CG1 3.97Å; R244-V259 PolarHBondContact N-O 3.33Å; R244-V259 PolarHBondContact O-N 2.8Å; I246-V259 HydrophobicContact CD1-CB 3.82Å; I246-V259 HydrophobicContact CD1-CG1 3.9Å; I246-V259 HydrophobicContact CG1-CB 4.33Å; I246-V259 HydrophobicContact CG1-CG1 3.95Å; V259-E261 HydrophobicContact CB-CG 4.4Å; V259-E261 HydrophobicContact CG1-CG 3.82Å; V259-E261 HydrophobicContact CG2-CG 3.84Å; V259-A285 HydrophobicContact CG2-CB 4.48Å
260	C	89.1	Confident	80.9	Confident	2 Å²	2	53.6 Å²	53.6	1%	0.014	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	113.6	169.7	-176.1	0	0	0	0	108.1	V241 N242 F272 W274 A285 C302	V241-C260 VanDerWaalsContact CG1-SG 3.51Å; N242-C260 WeakPolarHBondContact O-CA 3.41Å; C260-F272 HydrophobicContact CB-CD1 4.06Å; C260-F272 HydrophobicContact CB-CE1 4.12Å; C260-F272 WeakPolarHBondContact O-CE1 3.25Å; C260-W274 HydrophobicContact CB-CH2 4.09Å; C260-W274 HydrophobicContact CB-CZ2 3.53Å; C260-A285 PolarHBondContact N-O 3.04Å; C260-C302 HydrophobicContact CB-CB 3.69Å; C260-C302 WeakPolarHBondContact CB-SG 3.24Å; C260-C302 WeakPolarHBondContact SG-CB 3.41Å; C260-C302 CovalentContact SG-SG 2.02Å; C260-C302 PolarHBondContact SG-SG 2.88Å
261	E	88.4	Confident	82	Confident	63 Å²	63	55.2 Å²	55.2	29%	0.294	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	145.8	-176.3	-61.4	-178.5	134	0	0	108.3	N242 R244 V259	N242-E261 PolarHBondContact N-O 2.75Å; N242-E261 PolarHBondContact O-N 2.69Å; R244-E261 WeakPolarHBondContact CD-OE2 3.41Å; R244-E261 IonicContact NH1-OE2 3.55Å; V259-E261 HydrophobicContact CB-CG 4.4Å; V259-E261 HydrophobicContact CG1-CG 3.82Å; V259-E261 HydrophobicContact CG2-CG 3.84Å
262	V	84	Confident	83.4	Confident	9 Å²	9	52.6 Å²	52.6	6%	0.055	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	117.3	173.6	-172.8	0	0	0	0	106.6	H239 I240 V241 P264 P265 I270 F272 A304	H239-V262 HydrophobicContact CB-CG1 3.72Å; I240-V262 CarbonylContact O-C 3.58Å; I240-V262 WeakPolarHBondContact O-CA 3.47Å; V241-V262 HydrophobicContact CG2-CG2 4.33Å; V262-P264 CarbonylContact O-C 3.59Å; V262-P265 VanDerWaalsContact O-CA 3.29Å; V262-P265 WeakPolarHBondContact O-CA 3.22Å; V262-P265 WeakPolarHBondContact O-CD 3.4Å; V262-I270 HydrophobicContact CB-CD1 4.11Å; V262-I270 HydrophobicContact CG2-CD1 3.87Å; V262-I270 HydrophobicContact CG2-CG2 4.28Å; V262-F272 HydrophobicContact CG2-CE1 4.15Å; V262-F272 HydrophobicContact CG2-CZ 4.31Å; V262-A304 HydrophobicContact CG2-CB 3.78Å
263	E	75.6	Confident	84.5	Confident	102 Å²	102	51.9 Å²	51.9	48%	0.477	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	118.1	-172.9	-70	-168.6	113.7	0	0	110.7	I240 N242	I240-E263 WeakPolarHBondContact CB-O 3.47Å; I240-E263 PolarHBondContact N-O 2.95Å; I240-E263 PolarHBondContact O-N 2.77Å; N242-E263 PolarHBondContact ND2-OE2 3.02Å
264	P	77	Confident	85.7	Confident	46 Å²	46	50.7 Å²	50.7	30%	0.299	27%	0.269	S	S	.	.	S	Bend	cis	-68.6	160.5	-17.7	34.7	-37.3	0	0	0	111.3	M237 H239 V262	M237-P264 HydrophobicContact CB-CG 3.49Å; M237-P264 VanDerWaalsContact CB-CG 3.49Å; M237-P264 HydrophobicContact CE-CB 3.79Å; M237-P264 HydrophobicContact CE-CG 3.72Å; M237-P264 HydrophobicContact CG-CG 3.55Å; M237-P264 HydrophobicContact SD-CB 3.75Å; M237-P264 HydrophobicContact SD-CG 3.33Å; M237-P264 WeakPolarHBondContact SD-CG 3.46Å; H239-P264 PolarHBondContact CD2-O 2.83Å; V262-P264 CarbonylContact O-C 3.59Å
265	P	78.7	Confident	86.4	Confident	88 Å²	88	46 Å²	46	57%	0.571	25%	0.252	S	S	*	.	P	Polyproline II helix	trans	-78.4	147.8	-177.3	29.7	-34.9	0	0	0	112.7	V262	V262-P265 VanDerWaalsContact O-CA 3.29Å; V262-P265 WeakPolarHBondContact O-CA 3.22Å; V262-P265 WeakPolarHBondContact O-CD 3.4Å
266	P	78	Confident	86.5	Confident	20 Å²	20	43.6 Å²	43.6	13%	0.13	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-70.3	162.9	173.3	-5.4	20.8	0	0	0	112.2	H239 I270 W306	H239-P266 VanDerWaalsContact CD2-CG 3.45Å; H239-P266 WeakPolarHBondContact CD2-CG 3.48Å; H239-P266 VanDerWaalsContact NE2-CA 3.3Å; H239-P266 WeakPolarHBondContact NE2-CA 3.49Å; H239-P266 WeakPolarHBondContact NE2-CB 3.13Å; H239-P266 WeakPolarHBondContact NE2-CG 3.1Å; P266-I270 HydrophobicContact CG-CD1 4.24Å; P266-I270 HydrophobicContact CG-CG1 4.02Å; P266-W306 HydrophobicContact CB-CG 4.22Å; P266-W306 HydrophobicContact CG-CB 4.41Å; P266-W306 HydrophobicContact CG-CD2 3.9Å; P266-W306 HydrophobicContact CG-CG 3.76Å
267	E	81.7	Confident	86.4	Confident	107 Å²	107	48.4 Å²	48.4	50%	0.5	26%	0.262	S	S	.	.	S	Bend	trans	-75.5	-28	165.7	-70.4	-168.5	170.4	0	0	112.7	Q234 R309	Q234-E267 VanDerWaalsContact CD-OE1 3.26Å; Q234-E267 WeakPolarHBondContact CG-OE1 3.13Å; Q234-E267 PolarHBondContact NE2-OE1 2.02Å; Q234-E267 PolarHBondContact NE2-OE2 3.48Å; E267-R309 IonicContact OE2-CZ 3.39Å; E267-R309 IonicContact OE2-NH2 2.8Å; E267-R309 PolarHBondContact OE2-NH2 3.36Å
268	E	83.1	Confident	85.8	Confident	31 Å²	31	51 Å²	51	15%	0.145	29%	0.291	C	S	.	.	S	Bend	trans	-81.3	146.7	-178.4	-59.4	87.6	173.6	0	0	111.7	I270 T307 P308 R309	E268-I270 PolarHBondContact O-N 2.88Å; E268-I270 VanDerWaalsContact O-N 3.1Å; E268-T307 WeakPolarHBondContact CG-O 3.33Å; E268-P308 WeakPolarHBondContact OE1-CA 3.4Å; E268-R309 HydrophobicContact CG-CB 4.45Å; E268-R309 WeakPolarHBondContact OE1-CB 3.43Å; E268-R309 PolarHBondContact OE1-N 2.87Å
269	P	87.6	Confident	85.5	Confident	124 Å²	124	58 Å²	58	81%	0.805	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-60.3	118.5	-177.3	24	-34.3	0	0	0	111.5
270	I	89.7	Confident	85.5	Confident	48 Å²	48	60.1 Å²	60.1	25%	0.246	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-76.5	131.4	176.4	-34	175.6	0	0	0	109.2	V262 P266 E268 F272 A304	V262-I270 HydrophobicContact CB-CD1 4.11Å; V262-I270 HydrophobicContact CG2-CD1 3.87Å; V262-I270 HydrophobicContact CG2-CG2 4.28Å; P266-I270 HydrophobicContact CG-CD1 4.24Å; P266-I270 HydrophobicContact CG-CG1 4.02Å; E268-I270 PolarHBondContact O-N 2.88Å; E268-I270 VanDerWaalsContact O-N 3.1Å; I270-F272 HydrophobicContact CB-CD2 4.4Å; I270-F272 HydrophobicContact CB-CE2 3.71Å; I270-F272 HydrophobicContact CB-CZ 3.95Å; I270-F272 HydrophobicContact CD1-CE2 4.28Å; I270-F272 HydrophobicContact CD1-CZ 3.88Å; I270-F272 HydrophobicContact CG2-CD2 4.33Å; I270-F272 HydrophobicContact CG2-CE1 4.08Å; I270-F272 HydrophobicContact CG2-CE2 3.82Å; I270-F272 HydrophobicContact CG2-CZ 3.69Å; I270-A304 HydrophobicContact CG2-CB 3.95Å
271	S	91.3	Very high	85.6	Confident	59 Å²	59	63.3 Å²	63.3	41%	0.413	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	137.6	164.9	67.9	0	0	0	0	110.1	A304 E305	S271-A304 CarbonylContact O-C 3.59Å; S271-A304 WeakPolarHBondContact O-CA 3.04Å; S271-E305 PolarHBondContact N-O 3.06Å; S271-E305 PolarHBondContact O-N 2.97Å; S271-E305 PolarHBondContact OG-O 2.82Å
272	F	93.2	Very high	85.8	Confident	29 Å²	29	62.9 Å²	62.9	13%	0.127	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	140.5	-177.9	-66.6	-86.1	0	0	0	110.5	C260 V262 I270 R283 A285 R303 A304	C260-F272 HydrophobicContact CB-CD1 4.06Å; C260-F272 HydrophobicContact CB-CE1 4.12Å; C260-F272 WeakPolarHBondContact O-CE1 3.25Å; V262-F272 HydrophobicContact CG2-CE1 4.15Å; V262-F272 HydrophobicContact CG2-CZ 4.31Å; I270-F272 HydrophobicContact CB-CD2 4.4Å; I270-F272 HydrophobicContact CB-CE2 3.71Å; I270-F272 HydrophobicContact CB-CZ 3.95Å; I270-F272 HydrophobicContact CD1-CE2 4.28Å; I270-F272 HydrophobicContact CD1-CZ 3.88Å; I270-F272 HydrophobicContact CG2-CD2 4.33Å; I270-F272 HydrophobicContact CG2-CE1 4.08Å; I270-F272 HydrophobicContact CG2-CE2 3.82Å; I270-F272 HydrophobicContact CG2-CZ 3.69Å; F272-R283 CarbonylContact O-C 3.52Å; F272-R283 VanDerWaalsContact O-CA 3.32Å; F272-R283 WeakPolarHBondContact O-CA 3.49Å; F272-A285 HydrophobicContact CD2-CB 3.84Å; F272-A285 HydrophobicContact CE1-CB 4.41Å; F272-A285 HydrophobicContact CE2-CB 3.67Å; F272-A285 HydrophobicContact CG-CB 4.28Å; F272-A285 HydrophobicContact CZ-CB 3.96Å; F272-R303 WeakPolarHBondContact CA-O 3.45Å; F272-A304 HydrophobicContact CD1-CB 4.1Å; F272-A304 HydrophobicContact CE1-CB 3.98Å
273	V	92.6	Very high	86.3	Confident	14 Å²	14	70.6 Å²	70.6	9%	0.085	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	118.4	171.7	-170.6	0	0	0	0	109.3	Y275 V280 R303	V273-Y275 HydrophobicContact CB-CE2 3.79Å; V273-Y275 HydrophobicContact CG1-CD2 4.16Å; V273-Y275 HydrophobicContact CG1-CE1 4.27Å; V273-Y275 HydrophobicContact CG1-CE2 3.51Å; V273-V280 HydrophobicContact CG1-CB 4.34Å; V273-V280 HydrophobicContact CG1-CG1 3.72Å; V273-V280 HydrophobicContact CG1-CG2 3.73Å; V273-R303 PolarHBondContact N-O 3.11Å; V273-R303 PolarHBondContact O-N 2.03Å
274	W	92.5	Very high	87.1	Confident	0 Å²	0	72 Å²	72	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	127.4	174.3	-71.1	89.4	0	0	0	110.4	I243 M258 C260 V280 V281 H282 E284 A285 L287 Y300 I301 C302	I243-W274 HydrophobicContact CD1-CH2 4.24Å; I243-W274 HydrophobicContact CD1-CZ3 3.88Å; I243-W274 HydrophobicContact CG1-CH2 3.96Å; I243-W274 HydrophobicContact CG1-CZ3 4.13Å; I243-W274 HydrophobicContact CG2-CH2 3.97Å; I243-W274 HydrophobicContact CG2-CZ3 4.33Å; M258-W274 HydrophobicContact CB-CH2 4.48Å; M258-W274 HydrophobicContact CG-CH2 3.73Å; M258-W274 HydrophobicContact CG-CZ2 4.42Å; M258-W274 HydrophobicContact CG-CZ3 4.13Å; M258-W274 HydrophobicContact SD-CH2 3.87Å; M258-W274 HydrophobicContact SD-CZ3 3.71Å; C260-W274 HydrophobicContact CB-CH2 4.09Å; C260-W274 HydrophobicContact CB-CZ2 3.53Å; W274-V280 CarbonylContact O-C 3.54Å; W274-V280 WeakPolarHBondContact O-CA 3.39Å; W274-V281 HydrophobicContact CB-CG2 3.89Å; W274-V281 WeakPolarHBondContact O-CG2 3.31Å; W274-V281 PolarHBondContact O-N 3.37Å; W274-H282 HydrophobicContact CB-CB 4.04Å; W274-H282 HydrophobicContact CG-CB 4.26Å; W274-H282 PolarHBondContact N-O 2.84Å; W274-E284 VanDerWaalsContact CD1-O 3.24Å; W274-E284 PolarHBondContact NE1-O 3.33Å; W274-A285 WeakPolarHBondContact CZ2-O 3.34Å; W274-L287 HydrophobicContact CB-CD2 4.42Å; W274-L287 HydrophobicContact CD2-CB 3.73Å; W274-L287 HydrophobicContact CD2-CD2 3.81Å; W274-L287 HydrophobicContact CD2-CG 4.39Å; W274-L287 HydrophobicContact CE3-CB 4.2Å; W274-L287 HydrophobicContact CE3-CD2 3.63Å; W274-L287 HydrophobicContact CG-CB 4.11Å; W274-L287 HydrophobicContact CG-CD2 4.2Å; W274-L287 HydrophobicContact CH2-CB 4.22Å; W274-L287 HydrophobicContact CZ2-CB 3.75Å; W274-L287 HydrophobicContact CZ3-CB 4.43Å; W274-L287 HydrophobicContact CZ3-CD2 4.08Å; W274-Y300 HydrophobicContact CE3-CD1 4.48Å; W274-I301 CarbonylContact C-O 3.58Å; W274-I301 WeakPolarHBondContact CA-O 3.42Å; W274-C302 HydrophobicContact CD2-CB 4.24Å; W274-C302 HydrophobicContact CE3-CB 4.09Å; W274-C302 HydrophobicContact CH2-CB 4.32Å; W274-C302 HydrophobicContact CZ2-CB 4.45Å; W274-C302 HydrophobicContact CZ3-CB 4.13Å
275	Y	90.1	Very high	87.7	Confident	70 Å²	70	71.4 Å²	71.4	28%	0.275	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	140.6	174.2	-57.3	-100.7	0	0	0	110.5	V273 K279 V280 Y300 I301 R303	V273-Y275 HydrophobicContact CB-CE2 3.79Å; V273-Y275 HydrophobicContact CG1-CD2 4.16Å; V273-Y275 HydrophobicContact CG1-CE1 4.27Å; V273-Y275 HydrophobicContact CG1-CE2 3.51Å; Y275-K279 CarbonylContact C-O 3.53Å; Y275-K279 VanDerWaalsContact CA-O 3.27Å; Y275-K279 WeakPolarHBondContact CA-O 3.27Å; Y275-V280 HydrophobicContact CD1-CG2 3.94Å; Y275-V280 HydrophobicContact CE1-CG2 3.62Å; Y275-Y300 WeakPolarHBondContact O-CA 3.42Å; Y275-I301 PolarHBondContact N-O 2.79Å; Y275-I301 PolarHBondContact O-N 2.76Å; Y275-R303 HydrophobicContact CE2-CB 3.95Å
276	H	88.1	Confident	88.4	Confident	14 Å²	14	68.7 Å²	68.7	7%	0.065	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	135.9	170.7	174.6	71.2	0	0	0	108.4	A278 K279 V281 R295 I297 M299 Y300	H276-A278 PolarHBondContact O-N 2.84Å; H276-K279 PolarHBondContact N-O 2.92Å; H276-K279 PolarHBondContact O-N 2.84Å; H276-V281 HydrophobicContact CB-CG1 3.92Å; H276-V281 HydrophobicContact CB-CG2 4.05Å; H276-R295 PolarHBondContact NE2-O 2.76Å; H276-I297 PolarHBondContact CE1-O 3.47Å; H276-M299 PolarHBondContact ND1-O 2.92Å; H276-Y300 HydrophobicContact CB-CD1 3.71Å; H276-Y300 HydrophobicContact CB-CE1 3.54Å; H276-Y300 HydrophobicContact CB-CG 4.41Å; H276-Y300 AromaticContact CG-CE1 3.71Å; H276-Y300 AromaticContact CG-CZ 3.75Å; H276-Y300 AromaticContact ND1-CD2 3.92Å; H276-Y300 AromaticContact ND1-CE1 3.92Å; H276-Y300 AromaticContact ND1-CE2 3.63Å; H276-Y300 AromaticContact ND1-CZ 3.62Å
277	N	82.3	Confident	89.1	Confident	118 Å²	118	68 Å²	68	63%	0.631	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.9	46.7	-174.5	-79.9	-52.8	0	0	0	113	K279	N277-K279 PolarHBondContact O-N 2.8Å; N277-K279 VanDerWaalsContact O-N 3.11Å
278	A	76.3	Confident	89.6	Confident	103 Å²	103	70.5 Å²	70.5	85%	0.851	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.7	15.1	-175.8	0	0	0	0	0	116.6	H276	H276-A278 PolarHBondContact O-N 2.84Å
279	K	84.8	Confident	89.8	Confident	152 Å²	152	70.2 Å²	70.2	66%	0.661	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.5	143.6	178.4	-66.8	169.5	-173.9	170.1	0	110.8	Y275 H276 N277 V281	Y275-K279 CarbonylContact C-O 3.53Å; Y275-K279 VanDerWaalsContact CA-O 3.27Å; Y275-K279 WeakPolarHBondContact CA-O 3.27Å; H276-K279 PolarHBondContact N-O 2.92Å; H276-K279 PolarHBondContact O-N 2.84Å; N277-K279 PolarHBondContact O-N 2.8Å; N277-K279 VanDerWaalsContact O-N 3.11Å; K279-V281 PolarHBondContact O-N 2.89Å
280	V	90.9	Very high	89.7	Confident	63 Å²	63	70.1 Å²	70.1	38%	0.382	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	120.4	170.2	177.6	0	0	0	0	108.8	V273 W274 Y275 R283	V273-V280 HydrophobicContact CG1-CB 4.34Å; V273-V280 HydrophobicContact CG1-CG1 3.72Å; V273-V280 HydrophobicContact CG1-CG2 3.73Å; W274-V280 CarbonylContact O-C 3.54Å; W274-V280 WeakPolarHBondContact O-CA 3.39Å; Y275-V280 HydrophobicContact CD1-CG2 3.94Å; Y275-V280 HydrophobicContact CE1-CG2 3.62Å; V280-R283 HydrophobicContact CG1-CG 4.3Å
281	V	92.1	Very high	89.5	Confident	70 Å²	70	71 Å²	71	42%	0.424	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	-29.9	179	-69.6	0	0	0	0	112.9	W274 H276 K279 Y300	W274-V281 HydrophobicContact CB-CG2 3.89Å; W274-V281 WeakPolarHBondContact O-CG2 3.31Å; W274-V281 PolarHBondContact O-N 3.37Å; H276-V281 HydrophobicContact CB-CG1 3.92Å; H276-V281 HydrophobicContact CB-CG2 4.05Å; K279-V281 PolarHBondContact O-N 2.89Å; V281-Y300 HydrophobicContact CG2-CD1 4.43Å; V281-Y300 HydrophobicContact CG2-CE1 4.19Å
282	H	92.7	Very high	88.9	Confident	54 Å²	54	68.3 Å²	68.3	25%	0.25	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	167.3	179.6	-160.9	52.6	0	0	0	113	W274 E284 S286 L287	W274-H282 HydrophobicContact CB-CB 4.04Å; W274-H282 HydrophobicContact CG-CB 4.26Å; W274-H282 PolarHBondContact N-O 2.84Å; H282-E284 WeakPolarHBondContact NE2-CB 3.26Å; H282-S286 PolarHBondContact CD2-O 3.04Å; H282-S286 PolarHBondContact NE2-O 3.08Å; H282-L287 HydrophobicContact CB-CD1 3.76Å
283	R	93.5	Very high	88.3	Confident	170 Å²	170	69 Å²	69	64%	0.642	37%	0.365	S	S	*	.			trans	-138.3	10.1	-170	-67.3	-175.1	175.2	-83.2	1.9	115.2	F272 V280	F272-R283 CarbonylContact O-C 3.52Å; F272-R283 VanDerWaalsContact O-CA 3.32Å; F272-R283 WeakPolarHBondContact O-CA 3.49Å; V280-R283 HydrophobicContact CG1-CG 4.3Å
284	E	92.6	Very high	87.1	Confident	133 Å²	133	72.7 Å²	72.7	62%	0.621	38%	0.378	S	S	*	.	S	Bend	trans	-117.3	168	175.5	-50.6	178.3	-162.6	0	0	109.8	W274 H282 S286	W274-E284 VanDerWaalsContact CD1-O 3.24Å; W274-E284 PolarHBondContact NE1-O 3.33Å; H282-E284 WeakPolarHBondContact NE2-CB 3.26Å; E284-S286 PolarHBondContact O-N 2.56Å
285	A	91	Very high	86.5	Confident	33 Å²	33	83 Å²	83	27%	0.273	42%	0.417	S	S	.	.	S	Bend	trans	-63.7	-39.7	-176.4	0	0	0	0	0	113	V259 C260 F272 W274	V259-A285 HydrophobicContact CG2-CB 4.48Å; C260-A285 PolarHBondContact N-O 3.04Å; F272-A285 HydrophobicContact CD2-CB 3.84Å; F272-A285 HydrophobicContact CE1-CB 4.41Å; F272-A285 HydrophobicContact CE2-CB 3.67Å; F272-A285 HydrophobicContact CG-CB 4.28Å; F272-A285 HydrophobicContact CZ-CB 3.96Å; W274-A285 WeakPolarHBondContact CZ2-O 3.34Å
286	S	92.6	Very high	86.3	Confident	30 Å²	30	81.5 Å²	81.5	21%	0.21	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	121	174	-171.2	0	0	0	0	110.8	E257 H282 E284	E257-S286 WeakPolarHBondContact CG-OG 3.35Å; E257-S286 PolarHBondContact OE1-OG 3.41Å; H282-S286 PolarHBondContact CD2-O 3.04Å; H282-S286 PolarHBondContact NE2-O 3.08Å; E284-S286 PolarHBondContact O-N 2.56Å
287	L	91.8	Very high	85.9	Confident	7 Å²	7	83.3 Å²	83.3	4%	0.037	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	107.1	167.7	168.6	59	0	0	0	109.2	E257 M258 W274 H282 L289 Y300	E257-L287 WeakPolarHBondContact CA-O 3.43Å; M258-L287 HydrophobicContact CE-CD2 3.87Å; M258-L287 HydrophobicContact CG-CB 4.14Å; M258-L287 HydrophobicContact CG-CD2 4.39Å; M258-L287 HydrophobicContact CG-CG 4.44Å; M258-L287 PolarHBondContact N-O 3.3Å; M258-L287 VanDerWaalsContact N-O 3.11Å; M258-L287 PolarHBondContact O-N 2.85Å; M258-L287 HydrophobicContact SD-CD2 4.39Å; W274-L287 HydrophobicContact CB-CD2 4.42Å; W274-L287 HydrophobicContact CD2-CB 3.73Å; W274-L287 HydrophobicContact CD2-CD2 3.81Å; W274-L287 HydrophobicContact CD2-CG 4.39Å; W274-L287 HydrophobicContact CE3-CB 4.2Å; W274-L287 HydrophobicContact CE3-CD2 3.63Å; W274-L287 HydrophobicContact CG-CB 4.11Å; W274-L287 HydrophobicContact CG-CD2 4.2Å; W274-L287 HydrophobicContact CH2-CB 4.22Å; W274-L287 HydrophobicContact CZ2-CB 3.75Å; W274-L287 HydrophobicContact CZ3-CB 4.43Å; W274-L287 HydrophobicContact CZ3-CD2 4.08Å; H282-L287 HydrophobicContact CB-CD1 3.76Å; L287-L289 HydrophobicContact CD1-CD2 4.16Å; L287-Y300 HydrophobicContact CD2-CD1 3.43Å; L287-Y300 VanDerWaalsContact CD2-CD1 3.43Å; L287-Y300 HydrophobicContact CD2-CE1 3.51Å; L287-Y300 HydrophobicContact CD2-CG 4.34Å
288	R	91.9	Very high	85.5	Confident	159 Å²	159	78.5 Å²	78.5	60%	0.6	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.7	108.3	178.5	-171.1	177	-178.5	-177.8	1.4	112.3	E257	E257-R288 HydrophobicContact CB-CG 4.32Å; E257-R288 HydrophobicContact CG-CB 3.98Å; E257-R288 HydrophobicContact CG-CG 4.13Å; E257-R288 VanDerWaalsContact OE2-CD 3.26Å; E257-R288 WeakPolarHBondContact OE2-CD 3.28Å; E257-R288 IonicContact OE2-NE 2.7Å; E257-R288 PolarHBondContact OE2-NE 3.38Å
289	L	88.5	Confident	85.5	Confident	25 Å²	25	78.9 Å²	78.9	13%	0.131	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	122.1	169.7	-56.3	174.2	0	0	0	108.2	P255 Y256 L287 L292 D296 L323	P255-L289 CarbonylContact C-O 3.53Å; P255-L289 WeakPolarHBondContact CA-O 3.38Å; Y256-L289 PolarHBondContact N-O 3.03Å; Y256-L289 PolarHBondContact O-N 2.97Å; L287-L289 HydrophobicContact CD1-CD2 4.16Å; L289-L292 HydrophobicContact CD1-CD1 3.53Å; L289-D296 HydrophobicContact CD1-CB 4.01Å; L289-L323 HydrophobicContact CD1-CD2 4.29Å
290	T	86.4	Confident	85.6	Confident	121 Å²	121	71.8 Å²	71.8	74%	0.742	36%	0.356	S	S	*	.	S	Bend	trans	-76.3	-26.6	-174.1	51.5	0	0	0	0	113.6
291	S	84.9	Confident	85.4	Confident	68 Å²	68	71.4 Å²	71.4	48%	0.476	35%	0.352	S	S	.	.	S	Bend	trans	-155.9	107.8	173.3	-175.3	0	0	0	0	107.7	G253 R254	G253-S291 WeakPolarHBondContact CA-OG 3.45Å; G253-S291 PolarHBondContact O-OG 3.35Å; R254-S291 WeakPolarHBondContact O-CA 3.49Å
292	L	78.4	Confident	85.1	Confident	2 Å²	2	68.1 Å²	68.1	1%	0.01	33%	0.331	C	S	.	.			trans	-65.8	131	-174.2	-176.5	70.2	0	0	0	111.2	V250 I252 G253 R254 L289 D296 L323	V250-L292 HydrophobicContact CG1-CD2 3.55Å; I252-L292 WeakPolarHBondContact CA-O 3.01Å; I252-L292 HydrophobicContact CD1-CD2 4.28Å; I252-L292 HydrophobicContact CD1-CG 4.14Å; G253-L292 PolarHBondContact N-O 3.38Å; R254-L292 WeakPolarHBondContact O-CB 3.4Å; R254-L292 PolarHBondContact O-N 3.3Å; L289-L292 HydrophobicContact CD1-CD1 3.53Å; L292-D296 HydrophobicContact CD1-CB 3.72Å; L292-L323 HydrophobicContact CD1-CD2 3.62Å
293	S	80.6	Confident	84.9	Confident	43 Å²	43	68.2 Å²	68.2	30%	0.301	33%	0.33	S	S	.	.			trans	-121.1	167.7	177.3	85.2	0	0	0	0	112.4	R295 D296	S293-R295 PolarHBondContact O-N 2.85Å; S293-R295 VanDerWaalsContact O-N 3.07Å; S293-R295 PolarHBondContact OG-N 2.9Å; S293-D296 WeakPolarHBondContact CA-OD2 3.44Å; S293-D296 VanDerWaalsContact CB-OD2 3.23Å; S293-D296 WeakPolarHBondContact CB-OD2 3.31Å; S293-D296 PolarHBondContact N-OD2 3.37Å; S293-D296 WeakPolarHBondContact O-CB 3.4Å; S293-D296 PolarHBondContact O-N 3.13Å; S293-D296 PolarHBondContact OG-OD2 2.55Å
294	Y	68.1	Low	84.7	Confident	92 Å²	92	60.1 Å²	60.1	36%	0.361	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-60.4	-17.2	174.5	-58.1	-67.5	0	0	0	114.2	I252 D296 I297 L325 V342 H422 V424	I252-Y294 HydrophobicContact CD1-CD1 3.96Å; I252-Y294 HydrophobicContact CD1-CE1 3.92Å; I252-Y294 HydrophobicContact CD1-CG 4.48Å; I252-Y294 HydrophobicContact CG1-CD1 4.39Å; I252-Y294 HydrophobicContact CG1-CE1 3.83Å; I252-Y294 HydrophobicContact CG2-CE2 4.34Å; Y294-D296 VanDerWaalsContact C-N 3.29Å; Y294-I297 HydrophobicContact CD1-CD1 3.79Å; Y294-L325 HydrophobicContact CE1-CD1 4.37Å; Y294-V342 WeakPolarHBondContact OH-CG2 3.32Å; Y294-H422 AromaticContact CZ-CD2 3.46Å; Y294-H422 VanDerWaalsContact CZ-CD2 3.46Å; Y294-H422 AromaticContact CZ-CG 3.92Å; Y294-H422 AromaticContact CZ-NE2 3.88Å; Y294-H422 VanDerWaalsContact OH-CB 3.31Å; Y294-H422 WeakPolarHBondContact OH-CB 3.4Å; Y294-H422 PolarHBondContact OH-CD2 2.84Å; Y294-H422 VanDerWaalsContact OH-CG 3.24Å; Y294-V424 HydrophobicContact CE1-CG2 3.76Å
295	R	79.9	Confident	84.5	Confident	217 Å²	217	56.4 Å²	56.4	82%	0.819	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-84.3	-6.8	177.4	-60.1	-176.9	178.6	-138.9	-3.2	113.4	H276 S293	H276-R295 PolarHBondContact NE2-O 2.76Å; S293-R295 PolarHBondContact O-N 2.85Å; S293-R295 VanDerWaalsContact O-N 3.07Å; S293-R295 PolarHBondContact OG-N 2.9Å
296	D	84.9	Confident	84.3	Confident	37 Å²	37	55.2 Å²	55.2	20%	0.198	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-105.6	6.4	178.8	-49.6	-68.8	0	0	0	111.3	L289 L292 S293 Y294 Y300	L289-D296 HydrophobicContact CD1-CB 4.01Å; L292-D296 HydrophobicContact CD1-CB 3.72Å; S293-D296 WeakPolarHBondContact CA-OD2 3.44Å; S293-D296 VanDerWaalsContact CB-OD2 3.23Å; S293-D296 WeakPolarHBondContact CB-OD2 3.31Å; S293-D296 PolarHBondContact N-OD2 3.37Å; S293-D296 WeakPolarHBondContact O-CB 3.4Å; S293-D296 PolarHBondContact O-N 3.13Å; S293-D296 PolarHBondContact OG-OD2 2.55Å; Y294-D296 VanDerWaalsContact C-N 3.29Å; D296-Y300 WeakPolarHBondContact CA-OH 3.48Å; D296-Y300 WeakPolarHBondContact CB-OH 3.37Å; D296-Y300 VanDerWaalsContact O-CE2 3.29Å; D296-Y300 WeakPolarHBondContact O-CE2 3.3Å; D296-Y300 PolarHBondContact O-OH 3.44Å; D296-Y300 VanDerWaalsContact O-OH 3.07Å
297	I	79	Confident	83.8	Confident	53 Å²	53	57.3 Å²	57.3	27%	0.272	28%	0.282	S	S	.	.			trans	-83.2	141.4	176.5	-63.8	175.6	0	0	0	109.6	I252 H276 Y294 L323 L325	I252-I297 HydrophobicContact CD1-CD1 4.32Å; H276-I297 PolarHBondContact CE1-O 3.47Å; Y294-I297 HydrophobicContact CD1-CD1 3.79Å; I297-L323 WeakPolarHBondContact CG2-O 3.26Å; I297-L325 HydrophobicContact CD1-CD1 3.64Å; I297-L325 HydrophobicContact CD1-CD2 4.32Å; I297-L325 HydrophobicContact CD1-CG 3.79Å; I297-L325 HydrophobicContact CG1-CG 4.49Å
298	G	74.5	Confident	83	Confident	17 Å²	17	58.2 Å²	58.2	18%	0.175	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	114.4	-156.6	174.1	0	0	0	0	0	113.8	Y300 L323	G298-Y300 WeakPolarHBondContact O-CD2 3.38Å; G298-L323 PolarHBondContact N-O 2.69Å; G298-L323 PolarHBondContact O-N 2.88Å
299	M	77.2	Confident	82	Confident	111 Å²	111	58.2 Å²	58.2	55%	0.547	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	131.7	-170.2	-166.9	179.4	-64.4	0	0	113	H276	H276-M299 PolarHBondContact ND1-O 2.92Å
300	Y	85.9	Confident	80.8	Confident	2 Å²	2	66.5 Å²	66.5	1%	0.008	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	140.6	165.6	-74.2	-94.6	0	0	0	109.7	M258 W274 Y275 H276 V281 L287 D296 G298 T320 A321 L323	M258-Y300 HydrophobicContact CE-CD1 4.22Å; M258-Y300 HydrophobicContact CE-CD2 3.77Å; M258-Y300 HydrophobicContact CE-CE1 4.43Å; M258-Y300 HydrophobicContact CE-CE2 3.99Å; M258-Y300 HydrophobicContact CE-CG 3.89Å; W274-Y300 HydrophobicContact CE3-CD1 4.48Å; Y275-Y300 WeakPolarHBondContact O-CA 3.42Å; H276-Y300 HydrophobicContact CB-CD1 3.71Å; H276-Y300 HydrophobicContact CB-CE1 3.54Å; H276-Y300 HydrophobicContact CB-CG 4.41Å; H276-Y300 AromaticContact CG-CE1 3.71Å; H276-Y300 AromaticContact CG-CZ 3.75Å; H276-Y300 AromaticContact ND1-CD2 3.92Å; H276-Y300 AromaticContact ND1-CE1 3.92Å; H276-Y300 AromaticContact ND1-CE2 3.63Å; H276-Y300 AromaticContact ND1-CZ 3.62Å; V281-Y300 HydrophobicContact CG2-CD1 4.43Å; V281-Y300 HydrophobicContact CG2-CE1 4.19Å; L287-Y300 HydrophobicContact CD2-CD1 3.43Å; L287-Y300 VanDerWaalsContact CD2-CD1 3.43Å; L287-Y300 HydrophobicContact CD2-CE1 3.51Å; L287-Y300 HydrophobicContact CD2-CG 4.34Å; D296-Y300 WeakPolarHBondContact CA-OH 3.48Å; D296-Y300 WeakPolarHBondContact CB-OH 3.37Å; D296-Y300 VanDerWaalsContact O-CE2 3.29Å; D296-Y300 WeakPolarHBondContact O-CE2 3.3Å; D296-Y300 PolarHBondContact O-OH 3.44Å; D296-Y300 VanDerWaalsContact O-OH 3.07Å; G298-Y300 WeakPolarHBondContact O-CD2 3.38Å; Y300-T320 WeakPolarHBondContact O-CA 3.17Å; Y300-A321 PolarHBondContact N-O 3.28Å; Y300-A321 PolarHBondContact O-N 3.18Å; Y300-L323 HydrophobicContact CD2-CB 4.13Å; Y300-L323 HydrophobicContact CE2-CB 3.99Å; Y300-L323 HydrophobicContact CE2-CD2 4.15Å
301	I	86.5	Confident	79.6	Confident	56 Å²	56	62.6 Å²	62.6	29%	0.287	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	119.7	172.9	-43	-178.3	0	0	0	107.8	W274 Y275 N318 A319 T320	W274-I301 CarbonylContact C-O 3.58Å; W274-I301 WeakPolarHBondContact CA-O 3.42Å; Y275-I301 PolarHBondContact N-O 2.79Å; Y275-I301 PolarHBondContact O-N 2.76Å; I301-N318 HydrophobicContact CG2-CB 4.2Å; I301-A319 CarbonylContact C-O 3.5Å; I301-A319 VanDerWaalsContact CA-O 3.31Å; I301-A319 WeakPolarHBondContact CA-O 3.16Å; I301-A319 WeakPolarHBondContact CG2-O 3.29Å; I301-T320 HydrophobicContact CG1-CG2 4.25Å; I301-T320 HydrophobicContact CG2-CG2 4.24Å
302	C	86.5	Confident	78.7	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	130.1	162.9	176.4	0	0	0	0	108.8	I243 C260 W274 N318 A319	I243-C302 HydrophobicContact CD1-CB 3.86Å; I243-C302 HydrophobicContact CG1-CB 3.97Å; C260-C302 HydrophobicContact CB-CB 3.69Å; C260-C302 WeakPolarHBondContact CB-SG 3.24Å; C260-C302 WeakPolarHBondContact SG-CB 3.41Å; C260-C302 CovalentContact SG-SG 2.02Å; C260-C302 PolarHBondContact SG-SG 2.88Å; W274-C302 HydrophobicContact CD2-CB 4.24Å; W274-C302 HydrophobicContact CE3-CB 4.09Å; W274-C302 HydrophobicContact CH2-CB 4.32Å; W274-C302 HydrophobicContact CZ2-CB 4.45Å; W274-C302 HydrophobicContact CZ3-CB 4.13Å; C302-N318 CarbonylContact O-C 3.53Å; C302-N318 VanDerWaalsContact O-CA 3.24Å; C302-N318 WeakPolarHBondContact O-CA 3.27Å; C302-A319 PolarHBondContact N-O 3.5Å; C302-A319 PolarHBondContact O-N 2.82Å
303	R	88.7	Confident	78	Confident	56 Å²	56	76.2 Å²	76.2	21%	0.211	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	119.8	163.3	179.4	161.9	178.7	-93.5	-5.4	108.6	F272 V273 Y275 E305 S316 N318	F272-R303 WeakPolarHBondContact CA-O 3.45Å; V273-R303 PolarHBondContact N-O 3.11Å; V273-R303 PolarHBondContact O-N 2.03Å; Y275-R303 HydrophobicContact CE2-CB 3.95Å; R303-E305 IonicContact CZ-OE1 2.83Å; R303-E305 IonicContact CZ-OE2 3.14Å; R303-E305 VanDerWaalsContact CZ-OE2 3.28Å; R303-E305 IonicContact NH1-OE1 3.9Å; R303-E305 IonicContact NH1-OE2 3.04Å; R303-E305 PolarHBondContact NH1-OE2 2.91Å; R303-E305 IonicContact NH2-OE1 3.72Å; R303-E305 PolarHBondContact NH2-OE1 2.83Å; R303-E305 IonicContact NH2-OE2 3.67Å; R303-E305 PolarHBondContact NH2-OE2 2.75Å; R303-S316 PolarHBondContact NE-OG 3.06Å; R303-S316 PolarHBondContact NH2-OG 3.4Å; R303-N318 VanDerWaalsContact CB-OD1 3.32Å; R303-N318 WeakPolarHBondContact CB-OD1 3.48Å; R303-N318 WeakPolarHBondContact CD-OD1 3.43Å; R303-N318 WeakPolarHBondContact CG-OD1 3.45Å
304	A	88	Confident	77.7	Confident	0 Å²	0	76.3 Å²	76.3	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	133.3	168.3	0	0	0	0	0	108.7	V241 V262 I270 S271 F272 W306 S316 A317	V241-A304 HydrophobicContact CG1-CB 4.15Å; V241-A304 HydrophobicContact CG2-CB 3.89Å; V262-A304 HydrophobicContact CG2-CB 3.78Å; I270-A304 HydrophobicContact CG2-CB 3.95Å; S271-A304 CarbonylContact O-C 3.59Å; S271-A304 WeakPolarHBondContact O-CA 3.04Å; F272-A304 HydrophobicContact CD1-CB 4.1Å; F272-A304 HydrophobicContact CE1-CB 3.98Å; A304-W306 HydrophobicContact CB-CZ3 4.39Å; A304-S316 CarbonylContact O-C 3.56Å; A304-S316 WeakPolarHBondContact O-CA 3.05Å; A304-S316 WeakPolarHBondContact O-CB 3.28Å; A304-A317 PolarHBondContact N-O 3.16Å; A304-A317 PolarHBondContact O-N 3.35Å
305	E	88.2	Confident	77.9	Confident	55 Å²	55	75.7 Å²	75.7	26%	0.257	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	122.3	-176.7	177.1	165.9	-136	0	0	110.6	S271 R303 A314 I315	S271-E305 PolarHBondContact N-O 3.06Å; S271-E305 PolarHBondContact O-N 2.97Å; S271-E305 PolarHBondContact OG-O 2.82Å; R303-E305 IonicContact CZ-OE1 2.83Å; R303-E305 IonicContact CZ-OE2 3.14Å; R303-E305 VanDerWaalsContact CZ-OE2 3.28Å; R303-E305 IonicContact NH1-OE1 3.9Å; R303-E305 IonicContact NH1-OE2 3.04Å; R303-E305 PolarHBondContact NH1-OE2 2.91Å; R303-E305 IonicContact NH2-OE1 3.72Å; R303-E305 PolarHBondContact NH2-OE1 2.83Å; R303-E305 IonicContact NH2-OE2 3.67Å; R303-E305 PolarHBondContact NH2-OE2 2.75Å; E305-A314 HydrophobicContact CG-CB 3.99Å; E305-I315 VanDerWaalsContact CA-O 3.32Å; E305-I315 WeakPolarHBondContact CA-O 3.35Å
306	W	88.6	Confident	77.9	Confident	8 Å²	8	67.8 Å²	67.8	3%	0.03	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	155.9	-178.5	66.7	108.2	0	0	0	110.3	H239 P266 A304 A314 I315 A317	H239-W306 HydrophobicContact CB-CH2 3.63Å; H239-W306 HydrophobicContact CB-CZ2 3.49Å; H239-W306 VanDerWaalsContact CB-CZ2 3.49Å; H239-W306 AromaticContact CG-CZ2 3.55Å; H239-W306 AromaticContact ND1-CZ2 3.93Å; P266-W306 HydrophobicContact CB-CG 4.22Å; P266-W306 HydrophobicContact CG-CB 4.41Å; P266-W306 HydrophobicContact CG-CD2 3.9Å; P266-W306 HydrophobicContact CG-CG 3.76Å; A304-W306 HydrophobicContact CB-CZ3 4.39Å; W306-A314 CarbonylContact O-C 3.58Å; W306-A314 WeakPolarHBondContact O-CA 3.19Å; W306-I315 HydrophobicContact CD2-CB 4.27Å; W306-I315 HydrophobicContact CH2-CB 4.31Å; W306-I315 HydrophobicContact CH2-CG2 3.63Å; W306-I315 HydrophobicContact CZ2-CB 3.92Å; W306-I315 HydrophobicContact CZ2-CD1 4.43Å; W306-I315 HydrophobicContact CZ2-CG2 3.52Å; W306-I315 HydrophobicContact CZ3-CG2 4.24Å; W306-I315 PolarHBondContact N-O 3.06Å; W306-I315 PolarHBondContact O-N 2.86Å; W306-A317 HydrophobicContact CH2-CB 4.47Å
307	T	81.9	Confident	77.5	Confident	74 Å²	74	67.4 Å²	67.4	45%	0.454	34%	0.335	S	S	.	.			trans	-117.6	105.3	178.2	-56.2	0	0	0	0	109.3	E268	E268-T307 WeakPolarHBondContact CG-O 3.33Å
308	P	75.2	Confident	77.8	Confident	27 Å²	27	69.8 Å²	69.8	18%	0.175	35%	0.348	C	S	.	.			trans	-55.9	145	179.8	-26.2	33.3	0	0	0	112.6	E268 Y310 S311 I315	E268-P308 WeakPolarHBondContact OE1-CA 3.4Å; P308-Y310 PolarHBondContact O-N 2.9Å; P308-S311 PolarHBondContact O-N 3.05Å; P308-I315 HydrophobicContact CG-CD1 3.61Å; P308-I315 HydrophobicContact CG-CG1 4.07Å
309	R	71	Confident	77.7	Confident	159 Å²	159	69.6 Å²	69.6	60%	0.6	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-21.7	-172.7	-137.9	-176.4	-63.7	-140.2	7.5	114.6	E267 E268	E267-R309 IonicContact OE2-CZ 3.39Å; E267-R309 IonicContact OE2-NH2 2.8Å; E267-R309 PolarHBondContact OE2-NH2 3.36Å; E268-R309 HydrophobicContact CG-CB 4.45Å; E268-R309 WeakPolarHBondContact OE1-CB 3.43Å; E268-R309 PolarHBondContact OE1-N 2.87Å
310	Y	62.6	Low	77.6	Confident	198 Å²	198	69.1 Å²	69.1	78%	0.776	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.1	0.5	-179.2	-54.2	-77.3	0	0	0	113.4	P308	P308-Y310 PolarHBondContact O-N 2.9Å
311	S	60.3	Low	76.8	Confident	39 Å²	39	70.3 Å²	70.3	27%	0.273	36%	0.359	S	S	.	.			trans	-105.6	150.1	-179.4	-173.2	0	0	0	0	111.9	P308 T313	P308-S311 PolarHBondContact O-N 3.05Å; S311-T313 PolarHBondContact OG-N 3Å; S311-T313 PolarHBondContact OG-O 2.85Å; S311-T313 PolarHBondContact OG-OG1 3.07Å; S311-T313 VanDerWaalsContact OG-OG1 3.06Å
312	R	67.6	Low	76.2	Confident	254 Å²	254	74.2 Å²	74.2	96%	0.958	38%	0.376	S	S	*	.	S	Bend	trans	-100.4	-9.4	165	-65.4	-171.4	-176.1	-175.8	2.9	113.1
313	T	63.2	Low	75.5	Confident	103 Å²	103	74.6 Å²	74.6	63%	0.632	38%	0.378	S	S	*	.	S	Bend	trans	-101.2	132.7	173.8	44	0	0	0	0	109.5	S311	S311-T313 PolarHBondContact OG-N 3Å; S311-T313 PolarHBondContact OG-O 2.85Å; S311-T313 PolarHBondContact OG-OG1 3.07Å; S311-T313 VanDerWaalsContact OG-OG1 3.06Å
314	A	74.2	Confident	74.4	Confident	45 Å²	45	74.1 Å²	74.1	37%	0.372	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-66.6	140.6	165.8	0	0	0	0	0	109.4	E305 W306	E305-A314 HydrophobicContact CG-CB 3.99Å; W306-A314 CarbonylContact O-C 3.58Å; W306-A314 WeakPolarHBondContact O-CA 3.19Å
315	I	72.8	Confident	73.4	Confident	78 Å²	78	74.9 Å²	74.9	40%	0.4	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	135.5	164.5	-57.6	178.4	0	0	0	106.1	E305 W306 P308	E305-I315 VanDerWaalsContact CA-O 3.32Å; E305-I315 WeakPolarHBondContact CA-O 3.35Å; W306-I315 HydrophobicContact CD2-CB 4.27Å; W306-I315 HydrophobicContact CH2-CB 4.31Å; W306-I315 HydrophobicContact CH2-CG2 3.63Å; W306-I315 HydrophobicContact CZ2-CB 3.92Å; W306-I315 HydrophobicContact CZ2-CD1 4.43Å; W306-I315 HydrophobicContact CZ2-CG2 3.52Å; W306-I315 HydrophobicContact CZ3-CG2 4.24Å; W306-I315 PolarHBondContact N-O 3.06Å; W306-I315 PolarHBondContact O-N 2.86Å; P308-I315 HydrophobicContact CG-CD1 3.61Å; P308-I315 HydrophobicContact CG-CG1 4.07Å
316	S	78.7	Confident	72.2	Confident	51 Å²	51	75.3 Å²	75.3	36%	0.357	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	134.6	168.5	73.4	0	0	0	0	111.7	R303 A304	R303-S316 PolarHBondContact NE-OG 3.06Å; R303-S316 PolarHBondContact NH2-OG 3.4Å; A304-S316 CarbonylContact O-C 3.56Å; A304-S316 WeakPolarHBondContact O-CA 3.05Å; A304-S316 WeakPolarHBondContact O-CB 3.28Å
317	A	76.6	Confident	71	Confident	30 Å²	30	78.5 Å²	78.5	25%	0.248	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	154.6	177.1	0	0	0	0	0	109.9	V241 A304 W306	V241-A317 HydrophobicContact CG2-CB 3.5Å; A304-A317 PolarHBondContact N-O 3.16Å; A304-A317 PolarHBondContact O-N 3.35Å; W306-A317 HydrophobicContact CH2-CB 4.47Å
318	N	84.9	Confident	70.3	Confident	103 Å²	103	76.4 Å²	76.4	55%	0.551	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.1	145.3	-172.8	-62.3	-18.7	0	0	0	110.8	I301 C302 R303	I301-N318 HydrophobicContact CG2-CB 4.2Å; C302-N318 CarbonylContact O-C 3.53Å; C302-N318 VanDerWaalsContact O-CA 3.24Å; C302-N318 WeakPolarHBondContact O-CA 3.27Å; R303-N318 VanDerWaalsContact CB-OD1 3.32Å; R303-N318 WeakPolarHBondContact CB-OD1 3.48Å; R303-N318 WeakPolarHBondContact CD-OD1 3.43Å; R303-N318 WeakPolarHBondContact CG-OD1 3.45Å
319	A	72.8	Confident	70	Confident	12 Å²	12	86.9 Å²	86.9	10%	0.099	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	146.1	167.1	0	0	0	0	0	109.9	V241 I243 I301 C302	V241-A319 HydrophobicContact CB-CB 4.17Å; V241-A319 HydrophobicContact CG1-CB 3.76Å; V241-A319 WeakPolarHBondContact O-CB 3.49Å; I243-A319 HydrophobicContact CD1-CB 3.75Å; I243-A319 WeakPolarHBondContact CD1-O 3.49Å; I243-A319 HydrophobicContact CG1-CB 3.72Å; I301-A319 CarbonylContact C-O 3.5Å; I301-A319 VanDerWaalsContact CA-O 3.31Å; I301-A319 WeakPolarHBondContact CA-O 3.16Å; I301-A319 WeakPolarHBondContact CG2-O 3.29Å; C302-A319 PolarHBondContact N-O 3.5Å; C302-A319 PolarHBondContact O-N 2.82Å
320	T	74.7	Confident	70.3	Confident	101 Å²	101	85.2 Å²	85.2	62%	0.62	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.4	130.2	179.7	53.4	0	0	0	0	110.5	Y300 I301	Y300-T320 WeakPolarHBondContact O-CA 3.17Å; I301-T320 HydrophobicContact CG1-CG2 4.25Å; I301-T320 HydrophobicContact CG2-CG2 4.24Å
321	A	70.6	Confident	70.8	Confident	28 Å²	28	80.4 Å²	80.4	23%	0.231	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	140.5	172.9	0	0	0	0	0	109.9	I243 Y300	I243-A321 HydrophobicContact CB-CB 4.04Å; I243-A321 HydrophobicContact CD1-CB 3.88Å; I243-A321 HydrophobicContact CG2-CB 3.64Å; Y300-A321 PolarHBondContact N-O 3.28Å; Y300-A321 PolarHBondContact O-N 3.18Å
322	E	74.1	Confident	71.8	Confident	138 Å²	138	83.9 Å²	83.9	65%	0.645	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.3	115.8	175.4	-169.1	-174.7	159.4	0	0	110.4	S324	E322-S324 PolarHBondContact O-N 2.72Å
323	L	71.1	Confident	72.5	Confident	8 Å²	8	73 Å²	73	4%	0.042	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	90	175	-168.3	63.3	0	0	0	109.4	V250 Y256 M258 L289 L292 I297 G298 Y300	V250-L323 HydrophobicContact CB-CD1 4.35Å; V250-L323 HydrophobicContact CG1-CD1 3.66Å; V250-L323 HydrophobicContact CG1-CD2 4.49Å; V250-L323 HydrophobicContact CG1-CG 3.91Å; V250-L323 HydrophobicContact CG2-CD1 3.66Å; Y256-L323 HydrophobicContact CD1-CD1 4.06Å; Y256-L323 HydrophobicContact CD1-CD2 4.09Å; Y256-L323 HydrophobicContact CD2-CD1 4.49Å; Y256-L323 HydrophobicContact CE1-CD1 3.49Å; Y256-L323 VanDerWaalsContact CE1-CD1 3.49Å; Y256-L323 HydrophobicContact CE1-CD2 4.24Å; Y256-L323 HydrophobicContact CE2-CD1 3.98Å; Y256-L323 VanDerWaalsContact CZ-CD1 3.45Å; M258-L323 HydrophobicContact CE-CD2 4.32Å; L289-L323 HydrophobicContact CD1-CD2 4.29Å; L292-L323 HydrophobicContact CD1-CD2 3.62Å; I297-L323 WeakPolarHBondContact CG2-O 3.26Å; G298-L323 PolarHBondContact N-O 2.69Å; G298-L323 PolarHBondContact O-N 2.88Å; Y300-L323 HydrophobicContact CD2-CB 4.13Å; Y300-L323 HydrophobicContact CE2-CB 3.99Å; Y300-L323 HydrophobicContact CE2-CD2 4.15Å
324	S	66	Low	73.5	Confident	46 Å²	46	72 Å²	72	32%	0.322	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-100.5	149.1	173.7	69	0	0	0	0	111.5	E322	E322-S324 PolarHBondContact O-N 2.72Å
325	L	66	Low	74.1	Confident	15 Å²	15	70 Å²	70	8%	0.079	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-75.3	133.4	174.3	-62.9	170.4	0	0	0	110.2	V250 I252 Y294 I297 V342 V344 V424	V250-L325 HydrophobicContact CG1-CD2 3.96Å; I252-L325 HydrophobicContact CD1-CD2 4.05Å; I252-L325 HydrophobicContact CG1-CD1 4.46Å; I252-L325 HydrophobicContact CG1-CD2 3.84Å; Y294-L325 HydrophobicContact CE1-CD1 4.37Å; I297-L325 HydrophobicContact CD1-CD1 3.64Å; I297-L325 HydrophobicContact CD1-CD2 4.32Å; I297-L325 HydrophobicContact CD1-CG 3.79Å; I297-L325 HydrophobicContact CG1-CG 4.49Å; L325-V342 HydrophobicContact CD1-CG1 4.49Å; L325-V344 HydrophobicContact CB-CG1 4.47Å; L325-V344 HydrophobicContact CB-CG2 3.76Å; L325-V344 HydrophobicContact CD1-CG2 4.08Å; L325-V424 HydrophobicContact CD1-CB 4.47Å; L325-V424 HydrophobicContact CD1-CG1 4.4Å; L325-V424 HydrophobicContact CD1-CG2 3.99Å
326	A	63.5	Low	74.6	Confident	65 Å²	65	68.2 Å²	68.2	54%	0.537	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-67.9	139.5	175	0	0	0	0	0	111.5	T328 V344	A326-T328 PolarHBondContact O-N 3.01Å; A326-V344 WeakPolarHBondContact O-CB 3.42Å; A326-V344 WeakPolarHBondContact O-CG2 3.16Å
327	L	63.8	Low	74.7	Confident	75 Å²	75	69.8 Å²	69.8	39%	0.393	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-59.3	130.9	172.5	-75.9	169.1	0	0	0	110.5	R329 V344 L346	L327-R329 PolarHBondContact O-N 3.42Å; L327-V344 HydrophobicContact CD2-CG1 4.19Å; L327-L346 HydrophobicContact CD1-CD1 4.16Å; L327-L346 HydrophobicContact CD1-CD2 4.26Å; L327-L346 HydrophobicContact CD1-CG 4.15Å; L327-L346 HydrophobicContact CD2-CD2 3.84Å; L327-L346 HydrophobicContact CD2-CG 3.81Å
328	T	67.1	Low	74.6	Confident	29 Å²	29	71.8 Å²	71.8	18%	0.178	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-68.2	118.6	178.4	-57.1	0	0	0	0	109	A326 E330 M343 V344 R351	A326-T328 PolarHBondContact O-N 3.01Å; T328-E330 VanDerWaalsContact C-N 3.34Å; T328-M343 HydrophobicContact CG2-CG 4.5Å; T328-M343 WeakPolarHBondContact OG1-CA 3.42Å; T328-V344 PolarHBondContact N-O 2.97Å; T328-V344 PolarHBondContact OG1-N 3.16Å; T328-R351 PolarHBondContact O-NH1 2.86Å; T328-R351 PolarHBondContact O-NH2 2.86Å; T328-R351 VanDerWaalsContact O-NH2 3.13Å
329	R	69.6	Low	73.7	Confident	248 Å²	248	71.8 Å²	71.8	94%	0.936	39%	0.392	S	S	*	.			trans	-72.7	-26.1	-179.8	-68.6	-176.3	176.9	-178.6	-0.7	113.4	L327	L327-R329 PolarHBondContact O-N 3.42Å
330	E	75.7	Confident	73.7	Confident	124 Å²	124	72.1 Å²	72.1	58%	0.579	40%	0.397	S	S	*	.			trans	-82.5	125.6	178.4	-58.7	-165.2	171.5	0	0	111.2	T328 K332 R351	T328-E330 VanDerWaalsContact C-N 3.34Å; E330-K332 WeakPolarHBondContact CB-O 3.44Å; E330-K332 PolarHBondContact O-N 3.18Å; E330-R351 PolarHBondContact O-NH1 2.85Å
331	T	74.1	Confident	73.8	Confident	97 Å²	97	68.5 Å²	68.5	60%	0.595	38%	0.375	S	S	*	.	S	Bend	trans	-67.5	-10.4	174.5	51.3	0	0	0	0	113.2	R351 E352	T331-R351 CarbonylContact O-C 3.56Å; T331-R351 VanDerWaalsContact O-CA 3.27Å; T331-R351 WeakPolarHBondContact O-CA 3.37Å; T331-E352 PolarHBondContact O-N 2.81Å
332	K	81.8	Confident	74.1	Confident	112 Å²	112	68.7 Å²	68.7	49%	0.487	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	159.5	175.5	61.7	174.8	-177	171.8	0	110.2	E330 E352	E330-K332 WeakPolarHBondContact CB-O 3.44Å; E330-K332 PolarHBondContact O-N 3.18Å; K332-E352 CarbonylContact C-O 3.52Å; K332-E352 WeakPolarHBondContact CA-O 3.43Å; K332-E352 HydrophobicContact CB-CB 3.95Å
333	I	81.9	Confident	74.5	Confident	25 Å²	25	62.1 Å²	62.1	13%	0.128	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	137.7	168.3	-159.4	162.7	0	0	0	109.9	S341 M343 E352 L353 H354	I333-S341 WeakPolarHBondContact CD1-OG 3.44Å; I333-M343 HydrophobicContact CB-CE 3.7Å; I333-M343 HydrophobicContact CG2-CE 3.54Å; I333-E352 PolarHBondContact N-O 3.11Å; I333-L353 HydrophobicContact CG2-CD2 3.79Å; I333-H354 PolarHBondContact O-N 3.49Å
334	E	84.2	Confident	75	Confident	83 Å²	83	62 Å²	62	39%	0.388	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	128.5	167.3	-179.7	57.5	-144.1	0	0	108.8	H354 E356 K419	E334-H354 WeakPolarHBondContact OE2-CB 3.44Å; E334-E356 PolarHBondContact OE1-N 2.95Å; E334-K419 IonicContact OE1-NZ 3.38Å; E334-K419 PolarHBondContact OE1-NZ 3.35Å
335	M	85.9	Confident	75.8	Confident	2 Å²	2	59.8 Å²	59.8	1%	0.01	33%	0.327	C	S	.	.			trans	-73.4	137.8	-177.3	-65.2	175.4	68.6	0	0	111	L353 H354 C355 W367 Y410 C412 K419 T421	M335-L353 HydrophobicContact SD-CB 4.21Å; M335-H354 WeakPolarHBondContact CG-O 3.4Å; M335-H354 PolarHBondContact N-O 3.14Å; M335-C355 HydrophobicContact SD-CB 4.11Å; M335-W367 HydrophobicContact CE-CH2 4.41Å; M335-W367 HydrophobicContact CE-CZ3 3.92Å; M335-W367 HydrophobicContact SD-CE3 4.4Å; M335-W367 HydrophobicContact SD-CH2 3.24Å; M335-W367 WeakPolarHBondContact SD-CH2 3.29Å; M335-W367 HydrophobicContact SD-CZ2 4.32Å; M335-W367 HydrophobicContact SD-CZ3 3.29Å; M335-W367 WeakPolarHBondContact SD-CZ3 3.49Å; M335-Y410 WeakPolarHBondContact CE-O 3.37Å; M335-C412 HydrophobicContact CE-CB 4.26Å; M335-C412 HydrophobicContact SD-CB 4.36Å; M335-K419 HydrophobicContact CB-CB 3.76Å; M335-K419 HydrophobicContact CB-CD 4.37Å; M335-K419 WeakPolarHBondContact CE-O 3.25Å; M335-K419 WeakPolarHBondContact O-CD 3.17Å; M335-K419 WeakPolarHBondContact O-CE 3.49Å; M335-K419 PolarHBondContact O-NZ 2.83Å; M335-T421 HydrophobicContact CE-CG2 4.06Å; M335-T421 HydrophobicContact CG-CG2 3.9Å; M335-T421 HydrophobicContact SD-CG2 4.26Å
336	S	83.5	Confident	76.3	Confident	40 Å²	40	61.4 Å²	61.4	28%	0.28	34%	0.336	S	S	.	.	B	Isolated β-bridge	trans	-110.4	158.7	-179.5	53.3	0	0	0	0	111.7	G340 S341 K419 Q420	S336-G340 VanDerWaalsContact OG-CA 3.26Å; S336-G340 WeakPolarHBondContact OG-CA 3.42Å; S336-G340 PolarHBondContact OG-O 2.84Å; S336-S341 PolarHBondContact OG-N 2.76Å; S336-S341 VanDerWaalsContact OG-N 3.16Å; S336-K419 CarbonylContact O-C 3.58Å; S336-K419 VanDerWaalsContact O-CA 3.27Å; S336-K419 WeakPolarHBondContact O-CA 3.49Å; S336-Q420 PolarHBondContact O-N 2.83Å
337	P	81.8	Confident	77	Confident	85 Å²	85	61.5 Å²	61.5	55%	0.552	33%	0.331	S	S	*	.	S	Bend	trans	-57.3	151.9	172.6	-25.1	35.7	0	0	0	112.6	G340	P337-G340 WeakPolarHBondContact O-CA 3.46Å; P337-G340 PolarHBondContact O-N 2.76Å
338	P	74.7	Confident	77.8	Confident	72 Å²	72	60.6 Å²	60.6	47%	0.468	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.8	131.8	176.1	-29	33.8	0	0	0	112.7	G340 I418 Q420	P338-G340 VanDerWaalsContact C-N 3.34Å; P338-G340 VanDerWaalsContact CA-N 3.31Å; P338-I418 VanDerWaalsContact CD-O 3.31Å; P338-I418 WeakPolarHBondContact CD-O 3.41Å; P338-I418 HydrophobicContact CG-CG2 4.19Å; P338-Q420 HydrophobicContact CB-CG 4.48Å; P338-Q420 HydrophobicContact CG-CG 4.24Å
339	P	65.7	Low	78.5	Confident	102 Å²	102	62.1 Å²	62.1	66%	0.662	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	cis	-76	-3.1	14.5	31.4	-37.5	0	0	0	116.4	Q420	P339-Q420 VanDerWaalsContact C-NE2 3.27Å; P339-Q420 PolarHBondContact O-NE2 2.78Å
340	G	72.8	Confident	79.2	Confident	20 Å²	20	53.6 Å²	53.6	21%	0.206	32%	0.32	C	S	.	.			trans	83.8	-168.4	176.7	0	0	0	0	0	114.1	S336 P337 P338 Q420	S336-G340 VanDerWaalsContact OG-CA 3.26Å; S336-G340 WeakPolarHBondContact OG-CA 3.42Å; S336-G340 PolarHBondContact OG-O 2.84Å; P337-G340 WeakPolarHBondContact O-CA 3.46Å; P337-G340 PolarHBondContact O-N 2.76Å; P338-G340 VanDerWaalsContact C-N 3.34Å; P338-G340 VanDerWaalsContact CA-N 3.31Å; G340-Q420 WeakPolarHBondContact CA-O 3.28Å
341	S	76.6	Confident	79.9	Confident	24 Å²	24	48 Å²	48	17%	0.168	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	163.3	174.2	57.6	0	0	0	0	111.1	I333 S336 Q420 T421 H422	I333-S341 WeakPolarHBondContact CD1-OG 3.44Å; S336-S341 PolarHBondContact OG-N 2.76Å; S336-S341 VanDerWaalsContact OG-N 3.16Å; S341-Q420 PolarHBondContact N-O 3.46Å; S341-T421 CarbonylContact O-C 3.56Å; S341-T421 WeakPolarHBondContact O-CA 3.4Å; S341-T421 PolarHBondContact O-OG1 2.76Å; S341-T421 VanDerWaalsContact O-OG1 3.05Å; S341-T421 WeakPolarHBondContact OG-CB 3.4Å; S341-T421 PolarHBondContact OG-OG1 3.37Å; S341-H422 PolarHBondContact O-N 3.5Å
342	V	77.4	Confident	80.7	Confident	32 Å²	32	46.5 Å²	46.5	19%	0.194	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	131.4	173.3	178.6	0	0	0	0	109.5	I252 Y294 L325 V344 H422 V424	I252-V342 HydrophobicContact CB-CB 4.48Å; I252-V342 HydrophobicContact CB-CG2 3.62Å; I252-V342 HydrophobicContact CG1-CG1 4.5Å; I252-V342 HydrophobicContact CG1-CG2 3.97Å; I252-V342 HydrophobicContact CG2-CG2 3.97Å; Y294-V342 WeakPolarHBondContact OH-CG2 3.32Å; L325-V342 HydrophobicContact CD1-CG1 4.49Å; V342-V344 HydrophobicContact CG1-CG2 4.22Å; V342-H422 WeakPolarHBondContact CA-O 3.32Å; V342-H422 HydrophobicContact CG2-CB 4.41Å; V342-V424 HydrophobicContact CG1-CG2 3.97Å
343	M	82.6	Confident	81.2	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	132.4	172.8	177.6	177.9	-83.5	0	0	108.4	T328 I333 R351 L353 H422 L423 V424	T328-M343 HydrophobicContact CG2-CG 4.5Å; T328-M343 WeakPolarHBondContact OG1-CA 3.42Å; I333-M343 HydrophobicContact CB-CE 3.7Å; I333-M343 HydrophobicContact CG2-CE 3.54Å; M343-R351 HydrophobicContact CE-CB 4.13Å; M343-R351 HydrophobicContact CE-CG 4.39Å; M343-R351 HydrophobicContact SD-CB 3.52Å; M343-R351 VanDerWaalsContact SD-CB 3.52Å; M343-R351 HydrophobicContact SD-CG 3.54Å; M343-R351 VanDerWaalsContact SD-CG 3.54Å; M343-L353 HydrophobicContact CE-CD2 4.05Å; M343-L353 HydrophobicContact SD-CD2 3.97Å; M343-H422 PolarHBondContact N-O 2.78Å; M343-L423 HydrophobicContact CB-CD1 4.14Å; M343-L423 HydrophobicContact CG-CD1 3.83Å; M343-L423 CarbonylContact O-C 3.56Å; M343-L423 WeakPolarHBondContact O-CA 3.4Å; M343-L423 HydrophobicContact SD-CD1 4.03Å; M343-V424 PolarHBondContact O-N 3.4Å
344	V	81.1	Confident	81.6	Confident	5 Å²	5	41.4 Å²	41.4	3%	0.03	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	124.7	177.3	-169.1	0	0	0	0	108.2	L325 A326 L327 T328 V342 V424 R426	L325-V344 HydrophobicContact CB-CG1 4.47Å; L325-V344 HydrophobicContact CB-CG2 3.76Å; L325-V344 HydrophobicContact CD1-CG2 4.08Å; A326-V344 WeakPolarHBondContact O-CB 3.42Å; A326-V344 WeakPolarHBondContact O-CG2 3.16Å; L327-V344 HydrophobicContact CD2-CG1 4.19Å; T328-V344 PolarHBondContact N-O 2.97Å; T328-V344 PolarHBondContact OG1-N 3.16Å; V342-V344 HydrophobicContact CG1-CG2 4.22Å; V344-V424 WeakPolarHBondContact CA-O 3.17Å; V344-V424 HydrophobicContact CG1-CB 4.44Å; V344-V424 HydrophobicContact CG2-CB 4.37Å; V344-R426 HydrophobicContact CG1-CB 4.37Å
345	S	81.9	Confident	81.8	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	149.1	-171	-147.6	0	0	0	0	111.1	E349 R351 I402 V424 V425 R426	S345-E349 WeakPolarHBondContact CA-OE2 3.07Å; S345-E349 WeakPolarHBondContact CB-OE2 3.49Å; S345-E349 PolarHBondContact OG-OE2 2.9Å; S345-R351 WeakPolarHBondContact OG-CG 3.5Å; S345-R351 PolarHBondContact OG-NE 2.91Å; S345-I402 VanDerWaalsContact OG-CD1 3.31Å; S345-I402 WeakPolarHBondContact OG-CD1 3.29Å; S345-V424 PolarHBondContact N-O 3.41Å; S345-V425 CarbonylContact O-C 3.54Å; S345-V425 WeakPolarHBondContact O-CA 3.44Å; S345-R426 PolarHBondContact O-N 2.84Å
346	L	76.6	Confident	81.8	Confident	49 Å²	49	41.5 Å²	41.5	26%	0.257	26%	0.258	S	S	.	.			trans	-85.8	154.4	168.1	-59.5	178.6	0	0	0	110.6	L327 E349 R426	L327-L346 HydrophobicContact CD1-CD1 4.16Å; L327-L346 HydrophobicContact CD1-CD2 4.26Å; L327-L346 HydrophobicContact CD1-CG 4.15Å; L327-L346 HydrophobicContact CD2-CD2 3.84Å; L327-L346 HydrophobicContact CD2-CG 3.81Å; L346-E349 HydrophobicContact CB-CG 4.2Å; L346-E349 PolarHBondContact N-OE2 2.93Å; L346-E349 WeakPolarHBondContact O-CB 3.1Å; L346-E349 PolarHBondContact O-N 2.96Å; L346-R426 HydrophobicContact CD2-CB 4.31Å; L346-R426 HydrophobicContact CD2-CG 4.36Å; L346-R426 VanDerWaalsContact CD2-O 3.28Å; L346-R426 WeakPolarHBondContact CD2-O 3.41Å
347	P	79.4	Confident	81.5	Confident	67 Å²	67	40.4 Å²	40.4	44%	0.435	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	142.8	168.1	-26.5	34.5	0	0	0	112.5	E349 I402 V425 R426 A427	P347-E349 VanDerWaalsContact C-N 3.28Å; P347-E349 PolarHBondContact O-N 2.99Å; P347-I402 CarbonylContact C-O 3.54Å; P347-I402 VanDerWaalsContact CA-O 3.29Å; P347-I402 WeakPolarHBondContact CA-O 3.38Å; P347-V425 HydrophobicContact CG-CG1 4.14Å; P347-R426 VanDerWaalsContact CD-O 3.28Å; P347-R426 WeakPolarHBondContact CD-O 3.25Å; P347-A427 HydrophobicContact CG-CB 4.11Å
348	G	79	Confident	80.9	Confident	56 Å²	56	42.3 Å²	42.3	58%	0.577	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.6	-12.6	-179	0	0	0	0	0	115.6	I402	G348-I402 PolarHBondContact N-O 2.99Å
349	E	82.3	Confident	80.3	Confident	62 Å²	62	46 Å²	46	29%	0.29	28%	0.282	S	S	.	.			trans	-67	164.2	175	-70.9	-170.8	124.5	0	0	112.9	S345 L346 P347 R351 G401 I402	S345-E349 WeakPolarHBondContact CA-OE2 3.07Å; S345-E349 WeakPolarHBondContact CB-OE2 3.49Å; S345-E349 PolarHBondContact OG-OE2 2.9Å; L346-E349 HydrophobicContact CB-CG 4.2Å; L346-E349 PolarHBondContact N-OE2 2.93Å; L346-E349 WeakPolarHBondContact O-CB 3.1Å; L346-E349 PolarHBondContact O-N 2.96Å; P347-E349 VanDerWaalsContact C-N 3.28Å; P347-E349 PolarHBondContact O-N 2.99Å; E349-R351 VanDerWaalsContact CD-NH2 3.26Å; E349-R351 IonicContact OE1-CZ 2.81Å; E349-R351 IonicContact OE1-NH2 3.75Å; E349-R351 PolarHBondContact OE1-NH2 2.85Å; E349-R351 VanDerWaalsContact OE1-NH2 3.09Å; E349-R351 IonicContact OE2-CZ 3.73Å; E349-R351 IonicContact OE2-NE 3.74Å; E349-R351 PolarHBondContact OE2-NE 2.87Å; E349-R351 IonicContact OE2-NH2 2.88Å; E349-R351 PolarHBondContact OE2-NH2 2.88Å; E349-G401 WeakPolarHBondContact O-CA 3.14Å; E349-G401 PolarHBondContact O-N 3.04Å; E349-I402 PolarHBondContact O-N 2.81Å
350	T	85.3	Confident	80.1	Confident	69 Å²	69	42.2 Å²	42.2	42%	0.423	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	131.4	171.2	-66.6	0	0	0	0	109.6	T398 I399 R400	T350-T398 HydrophobicContact CG2-CG2 4.2Å; T350-I399 CarbonylContact C-O 3.59Å; T350-I399 VanDerWaalsContact CA-O 3.28Å; T350-I399 WeakPolarHBondContact CA-O 3.35Å; T350-R400 HydrophobicContact CG2-CG 3.97Å
351	R	88.7	Confident	79.8	Confident	5 Å²	5	45 Å²	45	2%	0.019	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	154.1	-176.7	-61.5	-66.7	-178.3	162.9	-3.9	112.4	T328 E330 T331 M343 S345 E349 T398 I399 I402	T328-R351 PolarHBondContact O-NH1 2.86Å; T328-R351 PolarHBondContact O-NH2 2.86Å; T328-R351 VanDerWaalsContact O-NH2 3.13Å; E330-R351 PolarHBondContact O-NH1 2.85Å; T331-R351 CarbonylContact O-C 3.56Å; T331-R351 VanDerWaalsContact O-CA 3.27Å; T331-R351 WeakPolarHBondContact O-CA 3.37Å; M343-R351 HydrophobicContact CE-CB 4.13Å; M343-R351 HydrophobicContact CE-CG 4.39Å; M343-R351 HydrophobicContact SD-CB 3.52Å; M343-R351 VanDerWaalsContact SD-CB 3.52Å; M343-R351 HydrophobicContact SD-CG 3.54Å; M343-R351 VanDerWaalsContact SD-CG 3.54Å; S345-R351 WeakPolarHBondContact OG-CG 3.5Å; S345-R351 PolarHBondContact OG-NE 2.91Å; E349-R351 VanDerWaalsContact CD-NH2 3.26Å; E349-R351 IonicContact OE1-CZ 2.81Å; E349-R351 IonicContact OE1-NH2 3.75Å; E349-R351 PolarHBondContact OE1-NH2 2.85Å; E349-R351 VanDerWaalsContact OE1-NH2 3.09Å; E349-R351 IonicContact OE2-CZ 3.73Å; E349-R351 IonicContact OE2-NE 3.74Å; E349-R351 PolarHBondContact OE2-NE 2.87Å; E349-R351 IonicContact OE2-NH2 2.88Å; E349-R351 PolarHBondContact OE2-NH2 2.88Å; R351-T398 CarbonylContact O-C 3.56Å; R351-T398 WeakPolarHBondContact O-CA 3.47Å; R351-I399 PolarHBondContact N-O 3.21Å; R351-I399 PolarHBondContact O-N 2.72Å; R351-I402 HydrophobicContact CB-CD1 3.93Å; R351-I402 HydrophobicContact CG-CD1 3.38Å
352	E	91.1	Very high	79.2	Confident	66 Å²	66	44.6 Å²	44.6	31%	0.308	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	127.7	175.9	-59.4	-174.5	158.1	0	0	112.2	T331 K332 I333 H354 I396 V397 T398	T331-E352 PolarHBondContact O-N 2.81Å; K332-E352 CarbonylContact C-O 3.52Å; K332-E352 WeakPolarHBondContact CA-O 3.43Å; K332-E352 HydrophobicContact CB-CB 3.95Å; I333-E352 PolarHBondContact N-O 3.11Å; E352-H354 WeakPolarHBondContact CB-NE2 3.46Å; E352-H354 IonicContact OE2-CD2 3.99Å; E352-H354 IonicContact OE2-CE1 3.24Å; E352-H354 IonicContact OE2-NE2 3.06Å; E352-H354 PolarHBondContact OE2-NE2 2.69Å; E352-I396 HydrophobicContact CB-CG2 4.2Å; E352-V397 CarbonylContact C-O 3.55Å; E352-V397 WeakPolarHBondContact CA-O 3.45Å; E352-T398 HydrophobicContact CG-CG2 4.15Å
353	L	92	Very high	78.8	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	109.8	172.5	-45.4	-176.9	0	0	0	107.7	I333 M335 M343 W367 I396 V397 Y410 T421	I333-L353 HydrophobicContact CG2-CD2 3.79Å; M335-L353 HydrophobicContact SD-CB 4.21Å; M343-L353 HydrophobicContact CE-CD2 4.05Å; M343-L353 HydrophobicContact SD-CD2 3.97Å; L353-W367 HydrophobicContact CB-CH2 3.82Å; L353-W367 HydrophobicContact CB-CZ3 4.05Å; L353-W367 HydrophobicContact CD1-CZ3 4.31Å; L353-W367 WeakPolarHBondContact O-CH2 3.39Å; L353-I396 CarbonylContact O-C 3.26Å; L353-I396 VanDerWaalsContact O-CA 3.29Å; L353-I396 WeakPolarHBondContact O-CA 3.16Å; L353-V397 HydrophobicContact CB-CB 4.39Å; L353-V397 PolarHBondContact N-O 3.2Å; L353-V397 PolarHBondContact O-N 2.83Å; L353-Y410 HydrophobicContact CD1-CD1 3.74Å; L353-Y410 HydrophobicContact CD1-CD2 3.77Å; L353-Y410 HydrophobicContact CD1-CE1 4.29Å; L353-Y410 HydrophobicContact CD1-CE2 4.31Å; L353-Y410 HydrophobicContact CD1-CG 3.45Å; L353-Y410 VanDerWaalsContact CD1-CG 3.45Å; L353-T421 HydrophobicContact CD1-CG2 3.92Å; L353-T421 HydrophobicContact CD2-CG2 3.95Å; L353-T421 HydrophobicContact CG-CG2 4.36Å
354	H	90.7	Very high	78.7	Confident	31 Å²	31	57.2 Å²	57.2	14%	0.144	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	138.5	-179.9	-70	-120.1	0	0	0	109.9	I333 E334 M335 E352 V394	I333-H354 PolarHBondContact O-N 3.49Å; E334-H354 WeakPolarHBondContact OE2-CB 3.44Å; M335-H354 WeakPolarHBondContact CG-O 3.4Å; M335-H354 PolarHBondContact N-O 3.14Å; E352-H354 WeakPolarHBondContact CB-NE2 3.46Å; E352-H354 IonicContact OE2-CD2 3.99Å; E352-H354 IonicContact OE2-CE1 3.24Å; E352-H354 IonicContact OE2-NE2 3.06Å; E352-H354 PolarHBondContact OE2-NE2 2.69Å; H354-V394 HydrophobicContact CB-CG2 4.17Å
355	C	89.3	Confident	78.9	Confident	1 Å²	1	57 Å²	57	1%	0.007	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	89.6	-178.2	179.1	0	0	0	0	110.7	M335 F357 W367 V394 S395 C412	M335-C355 HydrophobicContact SD-CB 4.11Å; C355-F357 WeakPolarHBondContact SG-CE2 3.26Å; C355-W367 HydrophobicContact CB-CH2 4.12Å; C355-W367 HydrophobicContact CB-CZ2 3.83Å; C355-V394 WeakPolarHBondContact O-CA 2.91Å; C355-S395 WeakPolarHBondContact CB-O 3.4Å; C355-S395 PolarHBondContact N-O 2.72Å; C355-S395 PolarHBondContact O-N 3.13Å; C355-C412 HydrophobicContact CB-CB 3.86Å; C355-C412 WeakPolarHBondContact CB-SG 3.18Å; C355-C412 WeakPolarHBondContact SG-CB 2.98Å; C355-C412 CovalentContact SG-SG 2.03Å; C355-C412 PolarHBondContact SG-SG 2.9Å
356	E	85.5	Confident	79.3	Confident	86 Å²	86	64.3 Å²	64.3	40%	0.402	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	138.2	173.4	179.8	166	-141.1	0	0	111.4	E334 R393 V394 K419	E334-E356 PolarHBondContact OE1-N 2.95Å; E356-R393 WeakPolarHBondContact CA-O 3.29Å; E356-R393 HydrophobicContact CG-CB 4.33Å; E356-R393 WeakPolarHBondContact OE1-CB 3.4Å; E356-V394 HydrophobicContact CB-CB 4.28Å; E356-V394 HydrophobicContact CB-CG2 4.35Å; E356-K419 WeakPolarHBondContact O-CE 3.48Å; E356-K419 PolarHBondContact O-NZ 2.92Å
357	F	78	Confident	80	Confident	16 Å²	16	62 Å²	62	7%	0.07	33%	0.331	C	S	.	.			trans	-127.1	128.8	171.8	-76.7	-72.6	0	0	0	110.3	C355 V359 A360 V365 R393 I414 D417 K419	C355-F357 WeakPolarHBondContact SG-CE2 3.26Å; F357-V359 PolarHBondContact O-N 2.97Å; F357-A360 HydrophobicContact CB-CB 3.52Å; F357-A360 PolarHBondContact O-N 3.43Å; F357-V365 HydrophobicContact CD2-CG2 3.88Å; F357-V365 HydrophobicContact CE2-CG1 4.31Å; F357-V365 HydrophobicContact CE2-CG2 4.17Å; F357-R393 PolarHBondContact N-O 3.25Å; F357-I414 HydrophobicContact CB-CG2 4.44Å; F357-I414 HydrophobicContact CD1-CG2 3.78Å; F357-I414 HydrophobicContact CD2-CB 4.41Å; F357-I414 HydrophobicContact CD2-CG2 3.58Å; F357-I414 HydrophobicContact CE1-CG2 3.79Å; F357-I414 HydrophobicContact CE2-CB 4.24Å; F357-I414 HydrophobicContact CE2-CG2 3.54Å; F357-I414 HydrophobicContact CG-CG2 3.69Å; F357-I414 HydrophobicContact CZ-CG2 3.66Å; F357-D417 HydrophobicContact CD1-CB 4.28Å; F357-D417 HydrophobicContact CE1-CB 3.71Å; F357-D417 HydrophobicContact CZ-CB 4.45Å; F357-K419 HydrophobicContact CE1-CD 3.95Å; F357-K419 HydrophobicContact CE1-CG 4.01Å; F357-K419 HydrophobicContact CZ-CD 3.98Å; F357-K419 HydrophobicContact CZ-CG 4.03Å
358	P	68.2	Low	80.6	Confident	125 Å²	125	60.6 Å²	60.6	81%	0.812	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-19.4	-164.2	-28.6	35.7	0	0	0	117.8
359	V	62.5	Low	81.1	Confident	150 Å²	150	58.5 Å²	58.5	91%	0.909	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-139.3	24.9	-175.6	-151.4	0	0	0	0	112.2	F357	F357-V359 PolarHBondContact O-N 2.97Å
360	A	61.4	Low	81.4	Confident	22 Å²	22	59.7 Å²	59.7	18%	0.182	30%	0.298	C	S	.	.			trans	-94.7	147.7	-171.9	0	0	0	0	0	114.4	F357 I414	F357-A360 HydrophobicContact CB-CB 3.52Å; F357-A360 PolarHBondContact O-N 3.43Å; A360-I414 HydrophobicContact CB-CD1 3.5Å; A360-I414 VanDerWaalsContact CB-CD1 3.5Å
361	N	67	Low	81.4	Confident	79 Å²	79	61.6 Å²	61.6	42%	0.422	31%	0.306	S	S	.	.			trans	-81.1	121.6	152.6	164.3	27	0	0	0	108	R363 D364	N361-R363 PolarHBondContact O-N 2.89Å; N361-R363 PolarHBondContact OD1-N 2.87Å; N361-D364 WeakPolarHBondContact CB-OD2 3Å; N361-D364 PolarHBondContact ND2-OD1 2.87Å; N361-D364 PolarHBondContact ND2-OD2 3.28Å; N361-D364 WeakPolarHBondContact O-CB 3.37Å; N361-D364 PolarHBondContact O-N 2.01Å
362	P	63.2	Low	81.4	Confident	15 Å²	15	66.2 Å²	66.2	10%	0.097	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-55.9	-26.8	-175.1	-25.7	31.8	0	0	0	114.9	D364 V365 R388 D390 R391	P362-D364 PolarHBondContact O-N 2.83Å; P362-V365 WeakPolarHBondContact O-CB 2.95Å; P362-V365 PolarHBondContact O-N 2.79Å; P362-R388 PolarHBondContact O-NH2 2.81Å; P362-D390 HydrophobicContact CB-CB 4.1Å; P362-R391 WeakPolarHBondContact CG-O 3.39Å
363	R	68.6	Low	81.3	Confident	203 Å²	203	65.3 Å²	65.3	77%	0.766	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-70.8	-17.8	178.5	-67.6	-176.6	171.2	-172.9	-3.1	114	N361 V365	N361-R363 PolarHBondContact O-N 2.89Å; N361-R363 PolarHBondContact OD1-N 2.87Å; R363-V365 VanDerWaalsContact C-N 3.32Å
364	D	81.7	Confident	81	Confident	94 Å²	94	65.9 Å²	65.9	50%	0.503	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-85.1	-11.7	178.3	-57.5	-26.5	0	0	0	111.7	N361 P362 I414	N361-D364 WeakPolarHBondContact CB-OD2 3Å; N361-D364 PolarHBondContact ND2-OD1 2.87Å; N361-D364 PolarHBondContact ND2-OD2 3.28Å; N361-D364 WeakPolarHBondContact O-CB 3.37Å; N361-D364 PolarHBondContact O-N 2.01Å; P362-D364 PolarHBondContact O-N 2.83Å; D364-I414 HydrophobicContact CB-CD1 3.85Å; D364-I414 HydrophobicContact CB-CG1 4.15Å
365	V	85.6	Confident	80.5	Confident	2 Å²	2	69.1 Å²	69.1	1%	0.012	34%	0.343	C	S	.	.			trans	-71.8	127.4	172.1	-176.2	0	0	0	0	109.7	F357 P362 R363 R388 C412 I414	F357-V365 HydrophobicContact CD2-CG2 3.88Å; F357-V365 HydrophobicContact CE2-CG1 4.31Å; F357-V365 HydrophobicContact CE2-CG2 4.17Å; P362-V365 WeakPolarHBondContact O-CB 2.95Å; P362-V365 PolarHBondContact O-N 2.79Å; R363-V365 VanDerWaalsContact C-N 3.32Å; V365-R388 PolarHBondContact O-NH1 2.86Å; V365-R388 PolarHBondContact O-NH2 3.4Å; V365-C412 HydrophobicContact CG1-CB 3.78Å; V365-I414 HydrophobicContact CG2-CB 4.45Å; V365-I414 HydrophobicContact CG2-CD1 4.26Å
366	R	89.2	Confident	80	Confident	152 Å²	152	75.2 Å²	75.2	57%	0.574	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.7	129.7	173.1	-66.4	-177.9	-175.1	173.4	1.2	110.3	Y368 C412 R413	R366-Y368 HydrophobicContact CB-CD2 4.5Å; R366-Y368 HydrophobicContact CB-CE2 3.65Å; R366-Y368 WeakPolarHBondContact O-CD2 3.38Å; R366-C412 WeakPolarHBondContact O-CA 3.4Å; R366-R413 PolarHBondContact N-O 2.78Å; R366-R413 PolarHBondContact O-N 2.8Å
367	W	91	Very high	79.7	Confident	1 Å²	1	71.9 Å²	71.9	0%	0.004	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	141.2	175.7	-74.1	87.8	0	0	0	111.6	M335 L353 C355 L374 S395 V397 E411 C412	M335-W367 HydrophobicContact CE-CH2 4.41Å; M335-W367 HydrophobicContact CE-CZ3 3.92Å; M335-W367 HydrophobicContact SD-CE3 4.4Å; M335-W367 HydrophobicContact SD-CH2 3.24Å; M335-W367 WeakPolarHBondContact SD-CH2 3.29Å; M335-W367 HydrophobicContact SD-CZ2 4.32Å; M335-W367 HydrophobicContact SD-CZ3 3.29Å; M335-W367 WeakPolarHBondContact SD-CZ3 3.49Å; L353-W367 HydrophobicContact CB-CH2 3.82Å; L353-W367 HydrophobicContact CB-CZ3 4.05Å; L353-W367 HydrophobicContact CD1-CZ3 4.31Å; L353-W367 WeakPolarHBondContact O-CH2 3.39Å; C355-W367 HydrophobicContact CB-CH2 4.12Å; C355-W367 HydrophobicContact CB-CZ2 3.83Å; W367-L374 HydrophobicContact CB-CB 3.78Å; W367-L374 HydrophobicContact CB-CD2 3.75Å; W367-L374 HydrophobicContact CB-CG 4.43Å; W367-L374 HydrophobicContact CG-CD2 4.3Å; W367-L374 PolarHBondContact O-N 3.02Å; W367-S395 PolarHBondContact NE1-OG 2.77Å; W367-V397 HydrophobicContact CD2-CB 4.44Å; W367-V397 HydrophobicContact CD2-CG2 3.45Å; W367-V397 VanDerWaalsContact CD2-CG2 3.45Å; W367-V397 VanDerWaalsContact CE2-CG2 3.49Å; W367-V397 HydrophobicContact CE3-CB 4.26Å; W367-V397 HydrophobicContact CE3-CG2 3.66Å; W367-V397 HydrophobicContact CG-CG2 3.96Å; W367-V397 HydrophobicContact CH2-CB 3.91Å; W367-V397 HydrophobicContact CH2-CG2 3.9Å; W367-V397 HydrophobicContact CZ2-CB 4.15Å; W367-V397 HydrophobicContact CZ2-CG2 3.74Å; W367-V397 HydrophobicContact CZ3-CB 3.97Å; W367-V397 HydrophobicContact CZ3-CG2 3.86Å; W367-E411 CarbonylContact C-O 3.45Å; W367-E411 WeakPolarHBondContact CA-O 3.2Å; W367-C412 HydrophobicContact CD2-CB 4.09Å; W367-C412 HydrophobicContact CE3-CB 4.21Å; W367-C412 HydrophobicContact CH2-CB 4.43Å; W367-C412 HydrophobicContact CZ2-CB 4.28Å; W367-C412 HydrophobicContact CZ3-CB 4.4Å
368	Y	91.5	Very high	79.4	Confident	37 Å²	37	75.6 Å²	75.6	15%	0.145	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	150.6	174.9	-60.6	-102.5	0	0	0	109.7	R366 Q372 L373 Y410 E411 R413	R366-Y368 HydrophobicContact CB-CD2 4.5Å; R366-Y368 HydrophobicContact CB-CE2 3.65Å; R366-Y368 WeakPolarHBondContact O-CD2 3.38Å; Y368-Q372 CarbonylContact C-O 3.55Å; Y368-Q372 WeakPolarHBondContact CA-O 3.41Å; Y368-Q372 VanDerWaalsContact CB-O 3.3Å; Y368-Q372 WeakPolarHBondContact CB-O 3.46Å; Y368-L373 HydrophobicContact CD1-CB 4.3Å; Y368-L373 HydrophobicContact CE1-CB 4.18Å; Y368-L373 HydrophobicContact CE1-CG 4.33Å; Y368-Y410 WeakPolarHBondContact O-CA 3.36Å; Y368-E411 PolarHBondContact N-O 2.66Å; Y368-E411 PolarHBondContact O-N 2.74Å; Y368-R413 HydrophobicContact CD2-CB 4.41Å; Y368-R413 HydrophobicContact CD2-CG 3.78Å; Y368-R413 HydrophobicContact CE2-CB 4.02Å; Y368-R413 HydrophobicContact CE2-CG 3.81Å
369	F	91.2	Very high	79.6	Confident	12 Å²	12	73 Å²	73	5%	0.053	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	129.9	164.8	175.1	-88.7	0	0	0	107.9	N371 Q372 L374 H377 I380 G407 T409 Y410	F369-N371 VanDerWaalsContact C-N 3.26Å; F369-N371 PolarHBondContact O-N 2.79Å; F369-Q372 PolarHBondContact N-O 3.23Å; F369-Q372 PolarHBondContact O-N 3.36Å; F369-L374 HydrophobicContact CB-CD1 3.97Å; F369-H377 AromaticContact CD1-CE1 3.39Å; F369-H377 WeakPolarHBondContact CD1-CE1 3.44Å; F369-H377 AromaticContact CD1-ND1 3.68Å; F369-H377 AromaticContact CD1-NE2 3.73Å; F369-H377 AromaticContact CE1-CE1 3.58Å; F369-I380 HydrophobicContact CB-CD1 4.28Å; F369-I380 HydrophobicContact CD1-CD1 3.53Å; F369-I380 HydrophobicContact CD2-CD1 3.45Å; F369-I380 VanDerWaalsContact CD2-CD1 3.45Å; F369-I380 HydrophobicContact CE1-CD1 3.54Å; F369-I380 HydrophobicContact CE2-CD1 3.45Å; F369-I380 VanDerWaalsContact CE2-CD1 3.45Å; F369-I380 HydrophobicContact CG-CD1 3.47Å; F369-I380 VanDerWaalsContact CG-CD1 3.47Å; F369-I380 HydrophobicContact CZ-CD1 3.49Å; F369-I380 VanDerWaalsContact CZ-CD1 3.49Å; F369-G407 WeakPolarHBondContact CZ-O 3.14Å; F369-T409 CarbonylContact C-O 3.57Å; F369-T409 VanDerWaalsContact CA-O 3.31Å; F369-T409 WeakPolarHBondContact CA-O 3.21Å; F369-Y410 HydrophobicContact CB-CD1 4.49Å; F369-Y410 HydrophobicContact CD2-CD1 4.05Å; F369-Y410 AromaticContact CD2-CD2 3.92Å; F369-Y410 HydrophobicContact CD2-CD2 3.92Å; F369-Y410 AromaticContact CD2-CE1 3.81Å; F369-Y410 HydrophobicContact CD2-CE1 3.81Å; F369-Y410 AromaticContact CD2-CE2 3.67Å; F369-Y410 HydrophobicContact CD2-CE2 3.67Å; F369-Y410 HydrophobicContact CD2-CG 4.1Å; F369-Y410 AromaticContact CD2-CZ 3.62Å; F369-Y410 HydrophobicContact CE2-CD2 4.25Å; F369-Y410 AromaticContact CE2-CE2 3.76Å; F369-Y410 HydrophobicContact CE2-CE2 3.76Å; F369-Y410 AromaticContact CE2-CZ 3.96Å
370	E	87.1	Confident	80.3	Confident	88 Å²	88	65.9 Å²	65.9	41%	0.411	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	44.5	51.1	-176.6	-70.3	-58.4	141.1	0	0	112.8	Q372 T409	E370-Q372 PolarHBondContact O-N 2.76Å; E370-T409 PolarHBondContact N-O 2.75Å; E370-T409 WeakPolarHBondContact OE1-CA 3.4Å; E370-T409 WeakPolarHBondContact OE1-CB 3.41Å; E370-T409 PolarHBondContact OE1-N 2.79Å; E370-T409 PolarHBondContact OE1-OG1 2.84Å
371	N	85.1	Confident	80.6	Confident	109 Å²	109	69.2 Å²	69.2	58%	0.583	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.1	-4	-175.3	-83.2	-87.2	0	0	0	117.5	F369 R413	F369-N371 VanDerWaalsContact C-N 3.26Å; F369-N371 PolarHBondContact O-N 2.79Å; N371-R413 PolarHBondContact OD1-NH2 2.94Å
372	Q	88.9	Confident	80.6	Confident	102 Å²	102	69.3 Å²	69.3	48%	0.477	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	149.4	173.4	-60.1	-170.9	34.2	0	0	111.3	Y368 F369 E370 L374	Y368-Q372 CarbonylContact C-O 3.55Å; Y368-Q372 WeakPolarHBondContact CA-O 3.41Å; Y368-Q372 VanDerWaalsContact CB-O 3.3Å; Y368-Q372 WeakPolarHBondContact CB-O 3.46Å; F369-Q372 PolarHBondContact N-O 3.23Å; F369-Q372 PolarHBondContact O-N 3.36Å; E370-Q372 PolarHBondContact O-N 2.76Å; Q372-L374 PolarHBondContact O-N 3.37Å
373	L	88.9	Confident	81	Confident	47 Å²	47	70.5 Å²	70.5	25%	0.246	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	122.9	-177.6	-158	158.7	0	0	0	109.5	Y368 E375 N376 H377	Y368-L373 HydrophobicContact CD1-CB 4.3Å; Y368-L373 HydrophobicContact CE1-CB 4.18Å; Y368-L373 HydrophobicContact CE1-CG 4.33Å; L373-E375 VanDerWaalsContact C-N 3.29Å; L373-E375 HydrophobicContact CD2-CB 3.82Å; L373-E375 HydrophobicContact CD2-CG 4.23Å; L373-E375 PolarHBondContact O-N 3.22Å; L373-N376 CarbonylContact O-C 3.6Å; L373-N376 WeakPolarHBondContact O-CA 3.28Å; L373-N376 PolarHBondContact O-N 2.76Å; L373-H377 PolarHBondContact O-N 3.21Å
374	L	86.7	Confident	81.5	Confident	12 Å²	12	62.9 Å²	62.9	6%	0.063	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-54.5	-42	-166	-179.2	66.9	0	0	0	113.1	W367 F369 Q372 N376 H377 I380 V386 V397 Y410	W367-L374 HydrophobicContact CB-CB 3.78Å; W367-L374 HydrophobicContact CB-CD2 3.75Å; W367-L374 HydrophobicContact CB-CG 4.43Å; W367-L374 HydrophobicContact CG-CD2 4.3Å; W367-L374 PolarHBondContact O-N 3.02Å; F369-L374 HydrophobicContact CB-CD1 3.97Å; Q372-L374 PolarHBondContact O-N 3.37Å; L374-N376 PolarHBondContact O-N 3.01Å; L374-H377 WeakPolarHBondContact O-CB 3.42Å; L374-H377 PolarHBondContact O-N 2.8Å; L374-H377 VanDerWaalsContact O-N 3.11Å; L374-I380 HydrophobicContact CD1-CG2 3.87Å; L374-V386 HydrophobicContact CD2-CG1 4.37Å; L374-V397 HydrophobicContact CD2-CG1 4.28Å; L374-V397 HydrophobicContact CD2-CG2 3.77Å; L374-Y410 HydrophobicContact CD1-CD1 4.49Å; L374-Y410 HydrophobicContact CD1-CE1 4.07Å
375	E	80.3	Confident	81.6	Confident	98 Å²	98	61 Å²	61	46%	0.458	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-62.6	-20.9	179.4	-63.7	159.4	-164.9	0	0	112.8	L373 N381 R388	L373-E375 VanDerWaalsContact C-N 3.29Å; L373-E375 HydrophobicContact CD2-CB 3.82Å; L373-E375 HydrophobicContact CD2-CG 4.23Å; L373-E375 PolarHBondContact O-N 3.22Å; E375-N381 PolarHBondContact O-ND2 2.93Å; E375-R388 IonicContact OE1-CZ 3.07Å; E375-R388 IonicContact OE1-NH1 3.28Å; E375-R388 PolarHBondContact OE1-NH1 2.86Å
376	N	78.4	Confident	81.7	Confident	129 Å²	129	62 Å²	62	69%	0.69	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-109.7	4.4	177.9	-64.7	-25.6	0	0	0	113.3	L373 L374	L373-N376 CarbonylContact O-C 3.6Å; L373-N376 WeakPolarHBondContact O-CA 3.28Å; L373-N376 PolarHBondContact O-N 2.76Å; L374-N376 PolarHBondContact O-N 3.01Å
377	H	79.6	Confident	81.6	Confident	16 Å²	16	59.7 Å²	59.7	7%	0.074	33%	0.328	C	S	.	.			trans	-74.5	122.6	-173.2	-167.3	-112.7	0	0	0	111.4	F369 L373 L374 T379 N381	F369-H377 AromaticContact CD1-CE1 3.39Å; F369-H377 WeakPolarHBondContact CD1-CE1 3.44Å; F369-H377 AromaticContact CD1-ND1 3.68Å; F369-H377 AromaticContact CD1-NE2 3.73Å; F369-H377 AromaticContact CE1-CE1 3.58Å; L373-H377 PolarHBondContact O-N 3.21Å; L374-H377 WeakPolarHBondContact O-CB 3.42Å; L374-H377 PolarHBondContact O-N 2.8Å; L374-H377 VanDerWaalsContact O-N 3.11Å; H377-T379 PolarHBondContact CE1-OG1 2.86Å; H377-T379 PolarHBondContact ND1-OG1 3.01Å; H377-T379 PolarHBondContact O-N 2.77Å; H377-N381 PolarHBondContact O-N 2.97Å
378	P	72	Confident	81.5	Confident	95 Å²	95	63.2 Å²	63.2	62%	0.617	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-22.5	-162.1	25.9	-35.9	0	0	0	115.4
379	T	71.6	Confident	81.2	Confident	69 Å²	69	64.3 Å²	64.3	42%	0.423	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-60.3	174.9	55.9	0	0	0	0	111	H377 N381 A382 T383	H377-T379 PolarHBondContact CE1-OG1 2.86Å; H377-T379 PolarHBondContact ND1-OG1 3.01Å; H377-T379 PolarHBondContact O-N 2.77Å; T379-N381 PolarHBondContact O-N 2.89Å; T379-A382 WeakPolarHBondContact O-CA 3.47Å; T379-A382 VanDerWaalsContact O-CB 3.31Å; T379-A382 WeakPolarHBondContact O-CB 3.3Å; T379-A382 PolarHBondContact O-N 2.72Å; T379-T383 PolarHBondContact O-N 2.74Å
380	I	77.3	Confident	80.9	Confident	2 Å²	2	66.6 Å²	66.6	1%	0.01	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-36.3	-170.2	-72.7	178.2	0	0	0	113.9	F369 L374 A382 T383 V386	F369-I380 HydrophobicContact CB-CD1 4.28Å; F369-I380 HydrophobicContact CD1-CD1 3.53Å; F369-I380 HydrophobicContact CD2-CD1 3.45Å; F369-I380 VanDerWaalsContact CD2-CD1 3.45Å; F369-I380 HydrophobicContact CE1-CD1 3.54Å; F369-I380 HydrophobicContact CE2-CD1 3.45Å; F369-I380 VanDerWaalsContact CE2-CD1 3.45Å; F369-I380 HydrophobicContact CG-CD1 3.47Å; F369-I380 VanDerWaalsContact CG-CD1 3.47Å; F369-I380 HydrophobicContact CZ-CD1 3.49Å; F369-I380 VanDerWaalsContact CZ-CD1 3.49Å; L374-I380 HydrophobicContact CD1-CG2 3.87Å; I380-A382 VanDerWaalsContact C-N 3.28Å; I380-T383 PolarHBondContact O-OG1 2.82Å; I380-T383 VanDerWaalsContact O-OG1 3.1Å; I380-V386 HydrophobicContact CG2-CB 3.98Å; I380-V386 HydrophobicContact CG2-CG1 4.29Å; I380-V386 HydrophobicContact CG2-CG2 3.54Å
381	N	68.2	Low	80.6	Confident	91 Å²	91	70.2 Å²	70.2	49%	0.487	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-19.4	176.2	-159.2	11.1	0	0	0	111.9	E375 H377 T379	E375-N381 PolarHBondContact O-ND2 2.93Å; H377-N381 PolarHBondContact O-N 2.97Å; T379-N381 PolarHBondContact O-N 2.89Å
382	A	66.2	Low	80.1	Confident	82 Å²	82	73 Å²	73	68%	0.678	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-20.2	178.1	0	0	0	0	0	113.7	T379 I380 G384	T379-A382 WeakPolarHBondContact O-CA 3.47Å; T379-A382 VanDerWaalsContact O-CB 3.31Å; T379-A382 WeakPolarHBondContact O-CB 3.3Å; T379-A382 PolarHBondContact O-N 2.72Å; I380-A382 VanDerWaalsContact C-N 3.28Å; A382-G384 PolarHBondContact O-N 2.84Å
383	T	71.9	Confident	79.6	Confident	39 Å²	39	76.5 Å²	76.5	24%	0.239	40%	0.395	C	S	.	.	S	Bend	trans	-69.5	-21.4	176.4	71.6	0	0	0	0	112.8	T379 I380 K385 D405 H406	T379-T383 PolarHBondContact O-N 2.74Å; I380-T383 PolarHBondContact O-OG1 2.82Å; I380-T383 VanDerWaalsContact O-OG1 3.1Å; T383-K385 PolarHBondContact O-N 2.91Å; T383-K385 PolarHBondContact OG1-N 2.76Å; T383-D405 WeakPolarHBondContact CG2-OD2 3.18Å; T383-H406 PolarHBondContact OG1-NE2 2.87Å; T383-H406 VanDerWaalsContact OG1-NE2 3.16Å
384	G	78.9	Confident	79.4	Confident	44 Å²	44	75.6 Å²	75.6	45%	0.454	39%	0.391	S	S	.	.	S	Bend	trans	66.5	12.3	-175.4	0	0	0	0	0	114.2	A382 Y387	A382-G384 PolarHBondContact O-N 2.84Å; G384-Y387 PolarHBondContact O-OH 3.18Å
385	K	84.6	Confident	79.5	Confident	53 Å²	53	75 Å²	75	23%	0.23	39%	0.388	C	S	.	.			trans	-104.4	-9.5	-174.1	-74.2	173.8	167.9	-176.3	0	114.9	T383 Y387 I399 R400 G401 E403	T383-K385 PolarHBondContact O-N 2.91Å; T383-K385 PolarHBondContact OG1-N 2.76Å; K385-Y387 VanDerWaalsContact C-CE2 3.44Å; K385-Y387 VanDerWaalsContact O-CD2 3.27Å; K385-Y387 WeakPolarHBondContact O-CD2 3.45Å; K385-Y387 WeakPolarHBondContact O-CE2 3.33Å; K385-I399 WeakPolarHBondContact O-CA 3.49Å; K385-R400 WeakPolarHBondContact CB-O 3.47Å; K385-R400 WeakPolarHBondContact CD-O 3.31Å; K385-R400 VanDerWaalsContact CG-O 3.23Å; K385-R400 WeakPolarHBondContact CG-O 3.45Å; K385-R400 PolarHBondContact O-N 2.84Å; K385-G401 WeakPolarHBondContact CD-O 3.3Å; K385-G401 WeakPolarHBondContact CE-O 3.34Å; K385-G401 PolarHBondContact NZ-O 2.74Å; K385-E403 VanDerWaalsContact CD-OE2 3.26Å; K385-E403 WeakPolarHBondContact CD-OE2 3.2Å; K385-E403 WeakPolarHBondContact CE-OE2 3.3Å; K385-E403 IonicContact NZ-OE1 2.73Å; K385-E403 PolarHBondContact NZ-OE1 2.82Å; K385-E403 IonicContact NZ-OE2 2.75Å; K385-E403 PolarHBondContact NZ-OE2 3.09Å
386	V	87	Confident	80	Confident	23 Å²	23	71.2 Å²	71.2	14%	0.139	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	125	-179.2	-175.9	0	0	0	0	110.8	L374 I380 V397 T398 I399 H406	L374-V386 HydrophobicContact CD2-CG1 4.37Å; I380-V386 HydrophobicContact CG2-CB 3.98Å; I380-V386 HydrophobicContact CG2-CG1 4.29Å; I380-V386 HydrophobicContact CG2-CG2 3.54Å; V386-V397 HydrophobicContact CG1-CG1 3.57Å; V386-T398 WeakPolarHBondContact CA-O 3.35Å; V386-I399 HydrophobicContact CG1-CG1 4.41Å; V386-I399 HydrophobicContact CG2-CB 4.47Å; V386-I399 HydrophobicContact CG2-CG1 4.04Å; V386-I399 HydrophobicContact CG2-CG2 4.1Å; V386-H406 VanDerWaalsContact CG2-CD2 3.49Å; V386-H406 WeakPolarHBondContact CG2-CD2 3.21Å
387	Y	88.4	Confident	80.6	Confident	105 Å²	105	65.1 Å²	65.1	41%	0.412	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	127.8	-172.1	-56.4	-89.4	0	0	0	110.8	G384 K385 V397 T398 R400	G384-Y387 PolarHBondContact O-OH 3.18Å; K385-Y387 VanDerWaalsContact C-CE2 3.44Å; K385-Y387 VanDerWaalsContact O-CD2 3.27Å; K385-Y387 WeakPolarHBondContact O-CD2 3.45Å; K385-Y387 WeakPolarHBondContact O-CE2 3.33Å; Y387-V397 CarbonylContact O-C 3.59Å; Y387-V397 WeakPolarHBondContact O-CA 3.49Å; Y387-T398 PolarHBondContact N-O 2.91Å; Y387-T398 PolarHBondContact O-N 2.62Å; Y387-R400 HydrophobicContact CD2-CG 4.24Å; Y387-R400 HydrophobicContact CE2-CB 4.27Å; Y387-R400 HydrophobicContact CE2-CG 4.07Å
388	R	88.1	Confident	81.1	Confident	75 Å²	75	64.6 Å²	64.6	28%	0.283	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	133.4	172.8	-178.2	-177.2	169.1	151.4	11.2	110.9	P362 V365 E375 D390 I396	P362-R388 PolarHBondContact O-NH2 2.81Å; V365-R388 PolarHBondContact O-NH1 2.86Å; V365-R388 PolarHBondContact O-NH2 3.4Å; E375-R388 IonicContact OE1-CZ 3.07Å; E375-R388 IonicContact OE1-NH1 3.28Å; E375-R388 PolarHBondContact OE1-NH1 2.86Å; R388-D390 IonicContact CZ-OD1 3.45Å; R388-D390 IonicContact CZ-OD2 3.48Å; R388-D390 IonicContact NE-OD1 3.37Å; R388-D390 PolarHBondContact NE-OD1 2.89Å; R388-D390 VanDerWaalsContact NE-OD1 3.08Å; R388-D390 IonicContact NE-OD2 2.66Å; R388-D390 PolarHBondContact NE-OD2 3.33Å; R388-D390 IonicContact NH2-OD1 2.69Å; R388-D390 PolarHBondContact NH2-OD1 2.96Å; R388-D390 IonicContact NH2-OD2 3.37Å; R388-D390 PolarHBondContact NH2-OD2 2.95Å; R388-I396 CarbonylContact C-O 3.57Å; R388-I396 WeakPolarHBondContact CA-O 3.26Å
389	I	85.6	Confident	82	Confident	60 Å²	60	60.1 Å²	60.1	31%	0.308	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	109.5	176.8	-53	176.9	0	0	0	109.1	R391 I396	I389-R391 HydrophobicContact CG2-CG 4.37Å; I389-I396 HydrophobicContact CB-CB 4.4Å; I389-I396 PolarHBondContact N-O 3.44Å; I389-I396 PolarHBondContact O-N 3.2Å
390	D	84.5	Confident	82.8	Confident	59 Å²	59	63.5 Å²	63.5	32%	0.316	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	129.6	174.8	-60.8	-48.7	0	0	0	111.4	P362 R388 S395	P362-D390 HydrophobicContact CB-CB 4.1Å; R388-D390 IonicContact CZ-OD1 3.45Å; R388-D390 IonicContact CZ-OD2 3.48Å; R388-D390 IonicContact NE-OD1 3.37Å; R388-D390 PolarHBondContact NE-OD1 2.89Å; R388-D390 VanDerWaalsContact NE-OD1 3.08Å; R388-D390 IonicContact NE-OD2 2.66Å; R388-D390 PolarHBondContact NE-OD2 3.33Å; R388-D390 IonicContact NH2-OD1 2.69Å; R388-D390 PolarHBondContact NH2-OD1 2.96Å; R388-D390 IonicContact NH2-OD2 3.37Å; R388-D390 PolarHBondContact NH2-OD2 2.95Å; D390-S395 VanDerWaalsContact OD1-CB 3.32Å; D390-S395 WeakPolarHBondContact OD1-CB 3.08Å; D390-S395 PolarHBondContact OD1-OG 2.77Å
391	R	81	Confident	83.1	Confident	164 Å²	164	64.3 Å²	64.3	62%	0.619	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.4	160	175	-60.8	-59.7	-167.2	-166.4	4.4	109.8	P362 I389 R393 V394	P362-R391 WeakPolarHBondContact CG-O 3.39Å; I389-R391 HydrophobicContact CG2-CG 4.37Å; R391-R393 PolarHBondContact O-N 2.88Å; R391-V394 HydrophobicContact CB-CG1 3.88Å; R391-V394 PolarHBondContact N-O 3.49Å; R391-V394 PolarHBondContact O-N 3.1Å
392	L	73.7	Confident	84	Confident	168 Å²	168	60 Å²	60	88%	0.88	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.1	-22	-164.7	-68.4	173.3	0	0	0	119.1
393	R	77.9	Confident	84.8	Confident	176 Å²	176	60 Å²	60	66%	0.664	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.2	-8.8	173.7	-63.4	-175.4	179.1	177.3	-1.3	115.1	E356 F357 R391	E356-R393 WeakPolarHBondContact CA-O 3.29Å; E356-R393 HydrophobicContact CG-CB 4.33Å; E356-R393 WeakPolarHBondContact OE1-CB 3.4Å; F357-R393 PolarHBondContact N-O 3.25Å; R391-R393 PolarHBondContact O-N 2.88Å
394	V	85.2	Confident	85.1	Confident	28 Å²	28	64.2 Å²	64.2	17%	0.17	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	131.5	-166.9	61.9	0	0	0	0	110	H354 C355 E356 R391 I396	H354-V394 HydrophobicContact CB-CG2 4.17Å; C355-V394 WeakPolarHBondContact O-CA 2.91Å; E356-V394 HydrophobicContact CB-CB 4.28Å; E356-V394 HydrophobicContact CB-CG2 4.35Å; R391-V394 HydrophobicContact CB-CG1 3.88Å; R391-V394 PolarHBondContact N-O 3.49Å; R391-V394 PolarHBondContact O-N 3.1Å; V394-I396 HydrophobicContact CG1-CD1 4.27Å; V394-I396 HydrophobicContact CG1-CG1 4.33Å; V394-I396 HydrophobicContact CG2-CG1 3.88Å
395	S	89.3	Confident	85.3	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	136.7	164.5	-166.7	0	0	0	0	108	C355 W367 D390	C355-S395 WeakPolarHBondContact CB-O 3.4Å; C355-S395 PolarHBondContact N-O 2.72Å; C355-S395 PolarHBondContact O-N 3.13Å; W367-S395 PolarHBondContact NE1-OG 2.77Å; D390-S395 VanDerWaalsContact OD1-CB 3.32Å; D390-S395 WeakPolarHBondContact OD1-CB 3.08Å; D390-S395 PolarHBondContact OD1-OG 2.77Å
396	I	89.9	Confident	85.5	Confident	18 Å²	18	62.9 Å²	62.9	9%	0.092	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	136.6	-175.9	-53	168.1	0	0	0	109	E352 L353 R388 I389 V394	E352-I396 HydrophobicContact CB-CG2 4.2Å; L353-I396 CarbonylContact O-C 3.26Å; L353-I396 VanDerWaalsContact O-CA 3.29Å; L353-I396 WeakPolarHBondContact O-CA 3.16Å; R388-I396 CarbonylContact C-O 3.57Å; R388-I396 WeakPolarHBondContact CA-O 3.26Å; I389-I396 HydrophobicContact CB-CB 4.4Å; I389-I396 PolarHBondContact N-O 3.44Å; I389-I396 PolarHBondContact O-N 3.2Å; V394-I396 HydrophobicContact CG1-CD1 4.27Å; V394-I396 HydrophobicContact CG1-CG1 4.33Å; V394-I396 HydrophobicContact CG2-CG1 3.88Å
397	V	91.6	Very high	85.5	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	114.2	166.8	165.1	0	0	0	0	109.4	E352 L353 W367 L374 V386 Y387 I399	E352-V397 CarbonylContact C-O 3.55Å; E352-V397 WeakPolarHBondContact CA-O 3.45Å; L353-V397 HydrophobicContact CB-CB 4.39Å; L353-V397 PolarHBondContact N-O 3.2Å; L353-V397 PolarHBondContact O-N 2.83Å; W367-V397 HydrophobicContact CD2-CB 4.44Å; W367-V397 HydrophobicContact CD2-CG2 3.45Å; W367-V397 VanDerWaalsContact CD2-CG2 3.45Å; W367-V397 VanDerWaalsContact CE2-CG2 3.49Å; W367-V397 HydrophobicContact CE3-CB 4.26Å; W367-V397 HydrophobicContact CE3-CG2 3.66Å; W367-V397 HydrophobicContact CG-CG2 3.96Å; W367-V397 HydrophobicContact CH2-CB 3.91Å; W367-V397 HydrophobicContact CH2-CG2 3.9Å; W367-V397 HydrophobicContact CZ2-CB 4.15Å; W367-V397 HydrophobicContact CZ2-CG2 3.74Å; W367-V397 HydrophobicContact CZ3-CB 3.97Å; W367-V397 HydrophobicContact CZ3-CG2 3.86Å; L374-V397 HydrophobicContact CD2-CG1 4.28Å; L374-V397 HydrophobicContact CD2-CG2 3.77Å; V386-V397 HydrophobicContact CG1-CG1 3.57Å; Y387-V397 CarbonylContact O-C 3.59Å; Y387-V397 WeakPolarHBondContact O-CA 3.49Å; V397-I399 HydrophobicContact CG1-CG1 4.31Å
398	T	91	Very high	85.5	Confident	6 Å²	6	58.4 Å²	58.4	4%	0.037	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	128	174.1	-51.8	0	0	0	0	109.4	T350 R351 E352 V386 Y387 R400	T350-T398 HydrophobicContact CG2-CG2 4.2Å; R351-T398 CarbonylContact O-C 3.56Å; R351-T398 WeakPolarHBondContact O-CA 3.47Å; E352-T398 HydrophobicContact CG-CG2 4.15Å; V386-T398 WeakPolarHBondContact CA-O 3.35Å; Y387-T398 PolarHBondContact N-O 2.91Å; Y387-T398 PolarHBondContact O-N 2.62Å; T398-R400 HydrophobicContact CG2-CG 4Å
399	I	90.9	Very high	85.6	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	123.2	172.7	-52	166.7	0	0	0	107.5	T350 R351 K385 V386 V397 I402 H406 Y410 L423	T350-I399 CarbonylContact C-O 3.59Å; T350-I399 VanDerWaalsContact CA-O 3.28Å; T350-I399 WeakPolarHBondContact CA-O 3.35Å; R351-I399 PolarHBondContact N-O 3.21Å; R351-I399 PolarHBondContact O-N 2.72Å; K385-I399 WeakPolarHBondContact O-CA 3.49Å; V386-I399 HydrophobicContact CG1-CG1 4.41Å; V386-I399 HydrophobicContact CG2-CB 4.47Å; V386-I399 HydrophobicContact CG2-CG1 4.04Å; V386-I399 HydrophobicContact CG2-CG2 4.1Å; V397-I399 HydrophobicContact CG1-CG1 4.31Å; I399-I402 HydrophobicContact CB-CG1 4.16Å; I399-I402 HydrophobicContact CG2-CD1 4.4Å; I399-I402 HydrophobicContact CG2-CG1 3.52Å; I399-H406 HydrophobicContact CG2-CB 4.48Å; I399-H406 VanDerWaalsContact CG2-CD2 3.42Å; I399-H406 WeakPolarHBondContact CG2-CD2 3.44Å; I399-Y410 HydrophobicContact CD1-CE1 4.33Å; I399-Y410 HydrophobicContact CD1-CE2 4.1Å; I399-Y410 WeakPolarHBondContact CD1-OH 3.05Å; I399-L423 HydrophobicContact CD1-CD2 3.59Å
400	R	88.5	Confident	85.9	Confident	140 Å²	140	53.3 Å²	53.3	53%	0.528	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	119	-175.9	-66.4	-175.6	174.9	177.6	-3.3	112.2	T350 K385 Y387 T398	T350-R400 HydrophobicContact CG2-CG 3.97Å; K385-R400 WeakPolarHBondContact CB-O 3.47Å; K385-R400 WeakPolarHBondContact CD-O 3.31Å; K385-R400 VanDerWaalsContact CG-O 3.23Å; K385-R400 WeakPolarHBondContact CG-O 3.45Å; K385-R400 PolarHBondContact O-N 2.84Å; Y387-R400 HydrophobicContact CD2-CG 4.24Å; Y387-R400 HydrophobicContact CE2-CB 4.27Å; Y387-R400 HydrophobicContact CE2-CG 4.07Å; T398-R400 HydrophobicContact CG2-CG 4Å
401	G	83.1	Confident	86.3	Confident	19 Å²	19	51 Å²	51	20%	0.196	24%	0.243	C	C	.	.	S	Bend	trans	73.1	54.8	179.1	0	0	0	0	0	111.4	E349 K385	E349-G401 WeakPolarHBondContact O-CA 3.14Å; E349-G401 PolarHBondContact O-N 3.04Å; K385-G401 WeakPolarHBondContact CD-O 3.3Å; K385-G401 WeakPolarHBondContact CE-O 3.34Å; K385-G401 PolarHBondContact NZ-O 2.74Å
402	I	86	Confident	86.8	Confident	2 Å²	2	43.2 Å²	43.2	1%	0.01	21%	0.214	C	C	.	.			trans	-46.4	138	-174	-78.4	168.3	0	0	0	112.5	S345 P347 G348 E349 R351 I399 L423 V425	S345-I402 VanDerWaalsContact OG-CD1 3.31Å; S345-I402 WeakPolarHBondContact OG-CD1 3.29Å; P347-I402 CarbonylContact C-O 3.54Å; P347-I402 VanDerWaalsContact CA-O 3.29Å; P347-I402 WeakPolarHBondContact CA-O 3.38Å; G348-I402 PolarHBondContact N-O 2.99Å; E349-I402 PolarHBondContact O-N 2.81Å; R351-I402 HydrophobicContact CB-CD1 3.93Å; R351-I402 HydrophobicContact CG-CD1 3.38Å; I399-I402 HydrophobicContact CB-CG1 4.16Å; I399-I402 HydrophobicContact CG2-CD1 4.4Å; I399-I402 HydrophobicContact CG2-CG1 3.52Å; I402-L423 HydrophobicContact CD1-CD2 4.26Å; I402-V425 HydrophobicContact CG2-CB 4.3Å; I402-V425 HydrophobicContact CG2-CG1 3.74Å; I402-V425 HydrophobicContact CG2-CG2 3.54Å
403	E	83	Confident	87.6	Confident	81 Å²	81	38 Å²	38	38%	0.379	18%	0.183	S	C	.	.			trans	-121.9	162.8	171.8	-77.5	152.9	157.1	0	0	109.9	K385 D405 H406	K385-E403 VanDerWaalsContact CD-OE2 3.26Å; K385-E403 WeakPolarHBondContact CD-OE2 3.2Å; K385-E403 WeakPolarHBondContact CE-OE2 3.3Å; K385-E403 IonicContact NZ-OE1 2.73Å; K385-E403 PolarHBondContact NZ-OE1 2.82Å; K385-E403 IonicContact NZ-OE2 2.75Å; K385-E403 PolarHBondContact NZ-OE2 3.09Å; E403-D405 WeakPolarHBondContact CB-OD1 3.27Å; E403-D405 PolarHBondContact O-N 3.4Å; E403-D405 VanDerWaalsContact O-N 3.12Å; E403-H406 PolarHBondContact N-ND1 3.44Å; E403-H406 WeakPolarHBondContact O-CB 3.48Å; E403-H406 PolarHBondContact O-N 2.7Å; E403-H406 PolarHBondContact O-ND1 3.1Å; E403-H406 IonicContact OE2-CE1 3.99Å; E403-H406 PolarHBondContact OE2-CE1 2.73Å
404	Q	79.5	Confident	88.1	Confident	128 Å²	128	31 Å²	31	60%	0.598	16%	0.158	S	C	*	.	G	3₁₀ helix	trans	-57.6	-28.6	-174.3	-161.9	178.3	48.8	0	0	113.3	H406 G407	Q404-H406 VanDerWaalsContact C-N 3.32Å; Q404-H406 PolarHBondContact O-N 3.39Å; Q404-G407 PolarHBondContact O-N 2.92Å
405	D	83.2	Confident	87.9	Confident	68 Å²	68	33.8 Å²	33.8	36%	0.364	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-76.4	-11.8	178.3	73	-37.8	0	0	0	114.7	T383 E403 G407	T383-D405 WeakPolarHBondContact CG2-OD2 3.18Å; E403-D405 WeakPolarHBondContact CB-OD1 3.27Å; E403-D405 PolarHBondContact O-N 3.4Å; E403-D405 VanDerWaalsContact O-N 3.12Å; D405-G407 VanDerWaalsContact C-N 3.26Å
406	H	88.9	Confident	87.6	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-82.3	-7.2	170.8	-61.2	71.7	0	0	0	111.8	T383 V386 I399 E403 Q404 Y410 L423	T383-H406 PolarHBondContact OG1-NE2 2.87Å; T383-H406 VanDerWaalsContact OG1-NE2 3.16Å; V386-H406 VanDerWaalsContact CG2-CD2 3.49Å; V386-H406 WeakPolarHBondContact CG2-CD2 3.21Å; I399-H406 HydrophobicContact CG2-CB 4.48Å; I399-H406 VanDerWaalsContact CG2-CD2 3.42Å; I399-H406 WeakPolarHBondContact CG2-CD2 3.44Å; E403-H406 PolarHBondContact N-ND1 3.44Å; E403-H406 WeakPolarHBondContact O-CB 3.48Å; E403-H406 PolarHBondContact O-N 2.7Å; E403-H406 PolarHBondContact O-ND1 3.1Å; E403-H406 IonicContact OE2-CE1 3.99Å; E403-H406 PolarHBondContact OE2-CE1 2.73Å; Q404-H406 VanDerWaalsContact C-N 3.32Å; Q404-H406 PolarHBondContact O-N 3.39Å; H406-Y410 WeakPolarHBondContact O-CE2 3.46Å; H406-Y410 PolarHBondContact O-OH 2.9Å; H406-L423 HydrophobicContact CB-CD2 4.44Å
407	G	86.8	Confident	87.4	Confident	29 Å²	29	49.3 Å²	49.3	30%	0.299	26%	0.258	S	S	.	.			trans	-70.6	128	175.8	0	0	0	0	0	112.3	F369 Q404 D405 L423	F369-G407 WeakPolarHBondContact CZ-O 3.14Å; Q404-G407 PolarHBondContact O-N 2.92Å; D405-G407 VanDerWaalsContact C-N 3.26Å; G407-L423 CarbonylContact C-O 3.57Å; G407-L423 WeakPolarHBondContact CA-O 3.5Å
408	G	88.4	Confident	87.3	Confident	5 Å²	5	52.3 Å²	52.3	5%	0.052	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	152.6	-172.5	-179.3	0	0	0	0	0	114.3	H422 L423	G408-H422 WeakPolarHBondContact O-CA 3.3Å; G408-L423 PolarHBondContact N-O 2.83Å; G408-L423 PolarHBondContact O-N 2.85Å
409	T	89.5	Confident	87.2	Confident	29 Å²	29	53.5 Å²	53.5	18%	0.178	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	112.8	-173.2	-42.4	0	0	0	0	111.5	F369 E370 E411 H422	F369-T409 CarbonylContact C-O 3.57Å; F369-T409 VanDerWaalsContact CA-O 3.31Å; F369-T409 WeakPolarHBondContact CA-O 3.21Å; E370-T409 PolarHBondContact N-O 2.75Å; E370-T409 WeakPolarHBondContact OE1-CA 3.4Å; E370-T409 WeakPolarHBondContact OE1-CB 3.41Å; E370-T409 PolarHBondContact OE1-N 2.79Å; E370-T409 PolarHBondContact OE1-OG1 2.84Å; T409-E411 HydrophobicContact CG2-CG 4.45Å; T409-H422 PolarHBondContact N-ND1 2.9Å; T409-H422 PolarHBondContact OG1-ND1 3.03Å
410	Y	92.6	Very high	87.3	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	133.9	170.1	-69.8	-95.3	0	0	0	110.3	M335 L353 Y368 F369 L374 I399 H406 Q420 T421 L423	M335-Y410 WeakPolarHBondContact CE-O 3.37Å; L353-Y410 HydrophobicContact CD1-CD1 3.74Å; L353-Y410 HydrophobicContact CD1-CD2 3.77Å; L353-Y410 HydrophobicContact CD1-CE1 4.29Å; L353-Y410 HydrophobicContact CD1-CE2 4.31Å; L353-Y410 HydrophobicContact CD1-CG 3.45Å; L353-Y410 VanDerWaalsContact CD1-CG 3.45Å; Y368-Y410 WeakPolarHBondContact O-CA 3.36Å; F369-Y410 HydrophobicContact CB-CD1 4.49Å; F369-Y410 HydrophobicContact CD2-CD1 4.05Å; F369-Y410 AromaticContact CD2-CD2 3.92Å; F369-Y410 HydrophobicContact CD2-CD2 3.92Å; F369-Y410 AromaticContact CD2-CE1 3.81Å; F369-Y410 HydrophobicContact CD2-CE1 3.81Å; F369-Y410 AromaticContact CD2-CE2 3.67Å; F369-Y410 HydrophobicContact CD2-CE2 3.67Å; F369-Y410 HydrophobicContact CD2-CG 4.1Å; F369-Y410 AromaticContact CD2-CZ 3.62Å; F369-Y410 HydrophobicContact CE2-CD2 4.25Å; F369-Y410 AromaticContact CE2-CE2 3.76Å; F369-Y410 HydrophobicContact CE2-CE2 3.76Å; F369-Y410 AromaticContact CE2-CZ 3.96Å; L374-Y410 HydrophobicContact CD1-CD1 4.49Å; L374-Y410 HydrophobicContact CD1-CE1 4.07Å; I399-Y410 HydrophobicContact CD1-CE1 4.33Å; I399-Y410 HydrophobicContact CD1-CE2 4.1Å; I399-Y410 WeakPolarHBondContact CD1-OH 3.05Å; H406-Y410 WeakPolarHBondContact O-CE2 3.46Å; H406-Y410 PolarHBondContact O-OH 2.9Å; Y410-Q420 CarbonylContact O-C 3.57Å; Y410-Q420 VanDerWaalsContact O-CA 3.26Å; Y410-Q420 WeakPolarHBondContact O-CA 3.32Å; Y410-T421 PolarHBondContact N-O 2.65Å; Y410-T421 PolarHBondContact O-N 3.45Å; Y410-T421 VanDerWaalsContact O-O 3.07Å; Y410-L423 HydrophobicContact CD2-CB 4.25Å; Y410-L423 HydrophobicContact CE2-CB 3.99Å; Y410-L423 HydrophobicContact CE2-CD2 4.13Å
411	E	92.5	Very high	87.3	Confident	10 Å²	10	48.9 Å²	48.9	5%	0.047	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	143.3	174.4	-53.9	178.9	-130.3	0	0	111.1	W367 Y368 T409 R413 K419 Q420	W367-E411 CarbonylContact C-O 3.45Å; W367-E411 WeakPolarHBondContact CA-O 3.2Å; Y368-E411 PolarHBondContact N-O 2.66Å; Y368-E411 PolarHBondContact O-N 2.74Å; T409-E411 HydrophobicContact CG2-CG 4.45Å; E411-R413 HydrophobicContact CB-CG 4.47Å; E411-R413 IonicContact OE1-CZ 3.17Å; E411-R413 IonicContact OE1-NH2 2.78Å; E411-R413 PolarHBondContact OE1-NH2 2.87Å; E411-R413 IonicContact OE2-CZ 2.75Å; E411-R413 IonicContact OE2-NE 3.94Å; E411-R413 PolarHBondContact OE2-NE 2.83Å; E411-R413 IonicContact OE2-NH2 3.25Å; E411-R413 PolarHBondContact OE2-NH2 2.88Å; E411-K419 WeakPolarHBondContact CA-O 3.47Å; E411-Q420 HydrophobicContact CB-CB 4.46Å; E411-Q420 HydrophobicContact CG-CB 3.89Å
412	C	91.8	Very high	87.5	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	126.2	164.5	62.4	0	0	0	0	108.9	M335 C355 V365 R366 W367 K419	M335-C412 HydrophobicContact CE-CB 4.26Å; M335-C412 HydrophobicContact SD-CB 4.36Å; C355-C412 HydrophobicContact CB-CB 3.86Å; C355-C412 WeakPolarHBondContact CB-SG 3.18Å; C355-C412 WeakPolarHBondContact SG-CB 2.98Å; C355-C412 CovalentContact SG-SG 2.03Å; C355-C412 PolarHBondContact SG-SG 2.9Å; V365-C412 HydrophobicContact CG1-CB 3.78Å; R366-C412 WeakPolarHBondContact O-CA 3.4Å; W367-C412 HydrophobicContact CD2-CB 4.09Å; W367-C412 HydrophobicContact CE3-CB 4.21Å; W367-C412 HydrophobicContact CH2-CB 4.43Å; W367-C412 HydrophobicContact CZ2-CB 4.28Å; W367-C412 HydrophobicContact CZ3-CB 4.4Å; C412-K419 PolarHBondContact N-O 2.94Å; C412-K419 PolarHBondContact O-N 3.24Å
413	R	90.5	Very high	87.6	Confident	59 Å²	59	50.1 Å²	50.1	22%	0.223	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	135.8	-173.5	-51.2	-173.6	-178.9	159.2	-8.4	110.4	R366 Y368 N371 E411 D417 I418	R366-R413 PolarHBondContact N-O 2.78Å; R366-R413 PolarHBondContact O-N 2.8Å; Y368-R413 HydrophobicContact CD2-CB 4.41Å; Y368-R413 HydrophobicContact CD2-CG 3.78Å; Y368-R413 HydrophobicContact CE2-CB 4.02Å; Y368-R413 HydrophobicContact CE2-CG 3.81Å; N371-R413 PolarHBondContact OD1-NH2 2.94Å; E411-R413 HydrophobicContact CB-CG 4.47Å; E411-R413 IonicContact OE1-CZ 3.17Å; E411-R413 IonicContact OE1-NH2 2.78Å; E411-R413 PolarHBondContact OE1-NH2 2.87Å; E411-R413 IonicContact OE2-CZ 2.75Å; E411-R413 IonicContact OE2-NE 3.94Å; E411-R413 PolarHBondContact OE2-NE 2.83Å; E411-R413 IonicContact OE2-NH2 3.25Å; E411-R413 PolarHBondContact OE2-NH2 2.88Å; R413-D417 WeakPolarHBondContact CA-O 3.15Å; R413-I418 HydrophobicContact CB-CG1 4.41Å; R413-I418 HydrophobicContact CG-CD1 4.43Å; R413-I418 HydrophobicContact CG-CG1 4.03Å; R413-I418 HydrophobicContact CG-CG2 4.23Å
414	I	86.9	Confident	87.7	Confident	28 Å²	28	47.9 Å²	47.9	14%	0.144	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	121	169.8	-169.4	174.8	0	0	0	110.7	F357 A360 D364 V365 R416 D417	F357-I414 HydrophobicContact CB-CG2 4.44Å; F357-I414 HydrophobicContact CD1-CG2 3.78Å; F357-I414 HydrophobicContact CD2-CB 4.41Å; F357-I414 HydrophobicContact CD2-CG2 3.58Å; F357-I414 HydrophobicContact CE1-CG2 3.79Å; F357-I414 HydrophobicContact CE2-CB 4.24Å; F357-I414 HydrophobicContact CE2-CG2 3.54Å; F357-I414 HydrophobicContact CG-CG2 3.69Å; F357-I414 HydrophobicContact CZ-CG2 3.66Å; A360-I414 HydrophobicContact CB-CD1 3.5Å; A360-I414 VanDerWaalsContact CB-CD1 3.5Å; D364-I414 HydrophobicContact CB-CD1 3.85Å; D364-I414 HydrophobicContact CB-CG1 4.15Å; V365-I414 HydrophobicContact CG2-CB 4.45Å; V365-I414 HydrophobicContact CG2-CD1 4.26Å; I414-R416 PolarHBondContact O-N 2.93Å; I414-D417 HydrophobicContact CG2-CB 4.17Å; I414-D417 PolarHBondContact N-O 2.84Å; I414-D417 PolarHBondContact O-N 2.73Å
415	G	82.2	Confident	87.8	Confident	88 Å²	88	42.8 Å²	42.8	91%	0.907	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	61	-96.5	-178.8	0	0	0	0	0	113.2
416	R	83.1	Confident	87.2	Confident	241 Å²	241	43.9 Å²	43.9	91%	0.909	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-117	-11.9	172.3	-68.2	-176.5	178.6	175.6	-0.2	113.5	I414	I414-R416 PolarHBondContact O-N 2.93Å
417	D	86.1	Confident	86	Confident	102 Å²	102	45.5 Å²	45.5	55%	0.545	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	132.5	-176.1	-56.9	-44.7	0	0	0	109.4	F357 R413 I414	F357-D417 HydrophobicContact CD1-CB 4.28Å; F357-D417 HydrophobicContact CE1-CB 3.71Å; F357-D417 HydrophobicContact CZ-CB 4.45Å; R413-D417 WeakPolarHBondContact CA-O 3.15Å; I414-D417 HydrophobicContact CG2-CB 4.17Å; I414-D417 PolarHBondContact N-O 2.84Å; I414-D417 PolarHBondContact O-N 2.73Å
418	I	89	Confident	84.9	Confident	64 Å²	64	47.6 Å²	47.6	33%	0.328	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	131.1	-179.9	-57.3	-178.4	0	0	0	107.3	P338 R413	P338-I418 VanDerWaalsContact CD-O 3.31Å; P338-I418 WeakPolarHBondContact CD-O 3.41Å; P338-I418 HydrophobicContact CG-CG2 4.19Å; R413-I418 HydrophobicContact CB-CG1 4.41Å; R413-I418 HydrophobicContact CG-CD1 4.43Å; R413-I418 HydrophobicContact CG-CG1 4.03Å; R413-I418 HydrophobicContact CG-CG2 4.23Å
419	K	89.7	Confident	83.7	Confident	31 Å²	31	54.1 Å²	54.1	14%	0.135	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	147.1	161.5	-63.1	169.6	142	-168.2	0	108.2	E334 M335 S336 E356 F357 E411 C412	E334-K419 IonicContact OE1-NZ 3.38Å; E334-K419 PolarHBondContact OE1-NZ 3.35Å; M335-K419 HydrophobicContact CB-CB 3.76Å; M335-K419 HydrophobicContact CB-CD 4.37Å; M335-K419 WeakPolarHBondContact CE-O 3.25Å; M335-K419 WeakPolarHBondContact O-CD 3.17Å; M335-K419 WeakPolarHBondContact O-CE 3.49Å; M335-K419 PolarHBondContact O-NZ 2.83Å; S336-K419 CarbonylContact O-C 3.58Å; S336-K419 VanDerWaalsContact O-CA 3.27Å; S336-K419 WeakPolarHBondContact O-CA 3.49Å; E356-K419 WeakPolarHBondContact O-CE 3.48Å; E356-K419 PolarHBondContact O-NZ 2.92Å; F357-K419 HydrophobicContact CE1-CD 3.95Å; F357-K419 HydrophobicContact CE1-CG 4.01Å; F357-K419 HydrophobicContact CZ-CD 3.98Å; F357-K419 HydrophobicContact CZ-CG 4.03Å; E411-K419 WeakPolarHBondContact CA-O 3.47Å; C412-K419 PolarHBondContact N-O 2.94Å; C412-K419 PolarHBondContact O-N 3.24Å
420	Q	91.2	Very high	83.1	Confident	42 Å²	42	53 Å²	53	20%	0.196	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	156.9	179.1	76.1	-175.1	33.8	0	0	112.1	S336 P338 P339 G340 S341 Y410 E411	S336-Q420 PolarHBondContact O-N 2.83Å; P338-Q420 HydrophobicContact CB-CG 4.48Å; P338-Q420 HydrophobicContact CG-CG 4.24Å; P339-Q420 VanDerWaalsContact C-NE2 3.27Å; P339-Q420 PolarHBondContact O-NE2 2.78Å; G340-Q420 WeakPolarHBondContact CA-O 3.28Å; S341-Q420 PolarHBondContact N-O 3.46Å; Y410-Q420 CarbonylContact O-C 3.57Å; Y410-Q420 VanDerWaalsContact O-CA 3.26Å; Y410-Q420 WeakPolarHBondContact O-CA 3.32Å; E411-Q420 HydrophobicContact CB-CB 4.46Å; E411-Q420 HydrophobicContact CG-CB 3.89Å
421	T	89.4	Confident	82.8	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.006	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	148.7	170.2	-167.7	0	0	0	0	108.9	M335 S341 L353 Y410	M335-T421 HydrophobicContact CE-CG2 4.06Å; M335-T421 HydrophobicContact CG-CG2 3.9Å; M335-T421 HydrophobicContact SD-CG2 4.26Å; S341-T421 CarbonylContact O-C 3.56Å; S341-T421 WeakPolarHBondContact O-CA 3.4Å; S341-T421 PolarHBondContact O-OG1 2.76Å; S341-T421 VanDerWaalsContact O-OG1 3.05Å; S341-T421 WeakPolarHBondContact OG-CB 3.4Å; S341-T421 PolarHBondContact OG-OG1 3.37Å; L353-T421 HydrophobicContact CD1-CG2 3.92Å; L353-T421 HydrophobicContact CD2-CG2 3.95Å; L353-T421 HydrophobicContact CG-CG2 4.36Å; Y410-T421 PolarHBondContact N-O 2.65Å; Y410-T421 PolarHBondContact O-N 3.45Å; Y410-T421 VanDerWaalsContact O-O 3.07Å
422	H	87	Confident	82.5	Confident	44 Å²	44	57.2 Å²	57.2	20%	0.204	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	123.2	179.2	-168.3	97.8	0	0	0	109.6	Y294 S341 V342 M343 G408 T409	Y294-H422 AromaticContact CZ-CD2 3.46Å; Y294-H422 VanDerWaalsContact CZ-CD2 3.46Å; Y294-H422 AromaticContact CZ-CG 3.92Å; Y294-H422 AromaticContact CZ-NE2 3.88Å; Y294-H422 VanDerWaalsContact OH-CB 3.31Å; Y294-H422 WeakPolarHBondContact OH-CB 3.4Å; Y294-H422 PolarHBondContact OH-CD2 2.84Å; Y294-H422 VanDerWaalsContact OH-CG 3.24Å; S341-H422 PolarHBondContact O-N 3.5Å; V342-H422 WeakPolarHBondContact CA-O 3.32Å; V342-H422 HydrophobicContact CG2-CB 4.41Å; M343-H422 PolarHBondContact N-O 2.78Å; G408-H422 WeakPolarHBondContact O-CA 3.3Å; T409-H422 PolarHBondContact N-ND1 2.9Å; T409-H422 PolarHBondContact OG1-ND1 3.03Å
423	L	88.7	Confident	82.3	Confident	2 Å²	2	57.3 Å²	57.3	1%	0.01	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	117.6	178.8	177.2	54.7	0	0	0	109.3	M343 I399 I402 H406 G407 G408 Y410 V425	M343-L423 HydrophobicContact CB-CD1 4.14Å; M343-L423 HydrophobicContact CG-CD1 3.83Å; M343-L423 CarbonylContact O-C 3.56Å; M343-L423 WeakPolarHBondContact O-CA 3.4Å; M343-L423 HydrophobicContact SD-CD1 4.03Å; I399-L423 HydrophobicContact CD1-CD2 3.59Å; I402-L423 HydrophobicContact CD1-CD2 4.26Å; H406-L423 HydrophobicContact CB-CD2 4.44Å; G407-L423 CarbonylContact C-O 3.57Å; G407-L423 WeakPolarHBondContact CA-O 3.5Å; G408-L423 PolarHBondContact N-O 2.83Å; G408-L423 PolarHBondContact O-N 2.85Å; Y410-L423 HydrophobicContact CD2-CB 4.25Å; Y410-L423 HydrophobicContact CE2-CB 3.99Å; Y410-L423 HydrophobicContact CE2-CD2 4.13Å; L423-V425 HydrophobicContact CG-CG2 4.2Å
424	V	83.6	Confident	82.2	Confident	35 Å²	35	59 Å²	59	21%	0.212	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	120	170.4	-177.5	0	0	0	0	108.2	Y294 L325 V342 M343 V344 S345	Y294-V424 HydrophobicContact CE1-CG2 3.76Å; L325-V424 HydrophobicContact CD1-CB 4.47Å; L325-V424 HydrophobicContact CD1-CG1 4.4Å; L325-V424 HydrophobicContact CD1-CG2 3.99Å; V342-V424 HydrophobicContact CG1-CG2 3.97Å; M343-V424 PolarHBondContact O-N 3.4Å; V344-V424 WeakPolarHBondContact CA-O 3.17Å; V344-V424 HydrophobicContact CG1-CB 4.44Å; V344-V424 HydrophobicContact CG2-CB 4.37Å; S345-V424 PolarHBondContact N-O 3.41Å
425	V	82.5	Confident	82.3	Confident	20 Å²	20	59.1 Å²	59.1	12%	0.121	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	103.4	174.8	-174.9	0	0	0	0	108.5	S345 P347 I402 L423 A427	S345-V425 CarbonylContact O-C 3.54Å; S345-V425 WeakPolarHBondContact O-CA 3.44Å; P347-V425 HydrophobicContact CG-CG1 4.14Å; I402-V425 HydrophobicContact CG2-CB 4.3Å; I402-V425 HydrophobicContact CG2-CG1 3.74Å; I402-V425 HydrophobicContact CG2-CG2 3.54Å; L423-V425 HydrophobicContact CG-CG2 4.2Å; V425-A427 PolarHBondContact O-N 2.86Å; V425-A427 VanDerWaalsContact O-N 3.11Å
426	R	71.4	Confident	82.1	Confident	92 Å²	92	62 Å²	62	35%	0.347	29%	0.294	S	S	.	.			trans	-80.6	86.8	173.5	178.7	178.9	167.9	139.7	1.2	108	V344 S345 L346 P347 E428	V344-R426 HydrophobicContact CG1-CB 4.37Å; S345-R426 PolarHBondContact O-N 2.84Å; L346-R426 HydrophobicContact CD2-CB 4.31Å; L346-R426 HydrophobicContact CD2-CG 4.36Å; L346-R426 VanDerWaalsContact CD2-O 3.28Å; L346-R426 WeakPolarHBondContact CD2-O 3.41Å; P347-R426 VanDerWaalsContact CD-O 3.28Å; P347-R426 WeakPolarHBondContact CD-O 3.25Å; R426-E428 HydrophobicContact CG-CG 4.34Å; R426-E428 IonicContact CZ-OE1 3.17Å; R426-E428 VanDerWaalsContact CZ-OE1 3.27Å; R426-E428 IonicContact NE-OE1 2.82Å; R426-E428 PolarHBondContact NE-OE1 2.76Å; R426-E428 IonicContact NH2-OE1 2.69Å; R426-E428 PolarHBondContact NH2-OE1 2.82Å; R426-E428 PolarHBondContact O-N 3.15Å
427	A	63.4	Low	82.2	Confident	33 Å²	33	53.6 Å²	53.6	27%	0.273	27%	0.272	S	S	.	.			trans	-66	126.4	159.2	0	0	0	0	0	108	P347 V425 E429	P347-A427 HydrophobicContact CG-CB 4.11Å; V425-A427 PolarHBondContact O-N 2.86Å; V425-A427 VanDerWaalsContact O-N 3.11Å; A427-E429 HydrophobicContact CB-CG 4.4Å
428	E	63.2	Low	82.2	Confident	74 Å²	74	50.8 Å²	50.8	35%	0.346	26%	0.257	S	S	.	.			trans	-91.1	132.5	159	-60.1	-170.7	148	0	0	105.7	R426 H453	R426-E428 HydrophobicContact CG-CG 4.34Å; R426-E428 IonicContact CZ-OE1 3.17Å; R426-E428 VanDerWaalsContact CZ-OE1 3.27Å; R426-E428 IonicContact NE-OE1 2.82Å; R426-E428 PolarHBondContact NE-OE1 2.76Å; R426-E428 IonicContact NH2-OE1 2.69Å; R426-E428 PolarHBondContact NH2-OE1 2.82Å; R426-E428 PolarHBondContact O-N 3.15Å; E428-H453 WeakPolarHBondContact O-CB 3.42Å
429	E	63.8	Low	82.1	Confident	142 Å²	142	50.7 Å²	50.7	66%	0.664	26%	0.26	S	S	*	.			trans	-124.5	144.2	-177	-70	-178.4	-167.8	0	0	108.3	A427	A427-E429 HydrophobicContact CB-CG 4.4Å
430	G	76.1	Confident	81.8	Confident	4 Å²	4	49.6 Å²	49.6	4%	0.041	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	93.1	-156.7	-179.9	0	0	0	0	0	114.6	H453 E522	G430-H453 PolarHBondContact O-N 2.91Å; G430-E522 WeakPolarHBondContact CA-OE2 3.49Å
431	L	86.2	Confident	81.3	Confident	26 Å²	26	50.5 Å²	50.5	14%	0.136	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	140.7	-172.6	-71.9	171.7	0	0	0	115.1	R451 V452 L463 L517 E522 I524	L431-R451 WeakPolarHBondContact CA-O 3.17Å; L431-V452 HydrophobicContact CD2-CG2 3.86Å; L431-L463 HydrophobicContact CD2-CD2 3.73Å; L431-L517 HydrophobicContact CD1-CB 3.98Å; L431-L517 HydrophobicContact CD2-CB 4.18Å; L431-L517 HydrophobicContact CG-CB 4.27Å; L431-E522 HydrophobicContact CD1-CB 3.81Å; L431-E522 WeakPolarHBondContact CD1-O 3.46Å; L431-E522 HydrophobicContact CG-CB 4.28Å; L431-E522 PolarHBondContact N-OE2 3.01Å; L431-I524 HydrophobicContact CB-CB 4.06Å; L431-I524 HydrophobicContact CB-CG2 3.77Å; L431-I524 HydrophobicContact CD1-CG2 4.24Å; L431-I524 WeakPolarHBondContact O-CD1 3.46Å
432	E	86.2	Confident	81	Confident	74 Å²	74	54.1 Å²	54.1	35%	0.346	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	143.7	167.9	-178.7	-177.9	-164.3	0	0	109.9	C450 R451 H453	E432-C450 CarbonylContact O-C 3.57Å; E432-C450 WeakPolarHBondContact O-CA 3.29Å; E432-R451 HydrophobicContact CB-CB 4.44Å; E432-R451 PolarHBondContact N-O 3.45Å; E432-R451 PolarHBondContact O-N 2.76Å; E432-H453 IonicContact OE2-CD2 2.77Å; E432-H453 IonicContact OE2-CE1 2.78Å; E432-H453 PolarHBondContact OE2-CE1 2.93Å; E432-H453 IonicContact OE2-NE2 2.91Å; E432-H453 PolarHBondContact OE2-NE2 2.71Å
433	I	88.7	Confident	80.7	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.005	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	138	168	-165.2	166.4	0	0	0	110.7	K436 F448 H449 W465 C515 I524	I433-K436 HydrophobicContact CG2-CG 4.36Å; I433-K436 WeakPolarHBondContact O-CG 3.3Å; I433-F448 HydrophobicContact CD1-CB 4.47Å; I433-F448 HydrophobicContact CD1-CD1 4.35Å; I433-F448 HydrophobicContact CG1-CD1 4.47Å; I433-H449 CarbonylContact C-O 3.39Å; I433-H449 VanDerWaalsContact CA-O 3.3Å; I433-H449 WeakPolarHBondContact CA-O 3.47Å; I433-W465 HydrophobicContact CD1-CH2 3.72Å; I433-W465 HydrophobicContact CD1-CZ3 3.61Å; I433-W465 HydrophobicContact CG1-CH2 4.33Å; I433-C515 HydrophobicContact CD1-CB 4.48Å; I433-I524 HydrophobicContact CB-CD1 4.46Å; I433-I524 HydrophobicContact CB-CG1 4.44Å; I433-I524 HydrophobicContact CB-CG2 3.95Å; I433-I524 HydrophobicContact CG2-CD1 3.96Å; I433-I524 HydrophobicContact CG2-CG1 3.78Å; I433-I524 HydrophobicContact CG2-CG2 4.17Å
434	N	87.5	Confident	80.7	Confident	94 Å²	94	58.6 Å²	58.6	50%	0.503	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	129.6	179.7	-179	60.1	0	0	0	110.7	H449	N434-H449 PolarHBondContact N-O 3.27Å; N434-H449 WeakPolarHBondContact O-CB 3.33Å; N434-H449 PolarHBondContact O-N 2.85Å
435	P	89.3	Confident	81	Confident	32 Å²	32	60.3 Å²	60.3	21%	0.208	33%	0.328	C	S	.	.	S	Bend	cis	-67.5	156.8	-9.5	31.3	-35.6	0	0	0	111.8	D438 E447 F448	P435-D438 HydrophobicContact CG-CB 3.82Å; P435-E447 VanDerWaalsContact CD-O 3.29Å; P435-E447 WeakPolarHBondContact CD-O 3.32Å; P435-F448 HydrophobicContact CG-CD1 4.06Å; P435-F448 HydrophobicContact CG-CE1 3.91Å; P435-F448 WeakPolarHBondContact O-CD1 3.36Å; P435-F448 WeakPolarHBondContact O-CE1 3.41Å
436	K	78.2	Confident	81.5	Confident	147 Å²	147	59.5 Å²	59.5	64%	0.639	32%	0.323	S	S	*	.	S	Bend	trans	-77.2	-25.4	172.8	-66.3	-174.6	-179.8	-178	0	112.4	I433 G526 K527	I433-K436 HydrophobicContact CG2-CG 4.36Å; I433-K436 WeakPolarHBondContact O-CG 3.3Å; K436-G526 WeakPolarHBondContact O-CA 3.31Å; K436-K527 PolarHBondContact O-N 2.85Å
437	S	85.8	Confident	82.5	Confident	65 Å²	65	59.3 Å²	59.3	46%	0.455	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	137	170.3	-168	0	0	0	0	108.4	K527	S437-K527 CarbonylContact C-O 3.54Å; S437-K527 VanDerWaalsContact CA-O 3.28Å; S437-K527 WeakPolarHBondContact CA-O 3.21Å
438	D	86.3	Confident	83.9	Confident	43 Å²	43	57.7 Å²	57.7	23%	0.23	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	157.2	177.1	-160	4.5	0	0	0	110.5	P435 F448 K527 L528 F529	P435-D438 HydrophobicContact CG-CB 3.82Å; D438-F448 HydrophobicContact CB-CE1 4.5Å; D438-F448 HydrophobicContact CB-CZ 4.26Å; D438-K527 PolarHBondContact N-O 2.97Å; D438-L528 HydrophobicContact CB-CD1 4.16Å; D438-F529 PolarHBondContact O-N 2.9Å
439	T	86.8	Confident	85.4	Confident	63 Å²	63	57 Å²	57	39%	0.387	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	110.3	-179.9	-60.3	0	0	0	0	110	F529	T439-F529 WeakPolarHBondContact CA-O 3.24Å; T439-F529 HydrophobicContact CG2-CB 4.12Å
440	V	83.3	Confident	86.8	Confident	8 Å²	8	50.2 Å²	50.2	5%	0.048	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	161.8	-174.6	-58.9	0	0	0	0	111.5	E444 V446 A505 L528 F529 V530 R531	V440-E444 HydrophobicContact CB-CB 4.15Å; V440-V446 HydrophobicContact CB-CG2 4.36Å; V440-V446 HydrophobicContact CG1-CG2 3.88Å; V440-V446 HydrophobicContact CG2-CG2 3.62Å; V440-A505 HydrophobicContact CG2-CB 3.67Å; V440-L528 HydrophobicContact CG2-CD1 4.18Å; V440-F529 PolarHBondContact N-O 3.16Å; V440-F529 VanDerWaalsContact N-O 3.1Å; V440-V530 HydrophobicContact CG2-CG1 4.42Å; V440-V530 HydrophobicContact CG2-CG2 4.22Å; V440-V530 WeakPolarHBondContact O-CA 3.43Å; V440-R531 PolarHBondContact O-N 3.19Å
441	D	80.8	Confident	87.4	Confident	60 Å²	60	55.5 Å²	55.5	32%	0.321	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	150.1	170.5	-66.1	-12.7	0	0	0	110.6	G443 E444 R531 V533	D441-G443 PolarHBondContact O-N 2.79Å; D441-E444 HydrophobicContact CB-CG 4.3Å; D441-E444 PolarHBondContact N-OE2 2.85Å; D441-E444 WeakPolarHBondContact O-CB 3.42Å; D441-E444 PolarHBondContact O-N 2.89Å; D441-R531 WeakPolarHBondContact OD1-CD 3.45Å; D441-R531 IonicContact OD1-CZ 3.72Å; D441-R531 IonicContact OD1-NE 3.25Å; D441-R531 IonicContact OD1-NH1 3.48Å; D441-R531 PolarHBondContact OD1-NH1 2.82Å; D441-V533 HydrophobicContact CB-CG2 3.79Å
442	E	82.1	Confident	87.4	Confident	77 Å²	77	54.4 Å²	54.4	36%	0.36	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	122.7	-177.5	178.7	155.6	-124.4	0	0	111.9	R506 V507 V530 R531 V533	E442-R506 WeakPolarHBondContact OE1-CA 3.45Å; E442-V507 PolarHBondContact OE1-N 3.17Å; E442-V530 HydrophobicContact CB-CG1 4.17Å; E442-R531 VanDerWaalsContact CB-O 3.27Å; E442-R531 WeakPolarHBondContact CB-O 3.36Å; E442-R531 PolarHBondContact N-O 2.76Å; E442-V533 HydrophobicContact CB-CG2 4.32Å
443	G	81.4	Confident	87.1	Confident	39 Å²	39	52.2 Å²	52.2	40%	0.402	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	103	-13.7	-172.3	0	0	0	0	0	115.3	D441 A505	D441-G443 PolarHBondContact O-N 2.79Å; G443-A505 PolarHBondContact N-O 2.74Å
444	E	87.4	Confident	86.1	Confident	101 Å²	101	55.5 Å²	55.5	47%	0.472	32%	0.315	S	S	.	.			trans	-76.3	169.7	174.5	-65.3	-164.3	115.7	0	0	113.1	V440 D441 R504 A505	V440-E444 HydrophobicContact CB-CB 4.15Å; D441-E444 HydrophobicContact CB-CG 4.3Å; D441-E444 PolarHBondContact N-OE2 2.85Å; D441-E444 WeakPolarHBondContact O-CB 3.42Å; D441-E444 PolarHBondContact O-N 2.89Å; E444-R504 CarbonylContact O-C 3.55Å; E444-R504 VanDerWaalsContact O-CA 3.25Å; E444-R504 WeakPolarHBondContact O-CA 3.36Å; E444-A505 PolarHBondContact O-N 2.76Å
445	A	90.4	Very high	85.2	Confident	71 Å²	71	53.7 Å²	53.7	59%	0.587	30%	0.304	S	S	*	.			trans	-96	144.3	179.8	0	0	0	0	0	112.5	K502	A445-K502 CarbonylContact C-O 3.57Å; A445-K502 WeakPolarHBondContact CA-O 3.48Å
446	V	92.4	Very high	84.2	Confident	4 Å²	4	59.9 Å²	59.9	2%	0.024	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	145.2	-178	175.9	0	0	0	0	109.9	V440 F448 F486 S501 K502 A505 L528	V440-V446 HydrophobicContact CB-CG2 4.36Å; V440-V446 HydrophobicContact CG1-CG2 3.88Å; V440-V446 HydrophobicContact CG2-CG2 3.62Å; V446-F448 HydrophobicContact CG1-CD2 4.15Å; V446-F448 HydrophobicContact CG1-CE2 3.77Å; V446-F486 HydrophobicContact CG1-CE1 4.22Å; V446-F486 HydrophobicContact CG1-CZ 4.32Å; V446-S501 CarbonylContact O-C 3.56Å; V446-S501 WeakPolarHBondContact O-CA 3.28Å; V446-S501 VanDerWaalsContact O-CB 3.26Å; V446-S501 WeakPolarHBondContact O-CB 3.22Å; V446-K502 PolarHBondContact N-O 3.47Å; V446-K502 PolarHBondContact O-N 2.96Å; V446-A505 HydrophobicContact CG2-CB 3.89Å; V446-L528 HydrophobicContact CB-CD1 4.45Å; V446-L528 HydrophobicContact CG1-CD1 3.81Å; V446-L528 HydrophobicContact CG1-CD2 4.03Å; V446-L528 HydrophobicContact CG2-CD1 3.7Å; V446-L528 HydrophobicContact CG2-CD2 4.13Å
447	E	93.2	Very high	83.9	Confident	87 Å²	87	54.7 Å²	54.7	41%	0.407	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	132.4	175.2	-174.9	170.8	86.3	0	0	112.4	P435 H449 I500	P435-E447 VanDerWaalsContact CD-O 3.29Å; P435-E447 WeakPolarHBondContact CD-O 3.32Å; E447-H449 IonicContact OE1-CD2 3.47Å; E447-H449 IonicContact OE1-CE1 3.52Å; E447-H449 IonicContact OE1-NE2 3.44Å; E447-H449 PolarHBondContact OE1-NE2 2.64Å; E447-I500 CarbonylContact C-O 3.57Å; E447-I500 WeakPolarHBondContact CA-O 3.37Å
448	F	93.6	Very high	83.6	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	131.5	172.1	-68.9	-79.8	0	0	0	111.4	I433 P435 D438 V446 W465 I500 Y513 L528	I433-F448 HydrophobicContact CD1-CB 4.47Å; I433-F448 HydrophobicContact CD1-CD1 4.35Å; I433-F448 HydrophobicContact CG1-CD1 4.47Å; P435-F448 HydrophobicContact CG-CD1 4.06Å; P435-F448 HydrophobicContact CG-CE1 3.91Å; P435-F448 WeakPolarHBondContact O-CD1 3.36Å; P435-F448 WeakPolarHBondContact O-CE1 3.41Å; D438-F448 HydrophobicContact CB-CE1 4.5Å; D438-F448 HydrophobicContact CB-CZ 4.26Å; V446-F448 HydrophobicContact CG1-CD2 4.15Å; V446-F448 HydrophobicContact CG1-CE2 3.77Å; F448-W465 HydrophobicContact CB-CH2 3.79Å; F448-W465 HydrophobicContact CB-CZ3 4.19Å; F448-I500 HydrophobicContact CB-CD1 4.35Å; F448-I500 HydrophobicContact CB-CG1 3.92Å; F448-I500 HydrophobicContact CD2-CD1 4.45Å; F448-I500 PolarHBondContact N-O 2.8Å; F448-I500 PolarHBondContact O-N 3.09Å; F448-Y513 HydrophobicContact CD2-CG 4.22Å; F448-Y513 AromaticContact CE2-CD2 3.92Å; F448-Y513 HydrophobicContact CE2-CD2 3.92Å; F448-Y513 HydrophobicContact CE2-CE2 4.48Å; F448-Y513 HydrophobicContact CE2-CG 4.02Å; F448-Y513 HydrophobicContact CZ-CD2 4.44Å; F448-L528 HydrophobicContact CE2-CB 4.12Å; F448-L528 HydrophobicContact CZ-CB 4.01Å
449	H	93.6	Very high	83.5	Confident	59 Å²	59	52.6 Å²	52.6	27%	0.273	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	118.9	178.1	-63.7	-139.2	0	0	0	108.1	I433 N434 E447 T497 F499	I433-H449 CarbonylContact C-O 3.39Å; I433-H449 VanDerWaalsContact CA-O 3.3Å; I433-H449 WeakPolarHBondContact CA-O 3.47Å; N434-H449 PolarHBondContact N-O 3.27Å; N434-H449 WeakPolarHBondContact O-CB 3.33Å; N434-H449 PolarHBondContact O-N 2.85Å; E447-H449 IonicContact OE1-CD2 3.47Å; E447-H449 IonicContact OE1-CE1 3.52Å; E447-H449 IonicContact OE1-NE2 3.44Å; E447-H449 PolarHBondContact OE1-NE2 2.64Å; H449-T497 HydrophobicContact CB-CG2 4.3Å; H449-F499 AromaticContact CE1-CD1 3.74Å; H449-F499 AromaticContact CE1-CE1 3.62Å; H449-F499 AromaticContact CG-CD1 3.88Å; H449-F499 AromaticContact ND1-CD1 3.65Å; H449-F499 AromaticContact ND1-CE1 3.39Å; H449-F499 WeakPolarHBondContact ND1-CE1 3.39Å
450	C	92.8	Very high	83.5	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	125.6	172.7	178.2	0	0	0	0	110.7	E432 L463 W465 T497 S498 C515	E432-C450 CarbonylContact O-C 3.57Å; E432-C450 WeakPolarHBondContact O-CA 3.29Å; C450-L463 HydrophobicContact CB-CD1 4.33Å; C450-L463 WeakPolarHBondContact O-CD1 3.41Å; C450-W465 HydrophobicContact CB-CH2 3.53Å; C450-W465 HydrophobicContact CB-CZ2 3.32Å; C450-W465 HydrophobicContact CB-CZ3 4.49Å; C450-T497 CarbonylContact O-C 3.25Å; C450-T497 VanDerWaalsContact O-CA 3.26Å; C450-T497 WeakPolarHBondContact O-CA 3.39Å; C450-T497 WeakPolarHBondContact O-CG2 2.93Å; C450-S498 PolarHBondContact N-O 3.01Å; C450-S498 PolarHBondContact O-N 2.98Å; C450-C515 HydrophobicContact CB-CB 3.57Å; C450-C515 WeakPolarHBondContact CB-SG 3.39Å; C450-C515 WeakPolarHBondContact SG-CB 3.5Å; C450-C515 CovalentContact SG-SG 2.02Å; C450-C515 PolarHBondContact SG-SG 2.84Å
451	R	89.6	Confident	83.5	Confident	114 Å²	114	57 Å²	57	43%	0.43	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	141	-173.8	176.8	176.3	171.5	179.4	-7.1	111.7	L431 E432 H453 H496 T497	L431-R451 WeakPolarHBondContact CA-O 3.17Å; E432-R451 HydrophobicContact CB-CB 4.44Å; E432-R451 PolarHBondContact N-O 3.45Å; E432-R451 PolarHBondContact O-N 2.76Å; R451-H453 PolarHBondContact NE-CE1 3.1Å; R451-H453 PolarHBondContact NE-ND1 2.85Å; R451-H453 PolarHBondContact NH2-CE1 3.13Å; R451-H453 PolarHBondContact NH2-ND1 2.87Å; R451-H496 WeakPolarHBondContact CA-O 3.45Å; R451-T497 HydrophobicContact CB-CG2 4.41Å
452	V	86.9	Confident	83.8	Confident	3 Å²	3	58.8 Å²	58.8	2%	0.018	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	134.4	167.1	-172.1	0	0	0	0	109.6	L431 M455 I459 L463 H496 L517	L431-V452 HydrophobicContact CD2-CG2 3.86Å; V452-M455 HydrophobicContact CG1-CB 4.03Å; V452-M455 HydrophobicContact CG1-CG 3.89Å; V452-M455 HydrophobicContact CG1-SD 3.92Å; V452-I459 HydrophobicContact CB-CG2 4.35Å; V452-I459 HydrophobicContact CG2-CG2 3.78Å; V452-L463 HydrophobicContact CG2-CD1 4.24Å; V452-L463 HydrophobicContact CG2-CD2 3.69Å; V452-L463 HydrophobicContact CG2-CG 4.25Å; V452-H496 PolarHBondContact N-O 2.93Å; V452-L517 HydrophobicContact CG1-CD2 4Å; V452-L517 HydrophobicContact CG2-CD1 4.38Å; V452-L517 HydrophobicContact CG2-CD2 4.19Å
453	H	78.6	Confident	84.2	Confident	29 Å²	29	55.2 Å²	55.2	13%	0.134	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	157.8	167.9	-58.5	-92.5	0	0	0	111.3	E428 G430 E432 R451 M455	E428-H453 WeakPolarHBondContact O-CB 3.42Å; G430-H453 PolarHBondContact O-N 2.91Å; E432-H453 IonicContact OE2-CD2 2.77Å; E432-H453 IonicContact OE2-CE1 2.78Å; E432-H453 PolarHBondContact OE2-CE1 2.93Å; E432-H453 IonicContact OE2-NE2 2.91Å; E432-H453 PolarHBondContact OE2-NE2 2.71Å; R451-H453 PolarHBondContact NE-CE1 3.1Å; R451-H453 PolarHBondContact NE-ND1 2.85Å; R451-H453 PolarHBondContact NH2-CE1 3.13Å; R451-H453 PolarHBondContact NH2-ND1 2.87Å; H453-M455 VanDerWaalsContact C-N 3.29Å; H453-M455 PolarHBondContact O-N 2.81Å
454	G	68.1	Low	84.7	Confident	70 Å²	70	55 Å²	55	72%	0.722	30%	0.295	S	S	*	.	S	Bend	trans	79.5	-15.5	177.1	0	0	0	0	0	117.1
455	M	69.2	Low	85	Confident	56 Å²	56	50.5 Å²	50.5	28%	0.276	27%	0.273	S	S	.	.			trans	-102.9	143.5	-178	-65.5	-168.6	73	0	0	114.6	V452 H453 I459 H496 L517 Q520	V452-M455 HydrophobicContact CG1-CB 4.03Å; V452-M455 HydrophobicContact CG1-CG 3.89Å; V452-M455 HydrophobicContact CG1-SD 3.92Å; H453-M455 VanDerWaalsContact C-N 3.29Å; H453-M455 PolarHBondContact O-N 2.81Å; M455-I459 HydrophobicContact CB-CD1 3.31Å; M455-I459 HydrophobicContact CE-CD1 4.13Å; M455-I459 HydrophobicContact CG-CD1 4.37Å; M455-I459 HydrophobicContact SD-CD1 4.21Å; M455-H496 PolarHBondContact O-CE1 2.76Å; M455-H496 PolarHBondContact O-ND1 2.8Å; M455-L517 HydrophobicContact SD-CD2 3.86Å; M455-Q520 PolarHBondContact SD-OE1 3Å
456	N	67.9	Low	85.2	Confident	161 Å²	161	48.8 Å²	48.8	86%	0.861	25%	0.252	S	S	*	.			trans	-97.5	142.6	178.3	-77.8	-44.8	0	0	0	113.5
457	G	71.7	Confident	85.3	Confident	38 Å²	38	50.1 Å²	50.1	39%	0.392	26%	0.257	S	S	.	.	S	Bend	trans	103.5	178.9	175.4	0	0	0	0	0	114	I459 H496	G457-I459 WeakPolarHBondContact O-CG1 3.39Å; G457-I459 PolarHBondContact O-N 3.02Å; G457-I459 VanDerWaalsContact O-N 3.13Å; G457-H496 PolarHBondContact O-CE1 3.13Å; G457-H496 VanDerWaalsContact O-CE1 3.3Å
458	N	80	Confident	85.3	Confident	62 Å²	62	50 Å²	50	33%	0.332	25%	0.253	S	S	.	.			trans	-80.2	96	-177.4	-165.2	42.8	0	0	0	111.3	N460 Q495	N458-N460 PolarHBondContact OD1-OD1 2.91Å; N458-N460 VanDerWaalsContact OD1-OD1 3.1Å; N458-Q495 HydrophobicContact CB-CB 4.5Å; N458-Q495 VanDerWaalsContact OD1-CA 3.31Å; N458-Q495 WeakPolarHBondContact OD1-CA 3.29Å; N458-Q495 WeakPolarHBondContact OD1-CB 3.47Å; N458-Q495 WeakPolarHBondContact OD1-CG 3.34Å
459	I	84.5	Confident	85.1	Confident	3 Å²	3	52.1 Å²	52.1	2%	0.015	27%	0.266	C	S	.	.			trans	-109.7	-18.3	-168.3	-65.9	158	0	0	0	111.8	V452 M455 G457 R461 Q462 L463 Q495 L517	V452-I459 HydrophobicContact CB-CG2 4.35Å; V452-I459 HydrophobicContact CG2-CG2 3.78Å; M455-I459 HydrophobicContact CB-CD1 3.31Å; M455-I459 HydrophobicContact CE-CD1 4.13Å; M455-I459 HydrophobicContact CG-CD1 4.37Å; M455-I459 HydrophobicContact SD-CD1 4.21Å; G457-I459 WeakPolarHBondContact O-CG1 3.39Å; G457-I459 PolarHBondContact O-N 3.02Å; G457-I459 VanDerWaalsContact O-N 3.13Å; I459-R461 VanDerWaalsContact C-N 3.28Å; I459-R461 PolarHBondContact O-N 2.93Å; I459-Q462 HydrophobicContact CG2-CB 4.45Å; I459-Q462 WeakPolarHBondContact O-CA 3.25Å; I459-Q462 VanDerWaalsContact O-CB 3.3Å; I459-Q462 WeakPolarHBondContact O-CB 3.21Å; I459-Q462 PolarHBondContact O-N 2.9Å; I459-L463 PolarHBondContact O-N 2.92Å; I459-Q495 PolarHBondContact N-O 2.94Å; I459-L517 HydrophobicContact CG2-CD1 4.06Å
460	N	85.7	Confident	84.4	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.005	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-49.2	-47.2	178.6	59.5	9.2	0	0	0	113	N458 Q462 L463 R488 D491 A494 Q495 T497	N458-N460 PolarHBondContact OD1-OD1 2.91Å; N458-N460 VanDerWaalsContact OD1-OD1 3.1Å; N460-Q462 PolarHBondContact O-N 2.89Å; N460-L463 WeakPolarHBondContact O-CB 3.17Å; N460-L463 PolarHBondContact O-N 2.82Å; N460-L463 VanDerWaalsContact O-N 3.1Å; N460-R488 PolarHBondContact O-NH2 2.92Å; N460-D491 PolarHBondContact ND2-O 3.17Å; N460-A494 PolarHBondContact ND2-O 2.65Å; N460-Q495 PolarHBondContact N-O 2.99Å; N460-T497 WeakPolarHBondContact CB-O 3.21Å
461	R	84	Confident	83.3	Confident	162 Å²	162	57.6 Å²	57.6	61%	0.611	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-68.1	-9.1	176	-69.7	176.3	-176.3	-153.6	-3.8	115.6	I459 D490	I459-R461 VanDerWaalsContact C-N 3.28Å; I459-R461 PolarHBondContact O-N 2.93Å; R461-D490 HydrophobicContact CG-CB 4.5Å
462	Q	87.5	Confident	82.7	Confident	97 Å²	97	54 Å²	54	45%	0.453	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-91.3	-16.1	173.7	-53.9	-176.3	18.5	0	0	112.2	I459 N460 P518	I459-Q462 HydrophobicContact CG2-CB 4.45Å; I459-Q462 WeakPolarHBondContact O-CA 3.25Å; I459-Q462 VanDerWaalsContact O-CB 3.3Å; I459-Q462 WeakPolarHBondContact O-CB 3.21Å; I459-Q462 PolarHBondContact O-N 2.9Å; N460-Q462 PolarHBondContact O-N 2.89Å; Q462-P518 WeakPolarHBondContact O-CD 3.45Å
463	L	90.2	Very high	82.3	Confident	2 Å²	2	58.8 Å²	58.8	1%	0.01	31%	0.313	C	S	.	.			trans	-68.6	134.2	173.8	-65.3	173.1	0	0	0	110.5	L431 C450 V452 I459 N460 R488 L517	L431-L463 HydrophobicContact CD2-CD2 3.73Å; C450-L463 HydrophobicContact CB-CD1 4.33Å; C450-L463 WeakPolarHBondContact O-CD1 3.41Å; V452-L463 HydrophobicContact CG2-CD1 4.24Å; V452-L463 HydrophobicContact CG2-CD2 3.69Å; V452-L463 HydrophobicContact CG2-CG 4.25Å; I459-L463 PolarHBondContact O-N 2.92Å; N460-L463 WeakPolarHBondContact O-CB 3.17Å; N460-L463 PolarHBondContact O-N 2.82Å; N460-L463 VanDerWaalsContact O-N 3.1Å; L463-R488 VanDerWaalsContact O-CZ 3.31Å; L463-R488 PolarHBondContact O-NH1 2.93Å; L463-R488 PolarHBondContact O-NH2 2.83Å; L463-L517 HydrophobicContact CD2-CB 4.17Å; L463-L517 HydrophobicContact CD2-CD1 4.13Å
464	E	92.2	Very high	82.5	Confident	36 Å²	36	61.4 Å²	61.4	17%	0.168	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	136	175.8	-59.5	-165.5	119	0	0	110.3	Y466 R477 C515 R516 P518	E464-Y466 HydrophobicContact CB-CD2 4.34Å; E464-Y466 HydrophobicContact CB-CE2 3.71Å; E464-Y466 PolarHBondContact OE2-OH 2.8Å; E464-R477 IonicContact OE1-CZ 2.8Å; E464-R477 IonicContact OE1-NH1 3.94Å; E464-R477 PolarHBondContact OE1-NH1 2.95Å; E464-R477 IonicContact OE1-NH2 2.69Å; E464-R477 PolarHBondContact OE1-NH2 3.31Å; E464-R477 IonicContact OE2-NH1 2.67Å; E464-C515 WeakPolarHBondContact O-CA 3.41Å; E464-R516 PolarHBondContact N-O 3.18Å; E464-R516 PolarHBondContact O-N 2.67Å; E464-R516 IonicContact OE2-NH1 2.75Å; E464-R516 PolarHBondContact OE2-NH1 3.38Å; E464-P518 HydrophobicContact CG-CG 3.72Å; E464-P518 WeakPolarHBondContact OE2-CG 3.27Å
465	W	93.8	Very high	83.4	Confident	6 Å²	6	64.4 Å²	64.4	2%	0.023	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	134.2	176	-71.2	97.6	0	0	0	110.7	I433 F448 C450 L478 S498 I500 I514 C515	I433-W465 HydrophobicContact CD1-CH2 3.72Å; I433-W465 HydrophobicContact CD1-CZ3 3.61Å; I433-W465 HydrophobicContact CG1-CH2 4.33Å; F448-W465 HydrophobicContact CB-CH2 3.79Å; F448-W465 HydrophobicContact CB-CZ3 4.19Å; C450-W465 HydrophobicContact CB-CH2 3.53Å; C450-W465 HydrophobicContact CB-CZ2 3.32Å; C450-W465 HydrophobicContact CB-CZ3 4.49Å; W465-L478 HydrophobicContact CB-CB 4.03Å; W465-L478 HydrophobicContact CB-CD2 4.03Å; W465-L478 PolarHBondContact O-N 3.36Å; W465-S498 PolarHBondContact NE1-OG 2.88Å; W465-I500 HydrophobicContact CD2-CD1 3.75Å; W465-I500 HydrophobicContact CD2-CG1 4.06Å; W465-I500 HydrophobicContact CD2-CG2 3.95Å; W465-I500 HydrophobicContact CE3-CD1 3.46Å; W465-I500 VanDerWaalsContact CE3-CD1 3.46Å; W465-I500 HydrophobicContact CE3-CG1 4.09Å; W465-I500 HydrophobicContact CG-CD1 4.37Å; W465-I500 HydrophobicContact CG-CG2 3.85Å; W465-I500 HydrophobicContact CH2-CD1 4.06Å; W465-I500 HydrophobicContact CH2-CG1 3.88Å; W465-I500 HydrophobicContact CZ2-CD1 4.34Å; W465-I500 HydrophobicContact CZ2-CG1 3.88Å; W465-I500 HydrophobicContact CZ2-CG2 4.39Å; W465-I500 HydrophobicContact CZ3-CD1 3.63Å; W465-I500 HydrophobicContact CZ3-CG1 4Å; W465-I514 WeakPolarHBondContact CA-O 3.39Å; W465-C515 HydrophobicContact CD2-CB 4.32Å; W465-C515 HydrophobicContact CE3-CB 3.97Å; W465-C515 HydrophobicContact CH2-CB 4.11Å; W465-C515 HydrophobicContact CZ2-CB 4.41Å; W465-C515 HydrophobicContact CZ3-CB 3.87Å
466	Y	94.4	Very high	84.5	Confident	35 Å²	35	65.1 Å²	65.1	14%	0.137	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	152.2	175.8	-67.8	-98.8	0	0	0	109.4	E464 V476 R477 I514 R516	E464-Y466 HydrophobicContact CB-CD2 4.34Å; E464-Y466 HydrophobicContact CB-CE2 3.71Å; E464-Y466 PolarHBondContact OE2-OH 2.8Å; Y466-V476 CarbonylContact C-O 3.58Å; Y466-V476 VanDerWaalsContact CA-O 3.22Å; Y466-V476 WeakPolarHBondContact CA-O 3.42Å; Y466-V476 WeakPolarHBondContact CB-O 3.41Å; Y466-V476 WeakPolarHBondContact CD1-O 3.21Å; Y466-R477 HydrophobicContact CD1-CB 4.3Å; Y466-R477 HydrophobicContact CE1-CB 4.21Å; Y466-I514 PolarHBondContact N-O 2.69Å; Y466-I514 PolarHBondContact O-N 2.83Å; Y466-R516 HydrophobicContact CD2-CB 4.46Å; Y466-R516 HydrophobicContact CE2-CB 4.38Å
467	Y	93.8	Very high	85.6	Confident	32 Å²	32	64.3 Å²	64.3	13%	0.125	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	142.2	174.9	170.7	-118.6	0	0	0	109.5	P469 R475 V476 A508 Q510 E512 Y513	Y467-P469 HydrophobicContact CE1-CG 3.77Å; Y467-R475 WeakPolarHBondContact O-CA 3.36Å; Y467-V476 HydrophobicContact CD1-CG2 4.07Å; Y467-V476 PolarHBondContact N-O 3.18Å; Y467-V476 WeakPolarHBondContact O-CG2 3.34Å; Y467-V476 PolarHBondContact O-N 2.85Å; Y467-A508 PolarHBondContact OH-O 3.02Å; Y467-A508 VanDerWaalsContact OH-O 3.11Å; Y467-Q510 PolarHBondContact OH-O 2.94Å; Y467-Q510 VanDerWaalsContact OH-O 3.07Å; Y467-E512 WeakPolarHBondContact CA-O 3.45Å; Y467-Y513 HydrophobicContact CD2-CD2 4.33Å; Y467-Y513 HydrophobicContact CD2-CE1 4.02Å; Y467-Y513 AromaticContact CD2-CE2 3.8Å; Y467-Y513 HydrophobicContact CD2-CE2 3.8Å; Y467-Y513 AromaticContact CD2-CZ 3.61Å; Y467-Y513 AromaticContact CE2-CE2 3.86Å; Y467-Y513 HydrophobicContact CE2-CE2 3.86Å; Y467-Y513 AromaticContact CE2-CZ 3.84Å
468	R	93	Very high	86.4	Confident	84 Å²	84	63.5 Å²	63.5	32%	0.317	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	113.5	171.9	174	167	67.1	-173	2	107.1	S472 E512 I514	R468-S472 WeakPolarHBondContact CD-O 3.48Å; R468-S472 WeakPolarHBondContact CG-O 3.35Å; R468-E512 HydrophobicContact CB-CB 4.41Å; R468-E512 IonicContact CZ-OE2 3.49Å; R468-E512 PolarHBondContact N-O 2.83Å; R468-E512 IonicContact NE-OE2 3.25Å; R468-E512 PolarHBondContact NE-OE2 2.84Å; R468-E512 IonicContact NH2-OE2 3.83Å; R468-E512 PolarHBondContact NH2-OE2 2.02Å; R468-E512 PolarHBondContact O-N 2.96Å; R468-I514 HydrophobicContact CB-CD1 3.93Å
469	P	88.9	Confident	86.2	Confident	45 Å²	45	64.8 Å²	64.8	29%	0.292	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.2	149.2	171.6	-23.8	32.4	0	0	0	110.7	Y467 S472	Y467-P469 HydrophobicContact CE1-CG 3.77Å; P469-S472 PolarHBondContact O-N 2.82Å
470	F	80.8	Confident	85.9	Confident	32 Å²	32	66.2 Å²	66.2	14%	0.14	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	147.2	162.4	-59.7	-39	0	0	0	108.7	S472 Q510 G511 E512 K527 L528 F529	F470-S472 PolarHBondContact O-N 2.9Å; F470-Q510 HydrophobicContact CD2-CG 3.43Å; F470-Q510 VanDerWaalsContact CD2-CG 3.43Å; F470-Q510 HydrophobicContact CE2-CG 3.48Å; F470-Q510 VanDerWaalsContact CE2-CG 3.48Å; F470-G511 VanDerWaalsContact CE1-C 3.45Å; F470-G511 WeakPolarHBondContact CZ-O 3.45Å; F470-E512 HydrophobicContact CD1-CG 3.87Å; F470-E512 HydrophobicContact CE1-CG 3.58Å; F470-K527 HydrophobicContact CE1-CB 4.37Å; F470-K527 HydrophobicContact CE1-CD 4.19Å; F470-K527 HydrophobicContact CE1-CG 4.45Å; F470-K527 HydrophobicContact CZ-CB 4.14Å; F470-L528 WeakPolarHBondContact CE2-O 3.27Å; F470-L528 WeakPolarHBondContact CZ-O 3.28Å; F470-F529 HydrophobicContact CD2-CD1 4.37Å; F470-F529 HydrophobicContact CD2-CE1 4.14Å; F470-F529 AromaticContact CE2-CD1 3.5Å; F470-F529 HydrophobicContact CE2-CD1 3.5Å; F470-F529 VanDerWaalsContact CE2-CD1 3.5Å; F470-F529 AromaticContact CE2-CE1 3.35Å; F470-F529 HydrophobicContact CE2-CE1 3.35Å; F470-F529 HydrophobicContact CE2-CE2 4.39Å; F470-F529 HydrophobicContact CE2-CG 4.09Å; F470-F529 AromaticContact CE2-CZ 3.84Å; F470-F529 HydrophobicContact CE2-CZ 3.84Å; F470-F529 HydrophobicContact CZ-CD1 4.15Å; F470-F529 HydrophobicContact CZ-CD2 4.46Å; F470-F529 AromaticContact CZ-CE1 3.75Å; F470-F529 HydrophobicContact CZ-CE1 3.75Å; F470-F529 HydrophobicContact CZ-CE2 4.08Å; F470-F529 HydrophobicContact CZ-CG 4.49Å; F470-F529 AromaticContact CZ-CZ 3.71Å; F470-F529 HydrophobicContact CZ-CZ 3.71Å
471	Y	68.1	Low	85.2	Confident	141 Å²	141	73.3 Å²	73.3	55%	0.553	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	34.1	-176.9	-31.4	-69.4	0	0	0	112.9	P172	P172-Y471 HydrophobicContact CB-CD1 3.7Å; P172-Y471 HydrophobicContact CB-CE1 3.82Å; P172-Y471 HydrophobicContact CG-CD1 3.71Å; P172-Y471 HydrophobicContact CG-CE1 4.16Å
472	S	77.5	Confident	84.5	Confident	40 Å²	40	68.3 Å²	68.3	28%	0.28	34%	0.34	S	S	.	.			trans	-139	131.2	165.9	-167.2	0	0	0	0	111.1	R468 P469 F470 T474	R468-S472 WeakPolarHBondContact CD-O 3.48Å; R468-S472 WeakPolarHBondContact CG-O 3.35Å; P469-S472 PolarHBondContact O-N 2.82Å; F470-S472 PolarHBondContact O-N 2.9Å; S472-T474 PolarHBondContact O-N 2.96Å; S472-T474 PolarHBondContact OG-N 2.8Å
473	S	78.2	Confident	83.8	Confident	103 Å²	103	69.6 Å²	69.6	72%	0.72	36%	0.357	S	S	*	.			trans	-71.7	-16.3	168.3	58	0	0	0	0	113.2	R475	S473-R475 PolarHBondContact O-N 2.88Å
474	T	82.5	Confident	82.9	Confident	83 Å²	83	75.7 Å²	75.7	51%	0.509	39%	0.39	S	S	.	.			trans	-83.5	110.7	-172.4	-62	0	0	0	0	111.6	S472 V476	S472-T474 PolarHBondContact O-N 2.96Å; S472-T474 PolarHBondContact OG-N 2.8Å; T474-V476 HydrophobicContact CG2-CG1 4.28Å
475	R	88.4	Confident	82.4	Confident	133 Å²	133	74.6 Å²	74.6	50%	0.502	39%	0.388	S	S	.	.			trans	-84.5	131.2	165.3	67.7	178	178.7	-177.4	-3.4	111	Y467 S473 E523	Y467-R475 WeakPolarHBondContact O-CA 3.36Å; S473-R475 PolarHBondContact O-N 2.88Å; R475-E523 IonicContact NH1-OE1 3.45Å; R475-E523 IonicContact NH1-OE2 2.7Å; R475-E523 PolarHBondContact NH1-OE2 3.15Å
476	V	90.7	Very high	82.2	Confident	72 Å²	72	74.6 Å²	74.6	44%	0.436	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	153.6	170.2	-64.6	0	0	0	0	109.9	Y466 Y467 T474	Y466-V476 CarbonylContact C-O 3.58Å; Y466-V476 VanDerWaalsContact CA-O 3.22Å; Y466-V476 WeakPolarHBondContact CA-O 3.42Å; Y466-V476 WeakPolarHBondContact CB-O 3.41Å; Y466-V476 WeakPolarHBondContact CD1-O 3.21Å; Y467-V476 HydrophobicContact CD1-CG2 4.07Å; Y467-V476 PolarHBondContact N-O 3.18Å; Y467-V476 WeakPolarHBondContact O-CG2 3.34Å; Y467-V476 PolarHBondContact O-N 2.85Å; T474-V476 HydrophobicContact CG2-CG1 4.28Å
477	R	90.9	Very high	81.9	Confident	143 Å²	143	76.6 Å²	76.6	54%	0.54	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	133.8	167.5	-167.5	-177	-168	89.3	-3.9	107.4	E464 Y466 D479	E464-R477 IonicContact OE1-CZ 2.8Å; E464-R477 IonicContact OE1-NH1 3.94Å; E464-R477 PolarHBondContact OE1-NH1 2.95Å; E464-R477 IonicContact OE1-NH2 2.69Å; E464-R477 PolarHBondContact OE1-NH2 3.31Å; E464-R477 IonicContact OE2-NH1 2.67Å; Y466-R477 HydrophobicContact CD1-CB 4.3Å; Y466-R477 HydrophobicContact CE1-CB 4.21Å; R477-D479 PolarHBondContact O-N 3.26Å
478	L	88.8	Confident	81.8	Confident	21 Å²	21	78.3 Å²	78.3	11%	0.11	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-67.8	122.4	178.3	-178.7	64.6	0	0	0	108.8	W465 V480 F486 I500 Y513	W465-L478 HydrophobicContact CB-CB 4.03Å; W465-L478 HydrophobicContact CB-CD2 4.03Å; W465-L478 PolarHBondContact O-N 3.36Å; L478-V480 HydrophobicContact CB-CG1 4.49Å; L478-V480 HydrophobicContact CD2-CG1 4.02Å; L478-V480 HydrophobicContact CG-CG1 3.94Å; L478-V480 PolarHBondContact O-N 2.79Å; L478-F486 HydrophobicContact CD1-CB 4.37Å; L478-F486 HydrophobicContact CD1-CD2 4.3Å; L478-F486 HydrophobicContact CD1-CG 4.49Å; L478-F486 HydrophobicContact CD2-CB 4.06Å; L478-F486 HydrophobicContact CD2-CG 4.31Å; L478-F486 HydrophobicContact CG-CB 4.45Å; L478-I500 HydrophobicContact CD2-CB 4.5Å; L478-I500 HydrophobicContact CD2-CD1 3.5Å; L478-I500 VanDerWaalsContact CD2-CD1 3.5Å; L478-I500 HydrophobicContact CD2-CG2 4.23Å; L478-Y513 HydrophobicContact CD1-CE1 4.16Å; L478-Y513 HydrophobicContact CD2-CD1 4.28Å; L478-Y513 HydrophobicContact CD2-CE1 4.3Å
479	D	76.7	Confident	81.3	Confident	90 Å²	90	78.8 Å²	78.8	48%	0.481	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-75.1	117.9	170	-171	-27.5	0	0	0	108.3	R477 D481 T482	R477-D479 PolarHBondContact O-N 3.26Å; D479-D481 PolarHBondContact OD1-N 2.94Å; D479-T482 WeakPolarHBondContact OD2-CG2 3.35Å
480	V	78.8	Confident	80.9	Confident	32 Å²	32	77.8 Å²	77.8	19%	0.194	40%	0.404	C	S	.	.			trans	-112.5	6.3	-175.1	-64.6	0	0	0	0	113.4	L478 F486 R488 I500	L478-V480 HydrophobicContact CB-CG1 4.49Å; L478-V480 HydrophobicContact CD2-CG1 4.02Å; L478-V480 HydrophobicContact CG-CG1 3.94Å; L478-V480 PolarHBondContact O-N 2.79Å; V480-F486 CarbonylContact C-O 3.58Å; V480-F486 VanDerWaalsContact CA-O 3.25Å; V480-F486 WeakPolarHBondContact CA-O 3.47Å; V480-R488 HydrophobicContact CB-CB 3.94Å; V480-R488 HydrophobicContact CG1-CB 4.17Å; V480-R488 HydrophobicContact CG2-CB 4.14Å; V480-I500 HydrophobicContact CG1-CG2 4.36Å
481	D	70.4	Confident	80.9	Confident	151 Å²	151	80.4 Å²	80.4	81%	0.807	42%	0.419	S	S	*	.	S	Bend	trans	-113.7	6.7	-174.9	-67.5	-50.1	0	0	0	112.5	D479	D479-D481 PolarHBondContact OD1-N 2.94Å
482	T	69.5	Low	81.5	Confident	57 Å²	57	79 Å²	79	35%	0.35	42%	0.421	S	S	.	.			trans	-94.6	134.4	-179.2	41.9	0	0	0	0	112.9	D479 D484 G485	D479-T482 WeakPolarHBondContact OD2-CG2 3.35Å; T482-D484 VanDerWaalsContact C-N 3.3Å; T482-D484 PolarHBondContact O-N 3.06Å; T482-G485 PolarHBondContact O-N 3.07Å; T482-G485 WeakPolarHBondContact OG1-CA 3.3Å
483	P	71.7	Confident	81.8	Confident	124 Å²	124	83.2 Å²	83.2	81%	0.805	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-33.3	-175.9	-27.5	35.4	0	0	0	115.7
484	D	71.8	Confident	82.1	Confident	129 Å²	129	79.6 Å²	79.6	69%	0.69	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.9	16.4	178.3	-55.3	-60.2	0	0	0	112.4	T482 K502	T482-D484 VanDerWaalsContact C-N 3.3Å; T482-D484 PolarHBondContact O-N 3.06Å; D484-K502 WeakPolarHBondContact O-CE 3.43Å; D484-K502 PolarHBondContact O-NZ 2.92Å
485	G	82.4	Confident	82.3	Confident	14 Å²	14	79.7 Å²	79.7	14%	0.144	42%	0.416	C	S	.	.	S	Bend	trans	-95.6	-156.3	-178.8	0	0	0	0	0	113.4	T482 K502	T482-G485 PolarHBondContact O-N 3.07Å; T482-G485 WeakPolarHBondContact OG1-CA 3.3Å; G485-K502 WeakPolarHBondContact O-CD 3.46Å; G485-K502 WeakPolarHBondContact O-CE 3.02Å; G485-K502 VanDerWaalsContact O-CG 3.3Å; G485-K502 WeakPolarHBondContact O-CG 3.23Å
486	F	88.8	Confident	82.2	Confident	5 Å²	5	76.2 Å²	76.2	2%	0.022	41%	0.405	C	S	.	.			trans	-85.2	150.9	158.3	-82.7	-105.6	0	0	0	108.5	V446 L478 V480 I500 S501 K502 Y513 L528	V446-F486 HydrophobicContact CG1-CE1 4.22Å; V446-F486 HydrophobicContact CG1-CZ 4.32Å; L478-F486 HydrophobicContact CD1-CB 4.37Å; L478-F486 HydrophobicContact CD1-CD2 4.3Å; L478-F486 HydrophobicContact CD1-CG 4.49Å; L478-F486 HydrophobicContact CD2-CB 4.06Å; L478-F486 HydrophobicContact CD2-CG 4.31Å; L478-F486 HydrophobicContact CG-CB 4.45Å; V480-F486 CarbonylContact C-O 3.58Å; V480-F486 VanDerWaalsContact CA-O 3.25Å; V480-F486 WeakPolarHBondContact CA-O 3.47Å; F486-I500 HydrophobicContact CD1-CB 4.16Å; F486-I500 HydrophobicContact CD1-CD1 4.11Å; F486-I500 HydrophobicContact CD1-CG1 4.28Å; F486-I500 HydrophobicContact CE1-CD1 4.49Å; F486-S501 CarbonylContact C-O 3.5Å; F486-S501 WeakPolarHBondContact CA-O 3.48Å; F486-K502 HydrophobicContact CD1-CB 3.87Å; F486-K502 HydrophobicContact CD2-CB 4.04Å; F486-K502 HydrophobicContact CD2-CD 3.84Å; F486-K502 HydrophobicContact CE1-CB 3.78Å; F486-K502 HydrophobicContact CE2-CB 3.92Å; F486-K502 HydrophobicContact CE2-CD 3.64Å; F486-K502 HydrophobicContact CE2-CG 4.41Å; F486-K502 HydrophobicContact CG-CB 4Å; F486-K502 HydrophobicContact CZ-CB 3.8Å; F486-K502 HydrophobicContact CZ-CD 4.27Å; F486-Y513 HydrophobicContact CD1-CE1 4.41Å; F486-Y513 HydrophobicContact CD2-CE1 4.03Å; F486-Y513 HydrophobicContact CE1-CE1 4.04Å; F486-Y513 AromaticContact CE2-CE1 3.65Å; F486-Y513 HydrophobicContact CE2-CE1 3.65Å; F486-Y513 AromaticContact CE2-CZ 3.63Å; F486-Y513 WeakPolarHBondContact CE2-OH 3.29Å; F486-Y513 HydrophobicContact CG-CE1 4.41Å; F486-Y513 AromaticContact CZ-CE1 3.64Å; F486-Y513 HydrophobicContact CZ-CE1 3.64Å; F486-Y513 AromaticContact CZ-CZ 3.63Å; F486-Y513 WeakPolarHBondContact CZ-OH 3.35Å; F486-L528 HydrophobicContact CZ-CD2 4.18Å
487	M	89.2	Confident	82.2	Confident	78 Å²	78	73.9 Å²	73.9	38%	0.384	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	146.9	169.9	-64.8	-176.1	-68.1	0	0	109.3	I500 S501	M487-I500 VanDerWaalsContact O-CA 3.31Å; M487-I500 WeakPolarHBondContact O-CA 3.41Å; M487-S501 PolarHBondContact N-O 3.28Å; M487-S501 PolarHBondContact O-N 2.88Å
488	R	89.9	Confident	82.2	Confident	68 Å²	68	67.1 Å²	67.1	26%	0.257	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	129.6	176.6	-175.5	176.4	175.7	150.7	2.3	111.3	N460 L463 V480 D490 S498 F499 I500	N460-R488 PolarHBondContact O-NH2 2.92Å; L463-R488 VanDerWaalsContact O-CZ 3.31Å; L463-R488 PolarHBondContact O-NH1 2.93Å; L463-R488 PolarHBondContact O-NH2 2.83Å; V480-R488 HydrophobicContact CB-CB 3.94Å; V480-R488 HydrophobicContact CG1-CB 4.17Å; V480-R488 HydrophobicContact CG2-CB 4.14Å; R488-D490 WeakPolarHBondContact CG-OD1 3.26Å; R488-D490 IonicContact CZ-OD1 3.2Å; R488-D490 IonicContact CZ-OD2 3.22Å; R488-D490 VanDerWaalsContact CZ-OD2 3.25Å; R488-D490 VanDerWaalsContact NE-CG 3.31Å; R488-D490 IonicContact NE-OD1 2.66Å; R488-D490 PolarHBondContact NE-OD1 2.78Å; R488-D490 VanDerWaalsContact NE-OD1 3.15Å; R488-D490 IonicContact NE-OD2 3.94Å; R488-D490 PolarHBondContact NE-OD2 3.23Å; R488-D490 IonicContact NH2-OD1 3.59Å; R488-D490 IonicContact NH2-OD2 2.65Å; R488-D490 PolarHBondContact NH2-OD2 3.23Å; R488-S498 PolarHBondContact NE-OG 3.25Å; R488-S498 PolarHBondContact NH2-OG 3.4Å; R488-F499 WeakPolarHBondContact CA-O 3.21Å; R488-I500 HydrophobicContact CB-CG2 4.36Å; R488-I500 HydrophobicContact CG-CG2 4.44Å
489	H	83.5	Confident	82.4	Confident	93 Å²	93	67.9 Å²	67.9	43%	0.431	37%	0.368	S	S	.	.			trans	-128.4	52.1	-169.8	-63.7	-35.9	0	0	0	113	D491 F499	H489-D491 PolarHBondContact O-N 2.83Å; H489-D491 VanDerWaalsContact O-N 3.1Å; H489-F499 HydrophobicContact CB-CB 4.4Å; H489-F499 PolarHBondContact N-O 3.04Å; H489-F499 VanDerWaalsContact O-CD2 3.3Å; H489-F499 WeakPolarHBondContact O-CD2 3.48Å
490	D	80.6	Confident	83.1	Confident	25 Å²	25	63.6 Å²	63.6	13%	0.134	35%	0.345	C	S	.	.			trans	-67.7	101.4	179.4	-68.3	9.5	0	0	0	112.9	R461 R488 S498 F499	R461-D490 HydrophobicContact CG-CB 4.5Å; R488-D490 WeakPolarHBondContact CG-OD1 3.26Å; R488-D490 IonicContact CZ-OD1 3.2Å; R488-D490 IonicContact CZ-OD2 3.22Å; R488-D490 VanDerWaalsContact CZ-OD2 3.25Å; R488-D490 VanDerWaalsContact NE-CG 3.31Å; R488-D490 IonicContact NE-OD1 2.66Å; R488-D490 PolarHBondContact NE-OD1 2.78Å; R488-D490 VanDerWaalsContact NE-OD1 3.15Å; R488-D490 IonicContact NE-OD2 3.94Å; R488-D490 PolarHBondContact NE-OD2 3.23Å; R488-D490 IonicContact NH2-OD1 3.59Å; R488-D490 IonicContact NH2-OD2 2.65Å; R488-D490 PolarHBondContact NH2-OD2 3.23Å; D490-S498 VanDerWaalsContact OD1-CA 3.27Å; D490-S498 WeakPolarHBondContact OD1-CA 3.2Å; D490-S498 VanDerWaalsContact OD1-CB 3.27Å; D490-S498 WeakPolarHBondContact OD1-CB 3.36Å; D490-S498 PolarHBondContact OD1-OG 2.97Å; D490-F499 PolarHBondContact OD1-N 3.01Å
491	D	80.1	Confident	83.8	Confident	86 Å²	86	63 Å²	63	46%	0.46	34%	0.342	S	S	.	.			trans	-71.3	148.8	177.2	-165.5	-67.5	0	0	0	113	N460 H489 V493 A494	N460-D491 PolarHBondContact ND2-O 3.17Å; H489-D491 PolarHBondContact O-N 2.83Å; H489-D491 VanDerWaalsContact O-N 3.1Å; D491-V493 VanDerWaalsContact C-N 3.34Å; D491-V493 VanDerWaalsContact OD1-CB 3.31Å; D491-V493 WeakPolarHBondContact OD1-CB 3.43Å; D491-V493 WeakPolarHBondContact OD1-CG2 3.14Å; D491-V493 PolarHBondContact OD1-N 3.49Å; D491-A494 HydrophobicContact CB-CB 4.06Å; D491-A494 PolarHBondContact O-N 2.78Å
492	L	81.1	Confident	84.8	Confident	112 Å²	112	56.1 Å²	56.1	59%	0.586	31%	0.305	S	S	*	.	S	Bend	trans	-75.4	-19	179.7	-63.6	176.8	0	0	0	114.1	Q495	L492-Q495 VanDerWaalsContact O-CG 3.22Å; L492-Q495 WeakPolarHBondContact O-CG 3.33Å; L492-Q495 PolarHBondContact O-NE2 3.21Å; L492-Q495 VanDerWaalsContact O-NE2 3.13Å
493	V	84.1	Confident	85.8	Confident	129 Å²	129	56.9 Å²	56.9	78%	0.782	32%	0.317	S	S	*	.	S	Bend	trans	-83.5	-38	172.6	-175.8	0	0	0	0	110.1	D491 Q495	D491-V493 VanDerWaalsContact C-N 3.34Å; D491-V493 VanDerWaalsContact OD1-CB 3.31Å; D491-V493 WeakPolarHBondContact OD1-CB 3.43Å; D491-V493 WeakPolarHBondContact OD1-CG2 3.14Å; D491-V493 PolarHBondContact OD1-N 3.49Å; V493-Q495 PolarHBondContact O-N 3.07Å
494	A	84.4	Confident	86.6	Confident	26 Å²	26	59.8 Å²	59.8	22%	0.215	31%	0.312	C	S	.	.			trans	-82.8	53.8	-179	0	0	0	0	0	112.7	N460 D491 H496 T497 F499	N460-A494 PolarHBondContact ND2-O 2.65Å; D491-A494 HydrophobicContact CB-CB 4.06Å; D491-A494 PolarHBondContact O-N 2.78Å; A494-H496 PolarHBondContact O-N 3.3Å; A494-T497 PolarHBondContact O-N 3.22Å; A494-T497 VanDerWaalsContact O-O 3.09Å; A494-F499 HydrophobicContact CB-CE2 3.66Å; A494-F499 HydrophobicContact CB-CZ 3.84Å
495	Q	86.2	Confident	87.4	Confident	85 Å²	85	53.7 Å²	53.7	40%	0.397	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-15.6	-167.6	-64.3	-172.2	8.2	0	0	115.8	N458 I459 N460 L492 V493	N458-Q495 HydrophobicContact CB-CB 4.5Å; N458-Q495 VanDerWaalsContact OD1-CA 3.31Å; N458-Q495 WeakPolarHBondContact OD1-CA 3.29Å; N458-Q495 WeakPolarHBondContact OD1-CB 3.47Å; N458-Q495 WeakPolarHBondContact OD1-CG 3.34Å; I459-Q495 PolarHBondContact N-O 2.94Å; N460-Q495 PolarHBondContact N-O 2.99Å; L492-Q495 VanDerWaalsContact O-CG 3.22Å; L492-Q495 WeakPolarHBondContact O-CG 3.33Å; L492-Q495 PolarHBondContact O-NE2 3.21Å; L492-Q495 VanDerWaalsContact O-NE2 3.13Å; V493-Q495 PolarHBondContact O-N 3.07Å
496	H	87.3	Confident	87.6	Confident	61 Å²	61	58.2 Å²	58.2	28%	0.282	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.6	-1.1	-179.4	-54.2	-79.7	0	0	0	113.9	R451 V452 M455 G457 A494	R451-H496 WeakPolarHBondContact CA-O 3.45Å; V452-H496 PolarHBondContact N-O 2.93Å; M455-H496 PolarHBondContact O-CE1 2.76Å; M455-H496 PolarHBondContact O-ND1 2.8Å; G457-H496 PolarHBondContact O-CE1 3.13Å; G457-H496 VanDerWaalsContact O-CE1 3.3Å; A494-H496 PolarHBondContact O-N 3.3Å
497	T	89.9	Confident	87.4	Confident	23 Å²	23	61 Å²	61	14%	0.141	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	127.4	-176.3	-50.3	0	0	0	0	111.3	H449 C450 R451 N460 A494 F499	H449-T497 HydrophobicContact CB-CG2 4.3Å; C450-T497 CarbonylContact O-C 3.25Å; C450-T497 VanDerWaalsContact O-CA 3.26Å; C450-T497 WeakPolarHBondContact O-CA 3.39Å; C450-T497 WeakPolarHBondContact O-CG2 2.93Å; R451-T497 HydrophobicContact CB-CG2 4.41Å; N460-T497 WeakPolarHBondContact CB-O 3.21Å; A494-T497 PolarHBondContact O-N 3.22Å; A494-T497 VanDerWaalsContact O-O 3.09Å; T497-F499 HydrophobicContact CG2-CD1 4.37Å; T497-F499 HydrophobicContact CG2-CD2 4.48Å; T497-F499 HydrophobicContact CG2-CE1 3.84Å; T497-F499 HydrophobicContact CG2-CE2 3.95Å; T497-F499 HydrophobicContact CG2-CZ 3.6Å; T497-F499 WeakPolarHBondContact O-CE2 3.27Å
498	S	91.9	Very high	87.2	Confident	0 Å²	0	61 Å²	61	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	143.8	167.2	-179.6	0	0	0	0	110.2	C450 W465 R488 D490	C450-S498 PolarHBondContact N-O 3.01Å; C450-S498 PolarHBondContact O-N 2.98Å; W465-S498 PolarHBondContact NE1-OG 2.88Å; R488-S498 PolarHBondContact NE-OG 3.25Å; R488-S498 PolarHBondContact NH2-OG 3.4Å; D490-S498 VanDerWaalsContact OD1-CA 3.27Å; D490-S498 WeakPolarHBondContact OD1-CA 3.2Å; D490-S498 VanDerWaalsContact OD1-CB 3.27Å; D490-S498 WeakPolarHBondContact OD1-CB 3.36Å; D490-S498 PolarHBondContact OD1-OG 2.97Å
499	F	91.4	Very high	87.2	Confident	38 Å²	38	58.4 Å²	58.4	17%	0.167	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	130.4	-176.7	-51.5	-99	0	0	0	109	H449 R488 H489 D490 A494 T497	H449-F499 AromaticContact CE1-CD1 3.74Å; H449-F499 AromaticContact CE1-CE1 3.62Å; H449-F499 AromaticContact CG-CD1 3.88Å; H449-F499 AromaticContact ND1-CD1 3.65Å; H449-F499 AromaticContact ND1-CE1 3.39Å; H449-F499 WeakPolarHBondContact ND1-CE1 3.39Å; R488-F499 WeakPolarHBondContact CA-O 3.21Å; H489-F499 HydrophobicContact CB-CB 4.4Å; H489-F499 PolarHBondContact N-O 3.04Å; H489-F499 VanDerWaalsContact O-CD2 3.3Å; H489-F499 WeakPolarHBondContact O-CD2 3.48Å; D490-F499 PolarHBondContact OD1-N 3.01Å; A494-F499 HydrophobicContact CB-CE2 3.66Å; A494-F499 HydrophobicContact CB-CZ 3.84Å; T497-F499 HydrophobicContact CG2-CD1 4.37Å; T497-F499 HydrophobicContact CG2-CD2 4.48Å; T497-F499 HydrophobicContact CG2-CE1 3.84Å; T497-F499 HydrophobicContact CG2-CE2 3.95Å; T497-F499 HydrophobicContact CG2-CZ 3.6Å; T497-F499 WeakPolarHBondContact O-CE2 3.27Å
500	I	92.7	Very high	87.6	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	137.8	163.3	58	167.5	0	0	0	109.3	E447 F448 W465 L478 V480 F486 M487 R488 Y513	E447-I500 CarbonylContact C-O 3.57Å; E447-I500 WeakPolarHBondContact CA-O 3.37Å; F448-I500 HydrophobicContact CB-CD1 4.35Å; F448-I500 HydrophobicContact CB-CG1 3.92Å; F448-I500 HydrophobicContact CD2-CD1 4.45Å; F448-I500 PolarHBondContact N-O 2.8Å; F448-I500 PolarHBondContact O-N 3.09Å; W465-I500 HydrophobicContact CD2-CD1 3.75Å; W465-I500 HydrophobicContact CD2-CG1 4.06Å; W465-I500 HydrophobicContact CD2-CG2 3.95Å; W465-I500 HydrophobicContact CE3-CD1 3.46Å; W465-I500 VanDerWaalsContact CE3-CD1 3.46Å; W465-I500 HydrophobicContact CE3-CG1 4.09Å; W465-I500 HydrophobicContact CG-CD1 4.37Å; W465-I500 HydrophobicContact CG-CG2 3.85Å; W465-I500 HydrophobicContact CH2-CD1 4.06Å; W465-I500 HydrophobicContact CH2-CG1 3.88Å; W465-I500 HydrophobicContact CZ2-CD1 4.34Å; W465-I500 HydrophobicContact CZ2-CG1 3.88Å; W465-I500 HydrophobicContact CZ2-CG2 4.39Å; W465-I500 HydrophobicContact CZ3-CD1 3.63Å; W465-I500 HydrophobicContact CZ3-CG1 4Å; L478-I500 HydrophobicContact CD2-CB 4.5Å; L478-I500 HydrophobicContact CD2-CD1 3.5Å; L478-I500 VanDerWaalsContact CD2-CD1 3.5Å; L478-I500 HydrophobicContact CD2-CG2 4.23Å; V480-I500 HydrophobicContact CG1-CG2 4.36Å; F486-I500 HydrophobicContact CD1-CB 4.16Å; F486-I500 HydrophobicContact CD1-CD1 4.11Å; F486-I500 HydrophobicContact CD1-CG1 4.28Å; F486-I500 HydrophobicContact CE1-CD1 4.49Å; M487-I500 VanDerWaalsContact O-CA 3.31Å; M487-I500 WeakPolarHBondContact O-CA 3.41Å; R488-I500 HydrophobicContact CB-CG2 4.36Å; R488-I500 HydrophobicContact CG-CG2 4.44Å; I500-Y513 HydrophobicContact CD1-CD1 3.73Å; I500-Y513 HydrophobicContact CD1-CE1 4.41Å
501	S	92.8	Very high	88	Confident	18 Å²	18	55.4 Å²	55.4	13%	0.126	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	160.3	174.6	66.7	0	0	0	0	112.1	V446 F486 M487	V446-S501 CarbonylContact O-C 3.56Å; V446-S501 WeakPolarHBondContact O-CA 3.28Å; V446-S501 VanDerWaalsContact O-CB 3.26Å; V446-S501 WeakPolarHBondContact O-CB 3.22Å; F486-S501 CarbonylContact C-O 3.5Å; F486-S501 WeakPolarHBondContact CA-O 3.48Å; M487-S501 PolarHBondContact N-O 3.28Å; M487-S501 PolarHBondContact O-N 2.88Å
502	K	91.7	Very high	88.7	Confident	8 Å²	8	52.5 Å²	52.5	4%	0.035	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	129	177.1	-178.8	161.8	-159.4	176.8	0	109.6	A445 V446 D484 G485 F486 R504 R506 D509	A445-K502 CarbonylContact C-O 3.57Å; A445-K502 WeakPolarHBondContact CA-O 3.48Å; V446-K502 PolarHBondContact N-O 3.47Å; V446-K502 PolarHBondContact O-N 2.96Å; D484-K502 WeakPolarHBondContact O-CE 3.43Å; D484-K502 PolarHBondContact O-NZ 2.92Å; G485-K502 WeakPolarHBondContact O-CD 3.46Å; G485-K502 WeakPolarHBondContact O-CE 3.02Å; G485-K502 VanDerWaalsContact O-CG 3.3Å; G485-K502 WeakPolarHBondContact O-CG 3.23Å; F486-K502 HydrophobicContact CD1-CB 3.87Å; F486-K502 HydrophobicContact CD2-CB 4.04Å; F486-K502 HydrophobicContact CD2-CD 3.84Å; F486-K502 HydrophobicContact CE1-CB 3.78Å; F486-K502 HydrophobicContact CE2-CB 3.92Å; F486-K502 HydrophobicContact CE2-CD 3.64Å; F486-K502 HydrophobicContact CE2-CG 4.41Å; F486-K502 HydrophobicContact CG-CB 4Å; F486-K502 HydrophobicContact CZ-CB 3.8Å; F486-K502 HydrophobicContact CZ-CD 4.27Å; K502-R504 VanDerWaalsContact C-N 3.33Å; K502-R504 WeakPolarHBondContact CE-O 3.46Å; K502-R504 WeakPolarHBondContact CG-O 3.26Å; K502-R504 PolarHBondContact O-N 2.89Å; K502-R506 VanDerWaalsContact NZ-CZ 3.34Å; K502-D509 IonicContact NZ-OD1 2.76Å; K502-D509 PolarHBondContact NZ-OD1 3.49Å; K502-D509 IonicContact NZ-OD2 3.08Å; K502-D509 PolarHBondContact NZ-OD2 3.05Å
503	A	89.5	Confident	89.3	Confident	72 Å²	72	47.3 Å²	47.3	60%	0.595	26%	0.255	S	S	*	.	S	Bend	trans	-76.1	-17.7	-174.7	0	0	0	0	0	114.6
504	R	89.1	Confident	89.8	Confident	186 Å²	186	41.5 Å²	41.5	70%	0.702	22%	0.219	S	C	*	.	S	Bend	trans	-149.9	105.1	177.1	-65	-172.5	177.5	179.7	-2.4	110.2	E444 K502	E444-R504 CarbonylContact O-C 3.55Å; E444-R504 VanDerWaalsContact O-CA 3.25Å; E444-R504 WeakPolarHBondContact O-CA 3.36Å; K502-R504 VanDerWaalsContact C-N 3.33Å; K502-R504 WeakPolarHBondContact CE-O 3.46Å; K502-R504 WeakPolarHBondContact CG-O 3.26Å; K502-R504 PolarHBondContact O-N 2.89Å
505	A	88.4	Confident	90.3	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.008	21%	0.209	C	C	.	.			trans	-69	148.2	171.8	0	0	0	0	0	111	V440 G443 E444 V446 V530	V440-A505 HydrophobicContact CG2-CB 3.67Å; G443-A505 PolarHBondContact N-O 2.74Å; E444-A505 PolarHBondContact O-N 2.76Å; V446-A505 HydrophobicContact CG2-CB 3.89Å; A505-V530 HydrophobicContact CB-CG1 4Å; A505-V530 HydrophobicContact CB-CG2 4.02Å
506	R	88.2	Confident	90.6	Very high	108 Å²	108	38.4 Å²	38.4	41%	0.408	20%	0.198	S	C	.	.			trans	-128.4	158.3	173.2	-51.9	165	-62.8	-171.3	7.6	109	E442 K502 A508 D509	E442-R506 WeakPolarHBondContact OE1-CA 3.45Å; K502-R506 VanDerWaalsContact NZ-CZ 3.34Å; R506-A508 PolarHBondContact O-N 3Å; R506-A508 VanDerWaalsContact O-N 3.1Å; R506-D509 VanDerWaalsContact CB-OD2 3.3Å; R506-D509 WeakPolarHBondContact CB-OD2 2.94Å; R506-D509 IonicContact CZ-OD1 3.53Å; R506-D509 IonicContact CZ-OD2 3.67Å; R506-D509 PolarHBondContact N-OD2 2.6Å; R506-D509 IonicContact NE-OD1 3.04Å; R506-D509 IonicContact NE-OD2 3.53Å; R506-D509 PolarHBondContact NE-OD2 3.33Å; R506-D509 IonicContact NH2-OD1 3.04Å; R506-D509 PolarHBondContact NH2-OD1 3.29Å; R506-D509 IonicContact NH2-OD2 3.33Å; R506-D509 WeakPolarHBondContact O-CB 3.27Å; R506-D509 PolarHBondContact O-N 3.46Å
507	V	83.3	Confident	90.8	Very high	63 Å²	63	35.5 Å²	35.5	38%	0.382	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	-53.8	-35	175.8	178.1	0	0	0	0	112	E442 D509 Q510 A532	E442-V507 PolarHBondContact OE1-N 3.17Å; V507-D509 PolarHBondContact O-N 3.46Å; V507-Q510 VanDerWaalsContact O-CB 3.25Å; V507-Q510 WeakPolarHBondContact O-CB 3.4Å; V507-Q510 PolarHBondContact O-N 3.29Å; V507-A532 HydrophobicContact CG2-CB 3.72Å
508	A	86.2	Confident	90.6	Very high	79 Å²	79	37.2 Å²	37.2	65%	0.653	20%	0.197	S	C	*	.	G	3₁₀ helix	trans	-70.2	-9.9	177.4	0	0	0	0	0	115.3	Y467 R506	Y467-A508 PolarHBondContact OH-O 3.02Å; Y467-A508 VanDerWaalsContact OH-O 3.11Å; R506-A508 PolarHBondContact O-N 3Å; R506-A508 VanDerWaalsContact O-N 3.1Å
509	D	89.7	Confident	90.2	Very high	13 Å²	13	40.8 Å²	40.8	7%	0.07	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-92.8	-0.6	175.1	-54.1	-56.1	0	0	0	112.1	K502 R506 V507 G511 Y513	K502-D509 IonicContact NZ-OD1 2.76Å; K502-D509 PolarHBondContact NZ-OD1 3.49Å; K502-D509 IonicContact NZ-OD2 3.08Å; K502-D509 PolarHBondContact NZ-OD2 3.05Å; R506-D509 VanDerWaalsContact CB-OD2 3.3Å; R506-D509 WeakPolarHBondContact CB-OD2 2.94Å; R506-D509 IonicContact CZ-OD1 3.53Å; R506-D509 IonicContact CZ-OD2 3.67Å; R506-D509 PolarHBondContact N-OD2 2.6Å; R506-D509 IonicContact NE-OD1 3.04Å; R506-D509 IonicContact NE-OD2 3.53Å; R506-D509 PolarHBondContact NE-OD2 3.33Å; R506-D509 IonicContact NH2-OD1 3.04Å; R506-D509 PolarHBondContact NH2-OD1 3.29Å; R506-D509 IonicContact NH2-OD2 3.33Å; R506-D509 WeakPolarHBondContact O-CB 3.27Å; R506-D509 PolarHBondContact O-N 3.46Å; V507-D509 PolarHBondContact O-N 3.46Å; D509-G511 PolarHBondContact O-N 3.36Å; D509-Y513 PolarHBondContact O-OH 2.76Å
510	Q	90.8	Very high	89.7	Confident	55 Å²	55	43.4 Å²	43.4	26%	0.257	23%	0.234	S	C	.	.			trans	-69.4	125.2	179.3	171.1	162.4	-79.9	0	0	112.7	Y467 F470 V507 L528 F529 V530	Y467-Q510 PolarHBondContact OH-O 2.94Å; Y467-Q510 VanDerWaalsContact OH-O 3.07Å; F470-Q510 HydrophobicContact CD2-CG 3.43Å; F470-Q510 VanDerWaalsContact CD2-CG 3.43Å; F470-Q510 HydrophobicContact CE2-CG 3.48Å; F470-Q510 VanDerWaalsContact CE2-CG 3.48Å; V507-Q510 VanDerWaalsContact O-CB 3.25Å; V507-Q510 WeakPolarHBondContact O-CB 3.4Å; V507-Q510 PolarHBondContact O-N 3.29Å; Q510-L528 WeakPolarHBondContact CG-O 3.29Å; Q510-F529 VanDerWaalsContact OE1-CA 3.31Å; Q510-V530 HydrophobicContact CB-CG2 4.36Å
511	G	89.8	Confident	89.4	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	165.2	-157.6	178.1	0	0	0	0	0	115.4	F470 D509 L528	F470-G511 VanDerWaalsContact CE1-C 3.45Å; F470-G511 WeakPolarHBondContact CZ-O 3.45Å; D509-G511 PolarHBondContact O-N 3.36Å; G511-L528 PolarHBondContact N-O 3.31Å; G511-L528 PolarHBondContact O-N 3.27Å
512	E	94	Very high	89	Confident	26 Å²	26	50.3 Å²	50.3	12%	0.121	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	128.9	179.8	-63.8	-169.9	144.7	0	0	111.6	Y467 R468 F470 I514 V525 G526 K527	Y467-E512 WeakPolarHBondContact CA-O 3.45Å; R468-E512 HydrophobicContact CB-CB 4.41Å; R468-E512 IonicContact CZ-OE2 3.49Å; R468-E512 PolarHBondContact N-O 2.83Å; R468-E512 IonicContact NE-OE2 3.25Å; R468-E512 PolarHBondContact NE-OE2 2.84Å; R468-E512 IonicContact NH2-OE2 3.83Å; R468-E512 PolarHBondContact NH2-OE2 2.02Å; R468-E512 PolarHBondContact O-N 2.96Å; F470-E512 HydrophobicContact CD1-CG 3.87Å; F470-E512 HydrophobicContact CE1-CG 3.58Å; E512-I514 HydrophobicContact CB-CD1 4.38Å; E512-V525 HydrophobicContact CB-CG1 3.77Å; E512-V525 HydrophobicContact CG-CG1 4.07Å; E512-G526 WeakPolarHBondContact CA-O 3.45Å; E512-K527 HydrophobicContact CG-CG 4.35Å; E512-K527 VanDerWaalsContact OE1-CE 3.29Å; E512-K527 WeakPolarHBondContact OE1-CE 3.19Å; E512-K527 IonicContact OE1-NZ 3.17Å; E512-K527 PolarHBondContact OE1-NZ 3.47Å
513	Y	94.3	Very high	89.1	Confident	3 Å²	3	54 Å²	54	1%	0.012	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	105.8	179.6	-73.1	-97.2	0	0	0	108.3	F448 Y467 L478 F486 I500 D509 G526 L528	F448-Y513 HydrophobicContact CD2-CG 4.22Å; F448-Y513 AromaticContact CE2-CD2 3.92Å; F448-Y513 HydrophobicContact CE2-CD2 3.92Å; F448-Y513 HydrophobicContact CE2-CE2 4.48Å; F448-Y513 HydrophobicContact CE2-CG 4.02Å; F448-Y513 HydrophobicContact CZ-CD2 4.44Å; Y467-Y513 HydrophobicContact CD2-CD2 4.33Å; Y467-Y513 HydrophobicContact CD2-CE1 4.02Å; Y467-Y513 AromaticContact CD2-CE2 3.8Å; Y467-Y513 HydrophobicContact CD2-CE2 3.8Å; Y467-Y513 AromaticContact CD2-CZ 3.61Å; Y467-Y513 AromaticContact CE2-CE2 3.86Å; Y467-Y513 HydrophobicContact CE2-CE2 3.86Å; Y467-Y513 AromaticContact CE2-CZ 3.84Å; L478-Y513 HydrophobicContact CD1-CE1 4.16Å; L478-Y513 HydrophobicContact CD2-CD1 4.28Å; L478-Y513 HydrophobicContact CD2-CE1 4.3Å; F486-Y513 HydrophobicContact CD1-CE1 4.41Å; F486-Y513 HydrophobicContact CD2-CE1 4.03Å; F486-Y513 HydrophobicContact CE1-CE1 4.04Å; F486-Y513 AromaticContact CE2-CE1 3.65Å; F486-Y513 HydrophobicContact CE2-CE1 3.65Å; F486-Y513 AromaticContact CE2-CZ 3.63Å; F486-Y513 WeakPolarHBondContact CE2-OH 3.29Å; F486-Y513 HydrophobicContact CG-CE1 4.41Å; F486-Y513 AromaticContact CZ-CE1 3.64Å; F486-Y513 HydrophobicContact CZ-CE1 3.64Å; F486-Y513 AromaticContact CZ-CZ 3.63Å; F486-Y513 WeakPolarHBondContact CZ-OH 3.35Å; I500-Y513 HydrophobicContact CD1-CD1 3.73Å; I500-Y513 HydrophobicContact CD1-CE1 4.41Å; D509-Y513 PolarHBondContact O-OH 2.76Å; Y513-G526 PolarHBondContact N-O 2.99Å; Y513-G526 PolarHBondContact O-N 3.47Å; Y513-L528 HydrophobicContact CD2-CB 4.06Å; Y513-L528 HydrophobicContact CE2-CB 3.78Å; Y513-L528 HydrophobicContact CE2-CD2 3.96Å
514	I	94.6	Very high	89.1	Confident	7 Å²	7	52.3 Å²	52.3	4%	0.036	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	117.7	-174.1	-48.5	94.2	0	0	0	109.2	W465 Y466 R468 E512 E523 I524 V525	W465-I514 WeakPolarHBondContact CA-O 3.39Å; Y466-I514 PolarHBondContact N-O 2.69Å; Y466-I514 PolarHBondContact O-N 2.83Å; R468-I514 HydrophobicContact CB-CD1 3.93Å; E512-I514 HydrophobicContact CB-CD1 4.38Å; I514-E523 HydrophobicContact CG2-CB 3.92Å; I514-I524 CarbonylContact C-O 3.44Å; I514-I524 WeakPolarHBondContact CA-O 3.3Å; I514-V525 HydrophobicContact CB-CG2 4.5Å; I514-V525 HydrophobicContact CG1-CG1 4.37Å; I514-V525 HydrophobicContact CG1-CG2 3.89Å; I514-V525 HydrophobicContact CG2-CG2 4.22Å
515	C	94	Very high	89.2	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	130	168.9	-179.7	0	0	0	0	109.6	I433 C450 E464 W465 E523 I524	I433-C515 HydrophobicContact CD1-CB 4.48Å; C450-C515 HydrophobicContact CB-CB 3.57Å; C450-C515 WeakPolarHBondContact CB-SG 3.39Å; C450-C515 WeakPolarHBondContact SG-CB 3.5Å; C450-C515 CovalentContact SG-SG 2.02Å; C450-C515 PolarHBondContact SG-SG 2.84Å; E464-C515 WeakPolarHBondContact O-CA 3.41Å; W465-C515 HydrophobicContact CD2-CB 4.32Å; W465-C515 HydrophobicContact CE3-CB 3.97Å; W465-C515 HydrophobicContact CH2-CB 4.11Å; W465-C515 HydrophobicContact CZ2-CB 4.41Å; W465-C515 HydrophobicContact CZ3-CB 3.87Å; C515-E523 CarbonylContact O-C 3.13Å; C515-E523 VanDerWaalsContact O-CA 3.28Å; C515-E523 WeakPolarHBondContact O-CA 3.29Å; C515-I524 HydrophobicContact CB-CG2 4.06Å; C515-I524 PolarHBondContact N-O 3.19Å; C515-I524 PolarHBondContact O-N 2.79Å
516	R	93.5	Very high	89.2	Confident	46 Å²	46	46 Å²	46	17%	0.174	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	140.3	-175	-179.8	166.9	179.2	-102.3	-0.6	111.6	E464 Y466 P518 N521 E522 E523	E464-R516 PolarHBondContact N-O 3.18Å; E464-R516 PolarHBondContact O-N 2.67Å; E464-R516 IonicContact OE2-NH1 2.75Å; E464-R516 PolarHBondContact OE2-NH1 3.38Å; Y466-R516 HydrophobicContact CD2-CB 4.46Å; Y466-R516 HydrophobicContact CE2-CB 4.38Å; R516-P518 WeakPolarHBondContact O-CD 3.45Å; R516-N521 PolarHBondContact NH2-OD1 3.1Å; R516-E522 WeakPolarHBondContact CA-O 3.49Å; R516-E523 HydrophobicContact CB-CB 3.96Å; R516-E523 HydrophobicContact CG-CB 4.05Å; R516-E523 IonicContact NE-OE1 3.19Å
517	L	90.3	Very high	89.3	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	100.6	174.5	179.6	59.3	0	0	0	109.7	L431 V452 M455 I459 L463 S519 Q520 N521 E522	L431-L517 HydrophobicContact CD1-CB 3.98Å; L431-L517 HydrophobicContact CD2-CB 4.18Å; L431-L517 HydrophobicContact CG-CB 4.27Å; V452-L517 HydrophobicContact CG1-CD2 4Å; V452-L517 HydrophobicContact CG2-CD1 4.38Å; V452-L517 HydrophobicContact CG2-CD2 4.19Å; M455-L517 HydrophobicContact SD-CD2 3.86Å; I459-L517 HydrophobicContact CG2-CD1 4.06Å; L463-L517 HydrophobicContact CD2-CB 4.17Å; L463-L517 HydrophobicContact CD2-CD1 4.13Å; L517-S519 WeakPolarHBondContact CD1-OG 3.27Å; L517-S519 WeakPolarHBondContact CG-OG 3.4Å; L517-S519 PolarHBondContact O-N 2.59Å; L517-S519 VanDerWaalsContact O-N 3.15Å; L517-Q520 HydrophobicContact CD2-CB 4.34Å; L517-Q520 HydrophobicContact CD2-CG 4.33Å; L517-Q520 PolarHBondContact O-N 3.08Å; L517-N521 WeakPolarHBondContact O-CA 3.47Å; L517-N521 PolarHBondContact O-N 2.97Å; L517-E522 PolarHBondContact N-O 2.89Å
518	P	86.4	Confident	89.5	Confident	59 Å²	59	41.6 Å²	41.6	38%	0.383	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-21.3	-171	-24.5	35.8	0	0	0	115.1	Q462 E464 R516	Q462-P518 WeakPolarHBondContact O-CD 3.45Å; E464-P518 HydrophobicContact CG-CG 3.72Å; E464-P518 WeakPolarHBondContact OE2-CG 3.27Å; R516-P518 WeakPolarHBondContact O-CD 3.45Å
519	S	84.6	Confident	89.7	Confident	74 Å²	74	41.4 Å²	41.4	52%	0.517	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-32.7	-177.8	51.1	0	0	0	0	113.9	L517	L517-S519 WeakPolarHBondContact CD1-OG 3.27Å; L517-S519 WeakPolarHBondContact CG-OG 3.4Å; L517-S519 PolarHBondContact O-N 2.59Å; L517-S519 VanDerWaalsContact O-N 3.15Å
520	Q	80.4	Confident	89.4	Confident	93 Å²	93	41.1 Å²	41.1	44%	0.435	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.1	-11.9	176.3	-67.8	179.9	-101.8	0	0	112.8	M455 L517 E522	M455-Q520 PolarHBondContact SD-OE1 3Å; L517-Q520 HydrophobicContact CD2-CB 4.34Å; L517-Q520 HydrophobicContact CD2-CG 4.33Å; L517-Q520 PolarHBondContact O-N 3.08Å; Q520-E522 HydrophobicContact CB-CG 4.11Å; Q520-E522 PolarHBondContact NE2-OE1 2.84Å; Q520-E522 PolarHBondContact O-N 2.96Å
521	N	84.9	Confident	88.7	Confident	97 Å²	97	45.4 Å²	45.4	52%	0.519	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	40.5	-168.2	-163.2	85.4	0	0	0	112.5	R516 L517	R516-N521 PolarHBondContact NH2-OD1 3.1Å; L517-N521 WeakPolarHBondContact O-CA 3.47Å; L517-N521 PolarHBondContact O-N 2.97Å
522	E	86.1	Confident	87.6	Confident	66 Å²	66	48.4 Å²	48.4	31%	0.308	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	145.8	165	-67.9	-176.8	-164.8	0	0	109.9	G430 L431 R516 L517 Q520	G430-E522 WeakPolarHBondContact CA-OE2 3.49Å; L431-E522 HydrophobicContact CD1-CB 3.81Å; L431-E522 WeakPolarHBondContact CD1-O 3.46Å; L431-E522 HydrophobicContact CG-CB 4.28Å; L431-E522 PolarHBondContact N-OE2 3.01Å; R516-E522 WeakPolarHBondContact CA-O 3.49Å; L517-E522 PolarHBondContact N-O 2.89Å; Q520-E522 HydrophobicContact CB-CG 4.11Å; Q520-E522 PolarHBondContact NE2-OE1 2.84Å; Q520-E522 PolarHBondContact O-N 2.96Å
523	E	92.3	Very high	86.2	Confident	85 Å²	85	50.4 Å²	50.4	40%	0.397	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	140.2	172.3	51.4	-163.1	121.5	0	0	110.8	R475 I514 C515 R516	R475-E523 IonicContact NH1-OE1 3.45Å; R475-E523 IonicContact NH1-OE2 2.7Å; R475-E523 PolarHBondContact NH1-OE2 3.15Å; I514-E523 HydrophobicContact CG2-CB 3.92Å; C515-E523 CarbonylContact O-C 3.13Å; C515-E523 VanDerWaalsContact O-CA 3.28Å; C515-E523 WeakPolarHBondContact O-CA 3.29Å; R516-E523 HydrophobicContact CB-CB 3.96Å; R516-E523 HydrophobicContact CG-CB 4.05Å; R516-E523 IonicContact NE-OE1 3.19Å
524	I	89.9	Confident	84.9	Confident	37 Å²	37	58.5 Å²	58.5	19%	0.19	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	148.1	-178.8	-166.6	164.8	0	0	0	110.3	L431 I433 I514 C515	L431-I524 HydrophobicContact CB-CB 4.06Å; L431-I524 HydrophobicContact CB-CG2 3.77Å; L431-I524 HydrophobicContact CD1-CG2 4.24Å; L431-I524 WeakPolarHBondContact O-CD1 3.46Å; I433-I524 HydrophobicContact CB-CD1 4.46Å; I433-I524 HydrophobicContact CB-CG1 4.44Å; I433-I524 HydrophobicContact CB-CG2 3.95Å; I433-I524 HydrophobicContact CG2-CD1 3.96Å; I433-I524 HydrophobicContact CG2-CG1 3.78Å; I433-I524 HydrophobicContact CG2-CG2 4.17Å; I514-I524 CarbonylContact C-O 3.44Å; I514-I524 WeakPolarHBondContact CA-O 3.3Å; C515-I524 HydrophobicContact CB-CG2 4.06Å; C515-I524 PolarHBondContact N-O 3.19Å; C515-I524 PolarHBondContact O-N 2.79Å
525	V	92.2	Very high	83.7	Confident	54 Å²	54	60.5 Å²	60.5	33%	0.327	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	126.6	-170.9	-174.2	0	0	0	0	111.3	E512 I514	E512-V525 HydrophobicContact CB-CG1 3.77Å; E512-V525 HydrophobicContact CG-CG1 4.07Å; I514-V525 HydrophobicContact CB-CG2 4.5Å; I514-V525 HydrophobicContact CG1-CG1 4.37Å; I514-V525 HydrophobicContact CG1-CG2 3.89Å; I514-V525 HydrophobicContact CG2-CG2 4.22Å
526	G	87.3	Confident	83.3	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	155.1	161.4	0	0	0	0	0	110.2	K436 E512 Y513	K436-G526 WeakPolarHBondContact O-CA 3.31Å; E512-G526 WeakPolarHBondContact CA-O 3.45Å; Y513-G526 PolarHBondContact N-O 2.99Å; Y513-G526 PolarHBondContact O-N 3.47Å
527	K	89.9	Confident	83.2	Confident	79 Å²	79	62.6 Å²	62.6	34%	0.343	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	138.2	179.4	-57.7	-160.2	-176	-134.2	0	111.1	K436 S437 D438 F470 E512 F529	K436-K527 PolarHBondContact O-N 2.85Å; S437-K527 CarbonylContact C-O 3.54Å; S437-K527 VanDerWaalsContact CA-O 3.28Å; S437-K527 WeakPolarHBondContact CA-O 3.21Å; D438-K527 PolarHBondContact N-O 2.97Å; F470-K527 HydrophobicContact CE1-CB 4.37Å; F470-K527 HydrophobicContact CE1-CD 4.19Å; F470-K527 HydrophobicContact CE1-CG 4.45Å; F470-K527 HydrophobicContact CZ-CB 4.14Å; E512-K527 HydrophobicContact CG-CG 4.35Å; E512-K527 VanDerWaalsContact OE1-CE 3.29Å; E512-K527 WeakPolarHBondContact OE1-CE 3.19Å; E512-K527 IonicContact OE1-NZ 3.17Å; E512-K527 PolarHBondContact OE1-NZ 3.47Å; K527-F529 HydrophobicContact CB-CE2 4.15Å
528	L	89.2	Confident	83.3	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	125.6	175	177.9	61.3	0	0	0	109.8	D438 V440 V446 F448 F470 F486 Q510 G511 Y513 V530	D438-L528 HydrophobicContact CB-CD1 4.16Å; V440-L528 HydrophobicContact CG2-CD1 4.18Å; V446-L528 HydrophobicContact CB-CD1 4.45Å; V446-L528 HydrophobicContact CG1-CD1 3.81Å; V446-L528 HydrophobicContact CG1-CD2 4.03Å; V446-L528 HydrophobicContact CG2-CD1 3.7Å; V446-L528 HydrophobicContact CG2-CD2 4.13Å; F448-L528 HydrophobicContact CE2-CB 4.12Å; F448-L528 HydrophobicContact CZ-CB 4.01Å; F470-L528 WeakPolarHBondContact CE2-O 3.27Å; F470-L528 WeakPolarHBondContact CZ-O 3.28Å; F486-L528 HydrophobicContact CZ-CD2 4.18Å; Q510-L528 WeakPolarHBondContact CG-O 3.29Å; G511-L528 PolarHBondContact N-O 3.31Å; G511-L528 PolarHBondContact O-N 3.27Å; Y513-L528 HydrophobicContact CD2-CB 4.06Å; Y513-L528 HydrophobicContact CE2-CB 3.78Å; Y513-L528 HydrophobicContact CE2-CD2 3.96Å; L528-V530 HydrophobicContact CD1-CG2 4.33Å; L528-V530 HydrophobicContact CD2-CG2 4.02Å; L528-V530 HydrophobicContact CG-CG2 3.89Å
529	F	89.3	Confident	83.6	Confident	75 Å²	75	61.3 Å²	61.3	33%	0.329	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	138.6	167.4	-59.6	-92.9	0	0	0	109.5	D438 T439 V440 F470 Q510 K527	D438-F529 PolarHBondContact O-N 2.9Å; T439-F529 WeakPolarHBondContact CA-O 3.24Å; T439-F529 HydrophobicContact CG2-CB 4.12Å; V440-F529 PolarHBondContact N-O 3.16Å; V440-F529 VanDerWaalsContact N-O 3.1Å; F470-F529 HydrophobicContact CD2-CD1 4.37Å; F470-F529 HydrophobicContact CD2-CE1 4.14Å; F470-F529 AromaticContact CE2-CD1 3.5Å; F470-F529 HydrophobicContact CE2-CD1 3.5Å; F470-F529 VanDerWaalsContact CE2-CD1 3.5Å; F470-F529 AromaticContact CE2-CE1 3.35Å; F470-F529 HydrophobicContact CE2-CE1 3.35Å; F470-F529 HydrophobicContact CE2-CE2 4.39Å; F470-F529 HydrophobicContact CE2-CG 4.09Å; F470-F529 AromaticContact CE2-CZ 3.84Å; F470-F529 HydrophobicContact CE2-CZ 3.84Å; F470-F529 HydrophobicContact CZ-CD1 4.15Å; F470-F529 HydrophobicContact CZ-CD2 4.46Å; F470-F529 AromaticContact CZ-CE1 3.75Å; F470-F529 HydrophobicContact CZ-CE1 3.75Å; F470-F529 HydrophobicContact CZ-CE2 4.08Å; F470-F529 HydrophobicContact CZ-CG 4.49Å; F470-F529 AromaticContact CZ-CZ 3.71Å; F470-F529 HydrophobicContact CZ-CZ 3.71Å; Q510-F529 VanDerWaalsContact OE1-CA 3.31Å; K527-F529 HydrophobicContact CB-CE2 4.15Å
530	V	83.6	Confident	84.1	Confident	7 Å²	7	57.9 Å²	57.9	4%	0.042	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	119.2	-179.3	-172.1	0	0	0	0	109.8	V440 E442 A505 Q510 L528	V440-V530 HydrophobicContact CG2-CG1 4.42Å; V440-V530 HydrophobicContact CG2-CG2 4.22Å; V440-V530 WeakPolarHBondContact O-CA 3.43Å; E442-V530 HydrophobicContact CB-CG1 4.17Å; A505-V530 HydrophobicContact CB-CG1 4Å; A505-V530 HydrophobicContact CB-CG2 4.02Å; Q510-V530 HydrophobicContact CB-CG2 4.36Å; L528-V530 HydrophobicContact CD1-CG2 4.33Å; L528-V530 HydrophobicContact CD2-CG2 4.02Å; L528-V530 HydrophobicContact CG-CG2 3.89Å
531	R	76.2	Confident	84.8	Confident	146 Å²	146	53.5 Å²	53.5	55%	0.551	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89	126	-178.6	-64.9	155.5	171.6	175.6	2.7	110.8	V440 D441 E442 V533	V440-R531 PolarHBondContact O-N 3.19Å; D441-R531 WeakPolarHBondContact OD1-CD 3.45Å; D441-R531 IonicContact OD1-CZ 3.72Å; D441-R531 IonicContact OD1-NE 3.25Å; D441-R531 IonicContact OD1-NH1 3.48Å; D441-R531 PolarHBondContact OD1-NH1 2.82Å; E442-R531 VanDerWaalsContact CB-O 3.27Å; E442-R531 WeakPolarHBondContact CB-O 3.36Å; E442-R531 PolarHBondContact N-O 2.76Å; R531-V533 PolarHBondContact O-N 3.13Å
532	A	67.6	Low	85.2	Confident	62 Å²	62	49 Å²	49	51%	0.512	24%	0.244	S	C	.	.			trans	-67.5	113.7	176.5	0	0	0	0	0	111.1	V507 R534	V507-A532 HydrophobicContact CG2-CB 3.72Å; A532-R534 PolarHBondContact O-N 3.11Å
533	V	63.5	Low	85.5	Confident	68 Å²	68	49.8 Å²	49.8	41%	0.412	25%	0.248	S	C	.	.			trans	-81.4	101.6	177.6	-177.3	0	0	0	0	109.4	D441 E442 R531 P616	D441-V533 HydrophobicContact CB-CG2 3.79Å; E442-V533 HydrophobicContact CB-CG2 4.32Å; R531-V533 PolarHBondContact O-N 3.13Å; V533-P616 HydrophobicContact CG1-CB 4.41Å; V533-P616 HydrophobicContact CG1-CG 4.16Å
534	R	66.1	Low	85.5	Confident	174 Å²	174	53.9 Å²	53.9	66%	0.657	26%	0.26	S	S	*	.			trans	-79.4	121.4	172	-68.1	-176.5	176.9	-175.6	-1	109.8	A532 Y536	A532-R534 PolarHBondContact O-N 3.11Å; R534-Y536 HydrophobicContact CB-CE2 3.81Å; R534-Y536 VanDerWaalsContact O-CD2 3.29Å; R534-Y536 WeakPolarHBondContact O-CD2 3.49Å; R534-Y536 VanDerWaalsContact O-CE2 3.28Å; R534-Y536 WeakPolarHBondContact O-CE2 3.46Å
535	S	70.5	Confident	85.6	Confident	49 Å²	49	52.3 Å²	52.3	34%	0.343	25%	0.252	S	S	.	.			trans	-80.3	139	168.1	48.3	0	0	0	0	110.8	E562	S535-E562 VanDerWaalsContact CB-OE1 3.27Å; S535-E562 WeakPolarHBondContact CB-OE1 3.48Å; S535-E562 VanDerWaalsContact OG-CD 3.29Å; S535-E562 PolarHBondContact OG-OE1 3.06Å
536	Y	85.2	Confident	85.4	Confident	21 Å²	21	50.9 Å²	50.9	8%	0.082	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	140.5	179.1	-61.3	-84.9	0	0	0	112.2	R534 A560 A567 F569 E615 P616 S617	R534-Y536 HydrophobicContact CB-CE2 3.81Å; R534-Y536 VanDerWaalsContact O-CD2 3.29Å; R534-Y536 WeakPolarHBondContact O-CD2 3.49Å; R534-Y536 VanDerWaalsContact O-CE2 3.28Å; R534-Y536 WeakPolarHBondContact O-CE2 3.46Å; Y536-A560 CarbonylContact C-O 3.57Å; Y536-A560 VanDerWaalsContact CA-O 3.32Å; Y536-A560 WeakPolarHBondContact CA-O 3.47Å; Y536-A567 HydrophobicContact CD1-CB 3.65Å; Y536-A567 HydrophobicContact CE1-CB 3.72Å; Y536-F569 AromaticContact CD1-CE1 3.8Å; Y536-F569 HydrophobicContact CD1-CE1 3.8Å; Y536-F569 HydrophobicContact CD1-CZ 4.28Å; Y536-F569 AromaticContact CD2-CE1 3.61Å; Y536-F569 HydrophobicContact CD2-CE1 3.61Å; Y536-F569 HydrophobicContact CD2-CZ 4.15Å; Y536-F569 AromaticContact CE1-CE1 3.97Å; Y536-F569 HydrophobicContact CE1-CE1 3.97Å; Y536-F569 AromaticContact CE2-CE1 3.76Å; Y536-F569 HydrophobicContact CE2-CE1 3.76Å; Y536-F569 AromaticContact CG-CE1 3.61Å; Y536-F569 HydrophobicContact CG-CE1 3.61Å; Y536-F569 AromaticContact CG-CZ 3.89Å; Y536-F569 HydrophobicContact CG-CZ 3.89Å; Y536-F569 AromaticContact CZ-CE1 3.94Å; Y536-E615 HydrophobicContact CD2-CB 3.88Å; Y536-E615 HydrophobicContact CE2-CB 4.06Å; Y536-E615 HydrophobicContact CE2-CG 4.29Å; Y536-P616 PolarHBondContact N-O 2.87Å; Y536-S617 VanDerWaalsContact O-CA 3.32Å; Y536-S617 WeakPolarHBondContact O-CA 3.39Å; Y536-S617 WeakPolarHBondContact O-CB 3.43Å
537	V	90.6	Very high	85.5	Confident	69 Å²	69	50.9 Å²	50.9	42%	0.418	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	117.8	175.1	-175.7	0	0	0	0	108.6	A560 E562	V537-A560 PolarHBondContact N-O 2.77Å; V537-A560 PolarHBondContact O-N 3.23Å; V537-E562 HydrophobicContact CG2-CG 4Å
538	L	93.7	Very high	85.2	Confident	12 Å²	12	51.6 Å²	51.6	6%	0.063	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	135.8	169.6	-58.3	-178.6	0	0	0	109.5	A559 F569 P571 C611 A620	L538-A559 HydrophobicContact CD2-CB 3.63Å; L538-F569 HydrophobicContact CD2-CE2 4.48Å; L538-P571 HydrophobicContact CD2-CB 3.98Å; L538-C611 WeakPolarHBondContact CD1-O 3.24Å; L538-A620 HydrophobicContact CB-CB 3.92Å
539	T	93.4	Very high	85.1	Confident	20 Å²	20	53 Å²	53	12%	0.123	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	127.6	171.5	-64.3	0	0	0	0	109.2	C557 F558	T539-C557 CarbonylContact O-C 3.53Å; T539-C557 VanDerWaalsContact O-CA 3.25Å; T539-C557 WeakPolarHBondContact O-CA 3.1Å; T539-C557 PolarHBondContact O-SG 2.69Å; T539-F558 HydrophobicContact CG2-CE1 3.8Å; T539-F558 HydrophobicContact CG2-CE2 4.15Å; T539-F558 HydrophobicContact CG2-CZ 3.49Å; T539-F558 VanDerWaalsContact CG2-CZ 3.49Å; T539-F558 PolarHBondContact N-O 2.64Å; T539-F558 PolarHBondContact O-N 2.81Å
540	I	94.4	Very high	85.1	Confident	2 Å²	2	56.7 Å²	56.7	1%	0.01	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	139.1	171.9	-168.9	168	0	0	0	109.8	Q543 F555 E556 F573 V609 C611 A620 A622	I540-Q543 WeakPolarHBondContact O-CG 3.32Å; I540-F555 HydrophobicContact CG1-CB 4.46Å; I540-F555 HydrophobicContact CG1-CD1 4.46Å; I540-E556 WeakPolarHBondContact CA-O 3.32Å; I540-F573 HydrophobicContact CD1-CD1 4.38Å; I540-F573 HydrophobicContact CD1-CE1 3.76Å; I540-F573 HydrophobicContact CG1-CE1 4.24Å; I540-V609 HydrophobicContact CD1-CG1 4.21Å; I540-C611 HydrophobicContact CD1-CB 4.36Å; I540-A620 HydrophobicContact CB-CB 4.24Å; I540-A620 HydrophobicContact CG2-CB 3.93Å; I540-A622 HydrophobicContact CD1-CB 3.6Å; I540-A622 HydrophobicContact CG1-CB 4.03Å; I540-A622 HydrophobicContact CG2-CB 4.13Å
541	T	94.1	Very high	85.2	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.006	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	135.5	179.4	-173.6	0	0	0	0	109.9	F555 E556 D834 M856 I857	T541-F555 CarbonylContact O-C 3.56Å; T541-F555 WeakPolarHBondContact O-CA 3.36Å; T541-E556 HydrophobicContact CG2-CB 4.16Å; T541-E556 PolarHBondContact N-O 3.48Å; T541-E556 PolarHBondContact O-N 2.66Å; T541-D834 WeakPolarHBondContact CB-OD2 3.43Å; T541-D834 WeakPolarHBondContact OG1-CB 3.33Å; T541-D834 PolarHBondContact OG1-OD2 2.65Å; T541-M856 HydrophobicContact CG2-CB 4.32Å; T541-M856 HydrophobicContact CG2-CE 4.19Å; T541-M856 WeakPolarHBondContact O-CE 3.13Å; T541-I857 WeakPolarHBondContact CG2-O 2.97Å; T541-I857 PolarHBondContact OG1-N 2.67Å
542	P	94.4	Very high	85.9	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.006	26%	0.264	C	S	.	.	S	Bend	cis	-65	151.3	-13.6	27.5	-34.1	0	0	0	113.2	L545 F555 A622 D834	P542-L545 HydrophobicContact CB-CD1 4.41Å; P542-L545 HydrophobicContact CG-CB 4.18Å; P542-L545 HydrophobicContact CG-CD1 3.72Å; P542-L545 HydrophobicContact CG-CD2 4.35Å; P542-L545 HydrophobicContact CG-CG 4.3Å; P542-F555 HydrophobicContact CG-CD1 3.89Å; P542-F555 HydrophobicContact CG-CE1 3.77Å; P542-F555 VanDerWaalsContact O-CD1 3.23Å; P542-F555 WeakPolarHBondContact O-CD1 2.89Å; P542-F555 WeakPolarHBondContact O-CE1 3.33Å; P542-A622 VanDerWaalsContact O-CB 3.3Å; P542-A622 WeakPolarHBondContact O-CB 3.5Å; P542-D834 WeakPolarHBondContact CA-OD2 3.07Å; P542-D834 HydrophobicContact CB-CB 4.19Å
543	Q	91.7	Very high	87	Confident	84 Å²	84	51 Å²	51	39%	0.393	24%	0.241	S	C	.	.	S	Bend	trans	-77	-25	175.2	-67	-171.3	-1.5	0	0	113.5	I540 A622 I623	I540-Q543 WeakPolarHBondContact O-CG 3.32Å; Q543-A622 VanDerWaalsContact O-CA 3.27Å; Q543-A622 WeakPolarHBondContact O-CA 3.43Å; Q543-I623 PolarHBondContact O-N 3.13Å; Q543-I623 VanDerWaalsContact O-N 3.15Å
544	R	92	Very high	88.4	Confident	171 Å²	171	49.5 Å²	49.5	65%	0.645	23%	0.229	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-141.6	129.9	177.6	-66.1	179.1	-179.2	-87.4	-4.9	108.2	N793	R544-N793 PolarHBondContact O-ND2 2.79Å; R544-N793 VanDerWaalsContact O-ND2 3.1Å
545	L	91.9	Very high	89.8	Confident	4 Å²	4	41.2 Å²	41.2	2%	0.021	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	117.8	179.5	-161.3	67.4	0	0	0	109.2	P542 V547 V553 F555 I623 I624 T625 N793 I836	P542-L545 HydrophobicContact CB-CD1 4.41Å; P542-L545 HydrophobicContact CG-CB 4.18Å; P542-L545 HydrophobicContact CG-CD1 3.72Å; P542-L545 HydrophobicContact CG-CD2 4.35Å; P542-L545 HydrophobicContact CG-CG 4.3Å; L545-V547 HydrophobicContact CD2-CG1 3.87Å; L545-V547 HydrophobicContact CG-CG1 3.89Å; L545-V553 HydrophobicContact CD2-CB 4.47Å; L545-V553 HydrophobicContact CD2-CG1 3.79Å; L545-V553 HydrophobicContact CD2-CG2 4.29Å; L545-F555 HydrophobicContact CB-CE1 4.3Å; L545-F555 HydrophobicContact CB-CZ 4.18Å; L545-F555 HydrophobicContact CD2-CZ 4.34Å; L545-I623 PolarHBondContact N-O 3.13Å; L545-I624 CarbonylContact O-C 3.5Å; L545-I624 WeakPolarHBondContact O-CA 3.23Å; L545-T625 PolarHBondContact O-N 3Å; L545-N793 WeakPolarHBondContact CD1-OD1 3.23Å; L545-I836 HydrophobicContact CD1-CB 4.27Å; L545-I836 HydrophobicContact CD1-CD1 3.63Å; L545-I836 HydrophobicContact CD1-CG1 3.73Å; L545-I836 HydrophobicContact CD2-CD1 4.1Å; L545-I836 HydrophobicContact CG-CD1 3.97Å
546	T	89.2	Confident	90.9	Very high	23 Å²	23	38.9 Å²	38.9	14%	0.141	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	133.6	167.1	-54.6	0	0	0	0	108	T625 E627 N793 W794	T546-T625 CarbonylContact C-O 3.58Å; T546-T625 VanDerWaalsContact CA-O 3.31Å; T546-T625 WeakPolarHBondContact CA-O 3.15Å; T546-E627 HydrophobicContact CG2-CB 4.08Å; T546-E627 HydrophobicContact CG2-CG 3.83Å; T546-N793 VanDerWaalsContact CB-O 3.3Å; T546-N793 WeakPolarHBondContact CB-O 3.43Å; T546-W794 VanDerWaalsContact O-CD1 3.29Å
547	V	89.1	Confident	91.4	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	157.5	179.8	-63.6	0	0	0	0	111.9	L545 Q551 V553 I624 T625 V626 E627 I836	L545-V547 HydrophobicContact CD2-CG1 3.87Å; L545-V547 HydrophobicContact CG-CG1 3.89Å; V547-Q551 HydrophobicContact CB-CB 4.35Å; V547-V553 HydrophobicContact CG1-CG2 4Å; V547-V553 HydrophobicContact CG2-CG2 4.15Å; V547-I624 HydrophobicContact CG2-CG2 3.79Å; V547-T625 PolarHBondContact N-O 3.13Å; V547-V626 HydrophobicContact CG2-CG2 4.3Å; V547-V626 WeakPolarHBondContact O-CA 3.37Å; V547-E627 PolarHBondContact O-N 3.01Å; V547-I836 HydrophobicContact CG1-CD1 3.76Å
548	R	84.4	Confident	91.5	Very high	95 Å²	95	35.2 Å²	35.2	36%	0.358	16%	0.161	S	C	.	.			trans	-70.9	158	166.9	-66.5	179.2	-65.8	-172.9	-7.6	111.2	Y550 Q551 I629 W794 D852	R548-Y550 PolarHBondContact O-N 3.26Å; R548-Q551 HydrophobicContact CB-CB 4.21Å; R548-Q551 VanDerWaalsContact O-CB 3.31Å; R548-Q551 WeakPolarHBondContact O-CB 3.4Å; R548-Q551 PolarHBondContact O-N 2.97Å; R548-I629 HydrophobicContact CG-CD1 3.58Å; R548-I629 HydrophobicContact CG-CG1 3.95Å; R548-W794 HydrophobicContact CG-CD2 4.27Å; R548-W794 HydrophobicContact CG-CE3 4.44Å; R548-W794 HydrophobicContact CG-CH2 4.38Å; R548-W794 HydrophobicContact CG-CZ2 4.19Å; R548-W794 HydrophobicContact CG-CZ3 4.46Å; R548-W794 VanDerWaalsContact CZ-CZ2 3.41Å; R548-D852 IonicContact NH2-OD2 3.42Å
549	P	86.7	Confident	91.5	Very high	30 Å²	30	34.7 Å²	34.7	20%	0.195	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	133.2	171.5	-26.5	36	0	0	0	112.2	Q551 L600 P602 V626 D628	P549-Q551 PolarHBondContact O-N 2.69Å; P549-Q551 VanDerWaalsContact O-N 3.13Å; P549-L600 WeakPolarHBondContact CA-O 3.32Å; P549-P602 HydrophobicContact CB-CG 4.12Å; P549-P602 HydrophobicContact CG-CG 3.93Å; P549-V626 HydrophobicContact CB-CG1 4.39Å; P549-V626 HydrophobicContact CG-CG1 4.11Å; P549-D628 HydrophobicContact CG-CB 3.94Å
550	Y	87.8	Confident	91.4	Very high	151 Å²	151	34.6 Å²	34.6	59%	0.592	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.6	12.6	179.1	-43.5	-69.7	0	0	0	116	R548 R598 L600	R548-Y550 PolarHBondContact O-N 3.26Å; Y550-R598 CarbonylContact C-O 3.59Å; Y550-R598 WeakPolarHBondContact CA-O 3.15Å; Y550-L600 PolarHBondContact N-O 2.89Å
551	Q	87.1	Confident	90.9	Very high	17 Å²	17	35.3 Å²	35.3	8%	0.079	16%	0.164	C	C	.	.			trans	-73.9	132.8	171.3	175.9	164.9	-29.6	0	0	110.6	V547 R548 P549 G599 D852	V547-Q551 HydrophobicContact CB-CB 4.35Å; R548-Q551 HydrophobicContact CB-CB 4.21Å; R548-Q551 VanDerWaalsContact O-CB 3.31Å; R548-Q551 WeakPolarHBondContact O-CB 3.4Å; R548-Q551 PolarHBondContact O-N 2.97Å; P549-Q551 PolarHBondContact O-N 2.69Å; P549-Q551 VanDerWaalsContact O-N 3.13Å; Q551-G599 WeakPolarHBondContact O-CA 3.38Å; Q551-D852 PolarHBondContact NE2-OD2 2.68Å
552	P	90.2	Very high	90.3	Very high	76 Å²	76	42.1 Å²	42.1	49%	0.494	20%	0.196	S	C	.	.			trans	-55.8	144.1	178.7	-25.5	33.8	0	0	0	113.1	L596	P552-L596 WeakPolarHBondContact CA-O 3.39Å
553	V	91.8	Very high	89.4	Confident	3 Å²	3	49 Å²	49	2%	0.018	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	135.6	-179.8	171.6	0	0	0	0	110	L545 V547 F555 L596 I624	L545-V553 HydrophobicContact CD2-CB 4.47Å; L545-V553 HydrophobicContact CD2-CG1 3.79Å; L545-V553 HydrophobicContact CD2-CG2 4.29Å; V547-V553 HydrophobicContact CG1-CG2 4Å; V547-V553 HydrophobicContact CG2-CG2 4.15Å; V553-F555 HydrophobicContact CG1-CD2 3.81Å; V553-F555 HydrophobicContact CG1-CE2 3.29Å; V553-F555 HydrophobicContact CG1-CZ 3.97Å; V553-L596 HydrophobicContact CB-CB 4.2Å; V553-L596 HydrophobicContact CB-CD2 4.48Å; V553-L596 PolarHBondContact N-O 2.65Å; V553-L596 PolarHBondContact O-N 3.37Å; V553-I624 HydrophobicContact CG1-CD1 4.22Å; V553-I624 HydrophobicContact CG1-CG1 4.44Å; V553-I624 HydrophobicContact CG2-CG2 4.48Å
554	E	92.5	Very high	88.8	Confident	37 Å²	37	47.5 Å²	47.5	17%	0.173	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	139.7	172.3	-164.9	-168.1	148.6	0	0	109.9	R593 F594 V595 R765 M856	E554-R593 HydrophobicContact CG-CG 3.97Å; E554-R593 WeakPolarHBondContact OE1-CD 3.49Å; E554-R593 IonicContact OE1-CZ 2.67Å; E554-R593 IonicContact OE1-NE 3.6Å; E554-R593 PolarHBondContact OE1-NE 2.88Å; E554-R593 VanDerWaalsContact OE1-NE 3.13Å; E554-F594 WeakPolarHBondContact CA-O 3.4Å; E554-F594 WeakPolarHBondContact CG-O 3.28Å; E554-V595 HydrophobicContact CG-CG2 4.44Å; E554-R765 VanDerWaalsContact CD-NE 3.34Å; E554-R765 IonicContact OE1-CZ 3.28Å; E554-R765 IonicContact OE1-NE 2.71Å; E554-R765 PolarHBondContact OE1-NE 2.83Å; E554-R765 IonicContact OE1-NH2 3.34Å; E554-R765 PolarHBondContact OE1-NH2 2.79Å; E554-R765 IonicContact OE2-NE 2.92Å; E554-R765 PolarHBondContact OE2-NE 2.86Å; E554-M856 HydrophobicContact CG-CE 4.48Å
555	F	94	Very high	88.4	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	156.1	163.4	-64.1	-82.5	0	0	0	109.9	I540 T541 P542 L545 V553 F573 R593 F594 V609 A622 I624	I540-F555 HydrophobicContact CG1-CB 4.46Å; I540-F555 HydrophobicContact CG1-CD1 4.46Å; T541-F555 CarbonylContact O-C 3.56Å; T541-F555 WeakPolarHBondContact O-CA 3.36Å; P542-F555 HydrophobicContact CG-CD1 3.89Å; P542-F555 HydrophobicContact CG-CE1 3.77Å; P542-F555 VanDerWaalsContact O-CD1 3.23Å; P542-F555 WeakPolarHBondContact O-CD1 2.89Å; P542-F555 WeakPolarHBondContact O-CE1 3.33Å; L545-F555 HydrophobicContact CB-CE1 4.3Å; L545-F555 HydrophobicContact CB-CZ 4.18Å; L545-F555 HydrophobicContact CD2-CZ 4.34Å; V553-F555 HydrophobicContact CG1-CD2 3.81Å; V553-F555 HydrophobicContact CG1-CE2 3.29Å; V553-F555 HydrophobicContact CG1-CZ 3.97Å; F555-F573 HydrophobicContact CB-CE1 4.24Å; F555-F573 HydrophobicContact CB-CZ 4.29Å; F555-R593 CarbonylContact O-C 3.54Å; F555-R593 WeakPolarHBondContact O-CA 3.25Å; F555-F594 HydrophobicContact CB-CB 4.21Å; F555-F594 AromaticContact CD2-CD1 3.74Å; F555-F594 HydrophobicContact CD2-CD1 3.74Å; F555-F594 AromaticContact CD2-CE1 3.98Å; F555-F594 HydrophobicContact CD2-CE1 3.98Å; F555-F594 HydrophobicContact CD2-CG 4.44Å; F555-F594 HydrophobicContact CE2-CE1 4.42Å; F555-F594 PolarHBondContact N-O 2.91Å; F555-F594 PolarHBondContact O-N 2.89Å; F555-V609 HydrophobicContact CD2-CG1 4.45Å; F555-V609 HydrophobicContact CD2-CG2 4.23Å; F555-V609 HydrophobicContact CE2-CB 4.42Å; F555-V609 HydrophobicContact CE2-CG2 3.82Å; F555-A622 HydrophobicContact CD1-CB 3.88Å; F555-A622 HydrophobicContact CE1-CB 3.5Å; F555-A622 VanDerWaalsContact CE1-CB 3.5Å; F555-A622 HydrophobicContact CZ-CB 4.04Å; F555-I624 HydrophobicContact CE2-CD1 3.89Å; F555-I624 HydrophobicContact CE2-CG1 3.72Å; F555-I624 HydrophobicContact CZ-CD1 4.32Å; F555-I624 HydrophobicContact CZ-CG1 3.62Å
556	E	94.4	Very high	88.2	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	146.9	161.7	-73.7	-176.7	158.5	0	0	110	I540 T541 R591 V592 R593 R765 M856	I540-E556 WeakPolarHBondContact CA-O 3.32Å; T541-E556 HydrophobicContact CG2-CB 4.16Å; T541-E556 PolarHBondContact N-O 3.48Å; T541-E556 PolarHBondContact O-N 2.66Å; E556-R591 IonicContact OE1-NE 3.9Å; E556-R591 IonicContact OE2-CZ 3.52Å; E556-R591 VanDerWaalsContact OE2-CZ 3.24Å; E556-R591 IonicContact OE2-NE 2.77Å; E556-R591 PolarHBondContact OE2-NE 2.96Å; E556-R591 IonicContact OE2-NH2 2.76Å; E556-R591 PolarHBondContact OE2-NH2 2.81Å; E556-V592 WeakPolarHBondContact CA-O 3.42Å; E556-R593 HydrophobicContact CG-CB 3.95Å; E556-R593 HydrophobicContact CG-CG 3.94Å; E556-R593 IonicContact OE1-CZ 2.72Å; E556-R593 VanDerWaalsContact OE1-CZ 3.25Å; E556-R593 IonicContact OE1-NE 3.25Å; E556-R593 PolarHBondContact OE1-NE 3.4Å; E556-R593 IonicContact OE1-NH2 3.44Å; E556-R593 PolarHBondContact OE1-NH2 2.94Å; E556-R765 IonicContact OE1-CZ 3.63Å; E556-R765 IonicContact OE1-NH2 3.13Å; E556-R765 PolarHBondContact OE1-NH2 2.98Å; E556-R765 IonicContact OE2-NH2 2.91Å; E556-R765 PolarHBondContact OE2-NH2 2.88Å; E556-M856 HydrophobicContact CB-CE 3.92Å; E556-M856 HydrophobicContact CG-CE 3.83Å
557	C	95.2	Very high	88.1	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	141.6	170.6	-174.6	0	0	0	0	110.3	T539 F573 R591 V592 C611	T539-C557 CarbonylContact O-C 3.53Å; T539-C557 VanDerWaalsContact O-CA 3.25Å; T539-C557 WeakPolarHBondContact O-CA 3.1Å; T539-C557 PolarHBondContact O-SG 2.69Å; C557-F573 HydrophobicContact CB-CE1 3.85Å; C557-F573 HydrophobicContact CB-CE2 4.33Å; C557-F573 HydrophobicContact CB-CZ 3.62Å; C557-R591 VanDerWaalsContact O-CA 3.32Å; C557-R591 WeakPolarHBondContact O-CA 3.35Å; C557-V592 HydrophobicContact CB-CG1 4.32Å; C557-V592 PolarHBondContact N-O 2.69Å; C557-V592 PolarHBondContact O-N 2.82Å; C557-C611 HydrophobicContact CB-CB 3.69Å; C557-C611 WeakPolarHBondContact CB-SG 3.34Å; C557-C611 WeakPolarHBondContact SG-CB 3.43Å; C557-C611 CovalentContact SG-SG 2.01Å; C557-C611 PolarHBondContact SG-SG 3.12Å
558	F	94	Very high	88	Confident	13 Å²	13	53 Å²	53	6%	0.057	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	155.3	175.1	56.7	-87.9	0	0	0	112.6	T539 N590 R591 I857	T539-F558 HydrophobicContact CG2-CE1 3.8Å; T539-F558 HydrophobicContact CG2-CE2 4.15Å; T539-F558 HydrophobicContact CG2-CZ 3.49Å; T539-F558 VanDerWaalsContact CG2-CZ 3.49Å; T539-F558 PolarHBondContact N-O 2.64Å; T539-F558 PolarHBondContact O-N 2.81Å; F558-N590 CarbonylContact C-O 3.54Å; F558-N590 WeakPolarHBondContact CA-O 3.45Å; F558-R591 HydrophobicContact CB-CB 4.04Å; F558-R591 HydrophobicContact CB-CG 4.04Å; F558-I857 WeakPolarHBondContact CE1-O 3.38Å
559	A	93.4	Very high	88.2	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	138.1	177.8	0	0	0	0	0	111.4	L538 A567 F569 P571 N590	L538-A559 HydrophobicContact CD2-CB 3.63Å; A559-A567 HydrophobicContact CB-CB 3.6Å; A559-A567 PolarHBondContact O-N 3.43Å; A559-A567 VanDerWaalsContact O-N 3.16Å; A559-F569 HydrophobicContact CB-CD2 4.49Å; A559-F569 HydrophobicContact CB-CE2 3.56Å; A559-F569 HydrophobicContact CB-CZ 3.6Å; A559-P571 HydrophobicContact CB-CG 4.19Å; A559-N590 PolarHBondContact N-O 3.29Å; A559-N590 WeakPolarHBondContact O-CB 3.4Å; A559-N590 PolarHBondContact O-ND2 2.86Å
560	A	90.3	Very high	88.4	Confident	19 Å²	19	50.9 Å²	50.9	16%	0.157	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	159.9	172.3	0	0	0	0	0	110.5	Y536 V537 Q565	Y536-A560 CarbonylContact C-O 3.57Å; Y536-A560 VanDerWaalsContact CA-O 3.32Å; Y536-A560 WeakPolarHBondContact CA-O 3.47Å; V537-A560 PolarHBondContact N-O 2.77Å; V537-A560 PolarHBondContact O-N 3.23Å; A560-Q565 CarbonylContact C-O 3.56Å; A560-Q565 WeakPolarHBondContact CA-O 3.42Å; A560-Q565 WeakPolarHBondContact CB-O 3.35Å
561	S	85.2	Confident	88.7	Confident	16 Å²	16	43.9 Å²	43.9	11%	0.112	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	169.4	167.9	73.2	0	0	0	0	111.2	D563 G564 Q565	S561-D563 PolarHBondContact O-N 3.22Å; S561-D563 PolarHBondContact OG-N 2.85Å; S561-D563 PolarHBondContact OG-OD2 3.43Å; S561-G564 PolarHBondContact O-N 3.18Å; S561-Q565 PolarHBondContact N-O 2.94Å; S561-Q565 PolarHBondContact OG-N 2.87Å
562	E	80.4	Confident	89.1	Confident	144 Å²	144	48.4 Å²	48.4	67%	0.673	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-26.1	172.1	-69.4	-176.2	-147.9	0	0	112.9	S535 V537 G564	S535-E562 VanDerWaalsContact CB-OE1 3.27Å; S535-E562 WeakPolarHBondContact CB-OE1 3.48Å; S535-E562 VanDerWaalsContact OG-CD 3.29Å; S535-E562 PolarHBondContact OG-OE1 3.06Å; V537-E562 HydrophobicContact CG2-CG 4Å; E562-G564 PolarHBondContact O-N 2.77Å
563	D	76.5	Confident	89.3	Confident	145 Å²	145	45.8 Å²	45.8	78%	0.775	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-1.4	171.6	-44	-77.6	0	0	0	114.2	S561	S561-D563 PolarHBondContact O-N 3.22Å; S561-D563 PolarHBondContact OG-N 2.85Å; S561-D563 PolarHBondContact OG-OD2 3.43Å
564	G	79.2	Confident	89.4	Confident	53 Å²	53	50.5 Å²	50.5	55%	0.546	28%	0.277	S	S	.	.			trans	80.4	9.5	-178.5	0	0	0	0	0	115.5	S561 E562	S561-G564 PolarHBondContact O-N 3.18Å; E562-G564 PolarHBondContact O-N 2.77Å
565	Q	83.1	Confident	89.4	Confident	128 Å²	128	49.7 Å²	49.7	60%	0.598	27%	0.274	S	S	*	.	P	Polyproline II helix	trans	-74.5	138.6	174.8	-68	-63.2	-34.4	0	0	111	A560 S561 A567	A560-Q565 CarbonylContact C-O 3.56Å; A560-Q565 WeakPolarHBondContact CA-O 3.42Å; A560-Q565 WeakPolarHBondContact CB-O 3.35Å; S561-Q565 PolarHBondContact N-O 2.94Å; S561-Q565 PolarHBondContact OG-N 2.87Å; Q565-A567 PolarHBondContact O-N 3.03Å
566	P	87.8	Confident	89.1	Confident	87 Å²	87	60.6 Å²	60.6	57%	0.565	32%	0.316	S	S	*	.	B	Isolated β-bridge	trans	-54.3	137.5	174.1	-26.2	35.3	0	0	0	112.4	N590	P566-N590 HydrophobicContact CB-CB 4.37Å
567	A	87.4	Confident	88.7	Confident	4 Å²	4	62.6 Å²	62.6	3%	0.033	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-75.4	148.6	176.1	0	0	0	0	0	112.3	Y536 A559 Q565 F569 N590	Y536-A567 HydrophobicContact CD1-CB 3.65Å; Y536-A567 HydrophobicContact CE1-CB 3.72Å; A559-A567 HydrophobicContact CB-CB 3.6Å; A559-A567 PolarHBondContact O-N 3.43Å; A559-A567 VanDerWaalsContact O-N 3.16Å; Q565-A567 PolarHBondContact O-N 3.03Å; A567-F569 HydrophobicContact CB-CD1 3.8Å; A567-F569 HydrophobicContact CB-CE1 3.49Å; A567-F569 VanDerWaalsContact CB-CE1 3.49Å; A567-F569 HydrophobicContact CB-CE2 4.45Å; A567-F569 HydrophobicContact CB-CG 4.44Å; A567-F569 HydrophobicContact CB-CZ 3.84Å; A567-F569 PolarHBondContact O-N 3.07Å; A567-N590 HydrophobicContact CB-CB 4.42Å; A567-N590 VanDerWaalsContact O-CB 3.23Å; A567-N590 WeakPolarHBondContact O-CB 3.2Å
568	S	86.9	Confident	88.2	Confident	95 Å²	95	68.6 Å²	68.6	66%	0.664	37%	0.368	S	S	*	.	S	Bend	trans	-85.8	30.3	177.2	60.1	0	0	0	0	113.6
569	F	88.4	Confident	87.8	Confident	30 Å²	30	74.8 Å²	74.8	13%	0.132	39%	0.391	C	S	.	.	S	Bend	trans	-149.4	152.1	179.6	67.1	-97.2	0	0	0	110.8	Y536 L538 A559 A567 E589 N590 S613 E615	Y536-F569 AromaticContact CD1-CE1 3.8Å; Y536-F569 HydrophobicContact CD1-CE1 3.8Å; Y536-F569 HydrophobicContact CD1-CZ 4.28Å; Y536-F569 AromaticContact CD2-CE1 3.61Å; Y536-F569 HydrophobicContact CD2-CE1 3.61Å; Y536-F569 HydrophobicContact CD2-CZ 4.15Å; Y536-F569 AromaticContact CE1-CE1 3.97Å; Y536-F569 HydrophobicContact CE1-CE1 3.97Å; Y536-F569 AromaticContact CE2-CE1 3.76Å; Y536-F569 HydrophobicContact CE2-CE1 3.76Å; Y536-F569 AromaticContact CG-CE1 3.61Å; Y536-F569 HydrophobicContact CG-CE1 3.61Å; Y536-F569 AromaticContact CG-CZ 3.89Å; Y536-F569 HydrophobicContact CG-CZ 3.89Å; Y536-F569 AromaticContact CZ-CE1 3.94Å; L538-F569 HydrophobicContact CD2-CE2 4.48Å; A559-F569 HydrophobicContact CB-CD2 4.49Å; A559-F569 HydrophobicContact CB-CE2 3.56Å; A559-F569 HydrophobicContact CB-CZ 3.6Å; A567-F569 HydrophobicContact CB-CD1 3.8Å; A567-F569 HydrophobicContact CB-CE1 3.49Å; A567-F569 VanDerWaalsContact CB-CE1 3.49Å; A567-F569 HydrophobicContact CB-CE2 4.45Å; A567-F569 HydrophobicContact CB-CG 4.44Å; A567-F569 HydrophobicContact CB-CZ 3.84Å; A567-F569 PolarHBondContact O-N 3.07Å; F569-E589 CarbonylContact C-O 3.59Å; F569-E589 VanDerWaalsContact O-O 3.08Å; F569-N590 WeakPolarHBondContact O-CA 3.18Å; F569-S613 WeakPolarHBondContact CD2-OG 3.23Å; F569-S613 WeakPolarHBondContact CE2-OG 3.3Å; F569-S613 WeakPolarHBondContact CZ-OG 3.36Å; F569-E615 HydrophobicContact CD1-CB 4.02Å; F569-E615 HydrophobicContact CD1-CG 3.48Å; F569-E615 VanDerWaalsContact CD1-CG 3.48Å; F569-E615 HydrophobicContact CE1-CB 3.59Å; F569-E615 HydrophobicContact CE1-CG 3.6Å; F569-E615 HydrophobicContact CG-CG 4.08Å; F569-E615 HydrophobicContact CZ-CB 3.95Å; F569-E615 HydrophobicContact CZ-CG 4.33Å
570	T	91.7	Very high	87.5	Confident	51 Å²	51	75.4 Å²	75.4	31%	0.313	39%	0.394	S	S	.	.			trans	-92.1	120.4	177.8	-50.7	0	0	0	0	110.1	R586 E589 V592	T570-R586 HydrophobicContact CG2-CG 4.11Å; T570-R586 PolarHBondContact OG1-NE 3.18Å; T570-R586 PolarHBondContact OG1-NH2 3.29Å; T570-E589 WeakPolarHBondContact CA-O 3.44Å; T570-E589 WeakPolarHBondContact CB-O 3.35Å; T570-E589 PolarHBondContact N-O 3.13Å; T570-E589 VanDerWaalsContact N-O 3.11Å; T570-E589 PolarHBondContact OG1-O 2.93Å; T570-V592 HydrophobicContact CG2-CB 4.15Å
571	P	94.2	Very high	87.4	Confident	4 Å²	4	79.8 Å²	79.8	3%	0.026	42%	0.423	C	S	.	.			trans	-69.8	162.6	174.9	26.6	-29.4	0	0	0	111.5	L538 A559 N590 V592 L612	L538-P571 HydrophobicContact CD2-CB 3.98Å; A559-P571 HydrophobicContact CB-CG 4.19Å; P571-N590 WeakPolarHBondContact CD-O 3.38Å; P571-V592 HydrophobicContact CG-CG1 4.22Å; P571-V592 WeakPolarHBondContact O-CG1 3.39Å; P571-L612 WeakPolarHBondContact CA-O 3.33Å; P571-L612 WeakPolarHBondContact CB-O 3.15Å
572	R	94.7	Very high	87.7	Confident	112 Å²	112	82 Å²	82	42%	0.423	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	150.6	-176.8	64.6	-179.5	167.8	-135.7	-12.5	112.1	C611 L612 S613 D614	R572-C611 WeakPolarHBondContact O-CA 3.36Å; R572-L612 HydrophobicContact CG-CB 3.95Å; R572-L612 PolarHBondContact N-O 2.77Å; R572-L612 PolarHBondContact O-N 2.71Å; R572-S613 PolarHBondContact NH2-O 2.61Å; R572-D614 IonicContact CZ-OD1 3.13Å; R572-D614 IonicContact CZ-OD2 2.74Å; R572-D614 IonicContact NH1-OD1 3.19Å; R572-D614 PolarHBondContact NH1-OD1 2.83Å; R572-D614 IonicContact NH1-OD2 2.7Å; R572-D614 PolarHBondContact NH1-OD2 2.83Å; R572-D614 IonicContact NH2-OD1 3.99Å; R572-D614 PolarHBondContact NH2-OD1 2.79Å; R572-D614 IonicContact NH2-OD2 2.79Å
573	F	94.8	Very high	88.4	Confident	21 Å²	21	80.2 Å²	80.2	9%	0.092	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	146.2	172.4	-72.2	-77.9	0	0	0	112.2	I540 F555 C557 F582 T584 V592 F594 V609 E610 C611	I540-F573 HydrophobicContact CD1-CD1 4.38Å; I540-F573 HydrophobicContact CD1-CE1 3.76Å; I540-F573 HydrophobicContact CG1-CE1 4.24Å; F555-F573 HydrophobicContact CB-CE1 4.24Å; F555-F573 HydrophobicContact CB-CZ 4.29Å; C557-F573 HydrophobicContact CB-CE1 3.85Å; C557-F573 HydrophobicContact CB-CE2 4.33Å; C557-F573 HydrophobicContact CB-CZ 3.62Å; F573-F582 HydrophobicContact CB-CE2 4.07Å; F573-F582 HydrophobicContact CB-CZ 4.44Å; F573-T584 HydrophobicContact CD2-CG2 4.08Å; F573-V592 HydrophobicContact CD2-CG1 3.78Å; F573-V592 HydrophobicContact CD2-CG2 4.05Å; F573-V592 HydrophobicContact CE2-CB 4.17Å; F573-V592 HydrophobicContact CE2-CG1 3.44Å; F573-V592 VanDerWaalsContact CE2-CG1 3.44Å; F573-V592 HydrophobicContact CE2-CG2 3.97Å; F573-V592 HydrophobicContact CZ-CG1 4.27Å; F573-F594 HydrophobicContact CB-CD2 4.03Å; F573-F594 HydrophobicContact CD1-CB 4.19Å; F573-F594 HydrophobicContact CD1-CD2 4.21Å; F573-F594 HydrophobicContact CD2-CB 3.71Å; F573-F594 HydrophobicContact CD2-CD2 4.35Å; F573-F594 HydrophobicContact CE1-CB 3.99Å; F573-F594 HydrophobicContact CE2-CB 3.48Å; F573-F594 VanDerWaalsContact CE2-CB 3.48Å; F573-F594 HydrophobicContact CG-CB 4.03Å; F573-F594 AromaticContact CG-CD2 3.97Å; F573-F594 HydrophobicContact CG-CD2 3.97Å; F573-F594 HydrophobicContact CG-CG 4.47Å; F573-F594 HydrophobicContact CZ-CB 3.63Å; F573-V609 HydrophobicContact CD1-CG1 3.74Å; F573-V609 HydrophobicContact CE1-CG1 4.23Å; F573-E610 CarbonylContact C-O 3.53Å; F573-E610 WeakPolarHBondContact CA-O 3.42Å; F573-C611 HydrophobicContact CD1-CB 4.43Å; F573-C611 HydrophobicContact CE1-CB 4.47Å
574	Q	93.5	Very high	89.2	Confident	102 Å²	102	77 Å²	77	48%	0.477	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	142.2	168.6	-178.7	165.3	53.9	0	0	109.9	E610 L612	Q574-E610 PolarHBondContact N-O 3.15Å; Q574-E610 PolarHBondContact O-N 2.7Å; Q574-L612 HydrophobicContact CB-CD1 3.89Å
575	V	92.1	Very high	89.8	Confident	19 Å²	19	78.2 Å²	78.2	12%	0.115	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	134.3	170.8	-177.3	0	0	0	0	107.8	I580 F582 F594 T607 V609	V575-I580 HydrophobicContact CG1-CB 4.15Å; V575-I580 HydrophobicContact CG1-CD1 3.83Å; V575-I580 HydrophobicContact CG1-CG2 4.3Å; V575-F582 HydrophobicContact CB-CE1 4.07Å; V575-F582 HydrophobicContact CG2-CD1 3.97Å; V575-F582 HydrophobicContact CG2-CE1 3.71Å; V575-F582 HydrophobicContact CG2-CZ 4.39Å; V575-F594 HydrophobicContact CG2-CE2 3.69Å; V575-F594 HydrophobicContact CG2-CZ 4.09Å; V575-T607 HydrophobicContact CG1-CG2 3.81Å; V575-V609 HydrophobicContact CG2-CB 4.49Å; V575-V609 HydrophobicContact CG2-CG1 4.25Å; V575-V609 HydrophobicContact CG2-CG2 4.12Å
576	R	87.3	Confident	90.2	Very high	230 Å²	230	78.8 Å²	78.8	87%	0.868	40%	0.402	S	S	*	.	S	Bend	trans	-74.4	-27.8	-171.3	-174.2	174	175.2	-172.8	-1.1	114.2
577	D	86.9	Confident	90.3	Very high	42 Å²	42	77.4 Å²	77.4	23%	0.225	39%	0.392	C	S	.	.			trans	-89.3	107.3	175.6	-175.7	-4.2	0	0	0	110.2	R579 I580	D577-R579 PolarHBondContact O-N 2.76Å; D577-R579 VanDerWaalsContact O-N 3.07Å; D577-R579 VanDerWaalsContact OD1-CB 3.25Å; D577-R579 WeakPolarHBondContact OD1-CB 3.11Å; D577-R579 WeakPolarHBondContact OD1-CG 3.15Å; D577-R579 PolarHBondContact OD1-N 2.81Å; D577-R579 IonicContact OD1-NE 3.74Å; D577-R579 PolarHBondContact OD1-NE 3.06Å; D577-R579 VanDerWaalsContact OD1-NE 3.13Å; D577-R579 IonicContact OD2-CZ 3.75Å; D577-R579 IonicContact OD2-NE 2.7Å; D577-R579 PolarHBondContact OD2-NE 2.87Å; D577-R579 IonicContact OD2-NH2 2.68Å; D577-R579 PolarHBondContact OD2-NH2 3.37Å; D577-I580 HydrophobicContact CB-CD1 3.93Å; D577-I580 HydrophobicContact CB-CG1 4.21Å; D577-I580 WeakPolarHBondContact O-CB 3.42Å; D577-I580 PolarHBondContact O-N 3.35Å
578	S	84	Confident	90.4	Very high	125 Å²	125	79.3 Å²	79.3	87%	0.874	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-2.8	-179.4	56.6	0	0	0	0	114.6	I580	S578-I580 VanDerWaalsContact C-N 3.27Å
579	R	85.8	Confident	90.6	Very high	144 Å²	144	80 Å²	80	54%	0.543	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-17.2	167.5	-57.7	179.1	-59.3	149.6	2.3	112.8	D577 S581 D603	D577-R579 PolarHBondContact O-N 2.76Å; D577-R579 VanDerWaalsContact O-N 3.07Å; D577-R579 VanDerWaalsContact OD1-CB 3.25Å; D577-R579 WeakPolarHBondContact OD1-CB 3.11Å; D577-R579 WeakPolarHBondContact OD1-CG 3.15Å; D577-R579 PolarHBondContact OD1-N 2.81Å; D577-R579 IonicContact OD1-NE 3.74Å; D577-R579 PolarHBondContact OD1-NE 3.06Å; D577-R579 VanDerWaalsContact OD1-NE 3.13Å; D577-R579 IonicContact OD2-CZ 3.75Å; D577-R579 IonicContact OD2-NE 2.7Å; D577-R579 PolarHBondContact OD2-NE 2.87Å; D577-R579 IonicContact OD2-NH2 2.68Å; D577-R579 PolarHBondContact OD2-NH2 3.37Å; R579-S581 PolarHBondContact O-N 2.97Å; R579-D603 IonicContact CZ-OD2 2.69Å; R579-D603 IonicContact NH1-OD2 2.6Å; R579-D603 PolarHBondContact NH1-OD2 2.85Å; R579-D603 IonicContact NH2-OD2 3.25Å; R579-D603 PolarHBondContact NH2-OD2 3.49Å
580	I	87.4	Confident	90.8	Very high	12 Å²	12	79.9 Å²	79.9	6%	0.062	40%	0.399	C	S	.	.			trans	-90.8	100.6	-175.4	-59.1	174.9	0	0	0	109.2	V575 D577 S578 L596 L600 T607	V575-I580 HydrophobicContact CG1-CB 4.15Å; V575-I580 HydrophobicContact CG1-CD1 3.83Å; V575-I580 HydrophobicContact CG1-CG2 4.3Å; D577-I580 HydrophobicContact CB-CD1 3.93Å; D577-I580 HydrophobicContact CB-CG1 4.21Å; D577-I580 WeakPolarHBondContact O-CB 3.42Å; D577-I580 PolarHBondContact O-N 3.35Å; S578-I580 VanDerWaalsContact C-N 3.27Å; I580-L596 HydrophobicContact CG2-CD1 3.96Å; I580-L596 HydrophobicContact CG2-CD2 4.22Å; I580-L600 HydrophobicContact CD1-CD2 3.63Å; I580-L600 HydrophobicContact CG1-CD2 3.82Å; I580-L600 HydrophobicContact CG2-CD2 4.02Å; I580-T607 HydrophobicContact CD1-CG2 3.59Å
581	S	88.3	Confident	90.8	Very high	111 Å²	111	80 Å²	80	78%	0.776	39%	0.393	S	S	*	.			trans	-88.5	120.4	172.6	-170.7	0	0	0	0	110.1	R579 L596	R579-S581 PolarHBondContact O-N 2.97Å; S581-L596 WeakPolarHBondContact O-CD1 3.44Å
582	F	92.4	Very high	90.9	Very high	63 Å²	63	80.3 Å²	80.3	28%	0.276	40%	0.395	S	S	.	.			trans	-125	158	179.9	58.8	-90.2	0	0	0	111	F573 V575 T584 F594 L596	F573-F582 HydrophobicContact CB-CE2 4.07Å; F573-F582 HydrophobicContact CB-CZ 4.44Å; V575-F582 HydrophobicContact CB-CE1 4.07Å; V575-F582 HydrophobicContact CG2-CD1 3.97Å; V575-F582 HydrophobicContact CG2-CE1 3.71Å; V575-F582 HydrophobicContact CG2-CZ 4.39Å; F582-T584 HydrophobicContact CD2-CG2 3.76Å; F582-T584 HydrophobicContact CE2-CG2 3.67Å; F582-F594 HydrophobicContact CB-CD2 4.02Å; F582-F594 HydrophobicContact CB-CE1 4.2Å; F582-F594 HydrophobicContact CB-CE2 3.48Å; F582-F594 VanDerWaalsContact CB-CE2 3.48Å; F582-F594 HydrophobicContact CB-CZ 3.58Å; F582-F594 HydrophobicContact CD1-CD2 4.41Å; F582-F594 AromaticContact CD1-CE2 3.57Å; F582-F594 HydrophobicContact CD1-CE2 3.57Å; F582-F594 HydrophobicContact CD1-CZ 4.16Å; F582-F594 AromaticContact CD2-CD2 3.36Å; F582-F594 HydrophobicContact CD2-CD2 3.36Å; F582-F594 AromaticContact CD2-CE2 3.36Å; F582-F594 HydrophobicContact CD2-CE2 3.36Å; F582-F594 HydrophobicContact CD2-CG 4.34Å; F582-F594 HydrophobicContact CD2-CZ 4.34Å; F582-F594 HydrophobicContact CE1-CE2 4.09Å; F582-F594 AromaticContact CE2-CD2 3.84Å; F582-F594 HydrophobicContact CE2-CD2 3.84Å; F582-F594 AromaticContact CE2-CE2 3.9Å; F582-F594 HydrophobicContact CE2-CE2 3.9Å; F582-F594 AromaticContact CG-CD2 3.69Å; F582-F594 HydrophobicContact CG-CD2 3.69Å; F582-F594 AromaticContact CG-CE2 3.17Å; F582-F594 HydrophobicContact CG-CE2 3.17Å; F582-F594 AromaticContact CG-CZ 3.79Å; F582-F594 HydrophobicContact CG-CZ 3.79Å; F582-F594 HydrophobicContact CZ-CE2 4.23Å; F582-L596 HydrophobicContact CB-CD1 4.38Å
583	E	93.3	Very high	90.8	Very high	106 Å²	106	78.3 Å²	78.3	50%	0.495	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	149.1	174.2	-70.2	159.4	-167.4	0	0	109.4	F594 V595 Q597	E583-F594 WeakPolarHBondContact O-CA 3Å; E583-V595 HydrophobicContact CB-CB 4.44Å; E583-V595 PolarHBondContact N-O 3Å; E583-V595 PolarHBondContact O-N 2.9Å; E583-Q597 VanDerWaalsContact OE2-CG 3.31Å; E583-Q597 WeakPolarHBondContact OE2-CG 3.42Å; E583-Q597 PolarHBondContact OE2-NE2 2.8Å
584	T	93.2	Very high	90.8	Very high	79 Å²	79	77.3 Å²	77.3	49%	0.485	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	143	172.5	56.4	0	0	0	0	112.3	F573 F582 R593	F573-T584 HydrophobicContact CD2-CG2 4.08Å; F582-T584 HydrophobicContact CD2-CG2 3.76Å; F582-T584 HydrophobicContact CE2-CG2 3.67Å; T584-R593 CarbonylContact C-O 3.56Å; T584-R593 WeakPolarHBondContact CA-O 2.99Å
585	T	93	Very high	90.8	Very high	77 Å²	77	73.6 Å²	73.6	47%	0.472	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	129.8	-179.8	-44.4	0	0	0	0	110.3	V587 R593	T585-V587 PolarHBondContact O-N 3.49Å; T585-R593 PolarHBondContact N-O 3.02Å; T585-R593 PolarHBondContact O-N 3.04Å
586	R	92	Very high	90.9	Very high	141 Å²	141	73 Å²	73	53%	0.532	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	124.7	172	-165	-179.9	-155.4	-135.2	2.7	108.5	T570 S588 E589	T570-R586 HydrophobicContact CG2-CG 4.11Å; T570-R586 PolarHBondContact OG1-NE 3.18Å; T570-R586 PolarHBondContact OG1-NH2 3.29Å; R586-S588 WeakPolarHBondContact CG-O 3.4Å; R586-E589 IonicContact CZ-OE1 3.71Å; R586-E589 IonicContact NH1-OE1 3.63Å; R586-E589 PolarHBondContact NH1-OE1 2.71Å; R586-E589 IonicContact NH2-OE1 2.77Å; R586-E589 PolarHBondContact NH2-OE1 3.31Å
587	V	90.1	Very high	91	Very high	58 Å²	58	67.2 Å²	67.2	35%	0.352	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	-36.8	-179.5	-179.3	0	0	0	0	110.6	T585 R591 R593	T585-V587 PolarHBondContact O-N 3.49Å; V587-R591 HydrophobicContact CB-CB 4.23Å; V587-R591 HydrophobicContact CB-CG 3.98Å; V587-R591 HydrophobicContact CG1-CG 4.32Å; V587-R591 PolarHBondContact N-O 2.85Å; V587-R593 HydrophobicContact CG2-CB 3.75Å
588	S	89.4	Confident	91.1	Very high	44 Å²	44	75.5 Å²	75.5	31%	0.308	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	176.7	168.6	59.6	0	0	0	0	108.6	R586 N590 R591	R586-S588 WeakPolarHBondContact CG-O 3.4Å; S588-N590 PolarHBondContact O-N 2.95Å; S588-N590 VanDerWaalsContact O-N 3.13Å; S588-N590 PolarHBondContact OG-OD1 3.32Å; S588-R591 PolarHBondContact N-O 2.01Å; S588-R591 PolarHBondContact O-N 2.97Å; S588-R591 VanDerWaalsContact O-O 3.09Å; S588-R591 WeakPolarHBondContact OG-CB 3.41Å; S588-R591 PolarHBondContact OG-N 2.75Å
589	E	89.9	Confident	91.3	Very high	109 Å²	109	69.9 Å²	69.9	51%	0.509	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.2	-42.9	173.5	-70.9	-96.3	95.9	0	0	112.4	F569 T570 R586	F569-E589 CarbonylContact C-O 3.59Å; F569-E589 VanDerWaalsContact O-O 3.08Å; T570-E589 WeakPolarHBondContact CA-O 3.44Å; T570-E589 WeakPolarHBondContact CB-O 3.35Å; T570-E589 PolarHBondContact N-O 3.13Å; T570-E589 VanDerWaalsContact N-O 3.11Å; T570-E589 PolarHBondContact OG1-O 2.93Å; R586-E589 IonicContact CZ-OE1 3.71Å; R586-E589 IonicContact NH1-OE1 3.63Å; R586-E589 PolarHBondContact NH1-OE1 2.71Å; R586-E589 IonicContact NH2-OE1 2.77Å; R586-E589 PolarHBondContact NH2-OE1 3.31Å
590	N	92	Very high	91.6	Very high	28 Å²	28	63.1 Å²	63.1	15%	0.15	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	4.5	-174.7	79.6	-48.3	0	0	0	115.5	F558 A559 P566 A567 F569 P571 S588	F558-N590 CarbonylContact C-O 3.54Å; F558-N590 WeakPolarHBondContact CA-O 3.45Å; A559-N590 PolarHBondContact N-O 3.29Å; A559-N590 WeakPolarHBondContact O-CB 3.4Å; A559-N590 PolarHBondContact O-ND2 2.86Å; P566-N590 HydrophobicContact CB-CB 4.37Å; A567-N590 HydrophobicContact CB-CB 4.42Å; A567-N590 VanDerWaalsContact O-CB 3.23Å; A567-N590 WeakPolarHBondContact O-CB 3.2Å; F569-N590 WeakPolarHBondContact O-CA 3.18Å; P571-N590 WeakPolarHBondContact CD-O 3.38Å; S588-N590 PolarHBondContact O-N 2.95Å; S588-N590 VanDerWaalsContact O-N 3.13Å; S588-N590 PolarHBondContact OG-OD1 3.32Å
591	R	93.7	Very high	91.5	Very high	54 Å²	54	62.5 Å²	62.5	20%	0.204	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	133.4	-169.2	-172.8	178.4	179.7	177	3.6	112.6	E556 C557 F558 V587 S588	E556-R591 IonicContact OE1-NE 3.9Å; E556-R591 IonicContact OE2-CZ 3.52Å; E556-R591 VanDerWaalsContact OE2-CZ 3.24Å; E556-R591 IonicContact OE2-NE 2.77Å; E556-R591 PolarHBondContact OE2-NE 2.96Å; E556-R591 IonicContact OE2-NH2 2.76Å; E556-R591 PolarHBondContact OE2-NH2 2.81Å; C557-R591 VanDerWaalsContact O-CA 3.32Å; C557-R591 WeakPolarHBondContact O-CA 3.35Å; F558-R591 HydrophobicContact CB-CB 4.04Å; F558-R591 HydrophobicContact CB-CG 4.04Å; V587-R591 HydrophobicContact CB-CB 4.23Å; V587-R591 HydrophobicContact CB-CG 3.98Å; V587-R591 HydrophobicContact CG1-CG 4.32Å; V587-R591 PolarHBondContact N-O 2.85Å; S588-R591 PolarHBondContact N-O 2.01Å; S588-R591 PolarHBondContact O-N 2.97Å; S588-R591 VanDerWaalsContact O-O 3.09Å; S588-R591 WeakPolarHBondContact OG-CB 3.41Å; S588-R591 PolarHBondContact OG-N 2.75Å
592	V	94.6	Very high	91.3	Very high	10 Å²	10	60.2 Å²	60.2	6%	0.061	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	145.4	176.4	58.7	0	0	0	0	110.5	E556 C557 T570 P571 F573	E556-V592 WeakPolarHBondContact CA-O 3.42Å; C557-V592 HydrophobicContact CB-CG1 4.32Å; C557-V592 PolarHBondContact N-O 2.69Å; C557-V592 PolarHBondContact O-N 2.82Å; T570-V592 HydrophobicContact CG2-CB 4.15Å; P571-V592 HydrophobicContact CG-CG1 4.22Å; P571-V592 WeakPolarHBondContact O-CG1 3.39Å; F573-V592 HydrophobicContact CD2-CG1 3.78Å; F573-V592 HydrophobicContact CD2-CG2 4.05Å; F573-V592 HydrophobicContact CE2-CB 4.17Å; F573-V592 HydrophobicContact CE2-CG1 3.44Å; F573-V592 VanDerWaalsContact CE2-CG1 3.44Å; F573-V592 HydrophobicContact CE2-CG2 3.97Å; F573-V592 HydrophobicContact CZ-CG1 4.27Å
593	R	94.3	Very high	90.9	Very high	70 Å²	70	62 Å²	62	26%	0.264	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	142.4	170.7	-172.8	176.5	-62.5	153.8	7.1	110.1	E554 F555 E556 T584 T585 V587 V595	E554-R593 HydrophobicContact CG-CG 3.97Å; E554-R593 WeakPolarHBondContact OE1-CD 3.49Å; E554-R593 IonicContact OE1-CZ 2.67Å; E554-R593 IonicContact OE1-NE 3.6Å; E554-R593 PolarHBondContact OE1-NE 2.88Å; E554-R593 VanDerWaalsContact OE1-NE 3.13Å; F555-R593 CarbonylContact O-C 3.54Å; F555-R593 WeakPolarHBondContact O-CA 3.25Å; E556-R593 HydrophobicContact CG-CB 3.95Å; E556-R593 HydrophobicContact CG-CG 3.94Å; E556-R593 IonicContact OE1-CZ 2.72Å; E556-R593 VanDerWaalsContact OE1-CZ 3.25Å; E556-R593 IonicContact OE1-NE 3.25Å; E556-R593 PolarHBondContact OE1-NE 3.4Å; E556-R593 IonicContact OE1-NH2 3.44Å; E556-R593 PolarHBondContact OE1-NH2 2.94Å; T584-R593 CarbonylContact C-O 3.56Å; T584-R593 WeakPolarHBondContact CA-O 2.99Å; T585-R593 PolarHBondContact N-O 3.02Å; T585-R593 PolarHBondContact O-N 3.04Å; V587-R593 HydrophobicContact CG2-CB 3.75Å; R593-V595 HydrophobicContact CG-CG2 3.98Å
594	F	94.2	Very high	90.6	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	133.1	171.4	170.5	-75.5	0	0	0	107.7	E554 F555 F573 V575 F582 E583 L596 V609	E554-F594 WeakPolarHBondContact CA-O 3.4Å; E554-F594 WeakPolarHBondContact CG-O 3.28Å; F555-F594 HydrophobicContact CB-CB 4.21Å; F555-F594 AromaticContact CD2-CD1 3.74Å; F555-F594 HydrophobicContact CD2-CD1 3.74Å; F555-F594 AromaticContact CD2-CE1 3.98Å; F555-F594 HydrophobicContact CD2-CE1 3.98Å; F555-F594 HydrophobicContact CD2-CG 4.44Å; F555-F594 HydrophobicContact CE2-CE1 4.42Å; F555-F594 PolarHBondContact N-O 2.91Å; F555-F594 PolarHBondContact O-N 2.89Å; F573-F594 HydrophobicContact CB-CD2 4.03Å; F573-F594 HydrophobicContact CD1-CB 4.19Å; F573-F594 HydrophobicContact CD1-CD2 4.21Å; F573-F594 HydrophobicContact CD2-CB 3.71Å; F573-F594 HydrophobicContact CD2-CD2 4.35Å; F573-F594 HydrophobicContact CE1-CB 3.99Å; F573-F594 HydrophobicContact CE2-CB 3.48Å; F573-F594 VanDerWaalsContact CE2-CB 3.48Å; F573-F594 HydrophobicContact CG-CB 4.03Å; F573-F594 AromaticContact CG-CD2 3.97Å; F573-F594 HydrophobicContact CG-CD2 3.97Å; F573-F594 HydrophobicContact CG-CG 4.47Å; F573-F594 HydrophobicContact CZ-CB 3.63Å; V575-F594 HydrophobicContact CG2-CE2 3.69Å; V575-F594 HydrophobicContact CG2-CZ 4.09Å; F582-F594 HydrophobicContact CB-CD2 4.02Å; F582-F594 HydrophobicContact CB-CE1 4.2Å; F582-F594 HydrophobicContact CB-CE2 3.48Å; F582-F594 VanDerWaalsContact CB-CE2 3.48Å; F582-F594 HydrophobicContact CB-CZ 3.58Å; F582-F594 HydrophobicContact CD1-CD2 4.41Å; F582-F594 AromaticContact CD1-CE2 3.57Å; F582-F594 HydrophobicContact CD1-CE2 3.57Å; F582-F594 HydrophobicContact CD1-CZ 4.16Å; F582-F594 AromaticContact CD2-CD2 3.36Å; F582-F594 HydrophobicContact CD2-CD2 3.36Å; F582-F594 AromaticContact CD2-CE2 3.36Å; F582-F594 HydrophobicContact CD2-CE2 3.36Å; F582-F594 HydrophobicContact CD2-CG 4.34Å; F582-F594 HydrophobicContact CD2-CZ 4.34Å; F582-F594 HydrophobicContact CE1-CE2 4.09Å; F582-F594 AromaticContact CE2-CD2 3.84Å; F582-F594 HydrophobicContact CE2-CD2 3.84Å; F582-F594 AromaticContact CE2-CE2 3.9Å; F582-F594 HydrophobicContact CE2-CE2 3.9Å; F582-F594 AromaticContact CG-CD2 3.69Å; F582-F594 HydrophobicContact CG-CD2 3.69Å; F582-F594 AromaticContact CG-CE2 3.17Å; F582-F594 HydrophobicContact CG-CE2 3.17Å; F582-F594 AromaticContact CG-CZ 3.79Å; F582-F594 HydrophobicContact CG-CZ 3.79Å; F582-F594 HydrophobicContact CZ-CE2 4.23Å; E583-F594 WeakPolarHBondContact O-CA 3Å; F594-L596 HydrophobicContact CE1-CB 3.89Å; F594-L596 HydrophobicContact CZ-CB 4.47Å; F594-V609 HydrophobicContact CD2-CG1 4.2Å; F594-V609 HydrophobicContact CE2-CG1 4.05Å; F594-V609 HydrophobicContact CZ-CG1 4.45Å; F594-V609 HydrophobicContact CZ-CG2 4.17Å
595	V	94	Very high	90.3	Very high	24 Å²	24	58.5 Å²	58.5	15%	0.145	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	132.1	176	-165.1	0	0	0	0	110.2	E554 E583 R593 Q597	E554-V595 HydrophobicContact CG-CG2 4.44Å; E583-V595 HydrophobicContact CB-CB 4.44Å; E583-V595 PolarHBondContact N-O 3Å; E583-V595 PolarHBondContact O-N 2.9Å; R593-V595 HydrophobicContact CG-CG2 3.98Å; V595-Q597 HydrophobicContact CG1-CG 4.34Å
596	L	93.1	Very high	90.1	Very high	7 Å²	7	56.8 Å²	56.8	4%	0.037	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	82.5	176.9	-179	67.5	0	0	0	108.9	P552 V553 I580 S581 F582 F594 R598 G599 L600	P552-L596 WeakPolarHBondContact CA-O 3.39Å; V553-L596 HydrophobicContact CB-CB 4.2Å; V553-L596 HydrophobicContact CB-CD2 4.48Å; V553-L596 PolarHBondContact N-O 2.65Å; V553-L596 PolarHBondContact O-N 3.37Å; I580-L596 HydrophobicContact CG2-CD1 3.96Å; I580-L596 HydrophobicContact CG2-CD2 4.22Å; S581-L596 WeakPolarHBondContact O-CD1 3.44Å; F582-L596 HydrophobicContact CB-CD1 4.38Å; F594-L596 HydrophobicContact CE1-CB 3.89Å; F594-L596 HydrophobicContact CZ-CB 4.47Å; L596-R598 PolarHBondContact O-N 3.39Å; L596-G599 WeakPolarHBondContact CD2-O 3.43Å; L596-G599 PolarHBondContact O-N 2.74Å; L596-L600 HydrophobicContact CD2-CD2 3.56Å; L596-L600 HydrophobicContact CD2-CG 3.64Å
597	Q	88.9	Confident	90.1	Very high	108 Å²	108	50.8 Å²	50.8	51%	0.505	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-25.9	-172	-55.7	-68.1	-0.1	0	0	114.5	E583 V595	E583-Q597 VanDerWaalsContact OE2-CG 3.31Å; E583-Q597 WeakPolarHBondContact OE2-CG 3.42Å; E583-Q597 PolarHBondContact OE2-NE2 2.8Å; V595-Q597 HydrophobicContact CG1-CG 4.34Å
598	R	89.4	Confident	90.4	Very high	216 Å²	216	50.7 Å²	50.7	82%	0.815	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	-0.7	-177.6	-60.5	-174.4	-177.3	-174.4	2.2	114.1	Y550 L596	Y550-R598 CarbonylContact C-O 3.59Å; Y550-R598 WeakPolarHBondContact CA-O 3.15Å; L596-R598 PolarHBondContact O-N 3.39Å
599	G	89.3	Confident	90.6	Very high	7 Å²	7	48.6 Å²	48.6	7%	0.072	25%	0.245	C	C	.	.			trans	59.4	-159.1	-171.5	0	0	0	0	0	114.2	Q551 L596	Q551-G599 WeakPolarHBondContact O-CA 3.38Å; L596-G599 WeakPolarHBondContact CD2-O 3.43Å; L596-G599 PolarHBondContact O-N 2.74Å
600	L	90.5	Very high	90.9	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.005	23%	0.233	C	C	.	.			trans	-123.5	146.9	178.2	-70.3	-175.7	0	0	0	111.7	P549 Y550 I580 L596 Q604 T607 I624 V626	P549-L600 WeakPolarHBondContact CA-O 3.32Å; Y550-L600 PolarHBondContact N-O 2.89Å; I580-L600 HydrophobicContact CD1-CD2 3.63Å; I580-L600 HydrophobicContact CG1-CD2 3.82Å; I580-L600 HydrophobicContact CG2-CD2 4.02Å; L596-L600 HydrophobicContact CD2-CD2 3.56Å; L596-L600 HydrophobicContact CD2-CG 3.64Å; L600-Q604 HydrophobicContact CB-CB 3.99Å; L600-Q604 HydrophobicContact CD1-CB 4.23Å; L600-Q604 HydrophobicContact CD2-CB 4.03Å; L600-Q604 HydrophobicContact CD2-CG 4.46Å; L600-Q604 HydrophobicContact CG-CB 4.32Å; L600-T607 HydrophobicContact CD1-CG2 4.06Å; L600-I624 HydrophobicContact CD1-CB 4.09Å; L600-I624 HydrophobicContact CD1-CD1 3.57Å; L600-I624 HydrophobicContact CD1-CG1 4.46Å; L600-I624 HydrophobicContact CD1-CG2 3.92Å; L600-I624 HydrophobicContact CG-CD1 4.5Å; L600-V626 HydrophobicContact CB-CG2 3.59Å; L600-V626 HydrophobicContact CD1-CG2 4.17Å
601	G	86.8	Confident	91.1	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.226	C	C	.	.			trans	-78.2	166.3	171.9	0	0	0	0	0	113	D603 Q604	G601-D603 PolarHBondContact O-N 2.83Å; G601-Q604 WeakPolarHBondContact O-CB 3.34Å; G601-Q604 PolarHBondContact O-N 2.95Å
602	P	82.8	Confident	91.1	Very high	63 Å²	63	43.9 Å²	43.9	41%	0.409	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-61.3	-24.2	176.9	-21	33.1	0	0	0	113.7	P549 Q604 N605	P549-P602 HydrophobicContact CB-CG 4.12Å; P549-P602 HydrophobicContact CG-CG 3.93Å; P602-Q604 PolarHBondContact O-N 2.98Å; P602-N605 WeakPolarHBondContact O-CB 3.45Å; P602-N605 PolarHBondContact O-N 2.93Å
603	D	84.6	Confident	90.9	Very high	100 Å²	100	44.3 Å²	44.3	54%	0.535	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-75.2	-4.8	174.3	72.4	-63.8	0	0	0	113.7	R579 G601	R579-D603 IonicContact CZ-OD2 2.69Å; R579-D603 IonicContact NH1-OD2 2.6Å; R579-D603 PolarHBondContact NH1-OD2 2.85Å; R579-D603 IonicContact NH2-OD2 3.25Å; R579-D603 PolarHBondContact NH2-OD2 3.49Å; G601-D603 PolarHBondContact O-N 2.83Å
604	Q	87.1	Confident	90.4	Very high	28 Å²	28	47.4 Å²	47.4	13%	0.131	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-113.3	12.8	179.2	-61.3	172.8	-51.9	0	0	111.9	L600 G601 P602 T607	L600-Q604 HydrophobicContact CB-CB 3.99Å; L600-Q604 HydrophobicContact CD1-CB 4.23Å; L600-Q604 HydrophobicContact CD2-CB 4.03Å; L600-Q604 HydrophobicContact CD2-CG 4.46Å; L600-Q604 HydrophobicContact CG-CB 4.32Å; G601-Q604 WeakPolarHBondContact O-CB 3.34Å; G601-Q604 PolarHBondContact O-N 2.95Å; P602-Q604 PolarHBondContact O-N 2.98Å; Q604-T607 WeakPolarHBondContact O-CB 3.38Å; Q604-T607 PolarHBondContact O-N 3.34Å; Q604-T607 PolarHBondContact O-OG1 3.09Å
605	N	86.6	Confident	89.8	Confident	83 Å²	83	51.9 Å²	51.9	44%	0.444	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	134.4	173.4	-172.5	7.6	0	0	0	111.4	P602 T625 V626	P602-N605 WeakPolarHBondContact O-CB 3.45Å; P602-N605 PolarHBondContact O-N 2.93Å; N605-T625 WeakPolarHBondContact OD1-CA 3.48Å; N605-T625 VanDerWaalsContact OD1-CG2 3.3Å; N605-T625 WeakPolarHBondContact OD1-CG2 3.5Å; N605-V626 HydrophobicContact CB-CB 4Å; N605-V626 PolarHBondContact ND2-O 2.86Å; N605-V626 VanDerWaalsContact ND2-O 3.14Å; N605-V626 PolarHBondContact OD1-N 2.77Å
606	G	89	Confident	89	Confident	41 Å²	41	54.1 Å²	54.1	42%	0.423	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.8	17.3	-176.6	0	0	0	0	0	113.8	V608 I624	G606-V608 PolarHBondContact O-N 2.88Å; G606-I624 CarbonylContact C-O 3.52Å; G606-I624 VanDerWaalsContact CA-O 3.31Å; G606-I624 WeakPolarHBondContact CA-O 3.27Å; G606-I624 PolarHBondContact N-O 2.75Å
607	T	92.8	Very high	88.5	Confident	16 Å²	16	55.7 Å²	55.7	10%	0.098	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	129	173.2	-71.8	0	0	0	0	110.3	V575 I580 L600 Q604 I624	V575-T607 HydrophobicContact CG1-CG2 3.81Å; I580-T607 HydrophobicContact CD1-CG2 3.59Å; L600-T607 HydrophobicContact CD1-CG2 4.06Å; Q604-T607 WeakPolarHBondContact O-CB 3.38Å; Q604-T607 PolarHBondContact O-N 3.34Å; Q604-T607 PolarHBondContact O-OG1 3.09Å; T607-I624 HydrophobicContact CG2-CD1 4.02Å; T607-I624 PolarHBondContact N-O 2.89Å; T607-I624 PolarHBondContact O-N 2.99Å
608	V	94.6	Very high	88.4	Confident	55 Å²	55	61 Å²	61	33%	0.333	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	128.9	173.1	-174	0	0	0	0	109.1	G606 E610 A622 I623	G606-V608 PolarHBondContact O-N 2.88Å; V608-E610 HydrophobicContact CG1-CG 3.96Å; V608-A622 WeakPolarHBondContact CA-O 3.42Å; V608-I623 HydrophobicContact CG2-CG1 4.49Å
609	V	94.4	Very high	88.5	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	121.5	170.7	-177.6	0	0	0	0	107.3	I540 F555 F573 V575 F594 S621 A622 I624	I540-V609 HydrophobicContact CD1-CG1 4.21Å; F555-V609 HydrophobicContact CD2-CG1 4.45Å; F555-V609 HydrophobicContact CD2-CG2 4.23Å; F555-V609 HydrophobicContact CE2-CB 4.42Å; F555-V609 HydrophobicContact CE2-CG2 3.82Å; F573-V609 HydrophobicContact CD1-CG1 3.74Å; F573-V609 HydrophobicContact CE1-CG1 4.23Å; V575-V609 HydrophobicContact CG2-CB 4.49Å; V575-V609 HydrophobicContact CG2-CG1 4.25Å; V575-V609 HydrophobicContact CG2-CG2 4.12Å; F594-V609 HydrophobicContact CD2-CG1 4.2Å; F594-V609 HydrophobicContact CE2-CG1 4.05Å; F594-V609 HydrophobicContact CZ-CG1 4.45Å; F594-V609 HydrophobicContact CZ-CG2 4.17Å; V609-S621 CarbonylContact O-C 3.45Å; V609-S621 WeakPolarHBondContact O-CA 3.46Å; V609-A622 PolarHBondContact N-O 2.66Å; V609-A622 PolarHBondContact O-N 2.81Å; V609-I624 HydrophobicContact CG2-CD1 3.8Å; V609-I624 HydrophobicContact CG2-CG1 4.32Å
610	E	95.9	Very high	88.7	Confident	58 Å²	58	54.8 Å²	54.8	27%	0.271	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	139.8	-179.2	-60.8	-175.8	107.7	0	0	109.8	F573 Q574 V608 L612 A620	F573-E610 CarbonylContact C-O 3.53Å; F573-E610 WeakPolarHBondContact CA-O 3.42Å; Q574-E610 PolarHBondContact N-O 3.15Å; Q574-E610 PolarHBondContact O-N 2.7Å; V608-E610 HydrophobicContact CG1-CG 3.96Å; E610-L612 HydrophobicContact CB-CD2 4.36Å; E610-A620 CarbonylContact C-O 3.56Å
611	C	95.6	Very high	88.9	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	129.7	171.5	178.8	0	0	0	0	109.4	L538 I540 C557 R572 F573 P619 A620	L538-C611 WeakPolarHBondContact CD1-O 3.24Å; I540-C611 HydrophobicContact CD1-CB 4.36Å; C557-C611 HydrophobicContact CB-CB 3.69Å; C557-C611 WeakPolarHBondContact CB-SG 3.34Å; C557-C611 WeakPolarHBondContact SG-CB 3.43Å; C557-C611 CovalentContact SG-SG 2.01Å; C557-C611 PolarHBondContact SG-SG 3.12Å; R572-C611 WeakPolarHBondContact O-CA 3.36Å; F573-C611 HydrophobicContact CD1-CB 4.43Å; F573-C611 HydrophobicContact CE1-CB 4.47Å; C611-P619 WeakPolarHBondContact O-CA 3.38Å; C611-A620 HydrophobicContact CB-CB 4.44Å; C611-A620 PolarHBondContact N-O 2.89Å; C611-A620 PolarHBondContact O-N 3.03Å
612	L	94.7	Very high	89.2	Confident	34 Å²	34	57.4 Å²	57.4	18%	0.178	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	163.3	-168.2	-50	176.5	0	0	0	110.8	P571 R572 Q574 E610 P619	P571-L612 WeakPolarHBondContact CA-O 3.33Å; P571-L612 WeakPolarHBondContact CB-O 3.15Å; R572-L612 HydrophobicContact CG-CB 3.95Å; R572-L612 PolarHBondContact N-O 2.77Å; R572-L612 PolarHBondContact O-N 2.71Å; Q574-L612 HydrophobicContact CB-CD1 3.89Å; E610-L612 HydrophobicContact CB-CD2 4.36Å; L612-P619 HydrophobicContact CD2-CB 3.63Å
613	S	89.9	Confident	89.7	Confident	20 Å²	20	57.1 Å²	57.1	14%	0.14	31%	0.314	C	S	.	.			trans	-128.1	173.5	166.5	-168.1	0	0	0	0	110.2	F569 R572 E615 S617	F569-S613 WeakPolarHBondContact CD2-OG 3.23Å; F569-S613 WeakPolarHBondContact CE2-OG 3.3Å; F569-S613 WeakPolarHBondContact CZ-OG 3.36Å; R572-S613 PolarHBondContact NH2-O 2.61Å; S613-E615 PolarHBondContact OG-N 2.87Å; S613-S617 WeakPolarHBondContact CB-OG 3.39Å
614	D	84.1	Confident	90.1	Very high	135 Å²	135	52.4 Å²	52.4	72%	0.722	29%	0.289	S	S	*	.	S	Bend	trans	-92.9	-21.6	157.4	-67.5	-59.9	0	0	0	111.5	R572	R572-D614 IonicContact CZ-OD1 3.13Å; R572-D614 IonicContact CZ-OD2 2.74Å; R572-D614 IonicContact NH1-OD1 3.19Å; R572-D614 PolarHBondContact NH1-OD1 2.83Å; R572-D614 IonicContact NH1-OD2 2.7Å; R572-D614 PolarHBondContact NH1-OD2 2.83Å; R572-D614 IonicContact NH2-OD1 3.99Å; R572-D614 PolarHBondContact NH2-OD1 2.79Å; R572-D614 IonicContact NH2-OD2 2.79Å
615	E	82.3	Confident	90.3	Very high	94 Å²	94	52.9 Å²	52.9	44%	0.439	29%	0.294	S	S	.	.	S	Bend	trans	-78.8	149.7	174.4	-69.7	-64.1	155.3	0	0	112.7	Y536 F569 S613 S617	Y536-E615 HydrophobicContact CD2-CB 3.88Å; Y536-E615 HydrophobicContact CE2-CB 4.06Å; Y536-E615 HydrophobicContact CE2-CG 4.29Å; F569-E615 HydrophobicContact CD1-CB 4.02Å; F569-E615 HydrophobicContact CD1-CG 3.48Å; F569-E615 VanDerWaalsContact CD1-CG 3.48Å; F569-E615 HydrophobicContact CE1-CB 3.59Å; F569-E615 HydrophobicContact CE1-CG 3.6Å; F569-E615 HydrophobicContact CG-CG 4.08Å; F569-E615 HydrophobicContact CZ-CB 3.95Å; F569-E615 HydrophobicContact CZ-CG 4.33Å; S613-E615 PolarHBondContact OG-N 2.87Å; E615-S617 PolarHBondContact O-N 2.89Å; E615-S617 PolarHBondContact O-OG 2.85Å
616	P	76.4	Confident	90.3	Very high	70 Å²	70	49.1 Å²	49.1	46%	0.455	27%	0.274	S	S	.	.	S	Bend	trans	-53	105.6	-179.5	-29.2	37.5	0	0	0	114	V533 Y536	V533-P616 HydrophobicContact CG1-CB 4.41Å; V533-P616 HydrophobicContact CG1-CG 4.16Å; Y536-P616 PolarHBondContact N-O 2.87Å
617	S	82.4	Confident	89.7	Confident	41 Å²	41	52 Å²	52	29%	0.287	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	163.6	-175	54	0	0	0	0	111.2	Y536 S613 E615	Y536-S617 VanDerWaalsContact O-CA 3.32Å; Y536-S617 WeakPolarHBondContact O-CA 3.39Å; Y536-S617 WeakPolarHBondContact O-CB 3.43Å; S613-S617 WeakPolarHBondContact CB-OG 3.39Å; E615-S617 PolarHBondContact O-N 2.89Å; E615-S617 PolarHBondContact O-OG 2.85Å
618	R	86.3	Confident	88.4	Confident	218 Å²	218	54.6 Å²	54.6	82%	0.823	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.6	138.3	167.2	-68.2	-173.8	-179	-172.9	2.3	109.5
619	P	91.4	Very high	87	Confident	80 Å²	80	55 Å²	55	52%	0.519	29%	0.289	S	S	.	.			trans	-63.7	142	176	29.4	-36.3	0	0	0	110.4	C611 L612	C611-P619 WeakPolarHBondContact O-CA 3.38Å; L612-P619 HydrophobicContact CD2-CB 3.63Å
620	A	93.4	Very high	85.8	Confident	14 Å²	14	55.4 Å²	55.4	12%	0.116	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	134	173	0	0	0	0	0	109.3	L538 I540 E610 C611	L538-A620 HydrophobicContact CB-CB 3.92Å; I540-A620 HydrophobicContact CB-CB 4.24Å; I540-A620 HydrophobicContact CG2-CB 3.93Å; E610-A620 CarbonylContact C-O 3.56Å; C611-A620 HydrophobicContact CB-CB 4.44Å; C611-A620 PolarHBondContact N-O 2.89Å; C611-A620 PolarHBondContact O-N 3.03Å
621	S	94.8	Very high	84.4	Confident	56 Å²	56	57 Å²	57	39%	0.392	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	134.6	-174.4	-46.9	0	0	0	0	111.5	V609	V609-S621 CarbonylContact O-C 3.45Å; V609-S621 WeakPolarHBondContact O-CA 3.46Å
622	A	94.3	Very high	82.9	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	153.2	167.6	0	0	0	0	0	110.8	I540 P542 Q543 F555 V608 V609	I540-A622 HydrophobicContact CD1-CB 3.6Å; I540-A622 HydrophobicContact CG1-CB 4.03Å; I540-A622 HydrophobicContact CG2-CB 4.13Å; P542-A622 VanDerWaalsContact O-CB 3.3Å; P542-A622 WeakPolarHBondContact O-CB 3.5Å; Q543-A622 VanDerWaalsContact O-CA 3.27Å; Q543-A622 WeakPolarHBondContact O-CA 3.43Å; F555-A622 HydrophobicContact CD1-CB 3.88Å; F555-A622 HydrophobicContact CE1-CB 3.5Å; F555-A622 VanDerWaalsContact CE1-CB 3.5Å; F555-A622 HydrophobicContact CZ-CB 4.04Å; V608-A622 WeakPolarHBondContact CA-O 3.42Å; V609-A622 PolarHBondContact N-O 2.66Å; V609-A622 PolarHBondContact O-N 2.81Å
623	I	94.1	Very high	81.5	Confident	56 Å²	56	61 Å²	61	29%	0.287	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	126.4	179.6	-53.7	178.2	0	0	0	109.6	Q543 L545 V608	Q543-I623 PolarHBondContact O-N 3.13Å; Q543-I623 VanDerWaalsContact O-N 3.15Å; L545-I623 PolarHBondContact N-O 3.13Å; V608-I623 HydrophobicContact CG2-CG1 4.49Å
624	I	92.9	Very high	80.8	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.005	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	116.7	171.1	-49.9	160.7	0	0	0	108.9	L545 V547 V553 F555 L600 G606 T607 V609 V626	L545-I624 CarbonylContact O-C 3.5Å; L545-I624 WeakPolarHBondContact O-CA 3.23Å; V547-I624 HydrophobicContact CG2-CG2 3.79Å; V553-I624 HydrophobicContact CG1-CD1 4.22Å; V553-I624 HydrophobicContact CG1-CG1 4.44Å; V553-I624 HydrophobicContact CG2-CG2 4.48Å; F555-I624 HydrophobicContact CE2-CD1 3.89Å; F555-I624 HydrophobicContact CE2-CG1 3.72Å; F555-I624 HydrophobicContact CZ-CD1 4.32Å; F555-I624 HydrophobicContact CZ-CG1 3.62Å; L600-I624 HydrophobicContact CD1-CB 4.09Å; L600-I624 HydrophobicContact CD1-CD1 3.57Å; L600-I624 HydrophobicContact CD1-CG1 4.46Å; L600-I624 HydrophobicContact CD1-CG2 3.92Å; L600-I624 HydrophobicContact CG-CD1 4.5Å; G606-I624 CarbonylContact C-O 3.52Å; G606-I624 VanDerWaalsContact CA-O 3.31Å; G606-I624 WeakPolarHBondContact CA-O 3.27Å; G606-I624 PolarHBondContact N-O 2.75Å; T607-I624 HydrophobicContact CG2-CD1 4.02Å; T607-I624 PolarHBondContact N-O 2.89Å; T607-I624 PolarHBondContact O-N 2.99Å; V609-I624 HydrophobicContact CG2-CD1 3.8Å; V609-I624 HydrophobicContact CG2-CG1 4.32Å; I624-V626 HydrophobicContact CG2-CG2 4.27Å
625	T	90.5	Very high	80.4	Confident	38 Å²	38	57 Å²	57	23%	0.233	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	122	168.1	-43.4	0	0	0	0	108.3	L545 T546 V547 N605 E627	L545-T625 PolarHBondContact O-N 3Å; T546-T625 CarbonylContact C-O 3.58Å; T546-T625 VanDerWaalsContact CA-O 3.31Å; T546-T625 WeakPolarHBondContact CA-O 3.15Å; V547-T625 PolarHBondContact N-O 3.13Å; N605-T625 WeakPolarHBondContact OD1-CA 3.48Å; N605-T625 VanDerWaalsContact OD1-CG2 3.3Å; N605-T625 WeakPolarHBondContact OD1-CG2 3.5Å; T625-E627 HydrophobicContact CG2-CG 3.72Å
626	V	86.4	Confident	80.2	Confident	4 Å²	4	57.3 Å²	57.3	2%	0.024	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	102.9	174.8	-174.3	0	0	0	0	108	V547 P549 L600 N605 I624	V547-V626 HydrophobicContact CG2-CG2 4.3Å; V547-V626 WeakPolarHBondContact O-CA 3.37Å; P549-V626 HydrophobicContact CB-CG1 4.39Å; P549-V626 HydrophobicContact CG-CG1 4.11Å; L600-V626 HydrophobicContact CB-CG2 3.59Å; L600-V626 HydrophobicContact CD1-CG2 4.17Å; N605-V626 HydrophobicContact CB-CB 4Å; N605-V626 PolarHBondContact ND2-O 2.86Å; N605-V626 VanDerWaalsContact ND2-O 3.14Å; N605-V626 PolarHBondContact OD1-N 2.77Å; I624-V626 HydrophobicContact CG2-CG2 4.27Å
627	E	76.5	Confident	80.6	Confident	102 Å²	102	54.1 Å²	54.1	48%	0.477	28%	0.284	S	S	.	.			trans	-105	118.2	178.9	-63.7	-166.6	169.2	0	0	109.5	T546 V547 T625 I629	T546-E627 HydrophobicContact CG2-CB 4.08Å; T546-E627 HydrophobicContact CG2-CG 3.83Å; V547-E627 PolarHBondContact O-N 3.01Å; T625-E627 HydrophobicContact CG2-CG 3.72Å; E627-I629 VanDerWaalsContact O-CG1 3.3Å; E627-I629 WeakPolarHBondContact O-CG1 3.45Å; E627-I629 PolarHBondContact O-N 2.88Å; E627-I629 VanDerWaalsContact O-N 3.14Å
628	D	65.9	Low	80.6	Confident	71 Å²	71	59 Å²	59	38%	0.38	30%	0.297	S	S	.	.			trans	-79.6	93.1	178.6	178.1	36.1	0	0	0	109	P549 R636	P549-D628 HydrophobicContact CG-CB 3.94Å; D628-R636 VanDerWaalsContact CB-NH1 3.34Å; D628-R636 PolarHBondContact O-NH1 2.79Å; D628-R636 IonicContact OD2-CZ 3.89Å; D628-R636 IonicContact OD2-NH1 3.71Å; D628-R636 PolarHBondContact OD2-NH1 2.89Å; D628-R636 IonicContact OD2-NH2 2.64Å; D628-R636 PolarHBondContact OD2-NH2 2.97Å
629	I	65.1	Low	80.5	Confident	62 Å²	62	51.2 Å²	51.2	32%	0.318	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-77.6	131.3	-169	-48.9	-173.1	0	0	0	110.6	R548 E627 W794	R548-I629 HydrophobicContact CG-CD1 3.58Å; R548-I629 HydrophobicContact CG-CG1 3.95Å; E627-I629 VanDerWaalsContact O-CG1 3.3Å; E627-I629 WeakPolarHBondContact O-CG1 3.45Å; E627-I629 PolarHBondContact O-N 2.88Å; E627-I629 VanDerWaalsContact O-N 3.14Å; I629-W794 HydrophobicContact CD1-CB 3.82Å; I629-W794 HydrophobicContact CD1-CD2 3.55Å; I629-W794 HydrophobicContact CD1-CE3 3.3Å; I629-W794 HydrophobicContact CD1-CG 3.75Å; I629-W794 HydrophobicContact CD1-CZ3 4.14Å
630	C	69.5	Low	79.9	Confident	10 Å²	10	48.7 Å²	48.7	7%	0.068	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-65	162.1	173.6	-67.9	0	0	0	0	112.5	R636 C642	C630-R636 VanDerWaalsContact SG-CA 3.55Å; C630-C642 VanDerWaalsContact CA-SG 3.55Å; C630-C642 HydrophobicContact CB-CB 3.62Å; C630-C642 WeakPolarHBondContact CB-SG 3.37Å; C630-C642 WeakPolarHBondContact SG-CA 3.17Å; C630-C642 WeakPolarHBondContact SG-CB 3.3Å; C630-C642 CovalentContact SG-SG 2.03Å; C630-C642 PolarHBondContact SG-SG 2.82Å
631	P	66.7	Low	79.5	Confident	91 Å²	91	50.9 Å²	50.9	59%	0.591	27%	0.272	S	S	*	.	S	Bend	trans	-53.6	151.3	178.1	-26.5	35.5	0	0	0	113.5	G633 S634	P631-G633 PolarHBondContact O-N 2.95Å; P631-S634 WeakPolarHBondContact O-CA 3.32Å; P631-S634 WeakPolarHBondContact O-CB 3.46Å; P631-S634 PolarHBondContact O-N 3.47Å; P631-S634 PolarHBondContact O-OG 3Å; P631-S634 VanDerWaalsContact O-OG 3.07Å
632	D	62.7	Low	79	Confident	107 Å²	107	51 Å²	51	57%	0.572	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.1	129.1	-171.2	-54.9	-43.3	0	0	0	113.3	S634	D632-S634 VanDerWaalsContact C-N 3.34Å
633	G	65.2	Low	78.5	Confident	10 Å²	10	51.5 Å²	51.5	10%	0.103	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.1	3.4	-173.4	0	0	0	0	0	115.8	P631 A645 R847	P631-G633 PolarHBondContact O-N 2.95Å; G633-A645 WeakPolarHBondContact O-CB 3.41Å; G633-A645 PolarHBondContact O-N 2.85Å; G633-R847 VanDerWaalsContact CA-NH1 3.31Å
634	S	76.9	Confident	77.9	Confident	35 Å²	35	51.9 Å²	51.9	25%	0.245	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	152.9	177.9	-50.6	0	0	0	0	112.8	P631 D632 L643	P631-S634 WeakPolarHBondContact O-CA 3.32Å; P631-S634 WeakPolarHBondContact O-CB 3.46Å; P631-S634 PolarHBondContact O-N 3.47Å; P631-S634 PolarHBondContact O-OG 3Å; P631-S634 VanDerWaalsContact O-OG 3.07Å; D632-S634 VanDerWaalsContact C-N 3.34Å; S634-L643 CarbonylContact C-O 3.53Å; S634-L643 WeakPolarHBondContact CA-O 3.35Å; S634-L643 VanDerWaalsContact CB-O 3.23Å; S634-L643 WeakPolarHBondContact CB-O 3.35Å
635	R	74.5	Confident	77	Confident	36 Å²	36	52.2 Å²	52.2	14%	0.136	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	154.6	176.1	-77.2	171.7	51.3	139.7	4.7	109.9	L643 A645 F648 M665 I668	R635-L643 PolarHBondContact N-O 2.88Å; R635-L643 PolarHBondContact O-N 2.84Å; R635-A645 HydrophobicContact CG-CB 3.97Å; R635-F648 HydrophobicContact CB-CD2 3.84Å; R635-F648 HydrophobicContact CB-CE1 4.5Å; R635-F648 HydrophobicContact CB-CE2 3.3Å; R635-F648 HydrophobicContact CB-CZ 3.7Å; R635-F648 HydrophobicContact CG-CE2 4.47Å; R635-M665 PolarHBondContact NH2-O 2.81Å; R635-I668 PolarHBondContact NH1-O 2.73Å; R635-I668 VanDerWaalsContact NH1-O 3.12Å
636	R	78.8	Confident	76.3	Confident	102 Å²	102	51.8 Å²	51.8	39%	0.385	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	125.4	-174.6	-160	-162.2	-177.9	89.5	-2.8	111.5	D628 C630 M665	D628-R636 VanDerWaalsContact CB-NH1 3.34Å; D628-R636 PolarHBondContact O-NH1 2.79Å; D628-R636 IonicContact OD2-CZ 3.89Å; D628-R636 IonicContact OD2-NH1 3.71Å; D628-R636 PolarHBondContact OD2-NH1 2.89Å; D628-R636 IonicContact OD2-NH2 2.64Å; D628-R636 PolarHBondContact OD2-NH2 2.97Å; C630-R636 VanDerWaalsContact SG-CA 3.55Å; R636-M665 WeakPolarHBondContact O-CE 3.42Å
637	C	84.4	Confident	76.2	Confident	2 Å²	2	57 Å²	57	1%	0.014	31%	0.307	C	S	.	.			trans	-62.8	154.5	163.6	-61	0	0	0	0	110.3	S639 G640 Q641 L643 C655	C637-S639 WeakPolarHBondContact CB-OG 3.41Å; C637-S639 PolarHBondContact O-N 2.99Å; C637-G640 WeakPolarHBondContact O-CA 3.38Å; C637-G640 PolarHBondContact O-N 2.91Å; C637-Q641 HydrophobicContact CB-CB 4.02Å; C637-Q641 WeakPolarHBondContact CB-O 3.5Å; C637-Q641 PolarHBondContact N-O 2.88Å; C637-L643 VanDerWaalsContact SG-CD1 3.57Å; C637-C655 HydrophobicContact CB-CB 3.81Å; C637-C655 WeakPolarHBondContact CB-SG 3.44Å; C637-C655 VanDerWaalsContact SG-CA 3.56Å; C637-C655 WeakPolarHBondContact SG-CB 3Å; C637-C655 CovalentContact SG-SG 2.03Å; C637-C655 PolarHBondContact SG-SG 3.19Å
638	R	83	Confident	76.4	Confident	144 Å²	144	52.4 Å²	52.4	54%	0.543	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-23.6	169.1	169.5	-168.8	-58.1	148.9	7	112.3	G640 D657 S659 D662	R638-G640 PolarHBondContact O-N 3.1Å; R638-D657 VanDerWaalsContact CB-OD2 3.23Å; R638-D657 WeakPolarHBondContact CB-OD2 3.3Å; R638-D657 WeakPolarHBondContact CG-OD2 3.31Å; R638-S659 WeakPolarHBondContact CB-OG 3.31Å; R638-S659 PolarHBondContact N-OG 2.69Å; R638-D662 IonicContact CZ-OD2 3.74Å; R638-D662 VanDerWaalsContact CZ-OD2 3.28Å; R638-D662 IonicContact NH1-OD2 3.75Å; R638-D662 PolarHBondContact NH1-OD2 3.44Å; R638-D662 IonicContact NH2-OD2 2.65Å; R638-D662 PolarHBondContact NH2-OD2 3.07Å
639	S	82.8	Confident	77.2	Confident	54 Å²	54	50.6 Å²	50.6	38%	0.378	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-18	166.6	65	0	0	0	0	114.5	C637 Q641 D657	C637-S639 WeakPolarHBondContact CB-OG 3.41Å; C637-S639 PolarHBondContact O-N 2.99Å; S639-Q641 WeakPolarHBondContact OG-CB 3.47Å; S639-Q641 PolarHBondContact OG-N 2.86Å; S639-D657 PolarHBondContact N-OD2 2.77Å
640	G	79	Confident	77.9	Confident	28 Å²	28	51.4 Å²	51.4	29%	0.289	28%	0.282	S	S	.	.	S	Bend	trans	93.8	-8.2	-173.4	0	0	0	0	0	114.9	C637 R638	C637-G640 WeakPolarHBondContact O-CA 3.38Å; C637-G640 PolarHBondContact O-N 2.91Å; R638-G640 PolarHBondContact O-N 3.1Å
641	Q	85.5	Confident	78.5	Confident	59 Å²	59	54 Å²	54	28%	0.276	31%	0.311	S	S	.	.			trans	-62.5	145.7	171.3	179.5	-173.3	-3.2	0	0	111.1	C637 S639 D654	C637-Q641 HydrophobicContact CB-CB 4.02Å; C637-Q641 WeakPolarHBondContact CB-O 3.5Å; C637-Q641 PolarHBondContact N-O 2.88Å; S639-Q641 WeakPolarHBondContact OG-CB 3.47Å; S639-Q641 PolarHBondContact OG-N 2.86Å; Q641-D654 PolarHBondContact NE2-O 2.97Å; Q641-D654 PolarHBondContact OE1-O 3.37Å
642	C	84.9	Confident	79.5	Confident	58 Å²	58	51.6 Å²	51.6	39%	0.392	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	131.7	174.6	-70.5	0	0	0	0	110.7	C630	C630-C642 VanDerWaalsContact CA-SG 3.55Å; C630-C642 HydrophobicContact CB-CB 3.62Å; C630-C642 WeakPolarHBondContact CB-SG 3.37Å; C630-C642 WeakPolarHBondContact SG-CA 3.17Å; C630-C642 WeakPolarHBondContact SG-CB 3.3Å; C630-C642 CovalentContact SG-SG 2.03Å; C630-C642 PolarHBondContact SG-SG 2.82Å
643	L	84	Confident	80.9	Confident	11 Å²	11	54.5 Å²	54.5	6%	0.058	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	150.2	177.7	-65.3	174.6	0	0	0	110.3	S634 R635 C637 A645 R647 F648 D654 C655	S634-L643 CarbonylContact C-O 3.53Å; S634-L643 WeakPolarHBondContact CA-O 3.35Å; S634-L643 VanDerWaalsContact CB-O 3.23Å; S634-L643 WeakPolarHBondContact CB-O 3.35Å; R635-L643 PolarHBondContact N-O 2.88Å; R635-L643 PolarHBondContact O-N 2.84Å; C637-L643 VanDerWaalsContact SG-CD1 3.57Å; L643-A645 PolarHBondContact O-N 2.8Å; L643-R647 HydrophobicContact CB-CB 4.35Å; L643-R647 HydrophobicContact CD1-CB 4.46Å; L643-F648 HydrophobicContact CB-CE2 4.08Å; L643-F648 HydrophobicContact CD1-CE2 4.46Å; L643-D654 HydrophobicContact CD1-CB 3.54Å; L643-D654 HydrophobicContact CD2-CB 4.03Å; L643-D654 HydrophobicContact CG-CB 4.44Å; L643-C655 VanDerWaalsContact CD1-SG 3.55Å
644	P	81.2	Confident	82.2	Confident	65 Å²	65	56.1 Å²	56.1	42%	0.422	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.4	140.9	169	-23.6	34.2	0	0	0	110.9	G646 R647	P644-G646 PolarHBondContact O-N 2.84Å; P644-R647 PolarHBondContact O-N 2.84Å
645	A	73.5	Confident	82.8	Confident	7 Å²	7	54.6 Å²	54.6	6%	0.058	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-29.6	-169.7	0	0	0	0	0	114.3	G633 R635 L643 R647	G633-A645 WeakPolarHBondContact O-CB 3.41Å; G633-A645 PolarHBondContact O-N 2.85Å; R635-A645 HydrophobicContact CG-CB 3.97Å; L643-A645 PolarHBondContact O-N 2.8Å; A645-R647 VanDerWaalsContact C-N 3.29Å; A645-R647 PolarHBondContact O-N 2.84Å
646	G	75.4	Confident	83.5	Confident	30 Å²	30	59 Å²	59	31%	0.309	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-1.1	175.8	0	0	0	0	0	116.2	P644 F648	P644-G646 PolarHBondContact O-N 2.84Å; G646-F648 VanDerWaalsContact C-N 3.3Å
647	R	85	Confident	84	Confident	114 Å²	114	57 Å²	57	43%	0.43	32%	0.321	S	S	.	.	S	Bend	trans	-96.8	33.1	168.6	-62	-160.6	-174.2	-160.6	-1.1	112.5	L643 P644 A645 D654	L643-R647 HydrophobicContact CB-CB 4.35Å; L643-R647 HydrophobicContact CD1-CB 4.46Å; P644-R647 PolarHBondContact O-N 2.84Å; A645-R647 VanDerWaalsContact C-N 3.29Å; A645-R647 PolarHBondContact O-N 2.84Å; R647-D654 IonicContact CZ-OD1 3.53Å; R647-D654 IonicContact NH1-OD1 3.49Å; R647-D654 PolarHBondContact NH1-OD1 2.93Å; R647-D654 IonicContact NH1-OD2 2.73Å
648	F	81.2	Confident	84.3	Confident	5 Å²	5	58 Å²	58	2%	0.022	33%	0.33	C	S	.	.	S	Bend	trans	-120.5	125.9	167.3	-77.4	-105.4	0	0	0	105.8	R635 L643 G646 D650 D660 M665	R635-F648 HydrophobicContact CB-CD2 3.84Å; R635-F648 HydrophobicContact CB-CE1 4.5Å; R635-F648 HydrophobicContact CB-CE2 3.3Å; R635-F648 HydrophobicContact CB-CZ 3.7Å; R635-F648 HydrophobicContact CG-CE2 4.47Å; L643-F648 HydrophobicContact CB-CE2 4.08Å; L643-F648 HydrophobicContact CD1-CE2 4.46Å; G646-F648 VanDerWaalsContact C-N 3.3Å; F648-D650 VanDerWaalsContact C-N 3.35Å; F648-D660 HydrophobicContact CD1-CB 4.18Å; F648-D660 HydrophobicContact CE1-CB 4.39Å; F648-D660 HydrophobicContact CG-CB 4.46Å; F648-M665 HydrophobicContact CE1-CE 4.23Å
649	C	81.5	Confident	84.6	Confident	32 Å²	32	51.1 Å²	51.1	22%	0.216	31%	0.305	C	S	.	.	S	Bend	trans	68.5	29.3	177.3	-29.2	0	0	0	0	114	E661 C666 S687	C649-E661 WeakPolarHBondContact CA-OE1 3.48Å; C649-E661 PolarHBondContact N-OE1 2.6Å; C649-C666 HydrophobicContact CB-CB 4.12Å; C649-C666 WeakPolarHBondContact CB-SG 3.46Å; C649-C666 WeakPolarHBondContact SG-CA 3.18Å; C649-C666 WeakPolarHBondContact SG-CB 3.45Å; C649-C666 CovalentContact SG-SG 2.02Å; C649-C666 PolarHBondContact SG-SG 3Å; C649-S687 WeakPolarHBondContact O-CB 3.5Å; C649-S687 PolarHBondContact O-OG 2.83Å
650	D	79.6	Confident	84.8	Confident	79 Å²	79	48.6 Å²	48.6	42%	0.422	29%	0.287	S	S	.	.	S	Bend	trans	-91.8	-4.8	172.4	71.5	2.9	0	0	0	112.7	F648 A652	F648-D650 VanDerWaalsContact C-N 3.35Å; D650-A652 VanDerWaalsContact OD1-CB 3.28Å; D650-A652 WeakPolarHBondContact OD1-CB 3.31Å; D650-A652 PolarHBondContact OD1-N 3.1Å
651	G	82.2	Confident	85.3	Confident	65 Å²	65	50.3 Å²	50.3	67%	0.67	29%	0.288	S	S	*	.	S	Bend	trans	88.8	-2.4	-178.8	0	0	0	0	0	114.6	E661	G651-E661 VanDerWaalsContact CA-OE2 3.25Å; G651-E661 WeakPolarHBondContact CA-OE2 3.25Å; G651-E661 PolarHBondContact N-OE2 2.82Å; G651-E661 VanDerWaalsContact N-OE2 3.14Å
652	A	88.3	Confident	85.3	Confident	40 Å²	40	49.2 Å²	49.2	33%	0.331	28%	0.283	S	S	.	.	S	Bend	trans	-88.4	170.6	169.4	0	0	0	0	0	111.1	D650 E661	D650-A652 VanDerWaalsContact OD1-CB 3.28Å; D650-A652 WeakPolarHBondContact OD1-CB 3.31Å; D650-A652 PolarHBondContact OD1-N 3.1Å; A652-E661 VanDerWaalsContact O-CD 3.32Å; A652-E661 WeakPolarHBondContact O-CG 3.21Å
653	R	91.9	Very high	85.2	Confident	168 Å²	168	50.7 Å²	50.7	63%	0.634	29%	0.293	S	S	*	.			trans	-122	90	171.6	-173.4	-172.1	165.7	164.5	-1.6	108.8	C655 D656 D657 G658	R653-C655 PolarHBondContact NE-O 3.35Å; R653-D656 PolarHBondContact NH2-O 3.03Å; R653-D657 PolarHBondContact NH2-O 2.91Å; R653-G658 VanDerWaalsContact NE-CA 3.35Å
654	D	91.8	Very high	84.9	Confident	44 Å²	44	58.1 Å²	58.1	24%	0.235	32%	0.324	C	S	.	.			trans	-92.9	-26.9	179.6	-87.6	-77.7	0	0	0	113	Q641 L643 R647 D660	Q641-D654 PolarHBondContact NE2-O 2.97Å; Q641-D654 PolarHBondContact OE1-O 3.37Å; L643-D654 HydrophobicContact CD1-CB 3.54Å; L643-D654 HydrophobicContact CD2-CB 4.03Å; L643-D654 HydrophobicContact CG-CB 4.44Å; R647-D654 IonicContact CZ-OD1 3.53Å; R647-D654 IonicContact NH1-OD1 3.49Å; R647-D654 PolarHBondContact NH1-OD1 2.93Å; R647-D654 IonicContact NH1-OD2 2.73Å; D654-D660 WeakPolarHBondContact CA-OD2 3.47Å; D654-D660 PolarHBondContact N-OD2 2.99Å
655	C	90.5	Very high	84.7	Confident	3 Å²	3	56.4 Å²	56.4	2%	0.02	31%	0.311	C	S	.	.	S	Bend	trans	-75.6	133	171.1	-69.9	0	0	0	0	111	C637 L643 R653 D657 G658 D660	C637-C655 HydrophobicContact CB-CB 3.81Å; C637-C655 WeakPolarHBondContact CB-SG 3.44Å; C637-C655 VanDerWaalsContact SG-CA 3.56Å; C637-C655 WeakPolarHBondContact SG-CB 3Å; C637-C655 CovalentContact SG-SG 2.03Å; C637-C655 PolarHBondContact SG-SG 3.19Å; L643-C655 VanDerWaalsContact CD1-SG 3.55Å; R653-C655 PolarHBondContact NE-O 3.35Å; C655-D657 PolarHBondContact O-N 2.99Å; C655-D657 VanDerWaalsContact O-N 3.09Å; C655-G658 PolarHBondContact O-N 2.86Å; C655-D660 HydrophobicContact CB-CB 4.24Å; C655-D660 PolarHBondContact N-OD2 3.13Å; C655-D660 VanDerWaalsContact SG-CB 3.57Å; C655-D660 PolarHBondContact SG-N 2.7Å; C655-D660 VanDerWaalsContact SG-N 3.45Å
656	D	88.9	Confident	84.7	Confident	130 Å²	130	57.4 Å²	57.4	70%	0.695	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.1	-41.6	173.1	-78.9	-38.1	0	0	0	112.7	R653	R653-D656 PolarHBondContact NH2-O 3.03Å
657	D	90.1	Very high	84.3	Confident	60 Å²	60	61.3 Å²	61.3	32%	0.321	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-10.7	179.3	73.6	-25.2	0	0	0	114.5	R638 S639 R653 C655 S659	R638-D657 VanDerWaalsContact CB-OD2 3.23Å; R638-D657 WeakPolarHBondContact CB-OD2 3.3Å; R638-D657 WeakPolarHBondContact CG-OD2 3.31Å; S639-D657 PolarHBondContact N-OD2 2.77Å; R653-D657 PolarHBondContact NH2-O 2.91Å; C655-D657 PolarHBondContact O-N 2.99Å; C655-D657 VanDerWaalsContact O-N 3.09Å; D657-S659 VanDerWaalsContact CG-OG 3.31Å; D657-S659 VanDerWaalsContact OD1-CB 3.26Å; D657-S659 WeakPolarHBondContact OD1-CB 3.37Å; D657-S659 PolarHBondContact OD1-N 3.29Å; D657-S659 PolarHBondContact OD1-OG 3.3Å; D657-S659 WeakPolarHBondContact OD2-CB 3.22Å; D657-S659 PolarHBondContact OD2-OG 2.89Å
658	G	89.2	Confident	83.4	Confident	21 Å²	21	60 Å²	60	22%	0.216	33%	0.332	C	S	.	.	S	Bend	trans	71.9	32.8	-176	0	0	0	0	0	113.9	R653 C655 D660	R653-G658 VanDerWaalsContact NE-CA 3.35Å; C655-G658 PolarHBondContact O-N 2.86Å; G658-D660 WeakPolarHBondContact CA-OD1 3.34Å
659	S	90.2	Very high	82.8	Confident	1 Å²	1	63.7 Å²	63.7	1%	0.007	36%	0.357	C	S	.	.			trans	-85.3	-16.5	177.9	56	0	0	0	0	114.7	R638 D657 E661 D662 M665	R638-S659 WeakPolarHBondContact CB-OG 3.31Å; R638-S659 PolarHBondContact N-OG 2.69Å; D657-S659 VanDerWaalsContact CG-OG 3.31Å; D657-S659 VanDerWaalsContact OD1-CB 3.26Å; D657-S659 WeakPolarHBondContact OD1-CB 3.37Å; D657-S659 PolarHBondContact OD1-N 3.29Å; D657-S659 PolarHBondContact OD1-OG 3.3Å; D657-S659 WeakPolarHBondContact OD2-CB 3.22Å; D657-S659 PolarHBondContact OD2-OG 2.89Å; S659-E661 VanDerWaalsContact C-N 3.28Å; S659-E661 PolarHBondContact O-N 2.98Å; S659-D662 WeakPolarHBondContact O-CB 3.38Å; S659-D662 PolarHBondContact O-N 2.86Å; S659-M665 WeakPolarHBondContact O-CB 3.39Å; S659-M665 WeakPolarHBondContact O-CG 3.3Å
660	D	86.1	Confident	82.3	Confident	0 Å²	0	63 Å²	63	0%	0	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-46.3	-51.8	162.8	39.8	1.9	0	0	0	112.1	F648 D654 C655 G658 D662 C666	F648-D660 HydrophobicContact CD1-CB 4.18Å; F648-D660 HydrophobicContact CE1-CB 4.39Å; F648-D660 HydrophobicContact CG-CB 4.46Å; D654-D660 WeakPolarHBondContact CA-OD2 3.47Å; D654-D660 PolarHBondContact N-OD2 2.99Å; C655-D660 HydrophobicContact CB-CB 4.24Å; C655-D660 PolarHBondContact N-OD2 3.13Å; C655-D660 VanDerWaalsContact SG-CB 3.57Å; C655-D660 PolarHBondContact SG-N 2.7Å; C655-D660 VanDerWaalsContact SG-N 3.45Å; G658-D660 WeakPolarHBondContact CA-OD1 3.34Å; D660-D662 VanDerWaalsContact C-N 3.32Å; D660-D662 PolarHBondContact O-N 2.91Å; D660-C666 PolarHBondContact O-SG 2.78Å; D660-C666 VanDerWaalsContact O-SG 3.33Å
661	E	89.6	Confident	82.1	Confident	65 Å²	65	60.1 Å²	60.1	30%	0.304	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	8.7	-178.2	-59.6	-56.8	99.6	0	0	114	C649 G651 A652 S659 P663	C649-E661 WeakPolarHBondContact CA-OE1 3.48Å; C649-E661 PolarHBondContact N-OE1 2.6Å; G651-E661 VanDerWaalsContact CA-OE2 3.25Å; G651-E661 WeakPolarHBondContact CA-OE2 3.25Å; G651-E661 PolarHBondContact N-OE2 2.82Å; G651-E661 VanDerWaalsContact N-OE2 3.14Å; A652-E661 VanDerWaalsContact O-CD 3.32Å; A652-E661 WeakPolarHBondContact O-CG 3.21Å; S659-E661 VanDerWaalsContact C-N 3.28Å; S659-E661 PolarHBondContact O-N 2.98Å; E661-P663 VanDerWaalsContact O-CD 3.31Å; E661-P663 WeakPolarHBondContact O-CD 3.24Å
662	D	87.2	Confident	81.7	Confident	35 Å²	35	57.2 Å²	57.2	19%	0.187	31%	0.306	C	S	.	.			trans	-71	121.7	171.7	-174.1	-34	0	0	0	108.9	R638 S659 D660 K664 M665 C666	R638-D662 IonicContact CZ-OD2 3.74Å; R638-D662 VanDerWaalsContact CZ-OD2 3.28Å; R638-D662 IonicContact NH1-OD2 3.75Å; R638-D662 PolarHBondContact NH1-OD2 3.44Å; R638-D662 IonicContact NH2-OD2 2.65Å; R638-D662 PolarHBondContact NH2-OD2 3.07Å; S659-D662 WeakPolarHBondContact O-CB 3.38Å; S659-D662 PolarHBondContact O-N 2.86Å; D660-D662 VanDerWaalsContact C-N 3.32Å; D660-D662 PolarHBondContact O-N 2.91Å; D662-K664 PolarHBondContact O-N 3.33Å; D662-K664 VanDerWaalsContact OD1-CB 3.31Å; D662-K664 WeakPolarHBondContact OD1-CB 3.4Å; D662-K664 PolarHBondContact OD1-N 3.36Å; D662-M665 HydrophobicContact CB-CB 4.34Å; D662-M665 HydrophobicContact CB-CG 4.03Å; D662-M665 WeakPolarHBondContact O-CA 3.33Å; D662-M665 PolarHBondContact O-N 3.02Å; D662-C666 PolarHBondContact O-N 2.03Å
663	P	82.4	Confident	81.1	Confident	90 Å²	90	56.8 Å²	56.8	58%	0.584	30%	0.3	S	S	*	.	H	α-helix	trans	-53.5	-21.4	178.7	-29.3	37.3	0	0	0	114.6	E661 N667	E661-P663 VanDerWaalsContact O-CD 3.31Å; E661-P663 WeakPolarHBondContact O-CD 3.24Å; P663-N667 PolarHBondContact O-N 2.74Å; P663-N667 PolarHBondContact O-ND2 3.25Å
664	K	77.9	Confident	80.5	Confident	167 Å²	167	53.3 Å²	53.3	73%	0.726	29%	0.287	S	S	*	.	H	α-helix	trans	-73.7	-41.8	172.7	-64	178.1	178.2	178.4	0	112.5	D662 N667 I668	D662-K664 PolarHBondContact O-N 3.33Å; D662-K664 VanDerWaalsContact OD1-CB 3.31Å; D662-K664 WeakPolarHBondContact OD1-CB 3.4Å; D662-K664 PolarHBondContact OD1-N 3.36Å; K664-N667 PolarHBondContact O-N 2.91Å; K664-I668 PolarHBondContact O-N 2.84Å
665	M	76.2	Confident	80	Confident	28 Å²	28	57.3 Å²	57.3	14%	0.138	30%	0.303	C	S	.	.	H	α-helix	trans	-71.4	-37.2	175.7	-60.1	-70.9	-75.3	0	0	110.1	R635 R636 F648 S659 D662 N667 I668	R635-M665 PolarHBondContact NH2-O 2.81Å; R636-M665 WeakPolarHBondContact O-CE 3.42Å; F648-M665 HydrophobicContact CE1-CE 4.23Å; S659-M665 WeakPolarHBondContact O-CB 3.39Å; S659-M665 WeakPolarHBondContact O-CG 3.3Å; D662-M665 HydrophobicContact CB-CB 4.34Å; D662-M665 HydrophobicContact CB-CG 4.03Å; D662-M665 WeakPolarHBondContact O-CA 3.33Å; D662-M665 PolarHBondContact O-N 3.02Å; M665-N667 PolarHBondContact O-N 3.04Å; M665-I668 HydrophobicContact CE-CD1 4.35Å; M665-I668 WeakPolarHBondContact O-CB 3.16Å; M665-I668 PolarHBondContact O-N 3.06Å; M665-I668 VanDerWaalsContact O-N 3.08Å; M665-I668 HydrophobicContact SD-CD1 3.72Å
666	C	72.7	Confident	79.8	Confident	29 Å²	29	57.9 Å²	57.9	20%	0.196	31%	0.306	C	S	.	.	H	α-helix	trans	-63.9	-22.4	175.1	-80.2	0	0	0	0	116	C649 D660 D662	C649-C666 HydrophobicContact CB-CB 4.12Å; C649-C666 WeakPolarHBondContact CB-SG 3.46Å; C649-C666 WeakPolarHBondContact SG-CA 3.18Å; C649-C666 WeakPolarHBondContact SG-CB 3.45Å; C649-C666 CovalentContact SG-SG 2.02Å; C649-C666 PolarHBondContact SG-SG 3Å; D660-C666 PolarHBondContact O-SG 2.78Å; D660-C666 VanDerWaalsContact O-SG 3.33Å; D662-C666 PolarHBondContact O-N 2.03Å
667	N	68.7	Low	79.8	Confident	111 Å²	111	57.3 Å²	57.3	59%	0.594	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.2	10.5	174.1	-67.7	-68.2	0	0	0	112.9	P663 K664 M665 C669 K675	P663-N667 PolarHBondContact O-N 2.74Å; P663-N667 PolarHBondContact O-ND2 3.25Å; K664-N667 PolarHBondContact O-N 2.91Å; M665-N667 PolarHBondContact O-N 3.04Å; N667-C669 PolarHBondContact O-N 2.9Å; N667-K675 PolarHBondContact OD1-NZ 3.4Å
668	I	65.3	Low	79.8	Confident	88 Å²	88	62 Å²	62	45%	0.451	31%	0.314	S	S	.	.	S	Bend	trans	-68.4	116.3	158.9	-61.6	173.2	0	0	0	107.1	R635 K664 M665 D670	R635-I668 PolarHBondContact NH1-O 2.73Å; R635-I668 VanDerWaalsContact NH1-O 3.12Å; K664-I668 PolarHBondContact O-N 2.84Å; M665-I668 HydrophobicContact CE-CD1 4.35Å; M665-I668 WeakPolarHBondContact O-CB 3.16Å; M665-I668 PolarHBondContact O-N 3.06Å; M665-I668 VanDerWaalsContact O-N 3.08Å; M665-I668 HydrophobicContact SD-CD1 3.72Å; I668-D670 PolarHBondContact O-N 2.89Å
669	C	68	Low	79.8	Confident	81 Å²	81	64.1 Å²	64.1	55%	0.547	32%	0.316	S	S	.	.			trans	-61.7	128.6	175.1	-176.1	0	0	0	0	110.3	N667 C796	N667-C669 PolarHBondContact O-N 2.9Å; C669-C796 HydrophobicContact CB-CB 3.77Å; C669-C796 WeakPolarHBondContact CB-SG 3.46Å; C669-C796 PolarHBondContact O-SG 2.96Å; C669-C796 WeakPolarHBondContact SG-CB 3.08Å; C669-C796 CovalentContact SG-SG 2.04Å; C669-C796 PolarHBondContact SG-SG 3.09Å
670	D	71.6	Confident	79.8	Confident	17 Å²	17	71.6 Å²	71.6	9%	0.091	35%	0.351	C	S	.	.			trans	-112.9	119.9	176.5	165.8	32.6	0	0	0	109.1	I668 L672 S673	I668-D670 PolarHBondContact O-N 2.89Å; D670-L672 PolarHBondContact O-N 3.31Å; D670-L672 WeakPolarHBondContact OD1-CB 3.46Å; D670-L672 PolarHBondContact OD1-N 3.5Å; D670-S673 WeakPolarHBondContact CB-OG 3.4Å; D670-S673 PolarHBondContact O-N 2.79Å; D670-S673 VanDerWaalsContact OD2-CB 3.31Å; D670-S673 WeakPolarHBondContact OD2-CB 3.07Å; D670-S673 PolarHBondContact OD2-N 3.42Å; D670-S673 PolarHBondContact OD2-OG 3.29Å
671	P	74.5	Confident	79.9	Confident	19 Å²	19	74.1 Å²	74.1	12%	0.123	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-16.8	177.6	-23.8	33.6	0	0	0	114.5	I789 R791	P671-I789 HydrophobicContact CB-CG2 3.71Å; P671-R791 HydrophobicContact CB-CG 4.29Å; P671-R791 HydrophobicContact CG-CG 4.05Å
672	L	73.7	Confident	79.9	Confident	4 Å²	4	79 Å²	79	2%	0.021	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-10.8	-173.1	-72.3	160.6	0	0	0	115.1	D670 M690 V691 I789 L842	D670-L672 PolarHBondContact O-N 3.31Å; D670-L672 WeakPolarHBondContact OD1-CB 3.46Å; D670-L672 PolarHBondContact OD1-N 3.5Å; L672-M690 CarbonylContact O-C 3.47Å; L672-M690 VanDerWaalsContact O-CA 3.27Å; L672-M690 WeakPolarHBondContact O-CA 3Å; L672-V691 PolarHBondContact O-N 2.93Å; L672-I789 HydrophobicContact CD2-CD1 3.48Å; L672-I789 VanDerWaalsContact CD2-CD1 3.48Å; L672-I789 HydrophobicContact CG-CD1 4.38Å; L672-L842 HydrophobicContact CD2-CD1 3.91Å; L672-L842 HydrophobicContact CD2-CD2 4.31Å
673	S	76.8	Confident	80	Confident	31 Å²	31	84.7 Å²	84.7	22%	0.217	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	156.3	-178.3	56.4	0	0	0	0	112.8	D670 F689	D670-S673 WeakPolarHBondContact CB-OG 3.4Å; D670-S673 PolarHBondContact O-N 2.79Å; D670-S673 VanDerWaalsContact OD2-CB 3.31Å; D670-S673 WeakPolarHBondContact OD2-CB 3.07Å; D670-S673 PolarHBondContact OD2-N 3.42Å; D670-S673 PolarHBondContact OD2-OG 3.29Å; S673-F689 CarbonylContact C-O 3.55Å; S673-F689 VanDerWaalsContact CA-O 3.32Å; S673-F689 WeakPolarHBondContact CA-O 3.45Å
674	R	79.3	Confident	80.2	Confident	95 Å²	95	82 Å²	82	36%	0.358	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	144.4	176.5	-58.3	-174.4	68.8	-150.7	-8.6	108.6	T688 F689 V691	R674-T688 CarbonylContact O-C 3.48Å; R674-T688 WeakPolarHBondContact O-CA 3.44Å; R674-T688 VanDerWaalsContact O-CB 3.29Å; R674-T688 WeakPolarHBondContact O-CB 3.49Å; R674-F689 HydrophobicContact CB-CD1 4.01Å; R674-F689 HydrophobicContact CB-CE1 3.53Å; R674-F689 HydrophobicContact CB-CE2 4.49Å; R674-F689 HydrophobicContact CB-CZ 3.82Å; R674-F689 HydrophobicContact CG-CZ 4.44Å; R674-F689 PolarHBondContact N-O 3.05Å; R674-F689 WeakPolarHBondContact O-CD1 3.45Å; R674-F689 PolarHBondContact O-N 3.12Å; R674-V691 HydrophobicContact CG-CG1 3.56Å
675	K	80.8	Confident	80.7	Confident	129 Å²	129	80.8 Å²	80.8	56%	0.561	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.2	135.8	173.3	-65.3	-172.5	177.1	-176.5	0	109.4	N667 T688	N667-K675 PolarHBondContact OD1-NZ 3.4Å; K675-T688 HydrophobicContact CG-CG2 4.41Å
676	C	86.9	Confident	81	Confident	14 Å²	14	84.4 Å²	84.4	10%	0.095	42%	0.415	C	S	.	.			trans	-75.7	133.5	167.3	-69	0	0	0	0	108.9	P684 K686 S687 C701	C676-P684 HydrophobicContact CB-CB 3.49Å; C676-P684 VanDerWaalsContact CB-CB 3.49Å; C676-P684 HydrophobicContact CB-CG 3.71Å; C676-K686 VanDerWaalsContact CB-O 3.29Å; C676-K686 WeakPolarHBondContact CB-O 3.49Å; C676-K686 PolarHBondContact SG-O 3.3Å; C676-S687 PolarHBondContact N-O 3.08Å; C676-C701 VanDerWaalsContact CA-SG 3.58Å; C676-C701 HydrophobicContact CB-CB 3.62Å; C676-C701 WeakPolarHBondContact CB-SG 2.98Å; C676-C701 WeakPolarHBondContact SG-CA 3.31Å; C676-C701 WeakPolarHBondContact SG-CB 3.31Å; C676-C701 CovalentContact SG-SG 2.03Å; C676-C701 PolarHBondContact SG-SG 2.78Å
677	E	87.9	Confident	81.3	Confident	118 Å²	118	85.5 Å²	85.5	55%	0.551	42%	0.423	S	S	*	.			trans	-110	169.5	178.1	-58.5	-179.7	-175.3	0	0	111.6	Y679 N703 F705	E677-Y679 PolarHBondContact O-N 2.04Å; E677-N703 PolarHBondContact O-ND2 2.65Å; E677-F705 HydrophobicContact CB-CD1 4.23Å; E677-F705 HydrophobicContact CB-CD2 3.99Å; E677-F705 HydrophobicContact CB-CE1 3.88Å; E677-F705 HydrophobicContact CB-CE2 3.64Å; E677-F705 HydrophobicContact CB-CG 4.26Å; E677-F705 HydrophobicContact CB-CZ 3.57Å; E677-F705 HydrophobicContact CG-CE1 3.8Å; E677-F705 HydrophobicContact CG-CE2 4.12Å; E677-F705 HydrophobicContact CG-CZ 3.54Å; E677-F705 VanDerWaalsContact N-CD1 3.31Å
678	Y	90.2	Very high	81.8	Confident	158 Å²	158	81.6 Å²	81.6	62%	0.62	40%	0.403	S	S	*	.			trans	-74.6	110.4	-178.6	-170.5	-89.3	0	0	0	110.9	G681 E683	Y678-G681 VanDerWaalsContact CZ-C 3.5Å; Y678-G681 VanDerWaalsContact OH-C 3.28Å; Y678-G681 PolarHBondContact OH-O 3.2Å; Y678-E683 HydrophobicContact CD2-CB 4.01Å; Y678-E683 HydrophobicContact CD2-CG 4.49Å; Y678-E683 HydrophobicContact CE2-CB 4.03Å
679	Y	90.8	Very high	82.6	Confident	67 Å²	67	77.6 Å²	77.6	26%	0.263	38%	0.382	S	S	.	.	B	Isolated β-bridge	trans	-120	136.3	-171.6	-173.5	-119.7	0	0	0	111.9	E677 G681 R682 N703 G704 F705	E677-Y679 PolarHBondContact O-N 2.04Å; Y679-G681 PolarHBondContact O-N 2.86Å; Y679-R682 PolarHBondContact N-O 3.46Å; Y679-R682 VanDerWaalsContact N-O 3.13Å; Y679-R682 PolarHBondContact O-N 3.04Å; Y679-N703 WeakPolarHBondContact CD1-O 3.43Å; Y679-N703 PolarHBondContact N-ND2 3.38Å; Y679-G704 WeakPolarHBondContact CD1-O 3.14Å; Y679-G704 WeakPolarHBondContact CE1-O 3.41Å; Y679-F705 HydrophobicContact CD2-CD2 4.37Å; Y679-F705 HydrophobicContact CG-CB 4.3Å; Y679-F705 HydrophobicContact CG-CD2 4.43Å
680	Q	88.8	Confident	83.1	Confident	158 Å²	158	75.3 Å²	75.3	74%	0.738	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.8	35	178.2	-59.4	-171.4	11.8	0	0	115.9
681	G	87.8	Confident	83.5	Confident	52 Å²	52	75 Å²	75	54%	0.536	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.4	16.4	-178.8	0	0	0	0	0	114.6	Y678 Y679	Y678-G681 VanDerWaalsContact CZ-C 3.5Å; Y678-G681 VanDerWaalsContact OH-C 3.28Å; Y678-G681 PolarHBondContact OH-O 3.2Å; Y679-G681 PolarHBondContact O-N 2.86Å
682	R	91.2	Very high	83.7	Confident	167 Å²	167	76 Å²	76	63%	0.63	37%	0.366	S	S	*	.	B	Isolated β-bridge	trans	-125.7	127.9	179.2	-62.4	-178.3	-176.1	-174.5	2.3	111	Y679 N703	Y679-R682 PolarHBondContact N-O 3.46Å; Y679-R682 VanDerWaalsContact N-O 3.13Å; Y679-R682 PolarHBondContact O-N 3.04Å; R682-N703 HydrophobicContact CB-CB 3.83Å; R682-N703 PolarHBondContact O-ND2 3.35Å
683	E	88.5	Confident	84.1	Confident	156 Å²	156	79.3 Å²	79.3	73%	0.729	38%	0.378	S	S	*	.			trans	-67.4	140.6	166.9	-163.3	164.2	-148.2	0	0	109.1	Y678	Y678-E683 HydrophobicContact CD2-CB 4.01Å; Y678-E683 HydrophobicContact CD2-CG 4.49Å; Y678-E683 HydrophobicContact CE2-CB 4.03Å
684	P	87.6	Confident	84.4	Confident	32 Å²	32	77.9 Å²	77.9	21%	0.208	37%	0.368	C	S	.	.			trans	-71.7	149.4	178.4	31.6	-36.3	0	0	0	111.2	C676 K686 C701	C676-P684 HydrophobicContact CB-CB 3.49Å; C676-P684 VanDerWaalsContact CB-CB 3.49Å; C676-P684 HydrophobicContact CB-CG 3.71Å; P684-K686 WeakPolarHBondContact CB-O 3.04Å; P684-C701 CarbonylContact C-O 3.44Å; P684-C701 VanDerWaalsContact CA-O 3.27Å; P684-C701 WeakPolarHBondContact CA-O 3.35Å; P684-C701 HydrophobicContact CB-CB 4.04Å; P684-C701 WeakPolarHBondContact CB-O 3.35Å
685	I	87.1	Confident	84.6	Confident	143 Å²	143	74 Å²	74	73%	0.733	36%	0.355	S	S	*	.	S	Bend	trans	-82.2	-35.8	179.9	-55.1	-178.9	0	0	0	110.6	C701	I685-C701 PolarHBondContact N-O 3.14Å
686	K	82	Confident	84.7	Confident	104 Å²	104	68.6 Å²	68.6	45%	0.452	33%	0.332	S	S	.	.	S	Bend	trans	-100.5	145	170.5	-55	-172.7	-160.5	170.3	0	109.5	C676 P684 T688 D700	C676-K686 VanDerWaalsContact CB-O 3.29Å; C676-K686 WeakPolarHBondContact CB-O 3.49Å; C676-K686 PolarHBondContact SG-O 3.3Å; P684-K686 WeakPolarHBondContact CB-O 3.04Å; K686-T688 VanDerWaalsContact C-N 3.32Å; K686-D700 WeakPolarHBondContact CD-O 3.42Å; K686-D700 WeakPolarHBondContact CE-O 3.31Å; K686-D700 WeakPolarHBondContact CG-O 3.29Å; K686-D700 IonicContact NZ-OD1 3.08Å; K686-D700 PolarHBondContact NZ-OD1 2.92Å
687	S	79.1	Confident	84.6	Confident	51 Å²	51	68.6 Å²	68.6	36%	0.357	34%	0.335	S	S	.	.	S	Bend	trans	-70.2	-29.7	175.4	58	0	0	0	0	112.9	C649 C676	C649-S687 WeakPolarHBondContact O-CB 3.5Å; C649-S687 PolarHBondContact O-OG 2.83Å; C676-S687 PolarHBondContact N-O 3.08Å
688	T	79.1	Confident	84.6	Confident	30 Å²	30	67 Å²	67	18%	0.184	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	162.5	-175.1	61.1	0	0	0	0	112.1	R674 K675 K686	R674-T688 CarbonylContact O-C 3.48Å; R674-T688 WeakPolarHBondContact O-CA 3.44Å; R674-T688 VanDerWaalsContact O-CB 3.29Å; R674-T688 WeakPolarHBondContact O-CB 3.49Å; K675-T688 HydrophobicContact CG-CG2 4.41Å; K686-T688 VanDerWaalsContact C-N 3.32Å
689	F	82.9	Confident	84.6	Confident	3 Å²	3	62 Å²	62	1%	0.013	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	158.2	171.2	69.2	-72.7	0	0	0	109.8	S673 R674 W693 T694 D700 C701 F705 D706	S673-F689 CarbonylContact C-O 3.55Å; S673-F689 VanDerWaalsContact CA-O 3.32Å; S673-F689 WeakPolarHBondContact CA-O 3.45Å; R674-F689 HydrophobicContact CB-CD1 4.01Å; R674-F689 HydrophobicContact CB-CE1 3.53Å; R674-F689 HydrophobicContact CB-CE2 4.49Å; R674-F689 HydrophobicContact CB-CZ 3.82Å; R674-F689 HydrophobicContact CG-CZ 4.44Å; R674-F689 PolarHBondContact N-O 3.05Å; R674-F689 WeakPolarHBondContact O-CD1 3.45Å; R674-F689 PolarHBondContact O-N 3.12Å; F689-W693 HydrophobicContact CB-CE3 4.31Å; F689-W693 HydrophobicContact CD2-CB 4.44Å; F689-T694 WeakPolarHBondContact CE2-OG1 3.41Å; F689-D700 HydrophobicContact CB-CB 4.05Å; F689-C701 WeakPolarHBondContact CD1-SG 3.43Å; F689-F705 HydrophobicContact CE1-CD1 4.16Å; F689-F705 HydrophobicContact CE1-CE1 4.27Å; F689-D706 HydrophobicContact CD1-CB 4.4Å; F689-D706 HydrophobicContact CD2-CB 3.66Å; F689-D706 HydrophobicContact CE1-CB 4.35Å; F689-D706 HydrophobicContact CE2-CB 3.59Å; F689-D706 HydrophobicContact CG-CB 4.06Å; F689-D706 HydrophobicContact CZ-CB 3.96Å
690	M	79.3	Confident	84.4	Confident	33 Å²	33	59.8 Å²	59.8	16%	0.163	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	145.4	177.8	-59.1	-160.9	-166.4	0	0	111.5	L672 H692 W693	L672-M690 CarbonylContact O-C 3.47Å; L672-M690 VanDerWaalsContact O-CA 3.27Å; L672-M690 WeakPolarHBondContact O-CA 3Å; M690-H692 PolarHBondContact O-N 2.99Å; M690-H692 VanDerWaalsContact O-N 3.12Å; M690-W693 HydrophobicContact CB-CD2 3.7Å; M690-W693 HydrophobicContact CB-CE3 3.77Å; M690-W693 HydrophobicContact CB-CG 4.2Å; M690-W693 HydrophobicContact CB-CH2 4.45Å; M690-W693 HydrophobicContact CB-CZ2 4.37Å; M690-W693 HydrophobicContact CB-CZ3 4.16Å; M690-W693 HydrophobicContact CE-CH2 3.8Å; M690-W693 HydrophobicContact CE-CZ2 4.09Å; M690-W693 HydrophobicContact CG-CD2 4.12Å; M690-W693 HydrophobicContact CG-CE3 3.89Å; M690-W693 HydrophobicContact CG-CH2 3.78Å; M690-W693 HydrophobicContact CG-CZ2 3.98Å; M690-W693 HydrophobicContact CG-CZ3 3.73Å; M690-W693 WeakPolarHBondContact O-CB 3.14Å; M690-W693 PolarHBondContact O-N 2.88Å; M690-W693 HydrophobicContact SD-CH2 4.11Å; M690-W693 HydrophobicContact SD-CZ2 3.97Å
691	V	79.9	Confident	84.4	Confident	10 Å²	10	52.2 Å²	52.2	6%	0.061	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-55.6	-35	-175.4	-69.5	0	0	0	0	113.7	L672 R674 W693 T694 Y787 I789 L842	L672-V691 PolarHBondContact O-N 2.93Å; R674-V691 HydrophobicContact CG-CG1 3.56Å; V691-W693 VanDerWaalsContact C-N 3.35Å; V691-T694 VanDerWaalsContact O-CB 3.29Å; V691-T694 WeakPolarHBondContact O-CB 3.35Å; V691-T694 PolarHBondContact O-N 3.48Å; V691-T694 PolarHBondContact O-OG1 3.25Å; V691-Y787 HydrophobicContact CB-CD1 4.46Å; V691-Y787 HydrophobicContact CB-CE1 3.71Å; V691-Y787 HydrophobicContact CG2-CD1 3.95Å; V691-Y787 HydrophobicContact CG2-CE1 3.58Å; V691-I789 HydrophobicContact CG2-CD1 3.45Å; V691-I789 VanDerWaalsContact CG2-CD1 3.45Å; V691-I789 HydrophobicContact CG2-CG1 3.95Å; V691-L842 HydrophobicContact CG2-CD1 4.34Å
692	H	77.5	Confident	84.5	Confident	42 Å²	42	51.1 Å²	51.1	19%	0.194	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-73.6	-23.3	179.7	66.5	-70.4	0	0	0	113.5	M690 T694 Y787 L842	M690-H692 PolarHBondContact O-N 2.99Å; M690-H692 VanDerWaalsContact O-N 3.12Å; H692-T694 PolarHBondContact O-N 2.95Å; H692-Y787 HydrophobicContact CB-CD1 4.43Å; H692-Y787 HydrophobicContact CB-CG 4.22Å; H692-L842 HydrophobicContact CB-CB 4.48Å; H692-L842 HydrophobicContact CB-CD1 3.88Å
693	W	83	Confident	84.5	Confident	72 Å²	72	43.8 Å²	43.8	27%	0.273	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-77	0.5	171	-51.1	-30.8	0	0	0	113.2	F689 M690 V691 C695 D696 D700	F689-W693 HydrophobicContact CB-CE3 4.31Å; F689-W693 HydrophobicContact CD2-CB 4.44Å; M690-W693 HydrophobicContact CB-CD2 3.7Å; M690-W693 HydrophobicContact CB-CE3 3.77Å; M690-W693 HydrophobicContact CB-CG 4.2Å; M690-W693 HydrophobicContact CB-CH2 4.45Å; M690-W693 HydrophobicContact CB-CZ2 4.37Å; M690-W693 HydrophobicContact CB-CZ3 4.16Å; M690-W693 HydrophobicContact CE-CH2 3.8Å; M690-W693 HydrophobicContact CE-CZ2 4.09Å; M690-W693 HydrophobicContact CG-CD2 4.12Å; M690-W693 HydrophobicContact CG-CE3 3.89Å; M690-W693 HydrophobicContact CG-CH2 3.78Å; M690-W693 HydrophobicContact CG-CZ2 3.98Å; M690-W693 HydrophobicContact CG-CZ3 3.73Å; M690-W693 WeakPolarHBondContact O-CB 3.14Å; M690-W693 PolarHBondContact O-N 2.88Å; M690-W693 HydrophobicContact SD-CH2 4.11Å; M690-W693 HydrophobicContact SD-CZ2 3.97Å; V691-W693 VanDerWaalsContact C-N 3.35Å; W693-C695 PolarHBondContact O-N 2.72Å; W693-C695 VanDerWaalsContact O-N 3.14Å; W693-D696 VanDerWaalsContact CA-OD2 3.28Å; W693-D696 WeakPolarHBondContact CA-OD2 3.3Å; W693-D696 WeakPolarHBondContact CB-OD2 3.45Å; W693-D700 VanDerWaalsContact CD2-OD2 3.28Å; W693-D700 HydrophobicContact CE3-CB 4.37Å
694	T	82	Confident	84.5	Confident	2 Å²	2	37 Å²	37	1%	0.012	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	115.1	167.8	-52.5	0	0	0	0	108.2	F689 V691 H692 R717	F689-T694 WeakPolarHBondContact CE2-OG1 3.41Å; V691-T694 VanDerWaalsContact O-CB 3.29Å; V691-T694 WeakPolarHBondContact O-CB 3.35Å; V691-T694 PolarHBondContact O-N 3.48Å; V691-T694 PolarHBondContact O-OG1 3.25Å; H692-T694 PolarHBondContact O-N 2.95Å; T694-R717 PolarHBondContact O-NH1 3.36Å; T694-R717 PolarHBondContact O-NH2 3.19Å
695	C	83.5	Confident	84.7	Confident	13 Å²	13	36.9 Å²	36.9	9%	0.088	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.3	36.1	175.8	-53.7	0	0	0	0	115.9	W693 D706 E707 C710	W693-C695 PolarHBondContact O-N 2.72Å; W693-C695 VanDerWaalsContact O-N 3.14Å; C695-D706 PolarHBondContact N-O 3.13Å; C695-E707 WeakPolarHBondContact CA-OE1 3.37Å; C695-E707 PolarHBondContact N-OE1 3.39Å; C695-C710 VanDerWaalsContact CA-SG 3.53Å; C695-C710 HydrophobicContact CB-CB 3.66Å; C695-C710 WeakPolarHBondContact CB-SG 3.31Å; C695-C710 WeakPolarHBondContact SG-CA 3.41Å; C695-C710 WeakPolarHBondContact SG-CB 3.47Å; C695-C710 CovalentContact SG-SG 2.02Å; C695-C710 PolarHBondContact SG-SG 3.29Å
696	D	83.5	Confident	84.7	Confident	15 Å²	15	30.1 Å²	30.1	8%	0.08	17%	0.168	C	C	.	.	S	Bend	trans	-96.3	-6.4	177.2	75.1	9.6	0	0	0	114.8	W693 E698 E707 M734 A735	W693-D696 VanDerWaalsContact CA-OD2 3.28Å; W693-D696 WeakPolarHBondContact CA-OD2 3.3Å; W693-D696 WeakPolarHBondContact CB-OD2 3.45Å; D696-E698 PolarHBondContact OD1-N 3.24Å; D696-E698 VanDerWaalsContact OD1-N 3.09Å; D696-E707 PolarHBondContact N-OE1 2.89Å; D696-M734 WeakPolarHBondContact O-CA 3.37Å; D696-M734 VanDerWaalsContact O-CB 3.31Å; D696-M734 WeakPolarHBondContact O-CB 3.32Å; D696-M734 PolarHBondContact O-N 3.34Å; D696-A735 HydrophobicContact CB-CB 4.32Å; D696-A735 PolarHBondContact O-N 2.9Å; D696-A735 VanDerWaalsContact O-N 3.13Å
697	G	84.7	Confident	85	Confident	15 Å²	15	26.6 Å²	26.6	16%	0.155	15%	0.153	C	C	.	.	S	Bend	trans	100.2	-7.5	174.6	0	0	0	0	0	115.8	E707	G697-E707 PolarHBondContact N-OE1 3.23Å
698	E	87.9	Confident	85.4	Confident	84 Å²	84	25.2 Å²	25.2	39%	0.393	14%	0.144	S	C	.	.	S	Bend	trans	-96	167.6	167.5	-92.9	-60.9	160.6	0	0	112.2	D696 E707 P733 A735 F736	D696-E698 PolarHBondContact OD1-N 3.24Å; D696-E698 VanDerWaalsContact OD1-N 3.09Å; E698-E707 WeakPolarHBondContact O-CG 2.95Å; E698-P733 HydrophobicContact CG-CB 4.13Å; E698-P733 HydrophobicContact CG-CG 4.12Å; E698-A735 HydrophobicContact CB-CB 4.49Å; E698-A735 HydrophobicContact CG-CB 4.43Å; E698-F736 HydrophobicContact CG-CE1 4.1Å; E698-F736 HydrophobicContact CG-CZ 3.81Å
699	S	90	Very high	85.3	Confident	53 Å²	53	29.2 Å²	29.2	37%	0.371	16%	0.164	S	C	.	.			trans	-107.7	72.7	-178.6	166.9	0	0	0	0	111.5	C701 G702 G704 D706	S699-C701 PolarHBondContact O-N 2.93Å; S699-G702 WeakPolarHBondContact O-CA 3.49Å; S699-G702 PolarHBondContact O-N 3.38Å; S699-G704 PolarHBondContact OG-N 3.22Å; S699-D706 WeakPolarHBondContact CA-OD2 3.02Å
700	D	87.5	Confident	85	Confident	20 Å²	20	29.3 Å²	29.3	11%	0.107	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-40.7	-170.4	-125.9	-57.4	0	0	0	113.5	K686 F689 W693 G702 D706	K686-D700 WeakPolarHBondContact CD-O 3.42Å; K686-D700 WeakPolarHBondContact CE-O 3.31Å; K686-D700 WeakPolarHBondContact CG-O 3.29Å; K686-D700 IonicContact NZ-OD1 3.08Å; K686-D700 PolarHBondContact NZ-OD1 2.92Å; F689-D700 HydrophobicContact CB-CB 4.05Å; W693-D700 VanDerWaalsContact CD2-OD2 3.28Å; W693-D700 HydrophobicContact CE3-CB 4.37Å; D700-G702 PolarHBondContact O-N 3.23Å; D700-D706 PolarHBondContact N-OD2 2.02Å
701	C	88.2	Confident	84.1	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-4.7	173.4	-65.5	0	0	0	0	113.2	C676 P684 I685 F689 S699 N703 F705 D706	C676-C701 VanDerWaalsContact CA-SG 3.58Å; C676-C701 HydrophobicContact CB-CB 3.62Å; C676-C701 WeakPolarHBondContact CB-SG 2.98Å; C676-C701 WeakPolarHBondContact SG-CA 3.31Å; C676-C701 WeakPolarHBondContact SG-CB 3.31Å; C676-C701 CovalentContact SG-SG 2.03Å; C676-C701 PolarHBondContact SG-SG 2.78Å; P684-C701 CarbonylContact C-O 3.44Å; P684-C701 VanDerWaalsContact CA-O 3.27Å; P684-C701 WeakPolarHBondContact CA-O 3.35Å; P684-C701 HydrophobicContact CB-CB 4.04Å; P684-C701 WeakPolarHBondContact CB-O 3.35Å; I685-C701 PolarHBondContact N-O 3.14Å; F689-C701 WeakPolarHBondContact CD1-SG 3.43Å; S699-C701 PolarHBondContact O-N 2.93Å; C701-N703 VanDerWaalsContact CB-OD1 3.25Å; C701-N703 WeakPolarHBondContact CB-OD1 3.47Å; C701-N703 PolarHBondContact O-N 3.34Å; C701-F705 HydrophobicContact CB-CB 4.32Å; C701-D706 WeakPolarHBondContact CB-OD1 3.45Å; C701-D706 PolarHBondContact N-OD1 3.12Å; C701-D706 PolarHBondContact SG-OD1 2.83Å; C701-D706 VanDerWaalsContact SG-OD1 3.36Å
702	G	89.5	Confident	82.8	Confident	28 Å²	28	38.7 Å²	38.7	29%	0.289	22%	0.219	S	C	.	.	S	Bend	trans	69.5	-8	-176.1	0	0	0	0	0	115.3	S699 D700	S699-G702 WeakPolarHBondContact O-CA 3.49Å; S699-G702 PolarHBondContact O-N 3.38Å; D700-G702 PolarHBondContact O-N 3.23Å
703	N	91.3	Very high	81.8	Confident	14 Å²	14	40 Å²	40	8%	0.075	22%	0.222	C	C	.	.	S	Bend	trans	-113.8	-6.4	171.9	70.4	-7.1	0	0	0	113.8	E677 Y679 R682 C701 F705	E677-N703 PolarHBondContact O-ND2 2.65Å; Y679-N703 WeakPolarHBondContact CD1-O 3.43Å; Y679-N703 PolarHBondContact N-ND2 3.38Å; R682-N703 HydrophobicContact CB-CB 3.83Å; R682-N703 PolarHBondContact O-ND2 3.35Å; C701-N703 VanDerWaalsContact CB-OD1 3.25Å; C701-N703 WeakPolarHBondContact CB-OD1 3.47Å; C701-N703 PolarHBondContact O-N 3.34Å; N703-F705 WeakPolarHBondContact OD1-CB 3.34Å; N703-F705 PolarHBondContact OD1-N 2.92Å; N703-F705 VanDerWaalsContact OD1-N 3.13Å
704	G	89.6	Confident	80.2	Confident	13 Å²	13	38.8 Å²	38.8	13%	0.134	23%	0.228	C	C	.	.	S	Bend	trans	79.4	22.7	-179.1	0	0	0	0	0	115.3	Y679 S699 S708	Y679-G704 WeakPolarHBondContact CD1-O 3.14Å; Y679-G704 WeakPolarHBondContact CE1-O 3.41Å; S699-G704 PolarHBondContact OG-N 3.22Å; G704-S708 PolarHBondContact O-N 2.85Å
705	F	91.6	Very high	78.6	Confident	29 Å²	29	44.3 Å²	44.3	13%	0.127	27%	0.266	C	S	.	.	S	Bend	trans	-67.3	-41	175.6	173.9	-108.3	0	0	0	112.9	E677 Y679 F689 C701 N703 E707 S708	E677-F705 HydrophobicContact CB-CD1 4.23Å; E677-F705 HydrophobicContact CB-CD2 3.99Å; E677-F705 HydrophobicContact CB-CE1 3.88Å; E677-F705 HydrophobicContact CB-CE2 3.64Å; E677-F705 HydrophobicContact CB-CG 4.26Å; E677-F705 HydrophobicContact CB-CZ 3.57Å; E677-F705 HydrophobicContact CG-CE1 3.8Å; E677-F705 HydrophobicContact CG-CE2 4.12Å; E677-F705 HydrophobicContact CG-CZ 3.54Å; E677-F705 VanDerWaalsContact N-CD1 3.31Å; Y679-F705 HydrophobicContact CD2-CD2 4.37Å; Y679-F705 HydrophobicContact CG-CB 4.3Å; Y679-F705 HydrophobicContact CG-CD2 4.43Å; F689-F705 HydrophobicContact CE1-CD1 4.16Å; F689-F705 HydrophobicContact CE1-CE1 4.27Å; C701-F705 HydrophobicContact CB-CB 4.32Å; N703-F705 WeakPolarHBondContact OD1-CB 3.34Å; N703-F705 PolarHBondContact OD1-N 2.92Å; N703-F705 VanDerWaalsContact OD1-N 3.13Å; F705-E707 VanDerWaalsContact C-N 3.28Å; F705-E707 PolarHBondContact O-N 2.8Å; F705-S708 WeakPolarHBondContact O-CB 3.38Å; F705-S708 PolarHBondContact O-N 3.43Å; F705-S708 PolarHBondContact O-OG 3.15Å
706	D	87.1	Confident	77.3	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.005	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-38.4	172.4	44.5	-65	0	0	0	112.8	F689 C695 S699 D700 C701 S708	F689-D706 HydrophobicContact CD1-CB 4.4Å; F689-D706 HydrophobicContact CD2-CB 3.66Å; F689-D706 HydrophobicContact CE1-CB 4.35Å; F689-D706 HydrophobicContact CE2-CB 3.59Å; F689-D706 HydrophobicContact CG-CB 4.06Å; F689-D706 HydrophobicContact CZ-CB 3.96Å; C695-D706 PolarHBondContact N-O 3.13Å; S699-D706 WeakPolarHBondContact CA-OD2 3.02Å; D700-D706 PolarHBondContact N-OD2 2.02Å; C701-D706 WeakPolarHBondContact CB-OD1 3.45Å; C701-D706 PolarHBondContact N-OD1 3.12Å; C701-D706 PolarHBondContact SG-OD1 2.83Å; C701-D706 VanDerWaalsContact SG-OD1 3.36Å; D706-S708 VanDerWaalsContact C-N 3.29Å; D706-S708 PolarHBondContact O-N 2.97Å
707	E	88.5	Confident	76.2	Confident	30 Å²	30	50.5 Å²	50.5	14%	0.14	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83	7	173.4	-75.9	-65.3	112.3	0	0	114.7	C695 D696 G697 E698 F705 C710 R721	C695-E707 WeakPolarHBondContact CA-OE1 3.37Å; C695-E707 PolarHBondContact N-OE1 3.39Å; D696-E707 PolarHBondContact N-OE1 2.89Å; G697-E707 PolarHBondContact N-OE1 3.23Å; E698-E707 WeakPolarHBondContact O-CG 2.95Å; F705-E707 VanDerWaalsContact C-N 3.28Å; F705-E707 PolarHBondContact O-N 2.8Å; E707-C710 VanDerWaalsContact C-SG 3.57Å; E707-C710 PolarHBondContact O-SG 2.99Å; E707-C710 VanDerWaalsContact O-SG 3.36Å; E707-R721 PolarHBondContact O-NH1 2.88Å; E707-R721 WeakPolarHBondContact OE2-CD 3.49Å; E707-R721 IonicContact OE2-CZ 2.76Å; E707-R721 IonicContact OE2-NE 3.78Å; E707-R721 IonicContact OE2-NH1 3.37Å; E707-R721 PolarHBondContact OE2-NH1 2.92Å
708	S	86.1	Confident	75.4	Confident	23 Å²	23	52.6 Å²	52.6	16%	0.161	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	147.7	179	79.5	0	0	0	0	113.1	G704 F705 D706 C710	G704-S708 PolarHBondContact O-N 2.85Å; F705-S708 WeakPolarHBondContact O-CB 3.38Å; F705-S708 PolarHBondContact O-N 3.43Å; F705-S708 PolarHBondContact O-OG 3.15Å; D706-S708 VanDerWaalsContact C-N 3.29Å; D706-S708 PolarHBondContact O-N 2.97Å; S708-C710 VanDerWaalsContact C-N 3.27Å; S708-C710 PolarHBondContact O-N 3.29Å
709	N	78.2	Confident	74.4	Confident	113 Å²	113	50.9 Å²	50.9	60%	0.604	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	28.5	174.4	-162.4	30.3	0	0	0	115.8
710	C	76	Confident	73.4	Confident	6 Å²	6	54 Å²	54	4%	0.041	31%	0.307	C	S	.	.			trans	-77.1	-20.3	178.2	-52.8	0	0	0	0	114.2	C695 E707 S708 A712 R713 A714 R721	C695-C710 VanDerWaalsContact CA-SG 3.53Å; C695-C710 HydrophobicContact CB-CB 3.66Å; C695-C710 WeakPolarHBondContact CB-SG 3.31Å; C695-C710 WeakPolarHBondContact SG-CA 3.41Å; C695-C710 WeakPolarHBondContact SG-CB 3.47Å; C695-C710 CovalentContact SG-SG 2.02Å; C695-C710 PolarHBondContact SG-SG 3.29Å; E707-C710 VanDerWaalsContact C-SG 3.57Å; E707-C710 PolarHBondContact O-SG 2.99Å; E707-C710 VanDerWaalsContact O-SG 3.36Å; S708-C710 VanDerWaalsContact C-N 3.27Å; S708-C710 PolarHBondContact O-N 3.29Å; C710-A712 PolarHBondContact O-N 3.13Å; C710-R713 CarbonylContact O-C 3.43Å; C710-R713 WeakPolarHBondContact O-CA 2.92Å; C710-R713 PolarHBondContact O-N 3.03Å; C710-A714 PolarHBondContact O-N 2.87Å; C710-R721 VanDerWaalsContact CB-CZ 3.46Å
711	E	60.4	Low	72.9	Confident	175 Å²	175	57 Å²	57	82%	0.818	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-32.3	179.8	-64.8	-177.8	167.5	0	0	112.2	R713	E711-R713 PolarHBondContact O-N 3.33Å
712	A	52.4	Low	72.6	Confident	64 Å²	64	60.5 Å²	60.5	53%	0.529	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-17.6	171.9	0	0	0	0	0	113.6	C710	C710-A712 PolarHBondContact O-N 3.13Å
713	R	56.7	Low	72.4	Confident	70 Å²	70	61.3 Å²	61.3	26%	0.264	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.3	-11.5	-172.6	-60.2	-170.7	176.7	118.3	2.2	114.9	C710 E711 S715 E716 R717	C710-R713 CarbonylContact O-C 3.43Å; C710-R713 WeakPolarHBondContact O-CA 2.92Å; C710-R713 PolarHBondContact O-N 3.03Å; E711-R713 PolarHBondContact O-N 3.33Å; R713-S715 VanDerWaalsContact C-N 3.32Å; R713-S715 PolarHBondContact O-N 2.02Å; R713-E716 CarbonylContact O-C 3.49Å; R713-E716 WeakPolarHBondContact O-CA 3.05Å; R713-E716 WeakPolarHBondContact O-CB 2.85Å; R713-E716 PolarHBondContact O-N 2.84Å; R713-R717 PolarHBondContact O-N 3.3Å
714	A	50.6	Low	72.2	Confident	47 Å²	47	64.7 Å²	64.7	39%	0.388	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-57.5	-45	-176.8	0	0	0	0	0	111.9	C710 E716 R717 C718	C710-A714 PolarHBondContact O-N 2.87Å; A714-E716 VanDerWaalsContact C-N 3.25Å; A714-E716 PolarHBondContact O-N 2.92Å; A714-R717 PolarHBondContact O-N 3.28Å; A714-C718 PolarHBondContact O-N 3.33Å
715	S	47.5	Very low	72.2	Confident	118 Å²	118	64.1 Å²	64.1	83%	0.825	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-70.6	-16.3	173.7	-52.9	0	0	0	0	114.3	R713	R713-S715 VanDerWaalsContact C-N 3.32Å; R713-S715 PolarHBondContact O-N 2.02Å
716	E	55.4	Low	71.9	Confident	114 Å²	114	70.5 Å²	70.5	53%	0.533	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-88.8	-4.8	177.4	-54.5	-174.5	137.4	0	0	113	R713 A714 P810	R713-E716 CarbonylContact O-C 3.49Å; R713-E716 WeakPolarHBondContact O-CA 3.05Å; R713-E716 WeakPolarHBondContact O-CB 2.85Å; R713-E716 PolarHBondContact O-N 2.84Å; A714-E716 VanDerWaalsContact C-N 3.25Å; A714-E716 PolarHBondContact O-N 2.92Å; E716-P810 WeakPolarHBondContact O-CD 3.48Å; E716-P810 VanDerWaalsContact O-CG 3.31Å; E716-P810 WeakPolarHBondContact O-CG 3.01Å
717	R	61.6	Low	71.8	Confident	44 Å²	44	78.5 Å²	78.5	17%	0.166	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.6	-12.3	-176.4	-68.9	-167.3	179.5	-171.8	7.1	115.8	T694 R713 A714 Q719	T694-R717 PolarHBondContact O-NH1 3.36Å; T694-R717 PolarHBondContact O-NH2 3.19Å; R713-R717 PolarHBondContact O-N 3.3Å; A714-R717 PolarHBondContact O-N 3.28Å; R717-Q719 HydrophobicContact CB-CB 4.39Å; R717-Q719 PolarHBondContact O-N 2.83Å
718	C	67	Low	71.4	Confident	58 Å²	58	80.5 Å²	80.5	39%	0.392	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.1	30.9	-176.9	-72.2	0	0	0	0	114.3	A714 P810 C813	A714-C718 PolarHBondContact O-N 3.33Å; C718-P810 HydrophobicContact CB-CB 4.46Å; C718-C813 HydrophobicContact CB-CB 3.39Å; C718-C813 WeakPolarHBondContact CB-SG 3.15Å; C718-C813 WeakPolarHBondContact SG-CB 3.23Å; C718-C813 CovalentContact SG-SG 2.02Å; C718-C813 PolarHBondContact SG-SG 2.89Å
719	Q	66.3	Low	71.3	Confident	49 Å²	49	82.2 Å²	82.2	23%	0.229	43%	0.433	C	S	.	.			trans	-148	120.7	-169.5	-165	171.9	17.1	0	0	108.7	R717 M734 V785	R717-Q719 HydrophobicContact CB-CB 4.39Å; R717-Q719 PolarHBondContact O-N 2.83Å; Q719-M734 HydrophobicContact CG-CE 3.89Å; Q719-M734 HydrophobicContact CG-CG 3.85Å; Q719-M734 HydrophobicContact CG-SD 3.97Å; Q719-M734 PolarHBondContact NE2-SD 3.14Å; Q719-V785 HydrophobicContact CB-CG2 4.38Å
720	D	70.9	Confident	71.8	Confident	117 Å²	117	82.3 Å²	82.3	63%	0.626	43%	0.425	S	S	*	.			trans	-70.5	154.9	169.3	-77	-42.5	0	0	0	109.9	M722 M734	D720-M722 PolarHBondContact O-N 2.71Å; D720-M722 VanDerWaalsContact O-N 3.15Å; D720-M734 WeakPolarHBondContact O-CE 3.16Å
721	R	76.3	Confident	72.4	Confident	85 Å²	85	88 Å²	88	32%	0.321	45%	0.451	S	S	.	.	S	Bend	trans	-68.4	-9.2	175.6	-50.6	-162.9	-134.9	-171.2	0.9	114	E707 C710 M734	E707-R721 PolarHBondContact O-NH1 2.88Å; E707-R721 WeakPolarHBondContact OE2-CD 3.49Å; E707-R721 IonicContact OE2-CZ 2.76Å; E707-R721 IonicContact OE2-NE 3.78Å; E707-R721 IonicContact OE2-NH1 3.37Å; E707-R721 PolarHBondContact OE2-NH1 2.92Å; C710-R721 VanDerWaalsContact CB-CZ 3.46Å; R721-M734 PolarHBondContact O-N 2.89Å; R721-M734 VanDerWaalsContact O-N 3.14Å
722	M	82.5	Confident	73.7	Confident	72 Å²	72	79.7 Å²	79.7	36%	0.355	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	122.8	-173.4	-68.1	-73.2	160.2	0	0	109.3	D720 Q731 I732	D720-M722 PolarHBondContact O-N 2.71Å; D720-M722 VanDerWaalsContact O-N 3.15Å; M722-Q731 HydrophobicContact CB-CB 4.43Å; M722-I732 CarbonylContact C-O 3.4Å; M722-I732 VanDerWaalsContact CA-O 3.28Å; M722-I732 WeakPolarHBondContact CA-O 3.31Å
723	F	84.8	Confident	75.4	Confident	46 Å²	46	77.4 Å²	77.4	20%	0.202	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	134.8	169.8	-177.4	-96.2	0	0	0	109.8	Q731 I732 M734 V737 E748 D749	F723-Q731 WeakPolarHBondContact O-CA 3.15Å; F723-I732 HydrophobicContact CB-CD1 4.48Å; F723-I732 HydrophobicContact CB-CG1 3.86Å; F723-I732 HydrophobicContact CD1-CD1 4Å; F723-I732 HydrophobicContact CD1-CG1 4.1Å; F723-I732 HydrophobicContact CG-CG1 4.47Å; F723-I732 PolarHBondContact N-O 3.39Å; F723-I732 PolarHBondContact O-N 2.02Å; F723-M734 HydrophobicContact CB-CE 3.88Å; F723-M734 HydrophobicContact CB-SD 4.36Å; F723-M734 HydrophobicContact CD2-CE 4.47Å; F723-V737 HydrophobicContact CB-CG2 3.63Å; F723-V737 HydrophobicContact CD1-CG2 4.34Å; F723-V737 HydrophobicContact CD2-CG2 4.09Å; F723-V737 HydrophobicContact CG-CG2 3.79Å; F723-E748 HydrophobicContact CE1-CG 4.47Å; F723-D749 HydrophobicContact CD1-CB 4.5Å; F723-D749 HydrophobicContact CE1-CB 4.18Å
724	N	87.5	Confident	76.7	Confident	84 Å²	84	75.4 Å²	75.4	45%	0.449	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	106.8	-178.4	-63.3	-48.2	0	0	0	109.8	K726 Q731	N724-K726 PolarHBondContact O-N 3.13Å; N724-K726 VanDerWaalsContact O-N 3.08Å; N724-Q731 WeakPolarHBondContact OD1-CG 3.35Å; N724-Q731 PolarHBondContact OD1-NE2 2.67Å
725	C	88.9	Confident	78.3	Confident	2 Å²	2	74.7 Å²	74.7	1%	0.014	38%	0.38	C	S	.	.			trans	-59	111.9	171.5	-57	0	0	0	0	109.5	R727 G729 R730 C744 E748	C725-R727 PolarHBondContact O-N 2.78Å; C725-G729 WeakPolarHBondContact O-CA 3.29Å; C725-G729 PolarHBondContact O-N 3.01Å; C725-R730 HydrophobicContact CB-CB 4.2Å; C725-R730 WeakPolarHBondContact CB-O 3.33Å; C725-R730 PolarHBondContact N-O 3.5Å; C725-R730 PolarHBondContact SG-O 3.35Å; C725-R730 VanDerWaalsContact SG-O 3.4Å; C725-C744 VanDerWaalsContact CA-SG 3.54Å; C725-C744 HydrophobicContact CB-CB 3.67Å; C725-C744 WeakPolarHBondContact CB-SG 3.45Å; C725-C744 WeakPolarHBondContact SG-CA 3.18Å; C725-C744 WeakPolarHBondContact SG-CB 3.47Å; C725-C744 CovalentContact SG-SG 2.03Å; C725-C744 PolarHBondContact SG-SG 3.14Å; C725-E748 VanDerWaalsContact C-OE1 3.29Å; C725-E748 WeakPolarHBondContact CA-OE1 3.27Å
726	K	85.5	Confident	80.3	Confident	163 Å²	163	71.8 Å²	71.8	71%	0.709	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-29.4	-173.3	-58	174.3	-159.4	88.8	0	112.5	N724 E748	N724-K726 PolarHBondContact O-N 3.13Å; N724-K726 VanDerWaalsContact O-N 3.08Å; K726-E748 VanDerWaalsContact CB-OE2 3.28Å; K726-E748 WeakPolarHBondContact CB-OE2 3.39Å; K726-E748 WeakPolarHBondContact CD-OE2 3.3Å; K726-E748 WeakPolarHBondContact CG-OE2 3.36Å; K726-E748 VanDerWaalsContact N-CD 3.28Å; K726-E748 PolarHBondContact N-OE1 2.96Å; K726-E748 PolarHBondContact N-OE2 2.79Å; K726-E748 IonicContact NZ-OE2 3.67Å; K726-E748 PolarHBondContact NZ-OE2 2.87Å
727	R	83.8	Confident	81.8	Confident	168 Å²	168	67 Å²	67	63%	0.634	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-46.7	-177.7	-176.3	165.9	178	173.2	-10	113.9	C725 D746 E748	C725-R727 PolarHBondContact O-N 2.78Å; R727-D746 WeakPolarHBondContact CD-OD2 3.33Å; R727-D746 IonicContact CZ-OD1 2.81Å; R727-D746 IonicContact CZ-OD2 2.71Å; R727-D746 IonicContact NE-OD2 3.18Å; R727-D746 IonicContact NH1-OD1 2.71Å; R727-D746 PolarHBondContact NH1-OD1 2.7Å; R727-D746 IonicContact NH1-OD2 2.67Å; R727-D746 PolarHBondContact NH1-OD2 3.4Å; R727-E748 PolarHBondContact N-OE1 3.36Å; R727-E748 VanDerWaalsContact N-OE1 3.14Å
728	D	80.3	Confident	83	Confident	73 Å²	73	65.5 Å²	65.5	39%	0.39	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-18.3	-171.1	-56.3	-40.2	0	0	0	113	R730 S745	D728-R730 HydrophobicContact CB-CB 4.26Å; D728-R730 PolarHBondContact O-N 3.43Å; D728-S745 VanDerWaalsContact CG-OG 3.31Å; D728-S745 WeakPolarHBondContact OD2-CB 2.98Å; D728-S745 PolarHBondContact OD2-N 3.44Å; D728-S745 VanDerWaalsContact OD2-N 3.08Å; D728-S745 PolarHBondContact OD2-OG 2.81Å
729	G	84.2	Confident	84	Confident	59 Å²	59	65.3 Å²	65.3	61%	0.608	32%	0.322	S	S	*	.			trans	68.6	7.5	-167.5	0	0	0	0	0	113.7	C725 Q731	C725-G729 WeakPolarHBondContact O-CA 3.29Å; C725-G729 PolarHBondContact O-N 3.01Å; G729-Q731 PolarHBondContact O-N 3.28Å
730	R	88.3	Confident	84.9	Confident	115 Å²	115	69.9 Å²	69.9	43%	0.434	34%	0.341	S	S	.	.			trans	-61.8	131.5	171.1	-176.7	-178.2	177.9	-163	-9.4	108.6	C725 D728 I732 D743	C725-R730 HydrophobicContact CB-CB 4.2Å; C725-R730 WeakPolarHBondContact CB-O 3.33Å; C725-R730 PolarHBondContact N-O 3.5Å; C725-R730 PolarHBondContact SG-O 3.35Å; C725-R730 VanDerWaalsContact SG-O 3.4Å; D728-R730 HydrophobicContact CB-CB 4.26Å; D728-R730 PolarHBondContact O-N 3.43Å; R730-I732 HydrophobicContact CG-CG2 3.84Å; R730-D743 IonicContact CZ-OD1 3.82Å; R730-D743 PolarHBondContact NH1-O 2.83Å; R730-D743 IonicContact NH1-OD1 4Å; R730-D743 PolarHBondContact NH1-OD1 2.97Å; R730-D743 IonicContact NH2-OD1 3.77Å; R730-D743 PolarHBondContact NH2-OD1 2.63Å
731	Q	88.5	Confident	85.8	Confident	126 Å²	126	70 Å²	70	59%	0.589	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.8	133.5	166.7	-51.2	-162.6	-85.8	0	0	108	M722 F723 N724 G729	M722-Q731 HydrophobicContact CB-CB 4.43Å; F723-Q731 WeakPolarHBondContact O-CA 3.15Å; N724-Q731 WeakPolarHBondContact OD1-CG 3.35Å; N724-Q731 PolarHBondContact OD1-NE2 2.67Å; G729-Q731 PolarHBondContact O-N 3.28Å
732	I	88.3	Confident	86.5	Confident	0 Å²	0	75 Å²	75	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	146.4	176.7	67.6	178.2	0	0	0	109.1	M722 F723 R730 F736 V737 D743 D749	M722-I732 CarbonylContact C-O 3.4Å; M722-I732 VanDerWaalsContact CA-O 3.28Å; M722-I732 WeakPolarHBondContact CA-O 3.31Å; F723-I732 HydrophobicContact CB-CD1 4.48Å; F723-I732 HydrophobicContact CB-CG1 3.86Å; F723-I732 HydrophobicContact CD1-CD1 4Å; F723-I732 HydrophobicContact CD1-CG1 4.1Å; F723-I732 HydrophobicContact CG-CG1 4.47Å; F723-I732 PolarHBondContact N-O 3.39Å; F723-I732 PolarHBondContact O-N 2.02Å; R730-I732 HydrophobicContact CG-CG2 3.84Å; I732-F736 HydrophobicContact CB-CD2 4.49Å; I732-F736 HydrophobicContact CD1-CB 4.3Å; I732-F736 WeakPolarHBondContact CD1-O 3.47Å; I732-V737 HydrophobicContact CD1-CG2 4.49Å; I732-D743 HydrophobicContact CD1-CB 3.92Å; I732-D743 HydrophobicContact CG2-CB 4.23Å; I732-D749 HydrophobicContact CD1-CB 3.91Å
733	P	87.8	Confident	86.9	Confident	16 Å²	16	73.6 Å²	73.6	10%	0.104	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-48.8	144.6	168.9	-29.4	36.1	0	0	0	111.8	E698 A735 F736	E698-P733 HydrophobicContact CG-CB 4.13Å; E698-P733 HydrophobicContact CG-CG 4.12Å; P733-A735 HydrophobicContact CB-CB 4.21Å; P733-A735 PolarHBondContact O-N 2.7Å; P733-F736 HydrophobicContact CB-CD2 4.23Å; P733-F736 HydrophobicContact CB-CE2 4.21Å; P733-F736 HydrophobicContact CG-CD2 4.04Å; P733-F736 HydrophobicContact CG-CE2 3.7Å; P733-F736 HydrophobicContact CG-CZ 4.19Å; P733-F736 PolarHBondContact O-N 2.8Å
734	M	84.3	Confident	87.1	Confident	28 Å²	28	71.5 Å²	71.5	14%	0.138	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-66.5	-16.8	175	-164.9	58.7	62.7	0	0	112.4	D696 Q719 D720 R721 F723 F736 V737	D696-M734 WeakPolarHBondContact O-CA 3.37Å; D696-M734 VanDerWaalsContact O-CB 3.31Å; D696-M734 WeakPolarHBondContact O-CB 3.32Å; D696-M734 PolarHBondContact O-N 3.34Å; Q719-M734 HydrophobicContact CG-CE 3.89Å; Q719-M734 HydrophobicContact CG-CG 3.85Å; Q719-M734 HydrophobicContact CG-SD 3.97Å; Q719-M734 PolarHBondContact NE2-SD 3.14Å; D720-M734 WeakPolarHBondContact O-CE 3.16Å; R721-M734 PolarHBondContact O-N 2.89Å; R721-M734 VanDerWaalsContact O-N 3.14Å; F723-M734 HydrophobicContact CB-CE 3.88Å; F723-M734 HydrophobicContact CB-SD 4.36Å; F723-M734 HydrophobicContact CD2-CE 4.47Å; M734-F736 PolarHBondContact O-N 3.23Å; M734-V737 HydrophobicContact SD-CB 4.17Å; M734-V737 HydrophobicContact SD-CG2 3.81Å
735	A	84.9	Confident	87.1	Confident	32 Å²	32	72 Å²	72	26%	0.264	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-55.4	-34	165.7	0	0	0	0	0	113.5	D696 E698 P733 V737	D696-A735 HydrophobicContact CB-CB 4.32Å; D696-A735 PolarHBondContact O-N 2.9Å; D696-A735 VanDerWaalsContact O-N 3.13Å; E698-A735 HydrophobicContact CB-CB 4.49Å; E698-A735 HydrophobicContact CG-CB 4.43Å; P733-A735 HydrophobicContact CB-CB 4.21Å; P733-A735 PolarHBondContact O-N 2.7Å; A735-V737 VanDerWaalsContact C-N 3.29Å; A735-V737 PolarHBondContact O-N 2.9Å
736	F	88.3	Confident	86.9	Confident	56 Å²	56	75.9 Å²	75.9	25%	0.246	38%	0.377	C	S	.	.	G	3₁₀ helix	trans	-94.9	42.5	-177.9	-48.8	-26.4	0	0	0	111.7	E698 I732 P733 M734 D743	E698-F736 HydrophobicContact CG-CE1 4.1Å; E698-F736 HydrophobicContact CG-CZ 3.81Å; I732-F736 HydrophobicContact CB-CD2 4.49Å; I732-F736 HydrophobicContact CD1-CB 4.3Å; I732-F736 WeakPolarHBondContact CD1-O 3.47Å; P733-F736 HydrophobicContact CB-CD2 4.23Å; P733-F736 HydrophobicContact CB-CE2 4.21Å; P733-F736 HydrophobicContact CG-CD2 4.04Å; P733-F736 HydrophobicContact CG-CE2 3.7Å; P733-F736 HydrophobicContact CG-CZ 4.19Å; P733-F736 PolarHBondContact O-N 2.8Å; M734-F736 PolarHBondContact O-N 3.23Å; F736-D743 HydrophobicContact CB-CB 4.43Å
737	V	87.6	Confident	87	Confident	14 Å²	14	68.3 Å²	68.3	9%	0.085	35%	0.345	C	S	.	.	S	Bend	trans	-132.2	115.5	176.7	-177.2	0	0	0	0	108.3	F723 I732 M734 A735 P784	F723-V737 HydrophobicContact CB-CG2 3.63Å; F723-V737 HydrophobicContact CD1-CG2 4.34Å; F723-V737 HydrophobicContact CD2-CG2 4.09Å; F723-V737 HydrophobicContact CG-CG2 3.79Å; I732-V737 HydrophobicContact CD1-CG2 4.49Å; M734-V737 HydrophobicContact SD-CB 4.17Å; M734-V737 HydrophobicContact SD-CG2 3.81Å; A735-V737 VanDerWaalsContact C-N 3.29Å; A735-V737 PolarHBondContact O-N 2.9Å; V737-P784 HydrophobicContact CB-CG 4.47Å; V737-P784 HydrophobicContact CG1-CG 4.07Å
738	C	87.8	Confident	87.3	Confident	13 Å²	13	61.2 Å²	61.2	9%	0.088	32%	0.319	C	S	.	.	S	Bend	trans	65.1	38.7	-172	-50.8	0	0	0	0	113.3	E750 C753 P784 A845	C738-E750 VanDerWaalsContact C-OE1 3.29Å; C738-E750 WeakPolarHBondContact CA-OE1 3.31Å; C738-E750 PolarHBondContact N-OE1 3.34Å; C738-C753 WeakPolarHBondContact CA-SG 3.04Å; C738-C753 HydrophobicContact CB-CB 3.75Å; C738-C753 WeakPolarHBondContact CB-SG 2.96Å; C738-C753 WeakPolarHBondContact SG-CA 3.29Å; C738-C753 WeakPolarHBondContact SG-CB 3.27Å; C738-C753 CovalentContact SG-SG 2.03Å; C738-C753 PolarHBondContact SG-SG 2.92Å; C738-P784 HydrophobicContact CB-CG 4.22Å; C738-A845 PolarHBondContact O-N 3.21Å
739	D	86.1	Confident	87.7	Confident	54 Å²	54	57.9 Å²	57.9	29%	0.289	30%	0.301	S	S	.	.	S	Bend	trans	-96.5	-18.4	173.2	79.6	0.5	0	0	0	113.4	D741 E750	D739-D741 PolarHBondContact OD1-N 2.98Å; D739-E750 PolarHBondContact N-OE1 3.12Å
740	K	86.8	Confident	88	Confident	144 Å²	144	57.3 Å²	57.3	63%	0.626	28%	0.282	S	S	*	.	S	Bend	trans	94	-2	178.8	-52.9	148.6	-167.4	152.8	0	117	E750	K740-E750 VanDerWaalsContact CA-CD 3.49Å; K740-E750 WeakPolarHBondContact CA-OE2 2.96Å; K740-E750 VanDerWaalsContact N-CD 3.29Å; K740-E750 PolarHBondContact N-OE1 3.37Å; K740-E750 PolarHBondContact N-OE2 2.86Å
741	D	89.2	Confident	87.9	Confident	119 Å²	119	57 Å²	57	64%	0.636	29%	0.289	S	S	*	.	S	Bend	trans	-87.7	-159.7	168.4	-85.1	-47.3	0	0	0	110.4	D739 E750	D739-D741 PolarHBondContact OD1-N 2.98Å; D741-E750 WeakPolarHBondContact O-CG 3Å
742	R	90.7	Very high	87.7	Confident	192 Å²	192	56 Å²	56	73%	0.725	29%	0.291	S	S	*	.			trans	-145.1	100	-179.5	-71.7	-170.6	-176.3	-171.9	-0.4	111.4	D749	R742-D749 WeakPolarHBondContact CA-OD2 3.38Å
743	D	90.3	Very high	87.7	Confident	42 Å²	42	58.4 Å²	58.4	23%	0.225	31%	0.307	C	S	.	.			trans	-102.9	-18.2	-175.1	-101.9	-82.9	0	0	0	114	R730 I732 F736 D749	R730-D743 IonicContact CZ-OD1 3.82Å; R730-D743 PolarHBondContact NH1-O 2.83Å; R730-D743 IonicContact NH1-OD1 4Å; R730-D743 PolarHBondContact NH1-OD1 2.97Å; R730-D743 IonicContact NH2-OD1 3.77Å; R730-D743 PolarHBondContact NH2-OD1 2.63Å; I732-D743 HydrophobicContact CD1-CB 3.92Å; I732-D743 HydrophobicContact CG2-CB 4.23Å; F736-D743 HydrophobicContact CB-CB 4.43Å; D743-D749 PolarHBondContact N-OD2 2.95Å
744	C	90.7	Very high	87.8	Confident	2 Å²	2	58.5 Å²	58.5	1%	0.014	31%	0.31	C	S	.	.	S	Bend	trans	-90.8	148.5	158.9	-55	0	0	0	0	110.7	C725 D746 G747 E748 D749	C725-C744 VanDerWaalsContact CA-SG 3.54Å; C725-C744 HydrophobicContact CB-CB 3.67Å; C725-C744 WeakPolarHBondContact CB-SG 3.45Å; C725-C744 WeakPolarHBondContact SG-CA 3.18Å; C725-C744 WeakPolarHBondContact SG-CB 3.47Å; C725-C744 CovalentContact SG-SG 2.03Å; C725-C744 PolarHBondContact SG-SG 3.14Å; C744-D746 PolarHBondContact O-N 2.68Å; C744-D746 VanDerWaalsContact O-N 3.07Å; C744-G747 PolarHBondContact O-N 2.87Å; C744-E748 HydrophobicContact CB-CG 3.55Å; C744-D749 WeakPolarHBondContact CB-OD1 3.29Å; C744-D749 PolarHBondContact N-OD1 3.03Å
745	S	86.8	Confident	88.1	Confident	93 Å²	93	60.8 Å²	60.8	65%	0.65	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-22.8	-171	-54.7	0	0	0	0	115.2	D728	D728-S745 VanDerWaalsContact CG-OG 3.31Å; D728-S745 WeakPolarHBondContact OD2-CB 2.98Å; D728-S745 PolarHBondContact OD2-N 3.44Å; D728-S745 VanDerWaalsContact OD2-N 3.08Å; D728-S745 PolarHBondContact OD2-OG 2.81Å
746	D	84.6	Confident	88.4	Confident	85 Å²	85	59.6 Å²	59.6	46%	0.455	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-7.5	173.4	-79.1	-14.7	0	0	0	113.3	R727 C744	R727-D746 WeakPolarHBondContact CD-OD2 3.33Å; R727-D746 IonicContact CZ-OD1 2.81Å; R727-D746 IonicContact CZ-OD2 2.71Å; R727-D746 IonicContact NE-OD2 3.18Å; R727-D746 IonicContact NH1-OD1 2.71Å; R727-D746 PolarHBondContact NH1-OD1 2.7Å; R727-D746 IonicContact NH1-OD2 2.67Å; R727-D746 PolarHBondContact NH1-OD2 3.4Å; C744-D746 PolarHBondContact O-N 2.68Å; C744-D746 VanDerWaalsContact O-N 3.07Å
747	G	88.4	Confident	88.7	Confident	4 Å²	4	62.7 Å²	62.7	4%	0.041	33%	0.333	C	S	.	.			trans	71.3	36.2	-170.8	0	0	0	0	0	113.5	C744 D749 E750	C744-G747 PolarHBondContact O-N 2.87Å; G747-D749 VanDerWaalsContact C-N 3.3Å; G747-D749 VanDerWaalsContact CA-OD1 3.24Å; G747-D749 WeakPolarHBondContact CA-OD1 3.21Å; G747-E750 PolarHBondContact O-N 3.18Å
748	E	89.9	Confident	88.9	Confident	19 Å²	19	63.7 Å²	63.7	9%	0.089	34%	0.338	C	S	.	.			trans	-76.9	-15.8	-178.2	60	170.5	132.4	0	0	114.7	F723 C725 K726 R727 C744 L751	F723-E748 HydrophobicContact CE1-CG 4.47Å; C725-E748 VanDerWaalsContact C-OE1 3.29Å; C725-E748 WeakPolarHBondContact CA-OE1 3.27Å; K726-E748 VanDerWaalsContact CB-OE2 3.28Å; K726-E748 WeakPolarHBondContact CB-OE2 3.39Å; K726-E748 WeakPolarHBondContact CD-OE2 3.3Å; K726-E748 WeakPolarHBondContact CG-OE2 3.36Å; K726-E748 VanDerWaalsContact N-CD 3.28Å; K726-E748 PolarHBondContact N-OE1 2.96Å; K726-E748 PolarHBondContact N-OE2 2.79Å; K726-E748 IonicContact NZ-OE2 3.67Å; K726-E748 PolarHBondContact NZ-OE2 2.87Å; R727-E748 PolarHBondContact N-OE1 3.36Å; R727-E748 VanDerWaalsContact N-OE1 3.14Å; C744-E748 HydrophobicContact CB-CG 3.55Å; E748-L751 HydrophobicContact CB-CD1 4.31Å; E748-L751 PolarHBondContact O-N 2.79Å
749	D	88.5	Confident	89.2	Confident	2 Å²	2	65.7 Å²	65.7	1%	0.011	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-36.8	165.5	41.5	-53.4	0	0	0	112.8	F723 I732 R742 D743 C744 G747	F723-D749 HydrophobicContact CD1-CB 4.5Å; F723-D749 HydrophobicContact CE1-CB 4.18Å; I732-D749 HydrophobicContact CD1-CB 3.91Å; R742-D749 WeakPolarHBondContact CA-OD2 3.38Å; D743-D749 PolarHBondContact N-OD2 2.95Å; C744-D749 WeakPolarHBondContact CB-OD1 3.29Å; C744-D749 PolarHBondContact N-OD1 3.03Å; G747-D749 VanDerWaalsContact C-N 3.3Å; G747-D749 VanDerWaalsContact CA-OD1 3.24Å; G747-D749 WeakPolarHBondContact CA-OD1 3.21Å
750	E	90.8	Very high	89.3	Confident	48 Å²	48	71.1 Å²	71.1	22%	0.224	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	8.1	175.3	-71.9	-59.8	123.4	0	0	113.8	C738 D739 K740 D741 G747	C738-E750 VanDerWaalsContact C-OE1 3.29Å; C738-E750 WeakPolarHBondContact CA-OE1 3.31Å; C738-E750 PolarHBondContact N-OE1 3.34Å; D739-E750 PolarHBondContact N-OE1 3.12Å; K740-E750 VanDerWaalsContact CA-CD 3.49Å; K740-E750 WeakPolarHBondContact CA-OE2 2.96Å; K740-E750 VanDerWaalsContact N-CD 3.29Å; K740-E750 PolarHBondContact N-OE1 3.37Å; K740-E750 PolarHBondContact N-OE2 2.86Å; D741-E750 WeakPolarHBondContact O-CG 3Å; G747-E750 PolarHBondContact O-N 3.18Å
751	L	84.7	Confident	89.2	Confident	109 Å²	109	65.8 Å²	65.8	57%	0.571	36%	0.359	S	S	*	.	S	Bend	trans	-92.6	143.4	175.8	-62.4	-179.3	0	0	0	110.9	E748 C753	E748-L751 HydrophobicContact CB-CD1 4.31Å; E748-L751 PolarHBondContact O-N 2.79Å; L751-C753 PolarHBondContact O-N 3.43Å
752	T	85.7	Confident	89	Confident	104 Å²	104	72.2 Å²	72.2	64%	0.638	37%	0.374	S	S	*	.	S	Bend	trans	69	5.2	-179.7	71.1	0	0	0	0	116.7	A754 N783	T752-A754 PolarHBondContact O-N 3.01Å; T752-N783 PolarHBondContact O-ND2 2.96Å; T752-N783 PolarHBondContact OG1-ND2 3.43Å; T752-N783 VanDerWaalsContact OG1-ND2 3.12Å
753	C	88.3	Confident	88.8	Confident	50 Å²	50	66.2 Å²	66.2	34%	0.338	36%	0.359	S	S	.	.			trans	-50.7	133.1	171.1	-59.2	0	0	0	0	112.7	C738 L751	C738-C753 WeakPolarHBondContact CA-SG 3.04Å; C738-C753 HydrophobicContact CB-CB 3.75Å; C738-C753 WeakPolarHBondContact CB-SG 2.96Å; C738-C753 WeakPolarHBondContact SG-CA 3.29Å; C738-C753 WeakPolarHBondContact SG-CB 3.27Å; C738-C753 CovalentContact SG-SG 2.03Å; C738-C753 PolarHBondContact SG-SG 2.92Å; L751-C753 PolarHBondContact O-N 3.43Å
754	A	90.4	Very high	88.8	Confident	18 Å²	18	67.6 Å²	67.6	15%	0.149	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	132	-179.7	0	0	0	0	0	111.5	T752 N783 M817 S843	T752-A754 PolarHBondContact O-N 3.01Å; A754-N783 HydrophobicContact CB-CB 4.05Å; A754-N783 PolarHBondContact N-O 3.36Å; A754-N783 PolarHBondContact O-N 3.02Å; A754-N783 VanDerWaalsContact O-N 3.08Å; A754-N783 VanDerWaalsContact O-O 3.08Å; A754-M817 HydrophobicContact CB-CE 4.04Å; A754-M817 HydrophobicContact CB-SD 3.33Å; A754-M817 WeakPolarHBondContact CB-SD 3.28Å; A754-S843 PolarHBondContact O-OG 3.33Å; A754-S843 VanDerWaalsContact O-OG 3.05Å
755	P	89.7	Confident	88.8	Confident	77 Å²	77	70.7 Å²	70.7	50%	0.5	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	154.8	178.9	30	-35.9	0	0	0	110.9	M757 T846	P755-M757 PolarHBondContact O-N 3.2Å; P755-T846 WeakPolarHBondContact CA-OG1 3.03Å
756	P	91.4	Very high	89	Confident	7 Å²	7	68.9 Å²	68.9	5%	0.045	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	132.6	178.8	30.5	-31	0	0	0	109.4	V780 T781 G841 T846 R847 A848	P756-V780 HydrophobicContact CB-CG1 4.06Å; P756-T781 CarbonylContact C-O 3.55Å; P756-T781 VanDerWaalsContact CA-O 3.23Å; P756-T781 WeakPolarHBondContact CA-O 3.35Å; P756-G841 VanDerWaalsContact CG-O 3.29Å; P756-G841 WeakPolarHBondContact CG-O 3.28Å; P756-T846 VanDerWaalsContact CD-OG1 3.24Å; P756-T846 WeakPolarHBondContact CD-OG1 3.49Å; P756-R847 VanDerWaalsContact CG-C 3.41Å; P756-A848 HydrophobicContact CB-CB 4.27Å; P756-A848 HydrophobicContact CG-CB 3.89Å; P756-A848 WeakPolarHBondContact O-CB 3.04Å
757	M	93.5	Very high	89.2	Confident	120 Å²	120	67.7 Å²	67.7	59%	0.591	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.5	119.3	175.4	-64.2	-176	67.2	0	0	108.8	P755 T781	P755-M757 PolarHBondContact O-N 3.2Å; M757-T781 PolarHBondContact N-O 3.31Å; M757-T781 PolarHBondContact O-N 3.28Å; M757-T781 PolarHBondContact O-OG1 3.4Å
758	I	93.6	Very high	89.3	Confident	36 Å²	36	68.6 Å²	68.6	19%	0.185	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	132	-178.6	-51.8	-171.3	0	0	0	108.9	E779 V780 A848	I758-E779 WeakPolarHBondContact CA-O 3.38Å; I758-V780 HydrophobicContact CD1-CG2 4.27Å; I758-V780 HydrophobicContact CG1-CG1 4.14Å; I758-V780 HydrophobicContact CG1-CG2 3.96Å; I758-V780 HydrophobicContact CG2-CG2 4.4Å; I758-A848 HydrophobicContact CD1-CB 4.33Å; I758-A848 HydrophobicContact CG1-CB 4.18Å
759	A	92.2	Very high	89.3	Confident	54 Å²	54	75.9 Å²	75.9	45%	0.446	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-70.3	144	176.4	0	0	0	0	0	111.4	E779	A759-E779 HydrophobicContact CB-CB 4.14Å; A759-E779 PolarHBondContact N-O 3.17Å
760	E	88.5	Confident	89.3	Confident	168 Å²	168	81.7 Å²	81.7	79%	0.785	41%	0.411	S	S	*	.	P	Polyproline II helix	trans	-65.4	130	176.5	-67.2	-171.6	156.6	0	0	111.1
761	P	86.1	Confident	89.2	Confident	33 Å²	33	81.2 Å²	81.2	21%	0.214	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-71.4	135.1	-178.7	29.4	-35.2	0	0	0	110.9	T763 T764 L853	P761-T763 PolarHBondContact O-N 2.92Å; P761-T763 VanDerWaalsContact O-N 3.1Å; P761-T764 HydrophobicContact CG-CG2 3.92Å; P761-L853 HydrophobicContact CB-CD2 3.75Å; P761-L853 HydrophobicContact CG-CD2 3.68Å
762	R	84.6	Confident	89.6	Confident	254 Å²	254	79.2 Å²	79.2	96%	0.958	41%	0.409	S	S	*	.	S	Bend	trans	-63.2	-15.6	176.4	-62.1	-174.4	-176.9	-166.5	1.4	114
763	T	87.1	Confident	89.9	Confident	66 Å²	66	78.1 Å²	78.1	41%	0.405	40%	0.402	S	S	.	.			trans	-150.4	117	-175.8	-56.5	0	0	0	0	108.1	P761 R765 Y766	P761-T763 PolarHBondContact O-N 2.92Å; P761-T763 VanDerWaalsContact O-N 3.1Å; T763-R765 WeakPolarHBondContact CG2-O 3.32Å; T763-Y766 HydrophobicContact CG2-CD2 4.42Å; T763-Y766 HydrophobicContact CG2-CE1 4.27Å; T763-Y766 HydrophobicContact CG2-CE2 4.11Å; T763-Y766 VanDerWaalsContact O-CE2 3.3Å; T763-Y766 WeakPolarHBondContact O-CE2 3.17Å; T763-Y766 PolarHBondContact O-OH 2.64Å
764	T	89.4	Confident	90.1	Very high	71 Å²	71	76 Å²	76	44%	0.436	39%	0.387	S	S	.	.	S	Bend	trans	-97.6	-6.3	176.9	48.6	0	0	0	0	113	P761 L853 V854	P761-T764 HydrophobicContact CG-CG2 3.92Å; T764-L853 HydrophobicContact CG2-CD2 4.48Å; T764-L853 CarbonylContact O-C 3.6Å; T764-L853 WeakPolarHBondContact O-CA 3.37Å; T764-V854 PolarHBondContact O-N 2.73Å
765	R	90.4	Very high	90.3	Very high	67 Å²	67	78.5 Å²	78.5	25%	0.253	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	117.2	-174	-170.1	-178.1	-176.6	-70.4	-7.2	110.7	E554 E556 T763 S767 V854	E554-R765 VanDerWaalsContact CD-NE 3.34Å; E554-R765 IonicContact OE1-CZ 3.28Å; E554-R765 IonicContact OE1-NE 2.71Å; E554-R765 PolarHBondContact OE1-NE 2.83Å; E554-R765 IonicContact OE1-NH2 3.34Å; E554-R765 PolarHBondContact OE1-NH2 2.79Å; E554-R765 IonicContact OE2-NE 2.92Å; E554-R765 PolarHBondContact OE2-NE 2.86Å; E556-R765 IonicContact OE1-CZ 3.63Å; E556-R765 IonicContact OE1-NH2 3.13Å; E556-R765 PolarHBondContact OE1-NH2 2.98Å; E556-R765 IonicContact OE2-NH2 2.91Å; E556-R765 PolarHBondContact OE2-NH2 2.88Å; T763-R765 WeakPolarHBondContact CG2-O 3.32Å; R765-S767 PolarHBondContact NH1-OG 3.14Å; R765-V854 WeakPolarHBondContact CA-O 3.13Å
766	Y	91.9	Very high	90.5	Very high	55 Å²	55	74.9 Å²	74.9	22%	0.216	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	135.7	-179.2	-64.6	-99.8	0	0	0	109.2	T763 L776 L853 V854 M856	T763-Y766 HydrophobicContact CG2-CD2 4.42Å; T763-Y766 HydrophobicContact CG2-CE1 4.27Å; T763-Y766 HydrophobicContact CG2-CE2 4.11Å; T763-Y766 VanDerWaalsContact O-CE2 3.3Å; T763-Y766 WeakPolarHBondContact O-CE2 3.17Å; T763-Y766 PolarHBondContact O-OH 2.64Å; Y766-L776 HydrophobicContact CD1-CD2 4.17Å; Y766-L776 HydrophobicContact CD2-CD2 3.75Å; Y766-L776 HydrophobicContact CE1-CD2 3.91Å; Y766-L776 HydrophobicContact CE2-CD2 3.49Å; Y766-L776 VanDerWaalsContact CE2-CD2 3.49Å; Y766-L776 HydrophobicContact CG-CD2 4.09Å; Y766-L853 HydrophobicContact CE2-CB 4.38Å; Y766-V854 PolarHBondContact N-O 2.59Å; Y766-M856 PolarHBondContact O-N 3.07Å
767	S	89.1	Confident	90.6	Very high	60 Å²	60	77.5 Å²	77.5	42%	0.42	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	117.9	174	-66.3	0	0	0	0	108.6	R765 M856	R765-S767 PolarHBondContact NH1-OG 3.14Å; S767-M856 WeakPolarHBondContact CA-O 3.08Å
768	V	90.2	Very high	90.6	Very high	22 Å²	22	72 Å²	72	13%	0.133	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	155.7	-171.6	-69.9	0	0	0	0	111.4	D772 V774 V829 V855 M856 I857 G858	V768-D772 HydrophobicContact CB-CB 4.16Å; V768-V774 HydrophobicContact CB-CG2 4.18Å; V768-V774 HydrophobicContact CG1-CG2 3.62Å; V768-V774 HydrophobicContact CG2-CG2 3.71Å; V768-V829 HydrophobicContact CG2-CG1 4.05Å; V768-V855 HydrophobicContact CG2-CG1 4.27Å; V768-M856 PolarHBondContact N-O 2.86Å; V768-I857 CarbonylContact O-C 3.57Å; V768-I857 WeakPolarHBondContact O-CA 3.08Å; V768-G858 PolarHBondContact O-N 2.71Å
769	R	89.8	Confident	90.7	Very high	173 Å²	173	74.2 Å²	74.2	65%	0.653	38%	0.376	S	S	*	.			trans	-88.6	163.3	176.1	-63.8	-180	176.5	164.4	1.7	110.9	G771 D772	R769-G771 PolarHBondContact O-N 3.46Å; R769-D772 WeakPolarHBondContact CB-OD2 3.23Å; R769-D772 PolarHBondContact N-OD2 2.74Å; R769-D772 WeakPolarHBondContact O-CB 3.48Å; R769-D772 PolarHBondContact O-N 3.22Å
770	R	88.2	Confident	90.7	Very high	123 Å²	123	71.6 Å²	71.6	46%	0.464	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	128.7	173.5	-62.9	177.5	-176.6	170.2	3.1	109.6	V829 I857	R770-V829 WeakPolarHBondContact CA-O 3.17Å; R770-I857 HydrophobicContact CG-CG2 3.69Å
771	G	88.5	Confident	91	Very high	38 Å²	38	65.6 Å²	65.6	39%	0.392	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.3	-12.1	-175.9	0	0	0	0	0	115.4	R769 N828 V829	R769-G771 PolarHBondContact O-N 3.46Å; G771-N828 WeakPolarHBondContact CA-OD1 3.47Å; G771-V829 PolarHBondContact N-O 3.44Å
772	D	92.1	Very high	91.1	Very high	68 Å²	68	64 Å²	64	36%	0.364	32%	0.319	S	S	.	.			trans	-64.5	174.1	176.2	-74	-11.3	0	0	0	112.1	V768 R769 N828 V829	V768-D772 HydrophobicContact CB-CB 4.16Å; R769-D772 WeakPolarHBondContact CB-OD2 3.23Å; R769-D772 PolarHBondContact N-OD2 2.74Å; R769-D772 WeakPolarHBondContact O-CB 3.48Å; R769-D772 PolarHBondContact O-N 3.22Å; D772-N828 WeakPolarHBondContact O-CA 3.43Å; D772-N828 PolarHBondContact O-N 3.03Å; D772-N828 VanDerWaalsContact O-N 3.13Å; D772-V829 PolarHBondContact O-N 2.89Å
773	T	93	Very high	91.3	Very high	81 Å²	81	53.5 Å²	53.5	50%	0.497	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	117.9	170.6	-62.2	0	0	0	0	109.9	T825 I826	T773-T825 HydrophobicContact CG2-CG2 3.58Å; T773-I826 CarbonylContact C-O 3.58Å; T773-I826 VanDerWaalsContact CA-O 3.28Å; T773-I826 WeakPolarHBondContact CA-O 3.36Å
774	V	92.6	Very high	91.2	Very high	4 Å²	4	50.8 Å²	50.8	2%	0.024	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	141.6	173.5	170	0	0	0	0	109.2	V768 L776 T825 I826 V829 V855	V768-V774 HydrophobicContact CB-CG2 4.18Å; V768-V774 HydrophobicContact CG1-CG2 3.62Å; V768-V774 HydrophobicContact CG2-CG2 3.71Å; V774-L776 HydrophobicContact CG1-CD2 3.58Å; V774-L776 HydrophobicContact CG1-CG 3.8Å; V774-T825 CarbonylContact O-C 3.56Å; V774-T825 WeakPolarHBondContact O-CA 3.31Å; V774-I826 HydrophobicContact CB-CB 4.24Å; V774-I826 HydrophobicContact CB-CD1 4.37Å; V774-I826 HydrophobicContact CG1-CD1 4.27Å; V774-I826 PolarHBondContact N-O 2.8Å; V774-I826 PolarHBondContact O-N 2.82Å; V774-V829 HydrophobicContact CB-CG2 4.38Å; V774-V829 HydrophobicContact CG2-CG2 3.86Å; V774-V855 HydrophobicContact CG1-CG2 4.45Å; V774-V855 HydrophobicContact CG2-CG1 4.2Å
775	V	94	Very high	91	Very high	72 Å²	72	48.6 Å²	48.6	44%	0.436	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	112.4	170.9	-176.4	0	0	0	0	108.5	V777 T823 T825	V775-V777 HydrophobicContact CG1-CG2 4.35Å; V775-T823 HydrophobicContact CG1-CG2 3.5Å; V775-T825 HydrophobicContact CG2-CG2 4.29Å
776	L	94.4	Very high	90.9	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	141.1	174.2	-52.1	-177.9	0	0	0	109.1	Y766 V774 W790 T823 L824 Y837 L853 V855	Y766-L776 HydrophobicContact CD1-CD2 4.17Å; Y766-L776 HydrophobicContact CD2-CD2 3.75Å; Y766-L776 HydrophobicContact CE1-CD2 3.91Å; Y766-L776 HydrophobicContact CE2-CD2 3.49Å; Y766-L776 VanDerWaalsContact CE2-CD2 3.49Å; Y766-L776 HydrophobicContact CG-CD2 4.09Å; V774-L776 HydrophobicContact CG1-CD2 3.58Å; V774-L776 HydrophobicContact CG1-CG 3.8Å; L776-W790 HydrophobicContact CB-CH2 3.59Å; L776-W790 HydrophobicContact CB-CZ2 4.35Å; L776-W790 HydrophobicContact CB-CZ3 3.82Å; L776-W790 HydrophobicContact CD1-CZ3 4.18Å; L776-T823 CarbonylContact O-C 3.52Å; L776-T823 WeakPolarHBondContact O-CA 3.48Å; L776-L824 HydrophobicContact CB-CB 4.4Å; L776-L824 HydrophobicContact CD1-CD2 4.38Å; L776-L824 PolarHBondContact N-O 3.39Å; L776-L824 PolarHBondContact O-N 3.09Å; L776-Y837 HydrophobicContact CD1-CD1 4.11Å; L776-Y837 HydrophobicContact CD1-CD2 4.09Å; L776-Y837 HydrophobicContact CD1-CG 3.65Å; L776-L853 HydrophobicContact CB-CD1 4.09Å; L776-L853 HydrophobicContact CD1-CD1 4.19Å; L776-L853 HydrophobicContact CD2-CD1 4.23Å; L776-L853 HydrophobicContact CG-CD1 4.39Å; L776-V855 HydrophobicContact CD1-CG2 4.35Å; L776-V855 HydrophobicContact CD2-CG2 4.38Å
777	V	93.9	Very high	90.6	Very high	62 Å²	62	46 Å²	46	38%	0.376	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	136.7	-176.8	-177	0	0	0	0	109.7	V775 E779 V821 S822 T823	V775-V777 HydrophobicContact CG1-CG2 4.35Å; V777-E779 HydrophobicContact CG1-CG 4.34Å; V777-V821 HydrophobicContact CG1-CG1 3.95Å; V777-S822 WeakPolarHBondContact CA-O 3Å; V777-T823 HydrophobicContact CG2-CG2 4.31Å
778	C	94	Very high	90.7	Very high	5 Å²	5	43.2 Å²	43.2	3%	0.034	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	115.9	-179.9	171.7	0	0	0	0	108.7	V780 W790 S822 C839	C778-V780 VanDerWaalsContact SG-CG2 3.58Å; C778-W790 HydrophobicContact CB-CH2 3.72Å; C778-W790 HydrophobicContact CB-CZ2 3.47Å; C778-W790 VanDerWaalsContact CB-CZ2 3.47Å; C778-S822 PolarHBondContact N-O 2.03Å; C778-S822 PolarHBondContact O-N 2.78Å; C778-C839 HydrophobicContact CB-CB 3.71Å; C778-C839 WeakPolarHBondContact CB-SG 2.97Å; C778-C839 WeakPolarHBondContact SG-CB 2.99Å; C778-C839 CovalentContact SG-SG 2.03Å; C778-C839 PolarHBondContact SG-SG 2.94Å
779	E	94.1	Very high	90.6	Very high	82 Å²	82	42.8 Å²	42.8	38%	0.383	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	120.1	177.8	-53.7	-163.3	144.5	0	0	109.4	I758 A759 V777 V821	I758-E779 WeakPolarHBondContact CA-O 3.38Å; A759-E779 HydrophobicContact CB-CB 4.14Å; A759-E779 PolarHBondContact N-O 3.17Å; V777-E779 HydrophobicContact CG1-CG 4.34Å; E779-V821 HydrophobicContact CB-CG2 4.5Å; E779-V821 HydrophobicContact CG-CG1 4.22Å; E779-V821 HydrophobicContact CG-CG2 3.97Å
780	V	93.5	Very high	90.7	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	125	-175.3	-171.6	0	0	0	0	109.8	P756 I758 C778 P786 V788 T819 V820	P756-V780 HydrophobicContact CB-CG1 4.06Å; I758-V780 HydrophobicContact CD1-CG2 4.27Å; I758-V780 HydrophobicContact CG1-CG1 4.14Å; I758-V780 HydrophobicContact CG1-CG2 3.96Å; I758-V780 HydrophobicContact CG2-CG2 4.4Å; C778-V780 VanDerWaalsContact SG-CG2 3.58Å; V780-P786 HydrophobicContact CB-CB 4.25Å; V780-P786 HydrophobicContact CG1-CB 3.62Å; V780-P786 HydrophobicContact CG1-CG 4.01Å; V780-V788 HydrophobicContact CB-CG2 3.83Å; V780-V788 HydrophobicContact CG1-CG2 4.46Å; V780-V788 HydrophobicContact CG2-CB 4.42Å; V780-V788 HydrophobicContact CG2-CG1 3.93Å; V780-V788 HydrophobicContact CG2-CG2 3.55Å; V780-T819 CarbonylContact O-C 3.41Å; V780-T819 WeakPolarHBondContact O-CA 3.43Å; V780-V820 PolarHBondContact N-O 2.9Å; V780-V820 PolarHBondContact O-N 2.75Å
781	T	93.4	Very high	90.7	Very high	42 Å²	42	30.4 Å²	30.4	26%	0.258	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	153	173.2	62.3	0	0	0	0	110.4	P756 M757 P818 T819	P756-T781 CarbonylContact C-O 3.55Å; P756-T781 VanDerWaalsContact CA-O 3.23Å; P756-T781 WeakPolarHBondContact CA-O 3.35Å; M757-T781 PolarHBondContact N-O 3.31Å; M757-T781 PolarHBondContact O-N 3.28Å; M757-T781 PolarHBondContact O-OG1 3.4Å; T781-P818 WeakPolarHBondContact CA-O 3.33Å; T781-T819 HydrophobicContact CG2-CG2 3.82Å
782	G	89.9	Confident	90.8	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	164.3	172.9	179.3	0	0	0	0	0	111.5	P784 P818	G782-P784 CarbonylContact C-O 3.6Å; G782-P818 PolarHBondContact N-O 3.3Å; G782-P818 WeakPolarHBondContact O-CD 3.46Å; G782-P818 VanDerWaalsContact O-CG 3.27Å; G782-P818 WeakPolarHBondContact O-CG 3.05Å
783	N	87.4	Confident	90.7	Very high	32 Å²	32	27.4 Å²	27.4	17%	0.171	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	118.5	175.8	-171.8	31.9	0	0	0	109.5	T752 A754 S843	T752-N783 PolarHBondContact O-ND2 2.96Å; T752-N783 PolarHBondContact OG1-ND2 3.43Å; T752-N783 VanDerWaalsContact OG1-ND2 3.12Å; A754-N783 HydrophobicContact CB-CB 4.05Å; A754-N783 PolarHBondContact N-O 3.36Å; A754-N783 PolarHBondContact O-N 3.02Å; A754-N783 VanDerWaalsContact O-N 3.08Å; A754-N783 VanDerWaalsContact O-O 3.08Å; N783-S843 PolarHBondContact N-OG 2.03Å; N783-S843 PolarHBondContact O-OG 3.42Å
784	P	84.9	Confident	90.2	Very high	10 Å²	10	24.3 Å²	24.3	7%	0.065	13%	0.127	C	C	.	.	S	Bend	cis	-64.6	175.4	8.7	-19.8	34.3	0	0	0	115.1	V737 C738 G782 P786 S843	V737-P784 HydrophobicContact CB-CG 4.47Å; V737-P784 HydrophobicContact CG1-CG 4.07Å; C738-P784 HydrophobicContact CB-CG 4.22Å; G782-P784 CarbonylContact C-O 3.6Å; P784-P786 VanDerWaalsContact O-CD 3.32Å; P784-P786 WeakPolarHBondContact O-CD 3.06Å; P784-P786 VanDerWaalsContact O-N 3.17Å; P784-S843 WeakPolarHBondContact CD-OG 3.27Å; P784-S843 PolarHBondContact O-OG 3.45Å
785	V	86	Confident	89.6	Confident	25 Å²	25	25.4 Å²	25.4	15%	0.152	14%	0.139	C	C	.	.	P	Polyproline II helix	trans	-56.3	119.7	-175	-175.2	0	0	0	0	110.5	Q719 Y787 P818 V820	Q719-V785 HydrophobicContact CB-CG2 4.38Å; V785-Y787 PolarHBondContact O-N 2.59Å; V785-P818 HydrophobicContact CB-CG 4.43Å; V785-P818 HydrophobicContact CG2-CB 4.22Å; V785-P818 HydrophobicContact CG2-CG 3.88Å; V785-V820 HydrophobicContact CG1-CG2 3.65Å
786	P	87.8	Confident	89.1	Confident	5 Å²	5	23.4 Å²	23.4	3%	0.032	13%	0.127	C	C	.	.	P	Polyproline II helix	trans	-66.1	130.5	-170	-26	34.8	0	0	0	114.6	V780 P784 V820 L842	V780-P786 HydrophobicContact CB-CB 4.25Å; V780-P786 HydrophobicContact CG1-CB 3.62Å; V780-P786 HydrophobicContact CG1-CG 4.01Å; P784-P786 VanDerWaalsContact O-CD 3.32Å; P784-P786 WeakPolarHBondContact O-CD 3.06Å; P784-P786 VanDerWaalsContact O-N 3.17Å; P786-V820 VanDerWaalsContact O-CG2 3.31Å; P786-V820 WeakPolarHBondContact O-CG2 2.99Å; P786-L842 CarbonylContact C-O 3.47Å; P786-L842 WeakPolarHBondContact CA-O 3.34Å
787	Y	86.4	Confident	88.8	Confident	62 Å²	62	24.9 Å²	24.9	24%	0.243	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	127.8	167	-167.3	-90.7	0	0	0	109.7	V691 H692 V785 I789 L842	V691-Y787 HydrophobicContact CB-CD1 4.46Å; V691-Y787 HydrophobicContact CB-CE1 3.71Å; V691-Y787 HydrophobicContact CG2-CD1 3.95Å; V691-Y787 HydrophobicContact CG2-CE1 3.58Å; H692-Y787 HydrophobicContact CB-CD1 4.43Å; H692-Y787 HydrophobicContact CB-CG 4.22Å; V785-Y787 PolarHBondContact O-N 2.59Å; Y787-I789 HydrophobicContact CD1-CD1 4.28Å; Y787-I789 HydrophobicContact CD1-CG1 3.82Å; Y787-I789 HydrophobicContact CE1-CD1 4.42Å; Y787-I789 HydrophobicContact CE1-CG1 3.74Å; Y787-L842 PolarHBondContact N-O 2.86Å; Y787-L842 PolarHBondContact O-N 2.76Å
788	V	89.5	Confident	88.5	Confident	2 Å²	2	24 Å²	24	1%	0.012	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	131.5	-174.2	-168.4	0	0	0	0	111.5	V780 N808 V820 S822 C839 E840	V780-V788 HydrophobicContact CB-CG2 3.83Å; V780-V788 HydrophobicContact CG1-CG2 4.46Å; V780-V788 HydrophobicContact CG2-CB 4.42Å; V780-V788 HydrophobicContact CG2-CG1 3.93Å; V780-V788 HydrophobicContact CG2-CG2 3.55Å; V788-N808 PolarHBondContact O-ND2 2.84Å; V788-V820 HydrophobicContact CG2-CB 4.02Å; V788-V820 HydrophobicContact CG2-CG1 3.77Å; V788-S822 VanDerWaalsContact CG1-CB 3.47Å; V788-C839 HydrophobicContact CG1-CB 4.22Å; V788-E840 WeakPolarHBondContact CA-O 3.25Å
789	I	89.3	Confident	88	Confident	13 Å²	13	31.3 Å²	31.3	7%	0.067	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	150.7	-175.6	-56.6	158.8	0	0	0	108.8	P671 L672 V691 Y787 C839 E840 L842	P671-I789 HydrophobicContact CB-CG2 3.71Å; L672-I789 HydrophobicContact CD2-CD1 3.48Å; L672-I789 VanDerWaalsContact CD2-CD1 3.48Å; L672-I789 HydrophobicContact CG-CD1 4.38Å; V691-I789 HydrophobicContact CG2-CD1 3.45Å; V691-I789 VanDerWaalsContact CG2-CD1 3.45Å; V691-I789 HydrophobicContact CG2-CG1 3.95Å; Y787-I789 HydrophobicContact CD1-CD1 4.28Å; Y787-I789 HydrophobicContact CD1-CG1 3.82Å; Y787-I789 HydrophobicContact CE1-CD1 4.42Å; Y787-I789 HydrophobicContact CE1-CG1 3.74Å; I789-C839 CarbonylContact O-C 3.39Å; I789-C839 WeakPolarHBondContact O-CA 3.36Å; I789-C839 WeakPolarHBondContact O-CB 3.11Å; I789-E840 HydrophobicContact CB-CB 4.42Å; I789-E840 PolarHBondContact N-O 3.3Å; I789-E840 PolarHBondContact O-N 3.35Å; I789-L842 HydrophobicContact CD1-CD1 3.65Å; I789-L842 HydrophobicContact CD1-CG 4.21Å
790	W	90.8	Very high	87.6	Confident	5 Å²	5	29.8 Å²	29.8	2%	0.019	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	140.2	170.5	-72.7	88	0	0	0	111.5	L776 C778 L797 I806 S822 L824 C839 L853	L776-W790 HydrophobicContact CB-CH2 3.59Å; L776-W790 HydrophobicContact CB-CZ2 4.35Å; L776-W790 HydrophobicContact CB-CZ3 3.82Å; L776-W790 HydrophobicContact CD1-CZ3 4.18Å; C778-W790 HydrophobicContact CB-CH2 3.72Å; C778-W790 HydrophobicContact CB-CZ2 3.47Å; C778-W790 VanDerWaalsContact CB-CZ2 3.47Å; W790-L797 HydrophobicContact CB-CD1 3.91Å; W790-L797 HydrophobicContact CB-CG 4.41Å; W790-I806 HydrophobicContact CB-CD1 4.23Å; W790-I806 HydrophobicContact CG-CD1 4.45Å; W790-S822 PolarHBondContact NE1-OG 2.76Å; W790-L824 HydrophobicContact CB-CD2 4.07Å; W790-L824 HydrophobicContact CD2-CB 3.68Å; W790-L824 HydrophobicContact CD2-CD2 3.85Å; W790-L824 HydrophobicContact CD2-CG 4.4Å; W790-L824 HydrophobicContact CE3-CB 4.19Å; W790-L824 HydrophobicContact CE3-CD2 3.86Å; W790-L824 HydrophobicContact CG-CB 3.97Å; W790-L824 HydrophobicContact CG-CD2 3.96Å; W790-L824 HydrophobicContact CG-CG 4.49Å; W790-L824 HydrophobicContact CH2-CB 4.49Å; W790-L824 HydrophobicContact CZ2-CB 4Å; W790-C839 HydrophobicContact CD2-CB 4.16Å; W790-C839 HydrophobicContact CE3-CB 4.15Å; W790-C839 HydrophobicContact CH2-CB 4.46Å; W790-C839 HydrophobicContact CZ2-CB 4.46Å; W790-C839 HydrophobicContact CZ3-CB 4.3Å; W790-L853 HydrophobicContact CH2-CD1 4.22Å; W790-L853 HydrophobicContact CZ3-CD1 3.98Å
791	R	89.5	Confident	87	Confident	30 Å²	30	34.4 Å²	34.4	11%	0.113	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	154.2	173	-57.2	-177.6	168.7	-118	6.9	110.3	P671 W794 G795 Y837 N838 E840	P671-R791 HydrophobicContact CB-CG 4.29Å; P671-R791 HydrophobicContact CG-CG 4.05Å; R791-W794 PolarHBondContact NH1-O 2.89Å; R791-G795 CarbonylContact C-O 3.46Å; R791-G795 VanDerWaalsContact CA-O 3.22Å; R791-G795 WeakPolarHBondContact CA-O 3.46Å; R791-G795 WeakPolarHBondContact CB-O 2.99Å; R791-Y837 WeakPolarHBondContact O-CA 3.43Å; R791-N838 WeakPolarHBondContact CB-OD1 3.15Å; R791-N838 WeakPolarHBondContact CD-OD1 3.02Å; R791-N838 PolarHBondContact N-O 3.04Å; R791-N838 PolarHBondContact O-N 2.67Å; R791-E840 IonicContact CZ-OE2 3.45Å; R791-E840 IonicContact NE-OE2 2.65Å; R791-E840 PolarHBondContact NE-OE2 3.39Å; R791-E840 VanDerWaalsContact NE-OE2 3.12Å; R791-E840 IonicContact NH2-OE2 2.67Å; R791-E840 PolarHBondContact NH2-OE2 2.03Å
792	F	90.7	Very high	86.6	Confident	24 Å²	24	36 Å²	36	11%	0.105	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	128.9	170.3	169.4	-118.4	0	0	0	109.7	W794 G795 L797 P798 G832 I836 Y837	F792-W794 PolarHBondContact O-N 3.5Å; F792-G795 PolarHBondContact N-O 2.9Å; F792-G795 CarbonylContact O-C 3.55Å; F792-G795 PolarHBondContact O-N 2.85Å; F792-L797 HydrophobicContact CB-CD2 3.94Å; F792-P798 HydrophobicContact CD1-CG 4.5Å; F792-G832 WeakPolarHBondContact CZ-O 3.42Å; F792-I836 CarbonylContact C-O 3.52Å; F792-I836 WeakPolarHBondContact CA-O 3.26Å; F792-I836 WeakPolarHBondContact CD2-O 3.45Å; F792-Y837 HydrophobicContact CB-CD1 4.03Å; F792-Y837 HydrophobicContact CB-CE1 3.82Å; F792-Y837 AromaticContact CD2-CD1 3.99Å; F792-Y837 HydrophobicContact CD2-CD1 3.99Å; F792-Y837 AromaticContact CD2-CD2 4Å; F792-Y837 HydrophobicContact CD2-CD2 4Å; F792-Y837 AromaticContact CD2-CE1 3.51Å; F792-Y837 HydrophobicContact CD2-CE1 3.51Å; F792-Y837 AromaticContact CD2-CE2 3.5Å; F792-Y837 HydrophobicContact CD2-CE2 3.5Å; F792-Y837 VanDerWaalsContact CD2-CE2 3.5Å; F792-Y837 HydrophobicContact CD2-CG 4.22Å; F792-Y837 AromaticContact CD2-CZ 3.23Å; F792-Y837 HydrophobicContact CE2-CD2 4.44Å; F792-Y837 HydrophobicContact CE2-CE1 4.31Å; F792-Y837 AromaticContact CE2-CE2 3.66Å; F792-Y837 HydrophobicContact CE2-CE2 3.66Å; F792-Y837 AromaticContact CE2-CZ 3.58Å; F792-Y837 HydrophobicContact CG-CD1 4.43Å; F792-Y837 AromaticContact CG-CE1 3.9Å; F792-Y837 HydrophobicContact CG-CE1 3.9Å; F792-Y837 AromaticContact CG-CZ 4Å
793	N	89.2	Confident	86.7	Confident	20 Å²	20	36.9 Å²	36.9	11%	0.107	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	43.2	49.6	-170.7	-73.7	-26.5	0	0	0	110.9	R544 L545 T546 G795 I836	R544-N793 PolarHBondContact O-ND2 2.79Å; R544-N793 VanDerWaalsContact O-ND2 3.1Å; L545-N793 WeakPolarHBondContact CD1-OD1 3.23Å; T546-N793 VanDerWaalsContact CB-O 3.3Å; T546-N793 WeakPolarHBondContact CB-O 3.43Å; N793-G795 PolarHBondContact O-N 2.78Å; N793-I836 PolarHBondContact N-O 2.9Å; N793-I836 PolarHBondContact OD1-N 2.99Å
794	W	82.1	Confident	87	Confident	16 Å²	16	36 Å²	36	6%	0.061	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.4	-13.9	-176.3	-68	85.2	0	0	0	117.8	T546 R548 I629 R791 F792 N838 L849 D852	T546-W794 VanDerWaalsContact O-CD1 3.29Å; R548-W794 HydrophobicContact CG-CD2 4.27Å; R548-W794 HydrophobicContact CG-CE3 4.44Å; R548-W794 HydrophobicContact CG-CH2 4.38Å; R548-W794 HydrophobicContact CG-CZ2 4.19Å; R548-W794 HydrophobicContact CG-CZ3 4.46Å; R548-W794 VanDerWaalsContact CZ-CZ2 3.41Å; I629-W794 HydrophobicContact CD1-CB 3.82Å; I629-W794 HydrophobicContact CD1-CD2 3.55Å; I629-W794 HydrophobicContact CD1-CE3 3.3Å; I629-W794 HydrophobicContact CD1-CG 3.75Å; I629-W794 HydrophobicContact CD1-CZ3 4.14Å; R791-W794 PolarHBondContact NH1-O 2.89Å; F792-W794 PolarHBondContact O-N 3.5Å; W794-N838 WeakPolarHBondContact CH2-ND2 3.39Å; W794-N838 VanDerWaalsContact CZ2-ND2 3.3Å; W794-N838 WeakPolarHBondContact CZ2-ND2 3.4Å; W794-L849 HydrophobicContact CH2-CD2 3.34Å; W794-L849 HydrophobicContact CZ3-CD2 3.36Å; W794-D852 VanDerWaalsContact CZ2-OD1 3.29Å; W794-D852 WeakPolarHBondContact CZ2-OD1 3.25Å
795	G	80.5	Confident	87.2	Confident	27 Å²	27	42.6 Å²	42.6	28%	0.278	23%	0.227	S	C	.	.	B	Isolated β-bridge	trans	-97	-156.3	172.4	0	0	0	0	0	113.9	R791 F792 N793	R791-G795 CarbonylContact C-O 3.46Å; R791-G795 VanDerWaalsContact CA-O 3.22Å; R791-G795 WeakPolarHBondContact CA-O 3.46Å; R791-G795 WeakPolarHBondContact CB-O 2.99Å; F792-G795 PolarHBondContact N-O 2.9Å; F792-G795 CarbonylContact O-C 3.55Å; F792-G795 PolarHBondContact O-N 2.85Å; N793-G795 PolarHBondContact O-N 2.78Å
796	C	83.8	Confident	87.4	Confident	29 Å²	29	45.3 Å²	45.3	20%	0.196	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-72	154	177.5	-69.1	0	0	0	0	113.8	C669	C669-C796 HydrophobicContact CB-CB 3.77Å; C669-C796 WeakPolarHBondContact CB-SG 3.46Å; C669-C796 PolarHBondContact O-SG 2.96Å; C669-C796 WeakPolarHBondContact SG-CB 3.08Å; C669-C796 CovalentContact SG-SG 2.04Å; C669-C796 PolarHBondContact SG-SG 3.09Å
797	L	88.9	Confident	87.5	Confident	32 Å²	32	48.1 Å²	48.1	17%	0.168	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-60.4	151.5	158	-66.2	170.6	0	0	0	111	W790 F792 F804 I806 L824 Y837	W790-L797 HydrophobicContact CB-CD1 3.91Å; W790-L797 HydrophobicContact CB-CG 4.41Å; F792-L797 HydrophobicContact CB-CD2 3.94Å; L797-F804 HydrophobicContact CD2-CD1 4Å; L797-F804 HydrophobicContact CD2-CE1 4.26Å; L797-I806 HydrophobicContact CD1-CD1 3.86Å; L797-I806 HydrophobicContact CD1-CG1 4.2Å; L797-L824 HydrophobicContact CD1-CD1 3.81Å; L797-L824 HydrophobicContact CD1-CD2 4.14Å; L797-L824 HydrophobicContact CD2-CD1 4.42Å; L797-L824 HydrophobicContact CD2-CD2 3.7Å; L797-Y837 HydrophobicContact CD2-CD1 3.98Å; L797-Y837 HydrophobicContact CD2-CE1 3.66Å
798	P	86.6	Confident	87.5	Confident	44 Å²	44	47.4 Å²	47.4	29%	0.286	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-61.1	141.3	170.2	-21.7	33.7	0	0	0	112.5	F792 E800 F804	F792-P798 HydrophobicContact CD1-CG 4.5Å; P798-E800 PolarHBondContact O-N 3.07Å; P798-F804 HydrophobicContact CB-CD2 4.17Å; P798-F804 HydrophobicContact CB-CE2 3.67Å; P798-F804 HydrophobicContact CB-CZ 4.31Å; P798-F804 HydrophobicContact CG-CD2 4.37Å; P798-F804 HydrophobicContact CG-CE2 3.57Å; P798-F804 HydrophobicContact CG-CZ 3.68Å
799	D	82.6	Confident	87.5	Confident	158 Å²	158	50.3 Å²	50.3	85%	0.845	28%	0.278	S	S	*	.	S	Bend	trans	-76.7	66.9	179.5	-169.8	17.4	0	0	0	112.1
800	E	86.8	Confident	87.4	Confident	50 Å²	50	50.8 Å²	50.8	23%	0.234	28%	0.282	C	S	.	.			trans	-130.8	72.5	175.1	-73	176.8	-83.3	0	0	110.1	P798 S802 R803 F804 R830	P798-E800 PolarHBondContact O-N 3.07Å; E800-S802 PolarHBondContact O-N 3.15Å; E800-R803 HydrophobicContact CB-CB 4.41Å; E800-R803 HydrophobicContact CB-CG 4.48Å; E800-R803 VanDerWaalsContact CD-NE 3.3Å; E800-R803 PolarHBondContact O-N 2.85Å; E800-R803 IonicContact OE1-CZ 2.74Å; E800-R803 IonicContact OE1-NE 3.53Å; E800-R803 PolarHBondContact OE1-NE 3.14Å; E800-R803 IonicContact OE1-NH2 3.09Å; E800-R803 PolarHBondContact OE1-NH2 3.27Å; E800-R803 IonicContact OE2-CZ 2.87Å; E800-R803 IonicContact OE2-NE 3.63Å; E800-R803 PolarHBondContact OE2-NE 3.13Å; E800-R803 IonicContact OE2-NH2 3.97Å; E800-F804 HydrophobicContact CB-CD2 4.18Å; E800-F804 PolarHBondContact O-N 2.03Å; E800-R830 VanDerWaalsContact CD-NH2 3.25Å; E800-R830 IonicContact OE1-CZ 2.74Å; E800-R830 IonicContact OE1-NH1 3.54Å; E800-R830 IonicContact OE1-NH2 3.12Å; E800-R830 PolarHBondContact OE1-NH2 2.69Å; E800-R830 IonicContact OE2-CZ 3.6Å; E800-R830 IonicContact OE2-NH1 3.67Å; E800-R830 PolarHBondContact OE2-NH1 3.08Å; E800-R830 IonicContact OE2-NH2 3.35Å; E800-R830 PolarHBondContact OE2-NH2 3.25Å; E800-R830 VanDerWaalsContact OE2-NH2 3.09Å
801	P	79.8	Confident	87.2	Confident	96 Å²	96	56.5 Å²	56.5	62%	0.623	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-10.3	-175.8	25	-35.4	0	0	0	114.5	F804	P801-F804 WeakPolarHBondContact CA-O 3.29Å
802	S	85.8	Confident	87	Confident	77 Å²	77	60.3 Å²	60.3	54%	0.538	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-35.2	168.6	55.7	0	0	0	0	112.5	E800 R805	E800-S802 PolarHBondContact O-N 3.15Å; S802-R805 PolarHBondContact O-NE 2.93Å; S802-R805 VanDerWaalsContact O-NE 3.12Å; S802-R805 PolarHBondContact O-NH2 3.42Å
803	R	92.8	Very high	86.5	Confident	17 Å²	17	61.3 Å²	61.3	6%	0.064	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-51.3	-176.7	-56.1	-160.3	-53.9	116.6	-0.9	113	E800 T825 S827 N828 R830 D833	E800-R803 HydrophobicContact CB-CB 4.41Å; E800-R803 HydrophobicContact CB-CG 4.48Å; E800-R803 VanDerWaalsContact CD-NE 3.3Å; E800-R803 PolarHBondContact O-N 2.85Å; E800-R803 IonicContact OE1-CZ 2.74Å; E800-R803 IonicContact OE1-NE 3.53Å; E800-R803 PolarHBondContact OE1-NE 3.14Å; E800-R803 IonicContact OE1-NH2 3.09Å; E800-R803 PolarHBondContact OE1-NH2 3.27Å; E800-R803 IonicContact OE2-CZ 2.87Å; E800-R803 IonicContact OE2-NE 3.63Å; E800-R803 PolarHBondContact OE2-NE 3.13Å; E800-R803 IonicContact OE2-NH2 3.97Å; R803-T825 VanDerWaalsContact O-O 3.08Å; R803-S827 PolarHBondContact O-N 2.96Å; R803-S827 PolarHBondContact O-OG 3.39Å; R803-N828 PolarHBondContact NH1-O 3.24Å; R803-R830 VanDerWaalsContact NH2-CZ 3.28Å; R803-D833 IonicContact CZ-OD1 3.64Å; R803-D833 IonicContact CZ-OD2 3.7Å; R803-D833 IonicContact NH1-OD1 3.51Å; R803-D833 PolarHBondContact NH1-OD1 2.82Å; R803-D833 IonicContact NH1-OD2 2.91Å; R803-D833 PolarHBondContact NH1-OD2 3.35Å; R803-D833 IonicContact NH2-OD1 2.7Å; R803-D833 PolarHBondContact NH2-OD1 2.69Å; R803-D833 IonicContact NH2-OD2 2.62Å
804	F	92.6	Very high	86.1	Confident	14 Å²	14	68.6 Å²	68.6	6%	0.061	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	117.3	177	-67.1	-86	0	0	0	109.2	L797 P798 E800 P801 L824 T825 I826 Y837	L797-F804 HydrophobicContact CD2-CD1 4Å; L797-F804 HydrophobicContact CD2-CE1 4.26Å; P798-F804 HydrophobicContact CB-CD2 4.17Å; P798-F804 HydrophobicContact CB-CE2 3.67Å; P798-F804 HydrophobicContact CB-CZ 4.31Å; P798-F804 HydrophobicContact CG-CD2 4.37Å; P798-F804 HydrophobicContact CG-CE2 3.57Å; P798-F804 HydrophobicContact CG-CZ 3.68Å; E800-F804 HydrophobicContact CB-CD2 4.18Å; E800-F804 PolarHBondContact O-N 2.03Å; P801-F804 WeakPolarHBondContact CA-O 3.29Å; F804-L824 HydrophobicContact CD1-CD1 4.36Å; F804-T825 WeakPolarHBondContact CA-O 3.14Å; F804-I826 HydrophobicContact CD1-CB 4.35Å; F804-I826 HydrophobicContact CD1-CD1 4.36Å; F804-I826 HydrophobicContact CD1-CG1 3.82Å; F804-I826 HydrophobicContact CD1-CG2 3.97Å; F804-I826 HydrophobicContact CE1-CB 4.27Å; F804-I826 HydrophobicContact CE1-CD1 3.93Å; F804-I826 HydrophobicContact CE1-CG1 3.82Å; F804-I826 HydrophobicContact CE1-CG2 3.55Å; F804-I826 HydrophobicContact CZ-CG2 3.92Å; F804-Y837 HydrophobicContact CE1-CE1 4.33Å
805	R	90.1	Very high	86.2	Confident	148 Å²	148	70 Å²	70	56%	0.558	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.9	120	-179.5	-58.7	-174.4	-168	-173.7	6.2	110	S802 L824 T825	S802-R805 PolarHBondContact O-NE 2.93Å; S802-R805 VanDerWaalsContact O-NE 3.12Å; S802-R805 PolarHBondContact O-NH2 3.42Å; R805-L824 WeakPolarHBondContact O-CA 3.11Å; R805-T825 PolarHBondContact N-O 3.12Å; R805-T825 PolarHBondContact O-N 2.6Å
806	I	89.8	Confident	86.2	Confident	82 Å²	82	73 Å²	73	42%	0.421	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	132.8	170.8	-58.8	169.8	0	0	0	108.2	W790 L797 N808 T823 L824	W790-I806 HydrophobicContact CB-CD1 4.23Å; W790-I806 HydrophobicContact CG-CD1 4.45Å; L797-I806 HydrophobicContact CD1-CD1 3.86Å; L797-I806 HydrophobicContact CD1-CG1 4.2Å; I806-N808 WeakPolarHBondContact CG2-OD1 3.19Å; I806-T823 CarbonylContact C-O 3.57Å; I806-T823 WeakPolarHBondContact CA-O 3.28Å; I806-L824 HydrophobicContact CG1-CD1 4.03Å
807	S	89.1	Confident	86.3	Confident	64 Å²	64	74.7 Å²	74.7	45%	0.448	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	116.2	167.3	-175.1	0	0	0	0	108.7	S822 T823	S807-S822 CarbonylContact O-C 3.6Å; S807-S822 WeakPolarHBondContact O-CA 3.46Å; S807-T823 PolarHBondContact N-O 2.92Å; S807-T823 PolarHBondContact O-N 3.18Å
808	N	87.5	Confident	86.3	Confident	48 Å²	48	73.4 Å²	73.4	26%	0.257	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	114.3	175.9	-72.4	-6.9	0	0	0	108.1	V788 I806 V820 S822	V788-N808 PolarHBondContact O-ND2 2.84Å; I806-N808 WeakPolarHBondContact CG2-OD1 3.19Å; N808-V820 HydrophobicContact CB-CG1 4.05Å; N808-S822 VanDerWaalsContact OD1-CB 3.24Å; N808-S822 WeakPolarHBondContact OD1-CB 3.02Å; N808-S822 PolarHBondContact OD1-OG 3.44Å
809	V	88.5	Confident	86.5	Confident	63 Å²	63	72.3 Å²	72.3	38%	0.382	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	108.8	-176.2	-177.1	0	0	0	0	110	V821	V809-V821 PolarHBondContact N-O 2.7Å; V809-V821 PolarHBondContact O-N 3.18Å
810	P	86.9	Confident	86.9	Confident	23 Å²	23	65 Å²	65	15%	0.149	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	150.4	173.9	32.2	-36.7	0	0	0	111.2	E716 C718 T819 V820	E716-P810 WeakPolarHBondContact O-CD 3.48Å; E716-P810 VanDerWaalsContact O-CG 3.31Å; E716-P810 WeakPolarHBondContact O-CG 3.01Å; C718-P810 HydrophobicContact CB-CB 4.46Å; P810-T819 CarbonylContact C-O 3.5Å; P810-T819 WeakPolarHBondContact CA-O 3.39Å; P810-V820 HydrophobicContact CB-CG2 4.24Å
811	R	87.7	Confident	87.2	Confident	125 Å²	125	63 Å²	63	47%	0.472	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	155.8	179.6	-61.1	-174.1	179.8	172.8	3	109.2	C813 T819 V821	R811-C813 VanDerWaalsContact C-N 3.33Å; R811-C813 PolarHBondContact O-N 2.84Å; R811-T819 PolarHBondContact N-O 3.08Å; R811-T819 PolarHBondContact O-N 3.24Å; R811-V821 HydrophobicContact CG-CG2 4.48Å
812	N	85.9	Confident	87.8	Confident	110 Å²	110	58.4 Å²	58.4	59%	0.588	32%	0.315	S	S	*	.			trans	54.8	47.1	178.1	-51.4	-30.4	0	0	0	112	D814 S815	N812-D814 VanDerWaalsContact C-N 3.28Å; N812-D814 PolarHBondContact O-N 3.05Å; N812-S815 WeakPolarHBondContact O-CB 3.4Å; N812-S815 PolarHBondContact O-N 3.44Å
813	C	80.4	Confident	88.2	Confident	45 Å²	45	56.4 Å²	56.4	30%	0.304	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-25.5	-169.9	-62.9	0	0	0	0	114.4	C718 R811 S815	C718-C813 HydrophobicContact CB-CB 3.39Å; C718-C813 WeakPolarHBondContact CB-SG 3.15Å; C718-C813 WeakPolarHBondContact SG-CB 3.23Å; C718-C813 CovalentContact SG-SG 2.02Å; C718-C813 PolarHBondContact SG-SG 2.89Å; R811-C813 VanDerWaalsContact C-N 3.33Å; R811-C813 PolarHBondContact O-N 2.84Å; C813-S815 PolarHBondContact O-N 3.12Å
814	D	80.3	Confident	88.3	Confident	172 Å²	172	55.6 Å²	55.6	92%	0.92	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	5	172.4	-44	-86.1	0	0	0	113.3	N812	N812-D814 VanDerWaalsContact C-N 3.28Å; N812-D814 PolarHBondContact O-N 3.05Å
815	S	82.9	Confident	88.4	Confident	45 Å²	45	56.6 Å²	56.6	32%	0.315	30%	0.304	S	S	.	.	S	Bend	trans	-82.3	147.5	177	-175.8	0	0	0	0	111.1	N812 C813 M817 P818	N812-S815 WeakPolarHBondContact O-CB 3.4Å; N812-S815 PolarHBondContact O-N 3.44Å; C813-S815 PolarHBondContact O-N 3.12Å; S815-M817 WeakPolarHBondContact CB-O 3.48Å; S815-M817 PolarHBondContact O-N 2.88Å; S815-M817 VanDerWaalsContact OG-C 3.31Å; S815-M817 PolarHBondContact OG-N 2.88Å; S815-M817 PolarHBondContact OG-O 3.47Å; S815-P818 WeakPolarHBondContact O-CD 3.43Å
816	P	81.4	Confident	88.6	Confident	92 Å²	92	49.6 Å²	49.6	60%	0.597	28%	0.278	S	S	*	.	S	Bend	trans	-66.7	-8.5	163.7	31.2	-36.9	0	0	0	113.2
817	M	85.7	Confident	88.7	Confident	64 Å²	64	47.2 Å²	47.2	32%	0.315	27%	0.268	S	S	.	.	S	Bend	trans	-131.9	83.3	170.8	-69.5	-66.3	-69.2	0	0	108.5	A754 S815	A754-M817 HydrophobicContact CB-CE 4.04Å; A754-M817 HydrophobicContact CB-SD 3.33Å; A754-M817 WeakPolarHBondContact CB-SD 3.28Å; S815-M817 WeakPolarHBondContact CB-O 3.48Å; S815-M817 PolarHBondContact O-N 2.88Å; S815-M817 VanDerWaalsContact OG-C 3.31Å; S815-M817 PolarHBondContact OG-N 2.88Å; S815-M817 PolarHBondContact OG-O 3.47Å
818	P	88.7	Confident	88.9	Confident	4 Å²	4	48.8 Å²	48.8	3%	0.026	27%	0.272	C	S	.	.			trans	-63.1	159.3	170.1	26.4	-34.4	0	0	0	111.2	T781 G782 V785 S815	T781-P818 WeakPolarHBondContact CA-O 3.33Å; G782-P818 PolarHBondContact N-O 3.3Å; G782-P818 WeakPolarHBondContact O-CD 3.46Å; G782-P818 VanDerWaalsContact O-CG 3.27Å; G782-P818 WeakPolarHBondContact O-CG 3.05Å; V785-P818 HydrophobicContact CB-CG 4.43Å; V785-P818 HydrophobicContact CG2-CB 4.22Å; V785-P818 HydrophobicContact CG2-CG 3.88Å; S815-P818 WeakPolarHBondContact O-CD 3.43Å
819	T	91	Very high	89.1	Confident	21 Å²	21	46.6 Å²	46.6	13%	0.129	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	124	-176.8	-47.3	0	0	0	0	110.3	V780 T781 P810 R811	V780-T819 CarbonylContact O-C 3.41Å; V780-T819 WeakPolarHBondContact O-CA 3.43Å; T781-T819 HydrophobicContact CG2-CG2 3.82Å; P810-T819 CarbonylContact C-O 3.5Å; P810-T819 WeakPolarHBondContact CA-O 3.39Å; R811-T819 PolarHBondContact N-O 3.08Å; R811-T819 PolarHBondContact O-N 3.24Å
820	V	91.1	Very high	89.2	Confident	6 Å²	6	48.7 Å²	48.7	4%	0.036	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	119.3	171	177.8	0	0	0	0	109.4	V780 V785 P786 V788 N808 P810	V780-V820 PolarHBondContact N-O 2.9Å; V780-V820 PolarHBondContact O-N 2.75Å; V785-V820 HydrophobicContact CG1-CG2 3.65Å; P786-V820 VanDerWaalsContact O-CG2 3.31Å; P786-V820 WeakPolarHBondContact O-CG2 2.99Å; V788-V820 HydrophobicContact CG2-CB 4.02Å; V788-V820 HydrophobicContact CG2-CG1 3.77Å; N808-V820 HydrophobicContact CB-CG1 4.05Å; P810-V820 HydrophobicContact CB-CG2 4.24Å
821	V	92.9	Very high	89.2	Confident	7 Å²	7	50 Å²	50	4%	0.042	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	104.2	171	-179.5	0	0	0	0	107.5	V777 E779 V809 R811	V777-V821 HydrophobicContact CG1-CG1 3.95Å; E779-V821 HydrophobicContact CB-CG2 4.5Å; E779-V821 HydrophobicContact CG-CG1 4.22Å; E779-V821 HydrophobicContact CG-CG2 3.97Å; V809-V821 PolarHBondContact N-O 2.7Å; V809-V821 PolarHBondContact O-N 3.18Å; R811-V821 HydrophobicContact CG-CG2 4.48Å
822	S	93.1	Very high	89.3	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	132.6	173.4	-169.1	0	0	0	0	110	V777 C778 V788 W790 S807 N808	V777-S822 WeakPolarHBondContact CA-O 3Å; C778-S822 PolarHBondContact N-O 2.03Å; C778-S822 PolarHBondContact O-N 2.78Å; V788-S822 VanDerWaalsContact CG1-CB 3.47Å; W790-S822 PolarHBondContact NE1-OG 2.76Å; S807-S822 CarbonylContact O-C 3.6Å; S807-S822 WeakPolarHBondContact O-CA 3.46Å; N808-S822 VanDerWaalsContact OD1-CB 3.24Å; N808-S822 WeakPolarHBondContact OD1-CB 3.02Å; N808-S822 PolarHBondContact OD1-OG 3.44Å
823	T	94	Very high	89.6	Confident	34 Å²	34	41.1 Å²	41.1	21%	0.209	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	120.8	179.3	-57.5	0	0	0	0	109	V775 L776 V777 I806 S807	V775-T823 HydrophobicContact CG1-CG2 3.5Å; L776-T823 CarbonylContact O-C 3.52Å; L776-T823 WeakPolarHBondContact O-CA 3.48Å; V777-T823 HydrophobicContact CG2-CG2 4.31Å; I806-T823 CarbonylContact C-O 3.57Å; I806-T823 WeakPolarHBondContact CA-O 3.28Å; S807-T823 PolarHBondContact N-O 2.92Å; S807-T823 PolarHBondContact O-N 3.18Å
824	L	94	Very high	90.2	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	112.1	172.5	171	60.8	0	0	0	109.4	L776 W790 L797 F804 R805 I806 I826 Y837	L776-L824 HydrophobicContact CB-CB 4.4Å; L776-L824 HydrophobicContact CD1-CD2 4.38Å; L776-L824 PolarHBondContact N-O 3.39Å; L776-L824 PolarHBondContact O-N 3.09Å; W790-L824 HydrophobicContact CB-CD2 4.07Å; W790-L824 HydrophobicContact CD2-CB 3.68Å; W790-L824 HydrophobicContact CD2-CD2 3.85Å; W790-L824 HydrophobicContact CD2-CG 4.4Å; W790-L824 HydrophobicContact CE3-CB 4.19Å; W790-L824 HydrophobicContact CE3-CD2 3.86Å; W790-L824 HydrophobicContact CG-CB 3.97Å; W790-L824 HydrophobicContact CG-CD2 3.96Å; W790-L824 HydrophobicContact CG-CG 4.49Å; W790-L824 HydrophobicContact CH2-CB 4.49Å; W790-L824 HydrophobicContact CZ2-CB 4Å; L797-L824 HydrophobicContact CD1-CD1 3.81Å; L797-L824 HydrophobicContact CD1-CD2 4.14Å; L797-L824 HydrophobicContact CD2-CD1 4.42Å; L797-L824 HydrophobicContact CD2-CD2 3.7Å; F804-L824 HydrophobicContact CD1-CD1 4.36Å; R805-L824 WeakPolarHBondContact O-CA 3.11Å; I806-L824 HydrophobicContact CG1-CD1 4.03Å; L824-I826 HydrophobicContact CD1-CG1 4.5Å; L824-I826 HydrophobicContact CG-CG1 4.2Å; L824-Y837 HydrophobicContact CD2-CD1 3.81Å; L824-Y837 HydrophobicContact CD2-CE1 4.14Å
825	T	94.7	Very high	90.9	Very high	36 Å²	36	31.1 Å²	31.1	22%	0.221	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	129.6	173.1	-58.4	0	0	0	0	109.8	T773 V774 V775 R803 F804 R805	T773-T825 HydrophobicContact CG2-CG2 3.58Å; V774-T825 CarbonylContact O-C 3.56Å; V774-T825 WeakPolarHBondContact O-CA 3.31Å; V775-T825 HydrophobicContact CG2-CG2 4.29Å; R803-T825 VanDerWaalsContact O-O 3.08Å; F804-T825 WeakPolarHBondContact CA-O 3.14Å; R805-T825 PolarHBondContact N-O 3.12Å; R805-T825 PolarHBondContact O-N 2.6Å
826	I	94.4	Very high	91.3	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.005	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	105.7	176.7	-46.3	172.8	0	0	0	107.5	T773 V774 F804 L824 V829 Y837	T773-I826 CarbonylContact C-O 3.58Å; T773-I826 VanDerWaalsContact CA-O 3.28Å; T773-I826 WeakPolarHBondContact CA-O 3.36Å; V774-I826 HydrophobicContact CB-CB 4.24Å; V774-I826 HydrophobicContact CB-CD1 4.37Å; V774-I826 HydrophobicContact CG1-CD1 4.27Å; V774-I826 PolarHBondContact N-O 2.8Å; V774-I826 PolarHBondContact O-N 2.82Å; F804-I826 HydrophobicContact CD1-CB 4.35Å; F804-I826 HydrophobicContact CD1-CD1 4.36Å; F804-I826 HydrophobicContact CD1-CG1 3.82Å; F804-I826 HydrophobicContact CD1-CG2 3.97Å; F804-I826 HydrophobicContact CE1-CB 4.27Å; F804-I826 HydrophobicContact CE1-CD1 3.93Å; F804-I826 HydrophobicContact CE1-CG1 3.82Å; F804-I826 HydrophobicContact CE1-CG2 3.55Å; F804-I826 HydrophobicContact CZ-CG2 3.92Å; L824-I826 HydrophobicContact CD1-CG1 4.5Å; L824-I826 HydrophobicContact CG-CG1 4.2Å; I826-V829 HydrophobicContact CB-CG2 4.46Å; I826-V829 HydrophobicContact CG2-CG2 4.15Å; I826-Y837 HydrophobicContact CD1-CD1 4.47Å; I826-Y837 HydrophobicContact CD1-CE1 3.7Å; I826-Y837 HydrophobicContact CD1-CE2 4.18Å
827	S	93.3	Very high	91.9	Very high	32 Å²	32	24.8 Å²	24.8	22%	0.224	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	139.4	-174.8	-45.8	0	0	0	0	111.9	R803	R803-S827 PolarHBondContact O-N 2.96Å; R803-S827 PolarHBondContact O-OG 3.39Å
828	N	91.8	Very high	92.2	Very high	96 Å²	96	21.8 Å²	21.8	51%	0.513	13%	0.128	S	C	.	.	S	Bend	trans	56	65.5	-179.1	-177.4	40.9	0	0	0	111.4	G771 D772 R803 R830	G771-N828 WeakPolarHBondContact CA-OD1 3.47Å; D772-N828 WeakPolarHBondContact O-CA 3.43Å; D772-N828 PolarHBondContact O-N 3.03Å; D772-N828 VanDerWaalsContact O-N 3.13Å; R803-N828 PolarHBondContact NH1-O 3.24Å; N828-R830 PolarHBondContact O-N 3.32Å
829	V	91.9	Very high	92.3	Very high	2 Å²	2	21.7 Å²	21.7	1%	0.012	13%	0.128	C	C	.	.			trans	-61.1	130.9	-177.9	174.4	0	0	0	0	111.2	V768 R770 G771 D772 V774 I826 D833 I857	V768-V829 HydrophobicContact CG2-CG1 4.05Å; R770-V829 WeakPolarHBondContact CA-O 3.17Å; G771-V829 PolarHBondContact N-O 3.44Å; D772-V829 PolarHBondContact O-N 2.89Å; V774-V829 HydrophobicContact CB-CG2 4.38Å; V774-V829 HydrophobicContact CG2-CG2 3.86Å; I826-V829 HydrophobicContact CB-CG2 4.46Å; I826-V829 HydrophobicContact CG2-CG2 4.15Å; V829-D833 WeakPolarHBondContact CA-OD2 3.24Å; V829-D833 HydrophobicContact CG1-CB 4.25Å; V829-I857 HydrophobicContact CG1-CD1 3.53Å; V829-I857 HydrophobicContact CG1-CG1 3.66Å
830	R	91.2	Very high	92.3	Very high	107 Å²	107	20.8 Å²	20.8	40%	0.404	12%	0.122	S	C	.	.			trans	-136.8	159.1	-178.7	65.7	-179.3	-165.3	-132.8	-4.8	111.3	E800 R803 N828 G832 D833 I857	E800-R830 VanDerWaalsContact CD-NH2 3.25Å; E800-R830 IonicContact OE1-CZ 2.74Å; E800-R830 IonicContact OE1-NH1 3.54Å; E800-R830 IonicContact OE1-NH2 3.12Å; E800-R830 PolarHBondContact OE1-NH2 2.69Å; E800-R830 IonicContact OE2-CZ 3.6Å; E800-R830 IonicContact OE2-NH1 3.67Å; E800-R830 PolarHBondContact OE2-NH1 3.08Å; E800-R830 IonicContact OE2-NH2 3.35Å; E800-R830 PolarHBondContact OE2-NH2 3.25Å; E800-R830 VanDerWaalsContact OE2-NH2 3.09Å; R803-R830 VanDerWaalsContact NH2-CZ 3.28Å; N828-R830 PolarHBondContact O-N 3.32Å; R830-G832 PolarHBondContact O-N 2.93Å; R830-D833 WeakPolarHBondContact CG-OD2 3.19Å; R830-D833 PolarHBondContact N-OD2 2.87Å; R830-D833 WeakPolarHBondContact O-CB 3.49Å; R830-D833 PolarHBondContact O-N 3.38Å; R830-I857 VanDerWaalsContact C-CD1 3.47Å; R830-I857 WeakPolarHBondContact O-CD1 2.94Å
831	P	87	Confident	92.2	Very high	52 Å²	52	20.5 Å²	20.5	34%	0.338	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	129.8	175.5	-26.9	35.7	0	0	0	112
832	G	89.1	Confident	91.9	Very high	44 Å²	44	20.3 Å²	20.3	45%	0.454	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	102.8	-14.8	-168.3	0	0	0	0	0	114.6	F792 R830 D834	F792-G832 WeakPolarHBondContact CZ-O 3.42Å; R830-G832 PolarHBondContact O-N 2.93Å; G832-D834 WeakPolarHBondContact CA-OD1 3.4Å; G832-D834 PolarHBondContact N-OD1 3.32Å
833	D	93.1	Very high	91.5	Very high	4 Å²	4	20.5 Å²	20.5	2%	0.021	12%	0.12	C	C	.	.	S	Bend	trans	-88.9	-7.3	167.3	-55.7	-33.5	0	0	0	112.2	R803 V829 R830 Y837	R803-D833 IonicContact CZ-OD1 3.64Å; R803-D833 IonicContact CZ-OD2 3.7Å; R803-D833 IonicContact NH1-OD1 3.51Å; R803-D833 PolarHBondContact NH1-OD1 2.82Å; R803-D833 IonicContact NH1-OD2 2.91Å; R803-D833 PolarHBondContact NH1-OD2 3.35Å; R803-D833 IonicContact NH2-OD1 2.7Å; R803-D833 PolarHBondContact NH2-OD1 2.69Å; R803-D833 IonicContact NH2-OD2 2.62Å; V829-D833 WeakPolarHBondContact CA-OD2 3.24Å; V829-D833 HydrophobicContact CG1-CB 4.25Å; R830-D833 WeakPolarHBondContact CG-OD2 3.19Å; R830-D833 PolarHBondContact N-OD2 2.87Å; R830-D833 WeakPolarHBondContact O-CB 3.49Å; R830-D833 PolarHBondContact O-N 3.38Å; D833-Y837 WeakPolarHBondContact O-CE2 3.11Å; D833-Y837 PolarHBondContact O-OH 2.03Å
834	D	93.7	Very high	90.8	Very high	6 Å²	6	20.2 Å²	20.2	3%	0.032	12%	0.124	C	C	.	.			trans	-80.2	135.3	175.2	44.3	-25.8	0	0	0	112.5	T541 P542 G832 V855 I857	T541-D834 WeakPolarHBondContact CB-OD2 3.43Å; T541-D834 WeakPolarHBondContact OG1-CB 3.33Å; T541-D834 PolarHBondContact OG1-OD2 2.65Å; P542-D834 WeakPolarHBondContact CA-OD2 3.07Å; P542-D834 HydrophobicContact CB-CB 4.19Å; G832-D834 WeakPolarHBondContact CA-OD1 3.4Å; G832-D834 PolarHBondContact N-OD1 3.32Å; D834-V855 WeakPolarHBondContact CA-O 3.12Å; D834-V855 WeakPolarHBondContact CB-O 3.24Å; D834-I857 HydrophobicContact CB-CB 4.41Å; D834-I857 HydrophobicContact CB-CD1 3.79Å; D834-I857 HydrophobicContact CB-CG1 3.92Å
835	G	93.4	Very high	89.9	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	154.4	-158.2	-175.7	0	0	0	0	0	113.7	V855	G835-V855 PolarHBondContact N-O 3.08Å; G835-V855 PolarHBondContact O-N 2.85Å
836	I	92.6	Very high	89.4	Confident	5 Å²	5	23.7 Å²	23.7	3%	0.026	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	132.7	179.5	-76.1	160.3	0	0	0	110.6	L545 V547 F792 N793 D852 V854	L545-I836 HydrophobicContact CD1-CB 4.27Å; L545-I836 HydrophobicContact CD1-CD1 3.63Å; L545-I836 HydrophobicContact CD1-CG1 3.73Å; L545-I836 HydrophobicContact CD2-CD1 4.1Å; L545-I836 HydrophobicContact CG-CD1 3.97Å; V547-I836 HydrophobicContact CG1-CD1 3.76Å; F792-I836 CarbonylContact C-O 3.52Å; F792-I836 WeakPolarHBondContact CA-O 3.26Å; F792-I836 WeakPolarHBondContact CD2-O 3.45Å; N793-I836 PolarHBondContact N-O 2.9Å; N793-I836 PolarHBondContact OD1-N 2.99Å; I836-D852 HydrophobicContact CG2-CB 3.88Å; I836-D852 WeakPolarHBondContact CG2-OD1 3.43Å; I836-V854 HydrophobicContact CG1-CG2 4.33Å
837	Y	93.4	Very high	89	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	137.8	170.8	-66.8	-96.8	0	0	0	109.9	L776 R791 F792 L797 F804 L824 I826 D833 L853 V855	L776-Y837 HydrophobicContact CD1-CD1 4.11Å; L776-Y837 HydrophobicContact CD1-CD2 4.09Å; L776-Y837 HydrophobicContact CD1-CG 3.65Å; R791-Y837 WeakPolarHBondContact O-CA 3.43Å; F792-Y837 HydrophobicContact CB-CD1 4.03Å; F792-Y837 HydrophobicContact CB-CE1 3.82Å; F792-Y837 AromaticContact CD2-CD1 3.99Å; F792-Y837 HydrophobicContact CD2-CD1 3.99Å; F792-Y837 AromaticContact CD2-CD2 4Å; F792-Y837 HydrophobicContact CD2-CD2 4Å; F792-Y837 AromaticContact CD2-CE1 3.51Å; F792-Y837 HydrophobicContact CD2-CE1 3.51Å; F792-Y837 AromaticContact CD2-CE2 3.5Å; F792-Y837 HydrophobicContact CD2-CE2 3.5Å; F792-Y837 VanDerWaalsContact CD2-CE2 3.5Å; F792-Y837 HydrophobicContact CD2-CG 4.22Å; F792-Y837 AromaticContact CD2-CZ 3.23Å; F792-Y837 HydrophobicContact CE2-CD2 4.44Å; F792-Y837 HydrophobicContact CE2-CE1 4.31Å; F792-Y837 AromaticContact CE2-CE2 3.66Å; F792-Y837 HydrophobicContact CE2-CE2 3.66Å; F792-Y837 AromaticContact CE2-CZ 3.58Å; F792-Y837 HydrophobicContact CG-CD1 4.43Å; F792-Y837 AromaticContact CG-CE1 3.9Å; F792-Y837 HydrophobicContact CG-CE1 3.9Å; F792-Y837 AromaticContact CG-CZ 4Å; L797-Y837 HydrophobicContact CD2-CD1 3.98Å; L797-Y837 HydrophobicContact CD2-CE1 3.66Å; F804-Y837 HydrophobicContact CE1-CE1 4.33Å; L824-Y837 HydrophobicContact CD2-CD1 3.81Å; L824-Y837 HydrophobicContact CD2-CE1 4.14Å; I826-Y837 HydrophobicContact CD1-CD1 4.47Å; I826-Y837 HydrophobicContact CD1-CE1 3.7Å; I826-Y837 HydrophobicContact CD1-CE2 4.18Å; D833-Y837 WeakPolarHBondContact O-CE2 3.11Å; D833-Y837 PolarHBondContact O-OH 2.03Å; Y837-L853 PolarHBondContact N-O 3.47Å; Y837-L853 WeakPolarHBondContact O-CA 3.28Å; Y837-L853 WeakPolarHBondContact O-CB 3.47Å; Y837-L853 PolarHBondContact O-N 3.45Å; Y837-V855 HydrophobicContact CD2-CB 4.13Å; Y837-V855 HydrophobicContact CD2-CG2 3.57Å; Y837-V855 HydrophobicContact CE2-CB 3.92Å; Y837-V855 HydrophobicContact CE2-CG2 3.73Å
838	N	91.5	Very high	88.9	Confident	1 Å²	1	26.3 Å²	26.3	1%	0.005	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	162.8	170.2	59.2	50.6	0	0	0	110.3	R791 W794 S850 D852	R791-N838 WeakPolarHBondContact CB-OD1 3.15Å; R791-N838 WeakPolarHBondContact CD-OD1 3.02Å; R791-N838 PolarHBondContact N-O 3.04Å; R791-N838 PolarHBondContact O-N 2.67Å; W794-N838 WeakPolarHBondContact CH2-ND2 3.39Å; W794-N838 VanDerWaalsContact CZ2-ND2 3.3Å; W794-N838 WeakPolarHBondContact CZ2-ND2 3.4Å; N838-S850 WeakPolarHBondContact CA-OG 3.44Å; N838-S850 WeakPolarHBondContact CB-OG 3.34Å; N838-D852 PolarHBondContact ND2-OD1 3.4Å
839	C	92.1	Very high	88.7	Confident	2 Å²	2	24 Å²	24	1%	0.014	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	143.6	177.3	61.4	0	0	0	0	111.7	C778 V788 I789 W790 L849 S850	C778-C839 HydrophobicContact CB-CB 3.71Å; C778-C839 WeakPolarHBondContact CB-SG 2.97Å; C778-C839 WeakPolarHBondContact SG-CB 2.99Å; C778-C839 CovalentContact SG-SG 2.03Å; C778-C839 PolarHBondContact SG-SG 2.94Å; V788-C839 HydrophobicContact CG1-CB 4.22Å; I789-C839 CarbonylContact O-C 3.39Å; I789-C839 WeakPolarHBondContact O-CA 3.36Å; I789-C839 WeakPolarHBondContact O-CB 3.11Å; W790-C839 HydrophobicContact CD2-CB 4.16Å; W790-C839 HydrophobicContact CE3-CB 4.15Å; W790-C839 HydrophobicContact CH2-CB 4.46Å; W790-C839 HydrophobicContact CZ2-CB 4.46Å; W790-C839 HydrophobicContact CZ3-CB 4.3Å; C839-L849 WeakPolarHBondContact O-CA 3.48Å; C839-L849 WeakPolarHBondContact O-CD1 3.14Å; C839-S850 PolarHBondContact N-OG 3.37Å; C839-S850 PolarHBondContact O-N 3.28Å; C839-S850 VanDerWaalsContact SG-CB 3.5Å
840	E	90.2	Very high	88.6	Confident	1 Å²	1	24.6 Å²	24.6	1%	0.005	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	126.3	175	-165.4	176.5	162.3	0	0	109	V788 I789 R791 L842 R847 A848 L849	V788-E840 WeakPolarHBondContact CA-O 3.25Å; I789-E840 HydrophobicContact CB-CB 4.42Å; I789-E840 PolarHBondContact N-O 3.3Å; I789-E840 PolarHBondContact O-N 3.35Å; R791-E840 IonicContact CZ-OE2 3.45Å; R791-E840 IonicContact NE-OE2 2.65Å; R791-E840 PolarHBondContact NE-OE2 3.39Å; R791-E840 VanDerWaalsContact NE-OE2 3.12Å; R791-E840 IonicContact NH2-OE2 2.67Å; R791-E840 PolarHBondContact NH2-OE2 2.03Å; E840-L842 HydrophobicContact CG-CD2 4.2Å; E840-R847 IonicContact OE1-CZ 2.92Å; E840-R847 IonicContact OE1-NH1 2.86Å; E840-R847 PolarHBondContact OE1-NH1 2.92Å; E840-A848 WeakPolarHBondContact CA-O 3.42Å; E840-L849 HydrophobicContact CB-CD1 3.73Å; E840-L849 HydrophobicContact CG-CD1 4Å
841	G	89.8	Confident	88.5	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	131.4	176.4	0	0	0	0	0	110.8	P756 R847 A848	P756-G841 VanDerWaalsContact CG-O 3.29Å; P756-G841 WeakPolarHBondContact CG-O 3.28Å; G841-R847 CarbonylContact O-C 3.55Å; G841-R847 WeakPolarHBondContact O-CA 3.35Å; G841-A848 PolarHBondContact N-O 3.03Å; G841-A848 PolarHBondContact O-N 3.44Å
842	L	86.2	Confident	88.6	Confident	4 Å²	4	22.7 Å²	22.7	2%	0.021	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	129.6	-178.6	-52.8	178	0	0	0	109.9	L672 V691 H692 P786 Y787 I789 E840 R847	L672-L842 HydrophobicContact CD2-CD1 3.91Å; L672-L842 HydrophobicContact CD2-CD2 4.31Å; V691-L842 HydrophobicContact CG2-CD1 4.34Å; H692-L842 HydrophobicContact CB-CB 4.48Å; H692-L842 HydrophobicContact CB-CD1 3.88Å; P786-L842 CarbonylContact C-O 3.47Å; P786-L842 WeakPolarHBondContact CA-O 3.34Å; Y787-L842 PolarHBondContact N-O 2.86Å; Y787-L842 PolarHBondContact O-N 2.76Å; I789-L842 HydrophobicContact CD1-CD1 3.65Å; I789-L842 HydrophobicContact CD1-CG 4.21Å; E840-L842 HydrophobicContact CG-CD2 4.2Å; L842-R847 HydrophobicContact CD2-CB 4.15Å; L842-R847 HydrophobicContact CD2-CG 3.59Å
843	S	85.1	Confident	88.8	Confident	4 Å²	4	20.8 Å²	20.8	3%	0.028	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	112	176.1	172.4	0	0	0	0	109.1	A754 N783 P784 A845 T846	A754-S843 PolarHBondContact O-OG 3.33Å; A754-S843 VanDerWaalsContact O-OG 3.05Å; N783-S843 PolarHBondContact N-OG 2.03Å; N783-S843 PolarHBondContact O-OG 3.42Å; P784-S843 WeakPolarHBondContact CD-OG 3.27Å; P784-S843 PolarHBondContact O-OG 3.45Å; S843-A845 PolarHBondContact O-N 2.88Å; S843-T846 PolarHBondContact N-O 3.03Å; S843-T846 WeakPolarHBondContact O-CA 3.4Å; S843-T846 PolarHBondContact O-N 3.14Å; S843-T846 PolarHBondContact O-OG1 2.76Å
844	G	77.8	Confident	88.8	Confident	27 Å²	27	21.9 Å²	21.9	28%	0.278	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.2	-134.9	-169.5	0	0	0	0	0	111.4	T846	G844-T846 PolarHBondContact O-N 3.24Å; G844-T846 VanDerWaalsContact O-N 3.12Å
845	A	74.9	Confident	88.8	Confident	57 Å²	57	21.6 Å²	21.6	47%	0.471	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	17.4	175.1	0	0	0	0	0	115.4	C738 S843	C738-A845 PolarHBondContact O-N 3.21Å; S843-A845 PolarHBondContact O-N 2.88Å
846	T	84.7	Confident	88.7	Confident	53 Å²	53	21.6 Å²	21.6	33%	0.325	13%	0.133	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	155.2	-173.6	65.3	0	0	0	0	113.9	P755 P756 S843 G844	P755-T846 WeakPolarHBondContact CA-OG1 3.03Å; P756-T846 VanDerWaalsContact CD-OG1 3.24Å; P756-T846 WeakPolarHBondContact CD-OG1 3.49Å; S843-T846 PolarHBondContact N-O 3.03Å; S843-T846 WeakPolarHBondContact O-CA 3.4Å; S843-T846 PolarHBondContact O-N 3.14Å; S843-T846 PolarHBondContact O-OG1 2.76Å; G844-T846 PolarHBondContact O-N 3.24Å; G844-T846 VanDerWaalsContact O-N 3.12Å
847	R	86.7	Confident	88.6	Confident	64 Å²	64	21.5 Å²	21.5	24%	0.242	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	153.6	-166.5	-53.2	-167.4	165	-137.2	0.6	112.4	G633 P756 E840 G841 L842	G633-R847 VanDerWaalsContact CA-NH1 3.31Å; P756-R847 VanDerWaalsContact CG-C 3.41Å; E840-R847 IonicContact OE1-CZ 2.92Å; E840-R847 IonicContact OE1-NH1 2.86Å; E840-R847 PolarHBondContact OE1-NH1 2.92Å; G841-R847 CarbonylContact O-C 3.55Å; G841-R847 WeakPolarHBondContact O-CA 3.35Å; L842-R847 HydrophobicContact CD2-CB 4.15Å; L842-R847 HydrophobicContact CD2-CG 3.59Å
848	A	89.7	Confident	87.8	Confident	24 Å²	24	21.8 Å²	21.8	20%	0.198	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	156	168.1	0	0	0	0	0	110.4	P756 I758 E840 G841	P756-A848 HydrophobicContact CB-CB 4.27Å; P756-A848 HydrophobicContact CG-CB 3.89Å; P756-A848 WeakPolarHBondContact O-CB 3.04Å; I758-A848 HydrophobicContact CD1-CB 4.33Å; I758-A848 HydrophobicContact CG1-CB 4.18Å; E840-A848 WeakPolarHBondContact CA-O 3.42Å; G841-A848 PolarHBondContact N-O 3.03Å; G841-A848 PolarHBondContact O-N 3.44Å
849	L	88.1	Confident	86.3	Confident	46 Å²	46	25.9 Å²	25.9	24%	0.241	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	143.3	-178.4	-166.5	80.4	0	0	0	110.1	W794 C839 E840	W794-L849 HydrophobicContact CH2-CD2 3.34Å; W794-L849 HydrophobicContact CZ3-CD2 3.36Å; C839-L849 WeakPolarHBondContact O-CA 3.48Å; C839-L849 WeakPolarHBondContact O-CD1 3.14Å; E840-L849 HydrophobicContact CB-CD1 3.73Å; E840-L849 HydrophobicContact CG-CD1 4Å
850	S	90.9	Very high	86	Confident	15 Å²	15	27.1 Å²	27.1	11%	0.105	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-75	166.2	178.8	73.8	0	0	0	0	113	N838 C839	N838-S850 WeakPolarHBondContact CA-OG 3.44Å; N838-S850 WeakPolarHBondContact CB-OG 3.34Å; C839-S850 PolarHBondContact N-OG 3.37Å; C839-S850 PolarHBondContact O-N 3.28Å; C839-S850 VanDerWaalsContact SG-CB 3.5Å
851	N	88.6	Confident	85.8	Confident	90 Å²	90	28.4 Å²	28.4	48%	0.481	20%	0.195	S	C	.	.	P	Polyproline II helix	trans	-58.7	153.8	155.5	-67.5	-30	0	0	0	110.3
852	D	89.5	Confident	85.5	Confident	29 Å²	29	30 Å²	30	16%	0.155	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-75	137.2	179.5	-68	-62.6	0	0	0	112.1	R548 Q551 W794 I836 N838	R548-D852 IonicContact NH2-OD2 3.42Å; Q551-D852 PolarHBondContact NE2-OD2 2.68Å; W794-D852 VanDerWaalsContact CZ2-OD1 3.29Å; W794-D852 WeakPolarHBondContact CZ2-OD1 3.25Å; I836-D852 HydrophobicContact CG2-CB 3.88Å; I836-D852 WeakPolarHBondContact CG2-OD1 3.43Å; N838-D852 PolarHBondContact ND2-OD1 3.4Å
853	L	92.9	Very high	85.5	Confident	4 Å²	4	31.5 Å²	31.5	2%	0.021	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	113	174.7	-50.3	-178.2	0	0	0	108.8	P761 T764 Y766 L776 W790 Y837	P761-L853 HydrophobicContact CB-CD2 3.75Å; P761-L853 HydrophobicContact CG-CD2 3.68Å; T764-L853 HydrophobicContact CG2-CD2 4.48Å; T764-L853 CarbonylContact O-C 3.6Å; T764-L853 WeakPolarHBondContact O-CA 3.37Å; Y766-L853 HydrophobicContact CE2-CB 4.38Å; L776-L853 HydrophobicContact CB-CD1 4.09Å; L776-L853 HydrophobicContact CD1-CD1 4.19Å; L776-L853 HydrophobicContact CD2-CD1 4.23Å; L776-L853 HydrophobicContact CG-CD1 4.39Å; W790-L853 HydrophobicContact CH2-CD1 4.22Å; W790-L853 HydrophobicContact CZ3-CD1 3.98Å; Y837-L853 PolarHBondContact N-O 3.47Å; Y837-L853 WeakPolarHBondContact O-CA 3.28Å; Y837-L853 WeakPolarHBondContact O-CB 3.47Å; Y837-L853 PolarHBondContact O-N 3.45Å
854	V	92.5	Very high	85.5	Confident	27 Å²	27	33.3 Å²	33.3	16%	0.164	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	124.9	-179.9	-174.5	0	0	0	0	109.7	T764 R765 Y766 I836 M856	T764-V854 PolarHBondContact O-N 2.73Å; R765-V854 WeakPolarHBondContact CA-O 3.13Å; Y766-V854 PolarHBondContact N-O 2.59Å; I836-V854 HydrophobicContact CG1-CG2 4.33Å; V854-M856 HydrophobicContact CG1-CG 4.06Å; V854-M856 HydrophobicContact CG1-SD 3.57Å; V854-M856 VanDerWaalsContact CG1-SD 3.57Å
855	V	94.1	Very high	86	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.006	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	118.6	175.1	178.7	0	0	0	0	109.4	V768 V774 L776 D834 G835 Y837	V768-V855 HydrophobicContact CG2-CG1 4.27Å; V774-V855 HydrophobicContact CG1-CG2 4.45Å; V774-V855 HydrophobicContact CG2-CG1 4.2Å; L776-V855 HydrophobicContact CD1-CG2 4.35Å; L776-V855 HydrophobicContact CD2-CG2 4.38Å; D834-V855 WeakPolarHBondContact CA-O 3.12Å; D834-V855 WeakPolarHBondContact CB-O 3.24Å; G835-V855 PolarHBondContact N-O 3.08Å; G835-V855 PolarHBondContact O-N 2.85Å; Y837-V855 HydrophobicContact CD2-CB 4.13Å; Y837-V855 HydrophobicContact CD2-CG2 3.57Å; Y837-V855 HydrophobicContact CE2-CB 3.92Å; Y837-V855 HydrophobicContact CE2-CG2 3.73Å
856	M	91.9	Very high	86.8	Confident	0 Å²	0	32 Å²	32	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	134.4	-177.4	-53	-66.2	-89.9	0	0	110.3	T541 E554 E556 Y766 S767 V768 V854	T541-M856 HydrophobicContact CG2-CB 4.32Å; T541-M856 HydrophobicContact CG2-CE 4.19Å; T541-M856 WeakPolarHBondContact O-CE 3.13Å; E554-M856 HydrophobicContact CG-CE 4.48Å; E556-M856 HydrophobicContact CB-CE 3.92Å; E556-M856 HydrophobicContact CG-CE 3.83Å; Y766-M856 PolarHBondContact O-N 3.07Å; S767-M856 WeakPolarHBondContact CA-O 3.08Å; V768-M856 PolarHBondContact N-O 2.86Å; V854-M856 HydrophobicContact CG1-CG 4.06Å; V854-M856 HydrophobicContact CG1-SD 3.57Å; V854-M856 VanDerWaalsContact CG1-SD 3.57Å
857	I	89.3	Confident	87	Confident	2 Å²	2	30.4 Å²	30.4	1%	0.01	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	111	177.1	-69	168.8	0	0	0	109.8	T541 F558 V768 R770 V829 R830 D834	T541-I857 WeakPolarHBondContact CG2-O 2.97Å; T541-I857 PolarHBondContact OG1-N 2.67Å; F558-I857 WeakPolarHBondContact CE1-O 3.38Å; V768-I857 CarbonylContact O-C 3.57Å; V768-I857 WeakPolarHBondContact O-CA 3.08Å; R770-I857 HydrophobicContact CG-CG2 3.69Å; V829-I857 HydrophobicContact CG1-CD1 3.53Å; V829-I857 HydrophobicContact CG1-CG1 3.66Å; R830-I857 VanDerWaalsContact C-CD1 3.47Å; R830-I857 WeakPolarHBondContact O-CD1 2.94Å; D834-I857 HydrophobicContact CB-CB 4.41Å; D834-I857 HydrophobicContact CB-CD1 3.79Å; D834-I857 HydrophobicContact CB-CG1 3.92Å
858	G	76.9	Confident	87	Confident	7 Å²	7	27.6 Å²	27.6	7%	0.072	20%	0.195	C	C	.	.			trans	-71.4	172.2	172.8	0	0	0	0	0	113.5	V768	V768-G858 PolarHBondContact O-N 2.71Å
859	G	60	Low	86.8	Confident	86 Å²	86	27.9 Å²	27.9	89%	0.887	20%	0.195	S	C	*	.			trans	-69	0	166.9	0	0	0	0	0	112

Retrieved 859 of 859 residues in 459.3 ms (Link to these results)

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